# 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 D C C 93.07 5.56 21.00 27.03 110.48 -138.91 -89.53 112.98 99.62 0.38 0.00 99.49 0.15 0.03 0.00 0.00 0.00 0.32 0.01 1 V C C 33.26 19.29 12.93 31.61 118.88 -156.14 -105.35 129.09 51.06 48.81 0.12 49.77 0.65 0.19 0.02 0.06 0.00 48.53 0.77 2 V E E 64.35 8.15 21.00 30.00 119.49 -164.80 -114.32 128.29 14.20 85.68 0.12 12.93 1.08 0.19 0.04 0.07 0.00 84.82 0.86 3 M E E 39.71 19.47 14.44 33.51 117.47 -154.38 -103.55 128.15 10.92 88.98 0.10 10.07 0.70 0.13 0.03 0.05 0.00 88.32 0.69 4 T E E 67.53 7.90 20.74 29.25 114.96 -170.35 -111.77 120.60 22.66 77.13 0.21 19.78 2.23 0.40 0.06 0.14 0.00 76.39 0.99 5 Q C E 67.03 13.81 15.12 28.96 126.03 35.66 -120.89 141.73 52.57 47.11 0.32 39.29 12.25 1.34 0.07 0.29 0.00 45.64 1.14 6 S C C 60.87 7.26 18.09 26.30 119.70 -128.61 -93.40 146.24 81.20 18.57 0.23 48.87 29.60 2.47 0.03 0.25 0.00 17.84 0.94 7 P C S 74.21 7.93 17.02 25.69 110.89 -43.37 -69.17 145.88 89.09 10.53 0.38 20.57 50.57 16.83 0.02 0.47 0.00 11.07 0.47 8 G C E 32.31 10.24 17.62 27.97 112.88 -146.51 92.73 -122.77 50.69 48.94 0.37 21.41 21.70 7.97 0.03 0.44 0.00 47.86 0.60 9 T E E 72.72 8.52 19.38 28.70 128.21 -9.28 -127.15 140.32 19.41 80.52 0.06 17.40 1.42 0.16 0.01 0.05 0.00 80.53 0.42 10 L E E 25.94 19.86 15.08 34.63 125.90 -169.70 -125.57 138.09 3.08 96.91 0.00 2.85 0.14 0.01 0.00 0.00 0.00 96.83 0.16 11 S E E 64.80 6.78 23.41 31.25 122.39 -156.25 -113.78 134.09 2.34 97.65 0.00 2.10 0.13 0.01 0.00 0.00 0.00 97.67 0.09 12 L E E 17.76 20.79 13.81 34.35 133.94 173.27 -137.65 152.88 15.81 84.18 0.01 15.04 0.61 0.02 0.00 0.01 0.00 83.03 1.29 13 S C C 53.77 4.69 23.38 27.76 121.99 -121.67 -86.21 157.15 94.13 5.84 0.03 93.05 1.25 0.11 0.01 0.02 0.00 5.13 0.44 14 P C T 62.64 13.46 14.35 27.98 109.42 -81.72 -59.82 135.74 99.09 0.39 0.52 0.31 2.69 96.35 0.03 0.35 0.00 0.20 0.07 15 G C T 47.47 4.05 19.27 24.11 96.09 23.35 88.53 -6.75 99.22 0.28 0.50 0.54 3.13 95.71 0.04 0.37 0.00 0.19 0.03 16 E C C 83.65 8.25 17.67 27.07 121.42 117.80 -83.70 148.51 92.11 7.57 0.32 74.32 17.23 0.61 0.05 0.29 0.00 6.68 0.81 17 R E E 126.06 9.28 18.66 29.13 123.25 -137.75 -107.44 141.61 49.56 50.39 0.05 48.44 0.87 0.08 0.01 0.04 0.00 49.44 1.11 18 A E E 10.19 21.19 15.50 36.59 130.50 -169.40 -129.69 147.50 2.91 97.08 0.01 2.71 0.10 0.01 0.00 0.00 0.00 97.05 0.12 19 T E E 66.80 8.63 24.59 33.81 121.71 -148.69 -114.69 132.58 1.12 98.87 0.00 1.00 0.05 0.00 0.00 0.00 0.00 98.91 0.03 20 L E E 6.42 25.06 16.96 42.43 122.98 -168.60 -117.44 133.24 4.70 95.30 0.01 4.24 0.25 0.02 0.00 0.00 0.00 95.40 0.09 21 S E E 38.26 9.95 26.42 36.82 126.00 -164.14 -115.30 142.84 14.47 85.52 0.01 13.21 0.66 0.03 0.00 0.01 0.00 85.94 0.15 22 C E E 5.42 25.05 17.02 42.24 131.87 -176.43 -135.77 147.21 14.84 85.13 0.02 13.88 0.66 0.05 0.00 0.02 0.00 84.96 0.44 23 R E E 112.39 6.97 26.75 34.55 120.32 -154.70 -114.07 131.97 10.03 89.92 0.05 9.35 0.49 0.05 0.02 0.03 0.00 86.28 3.77 24 A E E 10.15 23.73 13.39 36.67 120.63 -157.92 -98.46 144.43 49.48 50.24 0.27 46.86 1.75 0.29 0.08 0.18 0.00 48.03 2.81 25 S C C 49.75 7.20 19.70 27.49 117.59 -129.76 -85.29 161.89 86.75 12.35 0.89 67.56 14.92 3.86 0.15 0.97 0.00 10.68 1.87 26 Q C T 125.44 4.30 16.52 21.98 94.85 -96.83 -67.93 -21.81 95.33 2.90 1.76 7.58 39.53 48.40 0.13 1.74 0.00 2.10 0.53 27 S C T 83.78 2.95 18.60 21.88 96.91 53.91 -84.57 0.63 96.42 2.19 1.39 24.61 25.96 45.77 0.12 1.57 0.00 1.55 0.42 28 V C C 20.59 20.94 10.95 31.20 116.92 96.41 -97.44 131.50 91.69 7.08 1.23 59.93 29.91 1.96 0.43 0.80 0.00 3.36 3.61 29 P C C 64.32 5.76 22.08 28.20 112.61 -118.68 -71.00 144.39 94.68 3.06 2.26 85.48 5.67 3.45 0.39 2.05 0.00 1.99 0.97 30 S C G 39.35 18.00 15.87 32.50 96.09 -120.68 -67.82 -21.83 57.98 5.77 36.26 21.18 17.87 19.09 1.18 35.72 0.00 4.03 0.93 31 S C G 61.27 8.09 22.61 30.91 93.80 67.60 -77.13 -14.16 54.34 9.44 36.22 11.64 21.46 21.45 0.84 35.82 0.01 8.06 0.73 32 Y H E 51.20 16.25 21.58 37.34 105.97 52.92 -103.60 20.82 30.11 34.83 35.06 14.12 7.08 10.70 1.15 31.98 0.00 34.39 0.58 33 L E E 4.38 25.65 19.77 45.57 124.64 98.25 -115.49 138.94 10.84 89.11 0.06 9.64 1.00 0.08 0.01 0.03 0.00 88.93 0.31 34 A E E 11.14 18.04 27.80 45.56 132.32 -173.51 -130.98 149.49 0.95 99.05 0.00 0.86 0.03 0.00 0.00 0.00 0.00 99.08 0.02 35 W E E 9.63 24.12 23.26 47.10 124.40 -148.02 -112.15 138.90 0.72 99.27 0.00 0.64 0.03 0.00 0.00 0.00 0.00 99.31 0.01 36 Y E E 22.21 18.11 23.31 41.24 132.75 -174.18 -131.53 150.67 1.16 98.84 0.00 1.01 0.05 0.00 0.00 0.00 0.00 98.89 0.04 37 Q E E 45.51 14.16 21.69 36.04 122.63 -147.22 -111.76 136.21 3.03 96.97 0.01 2.56 0.24 0.02 0.00 0.00 0.00 97.08 0.10 38 Q E E 52.62 14.27 15.49 30.20 120.64 -155.23 -106.55 136.47 26.55 73.43 0.03 24.24 1.71 0.08 0.01 0.02 0.00 72.46 1.48 39 K C C 99.41 6.16 15.71 23.15 119.38 -139.09 -92.99 145.98 97.90 2.08 0.03 96.09 1.88 0.18 0.01 0.02 0.00 1.49 0.33 40 P C T 103.77 3.95 11.52 17.50 109.30 -86.28 -58.49 134.20 99.59 0.11 0.31 0.39 3.42 95.81 0.01 0.29 0.00 0.07 0.02 41 G C T 68.99 0.30 13.08 10.77 95.37 17.83 83.74 -2.93 99.61 0.07 0.32 0.49 3.33 95.78 0.01 0.34 0.00 0.05 0.01 42 Q C S 90.29 5.39 10.35 17.87 129.50 96.51 -113.53 159.67 94.47 5.04 0.48 36.29 56.75 1.52 0.09 0.40 0.00 1.77 3.17 43 A C C 74.01 2.59 17.82 20.46 116.64 -97.72 -70.96 150.83 97.59 2.37 0.03 85.95 11.66 0.19 0.01 0.03 0.00 1.81 0.35 44 P C C 42.52 18.33 12.01 29.67 114.82 -99.19 -65.96 144.21 90.55 9.41 0.04 88.64 1.90 0.14 0.00 0.03 0.00 8.99 0.30 45 R E E 98.57 9.30 21.91 31.69 124.74 -160.35 -120.28 138.22 8.77 91.16 0.07 7.81 0.83 0.09 0.03 0.03 0.00 90.45 0.78 46 L E E 53.65 17.01 19.17 35.56 110.94 -116.22 -75.92 126.31 1.42 98.57 0.02 1.29 0.07 0.01 0.01 0.00 0.00 98.57 0.06 47 L E E 17.35 19.68 22.13 41.51 101.46 176.14 -95.97 -33.44 2.65 97.33 0.03 1.88 0.61 0.03 0.01 0.01 0.00 97.44 0.03 48 I E E 9.31 22.11 22.58 44.40 134.64 5.69 -146.24 142.63 0.83 99.16 0.01 0.68 0.06 0.01 0.00 0.00 0.00 99.21 0.03 49 Y E E 51.01 18.04 23.64 40.45 129.30 -173.27 -132.04 140.68 5.60 94.33 0.07 4.68 0.55 0.09 0.02 0.03 0.00 94.43 0.20 50 G E E 11.78 17.69 21.46 38.25 127.61 153.17 -139.67 165.53 43.85 55.30 0.85 26.41 14.19 4.22 0.19 0.63 0.00 53.62 0.74 51 A C C 37.40 13.90 19.34 32.98 107.63 -115.85 -87.69 66.49 72.38 20.70 6.92 29.46 25.88 18.84 1.71 4.60 0.04 17.46 2.01 52 S C T 58.40 9.61 18.34 27.85 104.04 16.24 -89.62 -12.57 79.93 5.90 14.18 23.38 28.58 29.65 3.80 9.00 0.05 3.85 1.69 53 T C C 82.52 7.31 17.72 25.51 104.33 30.08 -92.14 7.09 69.83 11.41 18.76 25.50 22.76 23.93 6.21 10.84 0.15 7.90 2.70 54 R C C 120.06 8.75 17.09 26.38 112.44 63.13 -97.05 112.68 57.10 26.20 16.70 31.91 13.90 13.15 7.17 9.06 0.23 19.84 4.73 55 A C C 43.65 15.68 13.50 28.42 109.52 -145.83 -86.50 112.71 59.44 27.17 13.39 38.80 11.24 10.41 5.61 7.66 0.08 22.01 4.19 56 T C C 83.83 5.93 18.63 25.59 115.04 158.50 -104.02 128.41 64.85 25.64 9.52 30.64 15.62 20.77 3.56 5.43 0.14 20.26 3.57 57 G C C 38.65 7.43 19.25 27.37 110.18 10.78 93.56 2.75 78.96 17.68 3.36 36.74 24.26 19.47 0.65 2.76 0.01 13.58 2.52 58 I C C 31.62 21.26 12.17 32.29 115.98 139.58 -94.81 128.80 88.90 10.78 0.31 71.80 16.57 0.80 0.12 0.22 0.00 7.62 2.87 59 P C C 52.11 10.21 16.57 27.83 113.69 -113.79 -66.96 151.87 90.38 5.61 4.01 74.88 7.30 7.69 0.70 3.72 0.00 4.53 1.19 60 D C T 118.06 2.74 18.40 21.90 94.17 -107.13 -67.83 -18.85 84.18 4.37 11.44 13.88 29.07 41.53 0.82 10.74 0.01 3.14 0.82 61 R C T 99.23 11.16 17.66 28.85 97.82 61.13 -89.46 -5.01 72.14 15.48 12.38 16.61 22.51 34.13 0.87 11.12 0.02 13.74 1.01 62 F E E 23.19 23.18 12.87 35.23 122.09 80.50 -111.26 134.02 17.97 78.98 3.04 14.16 3.55 1.59 0.80 1.86 0.00 76.61 1.42 63 S E E 53.56 6.98 23.46 31.51 134.33 165.79 -136.28 153.57 7.91 91.89 0.20 6.68 1.04 0.22 0.09 0.09 0.00 91.17 0.69 64 G E E 23.28 17.90 15.61 32.37 141.17 166.71 -159.68 169.31 9.43 90.48 0.09 7.97 1.16 0.21 0.02 0.05 0.00 90.20 0.38 65 S E E 66.24 4.67 21.83 28.15 135.70 -162.37 -147.82 155.73 18.42 81.47 0.11 15.71 2.19 0.34 0.02 0.08 0.00 81.15 0.52 66 G E E 29.71 11.62 15.18 27.36 139.41 132.88 97.07 163.70 36.42 63.40 0.18 26.97 8.66 1.28 0.03 0.19 0.00 61.65 1.22 67 S C C 77.12 3.20 20.61 24.45 119.82 -112.30 -124.19 129.68 58.01 41.43 0.56 39.76 15.28 4.06 0.11 0.60 0.00 36.15 4.03 68 G C S 35.06 9.32 19.13 28.74 109.75 -45.90 64.23 -129.25 98.07 1.16 0.77 2.71 52.03 43.51 0.02 0.76 0.00 0.80 0.16 69 T C S 54.95 14.39 16.47 30.85 97.34 -8.22 -97.33 -2.52 98.08 1.27 0.65 2.52 51.71 44.04 0.02 0.62 0.00 0.95 0.14 70 D E E 58.53 9.29 22.45 32.83 119.20 85.31 -106.49 132.30 38.44 61.27 0.29 24.89 13.26 2.04 0.04 0.34 0.00 57.06 2.37 71 F E E 6.99 24.79 16.29 41.62 127.78 -173.13 -125.73 141.58 14.51 85.48 0.01 13.77 0.46 0.03 0.00 0.00 0.00 85.21 0.52 72 T E E 33.71 10.70 27.36 39.14 122.02 -162.28 -117.20 132.59 4.38 95.62 0.00 3.89 0.16 0.00 0.00 0.00 0.00 95.89 0.06 73 L E E 2.58 26.38 19.15 46.54 119.21 -162.15 -111.52 128.90 0.45 99.55 0.00 0.46 0.01 0.00 0.00 0.00 0.00 99.53 0.00 74 T E E 37.40 10.47 27.44 38.81 119.78 -164.41 -114.50 127.51 0.16 99.84 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.01 75 I E E 6.36 24.46 16.91 42.03 117.50 -167.49 -114.53 124.65 2.08 97.92 0.00 2.20 0.02 0.00 0.00 0.00 0.00 97.42 0.36 76 S C C 43.17 7.87 23.17 31.31 123.43 -168.89 -111.19 158.43 89.81 10.16 0.03 46.52 40.28 1.43 0.00 0.05 0.00 11.55 0.18 77 R C S 144.52 3.95 23.94 28.05 95.50 8.62 56.97 52.46 98.45 1.54 0.01 9.63 87.08 1.69 0.00 0.01 0.00 1.50 0.09 78 L C C 13.72 24.42 10.30 34.42 115.02 -153.59 -76.68 136.00 98.66 1.33 0.01 97.65 1.30 0.02 0.00 0.00 0.00 0.50 0.51 79 E C C 85.69 4.62 24.63 28.99 130.05 -170.04 -122.03 156.19 99.88 0.11 0.01 99.66 0.26 0.00 0.00 0.00 0.00 0.02 0.06 80 P H G 66.16 13.99 15.13 29.08 91.10 -106.22 -58.70 -31.09 3.31 0.02 96.67 0.16 0.19 2.08 0.23 97.33 0.00 0.01 0.00 81 E H G 122.67 4.22 21.70 26.79 90.11 62.98 -70.77 -16.18 2.77 0.03 97.20 0.08 0.14 1.86 0.14 97.76 0.00 0.02 0.00 82 D H G 15.05 20.27 17.23 37.90 94.64 60.65 -88.60 -1.72 3.69 0.05 96.26 0.43 0.35 1.63 0.20 97.35 0.00 0.04 0.00 83 F C C 35.59 18.92 20.74 39.59 117.84 101.84 -82.64 136.86 81.01 18.80 0.20 77.96 3.03 0.10 0.02 0.17 0.00 18.32 0.40 84 A E E 9.46 19.76 23.62 42.50 140.30 169.67 -147.26 167.78 4.94 95.06 0.00 4.77 0.23 0.01 0.00 0.00 0.00 94.67 0.31 85 V E E 25.68 16.89 25.96 42.60 119.84 -116.32 -108.27 132.51 0.66 99.34 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.34 0.02 86 Y E E 6.43 25.09 21.70 46.75 123.11 -165.57 -114.62 136.51 0.42 99.57 0.00 0.37 0.02 0.00 0.00 0.00 0.00 99.60 0.01 87 Y E E 28.71 17.28 27.01 43.87 128.39 -168.69 -122.11 144.67 1.72 98.27 0.01 1.49 0.09 0.01 0.00 0.00 0.00 98.36 0.04 88 C E E 3.31 24.94 21.15 46.31 123.87 -158.94 -116.08 138.00 7.06 92.81 0.13 6.03 0.70 0.13 0.04 0.06 0.00 92.87 0.18 89 Q E E 36.46 14.02 24.82 38.96 127.53 -169.49 -125.36 142.06 6.92 92.89 0.19 6.04 0.63 0.14 0.07 0.10 0.00 92.60 0.44 90 H E E 40.50 16.53 18.07 34.63 118.13 -146.99 -102.69 133.47 18.60 81.00 0.39 15.21 2.90 0.64 0.11 0.26 0.00 79.99 0.89 91 Y C E 95.77 10.30 16.49 27.62 114.38 -152.90 -103.61 121.85 49.76 49.46 0.78 35.97 11.21 3.71 0.15 0.71 0.00 46.67 1.57 92 D C S 78.58 5.98 13.90 21.09 124.08 120.98 -116.85 162.51 90.61 8.27 1.12 18.79 40.28 31.52 0.09 1.20 0.00 7.42 0.71 93 T C S 111.26 2.06 14.02 16.65 99.75 -48.31 -84.37 -7.75 96.88 2.00 1.13 16.59 48.21 32.10 0.09 1.19 0.00 1.44 0.39 94 S C S 66.85 3.61 15.24 20.05 123.76 42.01 -116.72 140.67 87.42 11.81 0.77 23.78 54.40 9.16 0.08 0.79 0.00 10.54 1.24 95 P C C 55.98 14.45 12.49 26.83 113.76 -106.33 -68.92 142.81 74.80 24.76 0.44 60.57 9.40 2.61 0.06 0.43 0.00 26.23 0.70 96 R E E 106.16 8.81 19.43 29.02 123.17 -161.31 -116.73 138.66 30.09 69.56 0.35 25.33 3.75 0.86 0.10 0.28 0.00 66.77 2.91 97 F E E 74.78 16.69 16.39 32.23 117.72 -140.85 -97.53 133.12 18.38 81.43 0.19 15.19 2.15 0.46 0.08 0.13 0.00 75.47 6.52 98 G C E 20.56 14.45 18.19 32.21 120.04 -147.73 -86.76 -168.73 52.37 47.47 0.16 41.73 8.92 1.39 0.03 0.14 0.00 46.85 0.95 99 G C C 40.59 7.31 22.12 29.31 116.27 -94.87 -57.02 3.86 68.10 31.79 0.11 55.06 9.88 1.05 0.01 0.10 0.00 33.43 0.46 100 G C E 21.04 17.37 15.84 31.99 128.58 -130.89 116.25 174.02 53.16 46.78 0.07 46.13 4.60 0.34 0.01 0.06 0.00 48.45 0.42 101 T E E 39.51 14.21 19.71 34.14 129.13 -115.66 -128.61 146.37 6.70 93.29 0.01 6.07 0.36 0.02 0.00 0.00 0.00 93.33 0.21 102 K E E 108.76 9.00 22.23 31.87 118.90 -133.21 -99.34 134.09 1.16 98.84 0.00 0.99 0.09 0.00 0.00 0.00 0.00 98.87 0.04 103 V E E 11.46 22.69 14.15 36.84 121.70 -165.14 -117.40 132.27 1.87 98.13 0.01 1.76 0.07 0.01 0.00 0.00 0.00 98.10 0.06 104 D E E 78.46 5.10 23.97 29.31 116.19 -148.92 -101.92 127.83 5.38 94.60 0.02 5.05 0.26 0.05 0.01 0.01 0.00 94.41 0.22 105 I E E 24.99 21.71 10.92 31.67 114.43 -157.32 -98.42 124.87 24.16 75.72 0.12 24.17 0.34 0.09 0.05 0.05 0.00 74.08 1.22 106 K C C 129.67 4.02 20.14 24.96 115.86 -162.67 -97.80 131.09 99.38 0.62 0.01 99.40 0.06 0.02 0.00 0.00 0.00 0.51 0.01