# 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 115.26 5.41 20.15 26.33 117.63 -143.40 -94.79 135.29 99.65 0.35 0.00 99.63 0.08 0.01 0.00 0.00 0.00 0.27 0.01 1 I C C 45.44 18.33 12.22 30.00 117.51 -147.67 -101.19 129.63 58.34 41.58 0.08 57.74 0.40 0.14 0.01 0.04 0.00 41.04 0.62 2 V E E 68.27 7.15 19.82 28.01 120.20 -165.89 -114.68 130.82 15.76 84.13 0.11 14.65 0.95 0.16 0.04 0.07 0.00 83.29 0.84 3 M E E 53.19 17.74 13.74 31.10 119.16 -155.09 -107.44 129.56 10.69 89.23 0.08 9.91 0.68 0.13 0.03 0.05 0.00 88.54 0.67 4 T E E 68.23 7.53 19.70 28.11 121.85 -170.44 -118.93 137.62 19.05 80.79 0.16 16.85 1.74 0.31 0.04 0.11 0.00 79.85 1.10 5 Q C E 72.05 13.19 15.16 28.56 125.56 -163.62 -123.01 141.85 50.26 49.52 0.21 37.20 12.39 1.01 0.04 0.20 0.00 48.04 1.12 6 S C C 60.44 7.59 17.77 26.37 121.06 -136.11 -98.66 145.92 80.19 19.66 0.15 47.16 31.46 1.34 0.02 0.15 0.00 19.10 0.76 7 P C C 67.98 8.59 16.75 26.21 113.79 -20.01 -68.45 148.71 88.13 11.57 0.30 55.28 28.07 3.72 0.03 0.34 0.00 12.09 0.45 8 A C E 46.00 13.28 15.55 28.90 100.95 -149.70 -84.97 -12.73 53.07 46.52 0.40 38.24 12.79 2.00 0.05 0.43 0.00 45.68 0.81 9 T E E 77.00 7.24 19.81 28.17 127.72 2.68 -127.16 139.70 17.80 82.10 0.10 15.78 1.56 0.20 0.01 0.08 0.00 81.97 0.40 10 L E E 29.00 19.65 14.54 33.77 127.85 -173.47 -131.06 139.36 3.09 96.90 0.01 2.86 0.16 0.01 0.00 0.00 0.00 96.83 0.13 11 S E E 65.27 6.23 23.34 30.65 122.67 -156.68 -114.28 135.46 2.00 98.00 0.00 1.84 0.10 0.00 0.00 0.00 0.00 98.00 0.05 12 V E E 15.29 20.86 13.65 34.38 133.15 173.75 -137.69 151.17 9.07 90.92 0.01 8.78 0.33 0.01 0.00 0.00 0.00 89.84 1.03 13 S C C 52.65 4.72 23.39 27.78 121.83 -122.99 -85.32 157.62 92.63 7.35 0.02 91.94 0.95 0.07 0.00 0.01 0.00 6.57 0.45 14 P C T 59.76 13.91 14.27 28.28 109.45 -81.89 -59.71 135.77 99.28 0.32 0.39 0.22 2.38 96.91 0.02 0.25 0.00 0.17 0.05 15 G C T 47.58 3.92 19.52 24.19 95.83 22.84 88.47 -6.39 99.37 0.27 0.36 0.39 2.79 96.35 0.02 0.24 0.00 0.18 0.02 16 E C C 82.42 8.29 17.55 27.02 122.07 119.51 -83.29 149.77 92.06 7.69 0.25 74.91 16.71 0.45 0.04 0.21 0.00 6.97 0.71 17 R E E 127.06 8.96 18.72 28.93 123.82 -136.23 -109.81 140.75 46.21 53.74 0.04 45.60 0.75 0.07 0.01 0.03 0.00 52.55 0.99 18 A E E 10.48 21.05 15.53 36.50 131.59 -172.55 -132.54 149.04 1.95 98.05 0.01 1.80 0.06 0.00 0.00 0.00 0.00 98.05 0.08 19 T E E 64.84 8.86 24.44 33.86 121.93 -148.18 -115.36 133.76 0.75 99.25 0.00 0.67 0.03 0.00 0.00 0.00 0.00 99.28 0.02 20 L E E 6.77 25.04 16.98 42.36 122.51 -168.61 -116.24 133.35 3.49 96.50 0.00 3.02 0.23 0.01 0.00 0.00 0.00 96.66 0.07 21 S E E 37.37 10.12 26.58 37.17 125.46 -164.39 -116.49 142.23 13.45 86.54 0.01 12.20 0.58 0.03 0.00 0.01 0.00 87.08 0.11 22 C E E 5.25 25.09 17.00 42.33 131.00 -174.38 -134.09 147.25 14.44 85.54 0.02 13.21 0.72 0.05 0.00 0.02 0.00 85.75 0.24 23 R E E 110.82 6.84 26.99 34.72 119.85 -151.97 -111.61 131.84 6.96 92.99 0.05 6.38 0.43 0.06 0.02 0.03 0.00 90.72 2.35 24 A E E 9.10 24.10 13.52 37.27 121.88 -159.52 -101.00 143.37 38.58 61.10 0.31 36.17 1.72 0.29 0.13 0.19 0.00 58.49 3.01 25 S C C 49.73 7.28 20.66 28.28 118.42 -142.76 -92.75 164.83 78.65 20.37 0.98 51.50 23.32 3.70 0.18 0.91 0.00 19.00 1.39 26 Q C S 124.52 4.59 17.95 23.34 100.59 -69.58 -74.14 -16.29 90.17 6.09 3.74 16.74 55.46 18.64 0.67 2.67 0.00 4.81 1.02 27 S C C 66.67 5.42 19.48 25.51 115.04 56.68 -98.49 131.02 90.25 5.57 4.18 42.23 29.65 18.62 0.70 3.69 0.00 3.88 1.23 28 I C C 46.94 19.07 14.55 32.36 113.20 -134.16 -90.66 130.84 83.35 11.04 5.61 51.67 20.70 10.89 1.28 4.66 0.00 7.18 3.63 29 S C C 31.83 12.82 19.26 32.42 128.03 -138.51 -115.00 157.16 84.12 11.08 4.79 64.42 10.92 8.23 0.86 4.37 0.00 8.72 2.48 30 S C S 64.10 9.79 21.01 30.86 97.46 -135.14 -84.36 -10.86 83.65 13.26 3.09 13.86 36.27 34.42 0.31 2.74 0.00 11.19 1.19 31 N C T 67.52 10.24 23.01 33.61 100.03 58.90 -97.96 23.38 71.38 26.71 1.91 20.71 20.07 31.21 0.16 1.87 0.00 25.26 0.72 32 L E E 5.92 25.02 17.29 42.58 122.49 123.47 -101.05 140.59 22.61 77.34 0.06 19.92 1.94 0.15 0.01 0.04 0.00 77.56 0.38 33 A E E 13.08 16.14 27.60 43.89 132.94 -174.11 -131.92 151.19 1.22 98.77 0.00 1.17 0.04 0.00 0.00 0.00 0.00 98.75 0.04 34 W E E 9.59 24.54 22.61 47.04 124.82 -148.71 -114.85 138.97 0.46 99.54 0.00 0.42 0.02 0.00 0.00 0.00 0.00 99.56 0.01 35 Y E E 24.97 17.06 23.73 40.79 132.77 -174.61 -131.43 150.26 0.72 99.28 0.00 0.63 0.02 0.00 0.00 0.00 0.00 99.32 0.02 36 Q E E 43.44 14.51 21.37 36.09 121.79 -145.19 -110.71 134.13 3.29 96.70 0.00 2.77 0.24 0.01 0.00 0.00 0.00 96.89 0.09 37 Q E E 54.15 13.96 15.48 29.95 118.65 -150.66 -102.57 135.27 31.19 68.79 0.02 28.59 1.60 0.06 0.00 0.01 0.00 68.43 1.30 38 K C C 98.15 6.29 15.29 22.94 119.36 -139.42 -89.68 147.65 98.24 1.73 0.03 96.49 1.84 0.18 0.01 0.02 0.00 1.17 0.29 39 P C T 105.50 3.60 11.30 16.94 109.47 -84.66 -58.54 134.21 99.69 0.09 0.22 0.32 3.18 96.22 0.01 0.21 0.00 0.05 0.02 40 G C T 69.59 0.24 12.90 10.23 95.11 17.59 83.40 -3.10 99.72 0.06 0.22 0.40 3.13 96.18 0.00 0.23 0.00 0.04 0.01 41 Q C S 89.47 5.47 9.73 17.34 128.92 96.21 -115.58 158.96 93.83 5.87 0.30 38.56 54.40 1.00 0.06 0.24 0.00 1.97 3.76 42 A C C 77.69 2.04 17.29 19.17 116.65 -97.25 -69.08 149.79 97.54 2.43 0.03 86.81 10.73 0.19 0.01 0.03 0.00 1.90 0.34 43 P C C 48.92 17.10 11.32 27.81 115.01 -99.66 -65.59 143.84 93.28 6.69 0.03 91.15 1.98 0.13 0.00 0.02 0.00 6.51 0.20 44 R E E 102.32 8.47 20.82 30.08 125.22 -162.18 -123.05 139.25 7.95 92.00 0.05 7.00 0.77 0.07 0.02 0.03 0.00 91.39 0.72 45 L E E 62.59 15.69 18.38 33.62 110.82 -115.67 -75.80 125.79 1.19 98.80 0.01 1.04 0.06 0.01 0.00 0.00 0.00 98.84 0.04 46 L E E 21.88 18.75 21.08 39.63 101.44 176.56 -95.90 -33.71 2.22 97.76 0.02 1.54 0.51 0.03 0.01 0.01 0.00 97.89 0.02 47 I E E 12.91 21.35 21.47 42.54 135.12 5.47 -146.57 141.88 0.90 99.09 0.02 0.72 0.07 0.01 0.01 0.00 0.00 99.16 0.03 48 Y E E 69.96 16.40 23.02 38.28 128.56 -173.94 -132.12 138.14 8.13 91.70 0.18 6.53 1.07 0.27 0.05 0.08 0.00 91.74 0.25 49 G C E 15.66 17.15 21.38 37.42 124.19 141.42 -130.59 168.60 56.16 42.40 1.44 28.99 20.97 7.01 0.34 0.99 0.00 40.83 0.87 50 A C C 39.39 14.04 19.94 33.59 113.22 -110.06 -100.09 128.91 70.71 23.68 5.62 35.74 24.71 12.06 1.77 3.55 0.04 19.56 2.57 51 S C C 41.82 12.42 18.25 30.77 118.14 61.47 -107.08 145.02 76.20 14.07 9.73 38.68 24.01 14.88 3.20 6.11 0.05 9.90 3.16 52 T C C 80.11 9.12 17.45 26.92 103.14 -145.21 -91.42 3.94 70.35 14.14 15.51 32.48 22.94 16.93 5.65 8.78 0.13 9.43 3.66 53 R C C 132.43 6.38 17.55 24.93 113.15 71.27 -99.35 113.73 66.85 18.95 14.20 38.74 15.74 13.71 5.41 8.26 0.10 13.08 4.96 54 A C C 42.01 15.15 12.14 26.69 112.84 -152.78 -91.16 123.01 70.73 17.51 11.76 45.65 12.87 12.11 4.58 7.06 0.04 11.85 5.84 55 T C T 87.92 5.80 16.62 23.46 109.16 -138.34 -95.12 92.31 84.72 8.16 7.12 21.52 18.30 45.73 2.41 4.18 0.03 5.40 2.44 56 G C T 52.78 3.78 17.98 22.62 101.13 -4.35 83.34 -0.39 92.79 4.48 2.73 17.23 30.06 45.91 0.45 2.19 0.00 3.20 0.96 57 I C C 44.60 16.86 12.30 29.00 118.05 106.87 -102.63 129.79 80.58 18.73 0.69 46.76 33.52 1.70 0.28 0.45 0.00 9.67 7.62 58 P C C 63.50 7.79 19.65 28.20 111.75 -113.23 -67.53 144.96 83.29 14.12 2.59 67.55 10.15 4.94 0.74 2.04 0.00 11.58 3.00 59 A C C 41.76 16.44 15.25 30.85 104.86 -130.98 -75.73 35.47 80.08 14.68 5.24 49.88 20.19 10.53 0.85 4.55 0.01 12.53 1.46 60 R C C 118.38 7.43 22.53 30.52 121.55 58.73 -121.56 129.85 57.40 37.50 5.10 39.76 12.18 6.39 1.08 3.65 0.01 35.28 1.66 61 F E E 31.82 22.93 13.55 35.65 124.46 -170.13 -118.28 141.04 24.81 74.22 0.97 21.46 2.98 0.86 0.42 0.54 0.00 71.75 1.99 62 S E E 56.75 6.10 24.00 31.25 134.09 -175.39 -137.12 156.29 12.86 86.83 0.31 11.08 1.49 0.36 0.13 0.15 0.00 85.76 1.04 63 G E E 25.33 16.59 15.71 31.44 140.59 156.92 -156.85 169.39 15.78 83.99 0.22 12.87 2.54 0.53 0.06 0.14 0.00 83.03 0.82 64 S E E 67.51 4.82 21.16 27.57 133.97 -160.16 -140.56 154.70 23.77 75.99 0.24 19.82 3.27 0.75 0.06 0.18 0.00 75.04 0.88 65 G E E 30.64 11.49 15.15 27.20 138.86 130.90 105.94 161.45 41.74 57.95 0.32 26.71 13.93 2.85 0.04 0.34 0.00 54.91 1.21 66 S C C 78.14 3.10 20.62 24.15 110.96 -111.61 -113.84 58.44 63.61 35.74 0.65 37.97 21.18 6.32 0.11 0.72 0.00 29.98 3.71 67 G C S 32.98 10.12 18.69 28.84 109.21 -53.65 67.42 -123.32 97.66 1.71 0.63 3.48 59.07 35.26 0.02 0.63 0.00 1.33 0.20 68 T C S 54.63 14.49 16.79 31.09 98.43 -12.24 -98.85 -2.34 97.35 2.18 0.47 3.25 61.07 33.14 0.02 0.45 0.00 1.89 0.18 69 E E E 79.07 8.63 22.53 32.31 122.58 83.78 -111.20 134.71 30.92 68.93 0.15 21.73 8.84 0.97 0.03 0.17 0.00 65.44 2.83 70 F E E 7.77 24.61 15.97 41.03 128.75 -174.13 -128.18 142.39 12.08 87.91 0.01 11.55 0.36 0.02 0.00 0.00 0.00 87.57 0.49 71 T E E 36.13 10.25 27.05 38.38 123.15 -159.01 -118.01 134.13 6.24 93.75 0.00 5.56 0.29 0.00 0.00 0.00 0.00 94.03 0.11 72 L E E 3.01 26.24 18.89 46.06 119.87 -162.76 -112.72 128.77 0.99 99.01 0.00 1.02 0.01 0.00 0.00 0.00 0.00 98.95 0.01 73 T E E 41.01 10.12 27.23 38.16 120.63 -165.58 -116.18 129.03 0.22 99.78 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.72 0.02 74 I E E 7.89 24.10 16.18 40.82 117.43 -163.95 -110.26 123.70 2.61 97.38 0.00 2.72 0.03 0.00 0.00 0.00 0.00 96.65 0.61 75 S C C 50.55 6.91 22.96 30.10 117.02 -167.74 -104.71 163.19 92.61 7.31 0.08 49.00 37.35 5.00 0.00 0.14 0.00 8.26 0.25 76 S C S 63.53 4.69 24.04 28.69 105.15 10.27 56.65 83.54 98.90 1.06 0.04 13.64 79.18 6.12 0.00 0.06 0.00 0.89 0.11 77 L C C 19.89 23.71 10.88 34.03 112.45 -142.62 -74.76 130.16 99.29 0.70 0.01 98.22 1.17 0.03 0.00 0.00 0.00 0.25 0.31 78 Q C C 80.05 4.33 23.93 28.06 132.40 163.50 -127.53 161.97 99.32 0.66 0.03 98.41 0.88 0.01 0.01 0.01 0.00 0.09 0.60 79 S H G 60.39 12.11 15.42 27.77 90.78 -101.68 -59.83 -31.53 3.76 0.02 96.22 0.19 0.26 2.43 0.27 96.83 0.00 0.02 0.00 80 E H G 121.92 4.38 21.52 26.72 90.70 62.85 -71.71 -15.85 3.19 0.03 96.77 0.11 0.18 2.21 0.19 97.29 0.00 0.02 0.00 81 D H G 14.32 20.70 16.76 37.75 94.71 59.15 -89.68 -3.42 3.97 0.05 95.98 0.44 0.38 1.95 0.26 96.93 0.00 0.04 0.00 82 F C C 40.62 18.22 20.88 38.93 118.31 101.55 -83.73 137.29 87.10 12.21 0.70 83.64 3.45 0.16 0.06 0.58 0.00 11.78 0.33 83 A E E 10.89 18.70 23.49 41.52 142.00 161.22 -152.82 169.66 4.03 95.96 0.01 3.75 0.25 0.02 0.00 0.01 0.00 95.68 0.30 84 V E E 28.43 16.26 25.77 41.86 118.94 -105.79 -106.00 131.47 0.41 99.59 0.00 0.37 0.02 0.00 0.00 0.00 0.00 99.60 0.01 85 Y E E 7.17 24.92 21.42 46.29 123.93 -166.30 -115.61 136.62 0.34 99.65 0.00 0.29 0.02 0.00 0.00 0.00 0.00 99.69 0.01 86 Y E E 29.79 16.95 27.22 43.87 129.33 -170.45 -125.09 143.98 1.31 98.68 0.01 1.09 0.08 0.01 0.00 0.00 0.00 98.78 0.04 87 C E E 3.41 25.06 21.10 46.39 123.45 -157.93 -116.99 136.29 7.68 92.17 0.15 6.42 0.90 0.16 0.05 0.08 0.00 92.14 0.25 88 Q E E 39.60 13.93 25.30 39.23 126.46 -168.67 -123.19 141.87 14.46 85.21 0.33 12.99 1.18 0.26 0.12 0.17 0.00 84.44 0.83 89 Q E E 44.56 16.81 18.53 34.90 116.18 -137.43 -92.24 135.55 41.10 58.08 0.82 33.40 6.36 1.64 0.22 0.60 0.00 56.53 1.25 90 S C C 40.35 11.27 16.35 28.43 115.01 -160.09 -108.09 133.89 69.72 28.53 1.74 47.35 15.75 7.13 0.30 1.61 0.00 25.45 2.40 91 N C S 95.81 6.25 14.13 21.55 108.27 -145.59 -96.35 27.90 90.84 7.19 1.97 22.34 37.92 30.95 0.17 2.01 0.00 5.50 1.11 92 N C S 124.89 2.26 14.92 17.71 99.77 -23.00 -90.33 9.35 95.71 2.76 1.54 18.45 47.04 30.28 0.13 1.62 0.00 1.85 0.63 93 W C S 111.22 8.91 11.06 21.39 121.03 86.61 -110.27 138.61 89.31 9.83 0.86 28.61 56.36 4.82 0.18 0.70 0.00 6.69 2.62 94 P C C 82.78 4.88 16.78 22.49 113.46 -95.94 -68.87 150.00 88.92 9.81 1.27 58.40 21.88 8.34 0.19 1.29 0.00 8.88 1.01 95 L C C 65.94 15.28 13.51 28.34 113.91 -107.84 -75.00 136.45 72.78 25.62 1.61 57.50 9.59 4.67 0.29 1.45 0.00 24.82 1.70 96 T E E 56.80 10.58 19.48 30.49 122.75 -166.38 -116.07 139.75 38.58 60.14 1.28 31.99 4.22 1.71 0.54 0.87 0.00 54.63 6.03 97 F E E 65.99 17.90 16.13 32.89 115.97 -151.41 -100.33 131.53 34.17 64.65 1.17 24.59 7.58 2.95 0.47 0.89 0.02 56.19 7.31 98 G C C 28.16 11.84 19.20 30.80 117.42 -154.42 68.46 -161.91 63.74 35.68 0.58 37.69 20.13 6.55 0.08 0.58 0.00 33.55 1.42 99 G C C 42.17 7.71 21.56 29.15 101.50 -57.03 -78.67 -0.71 74.06 25.54 0.40 50.80 18.01 4.29 0.05 0.44 0.00 25.64 0.77 100 G C C 18.25 17.17 16.12 32.29 127.76 -131.61 94.78 174.80 63.55 36.30 0.15 54.01 6.60 0.77 0.02 0.14 0.00 37.83 0.63 101 T E E 35.46 14.93 19.72 34.79 127.43 -104.98 -121.73 144.95 10.91 89.07 0.02 9.91 0.57 0.03 0.00 0.01 0.00 89.19 0.28 102 K E E 103.42 9.85 22.39 32.58 119.55 -136.84 -100.23 134.18 1.35 98.65 0.00 1.16 0.08 0.00 0.00 0.00 0.00 98.72 0.04 103 V E E 12.04 22.53 14.83 37.28 121.89 -166.06 -117.14 133.27 0.84 99.16 0.00 0.79 0.02 0.00 0.00 0.00 0.00 99.17 0.02 104 E E E 96.84 5.58 23.62 29.59 117.05 -152.04 -102.83 129.10 1.72 98.27 0.00 1.69 0.04 0.00 0.00 0.00 0.00 98.18 0.07 105 I E E 25.47 21.07 11.07 31.40 115.68 -155.59 -101.08 127.73 16.96 83.00 0.04 17.13 0.22 0.03 0.01 0.01 0.00 81.95 0.65 106 K C C 128.42 4.05 20.08 24.89 114.89 -153.91 -97.98 129.75 99.26 0.74 0.00 99.31 0.06 0.01 0.00 0.00 0.00 0.61 0.01