# 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 100.59 3.90 21.03 25.06 104.48 -128.51 -82.15 61.02 99.85 0.15 0.00 99.75 0.12 0.02 0.00 0.00 0.00 0.10 0.00 1 I C C 35.08 20.73 10.70 30.23 117.32 -152.53 -98.39 130.35 63.16 36.77 0.07 62.26 0.53 0.13 0.01 0.04 0.00 36.36 0.67 2 V E E 77.04 5.54 21.92 28.20 121.76 -167.95 -117.58 135.02 16.39 83.53 0.08 15.08 1.04 0.14 0.03 0.05 0.00 82.81 0.85 3 L E E 40.89 20.27 13.44 32.98 119.49 -157.00 -106.33 131.89 9.63 90.31 0.06 9.16 0.49 0.08 0.02 0.03 0.00 89.42 0.81 4 T E E 63.48 7.52 21.50 29.62 125.35 -172.75 -122.19 143.37 17.04 82.84 0.12 15.27 1.39 0.21 0.04 0.07 0.00 81.83 1.20 5 Q E E 70.32 15.11 15.00 29.75 125.70 -161.78 -123.89 140.79 46.12 53.69 0.20 36.52 8.90 0.77 0.05 0.18 0.00 52.30 1.30 6 S C C 57.74 9.05 17.44 27.22 119.17 -142.95 -102.64 145.34 84.17 15.68 0.15 57.99 24.26 1.37 0.02 0.16 0.00 15.46 0.73 7 P C C 58.55 8.52 16.77 26.23 116.52 18.27 -74.25 153.03 91.54 7.65 0.81 50.86 32.70 7.56 0.07 0.96 0.00 7.37 0.49 8 S C S 66.78 9.29 16.43 26.49 97.39 -146.45 -84.72 -20.26 79.97 19.53 0.50 23.71 49.75 4.98 0.03 0.55 0.00 20.39 0.59 9 T E E 70.59 6.50 19.87 27.65 132.07 29.09 -138.48 142.90 19.17 80.45 0.38 15.18 3.62 0.69 0.06 0.31 0.00 79.66 0.49 10 L E E 30.89 19.74 14.60 33.79 129.37 -174.98 -134.57 141.97 3.84 96.14 0.02 3.42 0.29 0.02 0.00 0.01 0.00 96.07 0.18 11 S E E 65.79 6.21 23.32 30.79 124.43 -159.90 -117.54 140.38 3.16 96.83 0.01 2.88 0.20 0.02 0.00 0.00 0.00 96.71 0.18 12 A E E 12.66 19.32 14.49 33.97 138.61 166.66 -147.35 159.88 17.84 82.12 0.04 16.06 1.07 0.08 0.01 0.03 0.00 82.31 0.45 13 S E E 55.07 4.82 23.71 28.31 124.06 -116.08 -90.99 159.62 41.54 58.28 0.18 37.41 3.13 0.42 0.07 0.14 0.00 52.94 5.89 14 V C T 62.16 14.85 14.19 28.99 109.17 -81.68 -59.77 134.64 98.57 0.97 0.46 0.48 3.69 94.80 0.02 0.32 0.00 0.57 0.13 15 G C T 45.38 4.32 19.96 24.98 95.87 23.10 89.19 -6.56 99.41 0.27 0.31 0.67 4.45 94.40 0.01 0.25 0.00 0.18 0.04 16 D C C 58.24 9.35 16.96 27.48 121.49 121.33 -79.13 152.59 96.41 3.40 0.18 62.21 33.94 0.63 0.03 0.16 0.00 2.52 0.50 17 R C C 129.29 7.90 19.70 28.75 120.44 -124.74 -99.90 137.11 74.00 25.99 0.01 74.47 0.51 0.03 0.00 0.01 0.00 24.37 0.62 18 V E E 11.49 22.43 14.62 37.03 128.47 -170.97 -127.68 143.85 1.10 98.89 0.00 1.12 0.02 0.00 0.00 0.00 0.00 98.76 0.10 19 T E E 61.65 8.03 25.20 33.70 118.08 -145.10 -108.87 128.32 0.39 99.61 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.00 20 I E E 4.75 25.66 16.63 43.12 120.30 -166.95 -114.99 128.83 1.65 98.35 0.00 1.55 0.04 0.00 0.00 0.00 0.00 98.40 0.01 21 T E E 42.67 9.42 27.00 37.20 121.51 -164.62 -112.95 134.00 7.76 92.24 0.00 7.14 0.16 0.00 0.00 0.00 0.00 92.65 0.04 22 C E E 4.38 25.73 16.77 42.96 126.64 -172.35 -126.67 140.19 7.68 92.32 0.00 7.04 0.24 0.01 0.00 0.00 0.00 92.62 0.09 23 R E E 103.00 7.37 27.41 35.62 120.77 -163.63 -117.20 131.54 3.69 96.30 0.02 3.47 0.17 0.01 0.01 0.01 0.00 95.60 0.74 24 A E E 9.51 23.83 14.03 37.48 122.85 -161.22 -106.52 144.21 32.68 67.12 0.20 31.29 1.27 0.19 0.07 0.12 0.00 64.90 2.15 25 S C C 50.01 7.60 20.37 28.40 116.18 -150.80 -91.62 160.40 80.59 18.59 0.82 51.28 25.58 3.46 0.13 0.80 0.00 17.59 1.16 26 Q C S 119.13 4.99 18.04 23.69 101.32 -48.19 -82.25 -15.52 90.90 4.99 4.11 17.38 52.84 21.31 0.56 3.25 0.00 3.68 0.97 27 S C C 64.54 6.24 18.53 25.48 113.92 48.62 -99.58 129.29 92.04 3.48 4.48 40.61 29.76 21.52 0.59 4.36 0.00 2.24 0.92 28 I C C 56.01 16.70 15.46 31.37 107.72 -143.63 -89.37 90.15 85.20 6.27 8.54 46.69 23.28 15.31 1.45 7.37 0.00 3.71 2.19 29 S C C 37.08 13.17 19.25 32.46 121.98 85.12 -103.30 148.36 84.20 6.31 9.49 56.36 14.88 12.32 1.11 9.27 0.00 4.85 1.21 30 S C S 49.40 11.47 21.87 33.18 100.03 -128.63 -90.30 -10.42 83.95 9.45 6.60 22.39 49.24 12.60 0.56 5.79 0.00 8.54 0.89 31 W E E 69.95 14.42 23.38 37.50 119.08 49.48 -112.02 133.26 37.95 57.00 5.05 24.99 8.48 5.22 0.58 4.43 0.00 55.47 0.82 32 L E E 4.48 25.53 20.16 45.77 127.50 94.57 -119.64 140.76 8.32 91.65 0.04 7.43 0.72 0.06 0.01 0.02 0.00 91.56 0.19 33 A E E 9.82 18.26 27.60 45.64 131.00 -171.42 -129.07 147.82 0.68 99.32 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.34 0.01 34 W E E 7.66 24.72 23.01 47.62 125.30 -152.21 -113.93 139.94 0.44 99.56 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.00 35 Y E E 23.92 17.29 24.02 41.22 132.26 -174.42 -130.98 150.49 0.71 99.29 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.33 0.02 36 Q E E 39.21 15.03 21.38 36.62 120.78 -144.82 -110.24 134.63 2.84 97.16 0.00 2.39 0.20 0.01 0.00 0.00 0.00 97.31 0.08 37 Q E E 50.21 14.16 15.88 30.59 120.46 -158.48 -107.01 136.40 27.84 72.15 0.02 25.56 1.46 0.07 0.00 0.02 0.00 71.60 1.29 38 K C C 100.04 6.07 15.99 23.29 119.21 -137.04 -88.31 146.19 97.67 2.30 0.03 95.98 1.87 0.14 0.01 0.02 0.00 1.59 0.39 39 P C T 101.76 4.25 11.42 17.74 109.57 -85.63 -58.60 134.01 99.61 0.11 0.28 0.36 3.29 95.98 0.01 0.26 0.00 0.07 0.03 40 G C T 68.72 0.33 13.16 10.95 95.64 18.54 83.21 -3.63 99.63 0.08 0.29 0.44 3.21 95.98 0.01 0.30 0.00 0.05 0.01 41 E C S 100.36 4.72 10.82 17.65 128.82 95.95 -112.74 158.09 93.11 6.47 0.42 36.78 54.76 1.62 0.09 0.36 0.00 2.29 4.10 42 A C C 73.53 2.78 16.84 20.00 116.03 -97.12 -70.70 149.96 97.11 2.86 0.03 87.07 10.12 0.17 0.01 0.02 0.00 2.23 0.39 43 P C C 42.63 18.49 10.84 28.45 115.04 -101.86 -65.96 144.06 90.85 9.12 0.02 89.20 1.72 0.11 0.00 0.02 0.00 8.64 0.31 44 K E E 104.63 6.21 21.29 28.46 123.69 -158.66 -120.41 138.97 8.85 91.11 0.05 7.84 0.87 0.07 0.02 0.03 0.00 90.45 0.73 45 L E E 68.57 15.28 17.16 32.08 110.78 -116.01 -75.67 126.94 1.01 98.98 0.01 0.92 0.04 0.00 0.00 0.00 0.00 98.97 0.06 46 L E E 30.07 16.95 20.21 37.18 101.05 176.72 -95.56 -33.28 2.77 97.21 0.02 1.73 0.85 0.04 0.00 0.01 0.00 97.35 0.02 47 I E E 24.66 17.96 20.75 38.70 135.92 6.26 -147.32 142.70 1.19 98.80 0.01 0.88 0.15 0.01 0.00 0.00 0.00 98.91 0.04 48 S E E 28.96 17.73 19.65 36.47 131.27 -175.61 -138.05 142.38 8.63 91.28 0.08 7.26 0.93 0.11 0.03 0.04 0.00 91.42 0.21 49 D E E 55.84 10.16 22.92 33.15 116.15 -153.08 -111.95 123.49 37.10 60.52 2.38 28.58 7.83 1.97 1.17 1.25 0.00 57.76 1.43 50 A H G 31.66 17.35 14.79 31.40 96.67 -147.61 -67.38 -24.98 41.12 6.58 52.30 16.65 9.88 15.97 20.77 30.43 0.17 4.85 1.29 51 S H G 74.39 3.71 19.20 23.33 93.82 64.30 -71.74 -24.23 41.40 2.44 56.15 11.47 8.77 20.70 23.75 32.76 0.14 1.48 0.92 52 S H G 50.06 8.71 16.68 26.20 99.33 49.73 -88.95 -10.12 38.93 3.22 57.85 16.17 8.64 14.34 24.31 33.49 0.09 1.84 1.12 53 L C H 43.19 18.56 11.26 28.30 101.78 78.88 -79.48 -11.58 49.93 4.97 45.10 27.95 11.12 11.67 29.23 15.25 0.10 2.79 1.88 54 E C H 130.31 3.99 16.55 21.66 98.57 77.97 -75.26 -17.83 55.47 6.08 38.45 24.86 11.61 20.04 24.89 12.45 0.21 3.67 2.27 55 S C T 75.39 4.35 15.94 21.14 103.18 55.34 -87.05 1.95 72.90 2.38 24.73 14.53 15.97 42.24 14.71 9.89 0.09 1.29 1.28 56 G C T 45.76 6.20 16.87 23.93 103.21 -89.63 87.34 4.88 93.46 2.27 4.26 27.03 24.68 42.27 1.21 2.74 0.00 1.29 0.79 57 V C C 36.70 17.50 11.99 29.17 116.97 127.42 -91.51 131.11 90.38 8.76 0.86 62.30 26.56 1.87 0.34 0.52 0.00 4.19 4.21 58 P C C 56.73 9.67 17.62 28.19 111.36 -110.18 -66.72 148.37 90.67 5.63 3.69 65.53 13.93 10.83 0.78 3.30 0.00 4.03 1.61 59 S C C 67.16 9.59 17.32 27.24 99.87 -116.19 -74.49 -3.27 87.41 6.38 6.21 47.72 21.21 18.44 0.73 6.18 0.00 4.58 1.14 60 R C C 104.96 10.47 19.63 30.06 101.11 72.33 -93.83 10.14 76.32 18.58 5.10 38.22 26.92 11.74 0.64 4.44 0.00 16.80 1.22 61 F E E 27.20 22.75 13.19 35.15 122.62 109.43 -108.85 137.54 25.31 74.01 0.69 20.94 4.26 0.88 0.22 0.45 0.00 72.05 1.19 62 S E E 55.60 6.41 23.98 31.58 133.72 -174.07 -137.15 154.77 6.69 93.21 0.10 5.98 0.58 0.09 0.04 0.04 0.00 92.86 0.42 63 G E E 23.55 18.85 14.88 32.36 140.04 171.52 -154.08 166.48 5.10 94.86 0.04 4.38 0.48 0.07 0.01 0.02 0.00 94.84 0.21 64 S E E 64.94 4.63 21.70 27.90 135.82 -172.18 -147.28 156.73 9.26 90.70 0.04 8.04 0.90 0.12 0.01 0.03 0.00 90.60 0.31 65 G E E 32.03 10.07 15.29 26.37 138.54 130.99 141.82 -169.24 26.13 73.77 0.10 19.07 6.82 0.88 0.01 0.11 0.00 72.45 0.66 66 S C C 79.77 2.77 20.04 23.21 115.45 -102.74 -120.37 115.15 58.87 40.86 0.27 44.89 11.59 2.22 0.05 0.30 0.00 38.86 2.09 67 G C S 36.99 8.42 18.69 27.47 108.61 -50.60 65.00 -125.10 98.64 0.89 0.48 1.93 56.84 40.04 0.02 0.44 0.00 0.64 0.10 68 T C S 54.51 14.43 16.09 30.52 97.61 -10.63 -97.61 0.05 98.60 1.01 0.39 1.87 57.35 39.56 0.01 0.34 0.00 0.78 0.09 69 E E E 78.27 8.81 22.24 32.15 122.64 82.95 -109.64 134.40 31.32 68.57 0.11 22.87 8.16 0.81 0.01 0.14 0.00 66.58 1.43 70 F E E 7.95 24.38 15.99 40.80 128.55 -174.14 -127.31 142.61 9.10 90.90 0.00 8.74 0.21 0.01 0.00 0.00 0.00 90.84 0.20 71 T E E 34.07 10.30 27.06 38.48 121.74 -158.38 -117.57 133.06 1.99 98.01 0.00 1.71 0.06 0.00 0.00 0.00 0.00 98.20 0.02 72 L E E 2.83 26.23 18.88 46.09 119.86 -163.49 -113.60 128.63 0.21 99.79 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 73 T E E 38.74 10.31 27.31 38.46 120.25 -164.22 -114.95 130.28 0.11 99.89 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.87 0.00 74 I E E 7.56 24.11 16.54 41.15 117.66 -165.13 -113.12 124.98 2.61 97.39 0.00 2.69 0.03 0.00 0.00 0.00 0.00 96.97 0.31 75 S C C 47.81 7.29 22.89 30.40 120.50 -163.96 -105.94 158.99 94.81 5.14 0.05 51.64 39.09 3.18 0.00 0.10 0.00 5.80 0.19 76 S C S 67.72 4.28 24.18 28.42 98.04 11.09 60.78 60.67 99.27 0.70 0.03 12.83 82.53 3.95 0.00 0.04 0.00 0.56 0.08 77 L C C 19.28 23.71 10.46 33.61 113.35 -143.34 -74.73 131.99 99.46 0.53 0.01 97.97 1.51 0.03 0.00 0.00 0.00 0.17 0.30 78 Q C C 80.44 4.53 23.81 28.26 130.92 -173.29 -125.29 157.06 99.90 0.09 0.01 99.28 0.62 0.01 0.00 0.00 0.00 0.02 0.07 79 P H G 71.99 12.30 15.28 27.87 90.97 -103.94 -58.97 -31.57 4.08 0.02 95.90 0.15 0.21 2.74 0.22 96.67 0.00 0.01 0.00 80 D H G 101.04 3.59 21.29 25.64 89.56 62.51 -72.90 -12.56 3.38 0.03 96.59 0.09 0.17 2.34 0.15 97.23 0.00 0.02 0.00 81 D H G 15.47 20.23 16.15 36.86 93.42 63.31 -87.41 -1.96 4.31 0.06 95.62 0.60 0.44 1.78 0.25 96.88 0.00 0.06 0.00 82 F C C 50.72 16.83 19.97 36.85 118.27 105.10 -80.22 138.10 84.10 15.74 0.16 80.73 3.39 0.10 0.02 0.14 0.00 15.20 0.43 83 A E E 12.88 17.24 22.53 39.43 143.10 154.53 -155.83 172.21 5.19 94.81 0.00 5.04 0.23 0.01 0.00 0.00 0.00 94.37 0.34 84 T E E 36.81 12.95 25.64 39.02 119.60 -94.12 -103.57 135.55 0.66 99.34 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.35 0.02 85 Y E E 6.63 25.38 19.53 45.18 124.74 -164.69 -117.25 139.15 0.52 99.48 0.00 0.45 0.03 0.00 0.00 0.00 0.00 99.51 0.01 86 Y E E 35.70 15.40 27.18 42.63 128.56 -168.73 -123.60 146.52 1.92 98.06 0.01 1.66 0.12 0.01 0.00 0.01 0.00 98.14 0.06 87 C E E 3.08 25.33 20.94 46.61 123.66 -157.13 -114.25 136.60 8.02 91.80 0.18 6.87 0.78 0.15 0.06 0.09 0.00 91.82 0.23 88 Q E E 34.11 14.47 25.61 40.12 126.73 -169.39 -124.54 141.68 7.39 92.31 0.30 6.47 0.64 0.16 0.11 0.14 0.00 92.08 0.40 89 Q E E 28.91 18.30 18.74 36.89 121.92 -154.75 -111.34 135.98 13.53 86.02 0.45 10.84 2.25 0.58 0.13 0.26 0.00 85.36 0.57 90 Y E E 81.32 10.98 17.63 29.53 117.77 -157.52 -108.18 128.45 30.19 69.24 0.57 23.26 6.03 1.65 0.13 0.43 0.00 67.28 1.22 91 Y C E 111.04 8.34 13.37 22.81 115.93 173.33 -113.41 144.55 62.69 36.20 1.12 33.65 19.44 10.39 0.16 1.00 0.00 33.95 1.42 92 S C S 90.75 1.76 14.96 16.84 101.69 -34.67 -85.13 -10.01 95.43 3.34 1.23 21.70 42.45 31.44 0.13 1.17 0.00 2.63 0.48 93 S C S 66.89 3.75 14.41 19.49 125.70 29.73 -121.26 147.47 93.31 5.57 1.12 24.22 47.95 21.20 0.12 1.09 0.00 4.73 0.70 94 P C C 69.47 10.34 14.02 25.12 113.62 -95.93 -70.06 144.19 66.23 33.32 0.45 50.38 10.85 3.01 0.06 0.44 0.00 34.42 0.84 95 T E E 52.54 11.76 16.75 29.20 124.13 -157.87 -116.36 138.56 25.96 73.76 0.28 21.70 3.15 0.78 0.08 0.22 0.00 71.54 2.52 96 F E E 78.85 14.55 17.36 31.67 119.99 -153.99 -106.06 134.31 17.80 82.05 0.16 14.93 2.02 0.44 0.06 0.11 0.00 78.61 3.84 97 G E E 20.82 14.66 18.25 32.45 121.28 -164.53 -90.31 171.36 47.79 52.07 0.14 38.32 7.65 1.16 0.03 0.12 0.00 51.76 0.97 98 G C C 36.71 9.26 21.93 30.88 114.67 -105.65 -77.96 160.98 63.68 36.23 0.09 53.73 7.05 0.69 0.01 0.08 0.00 37.94 0.50 99 G C C 18.91 17.16 17.01 33.10 131.27 -138.51 -126.62 175.91 54.31 45.64 0.05 48.56 3.39 0.24 0.01 0.04 0.00 47.35 0.41 100 T E E 33.79 15.41 19.53 35.06 129.77 -115.30 -128.01 146.44 8.68 91.32 0.01 8.10 0.33 0.01 0.00 0.00 0.00 91.34 0.21 101 K E E 102.07 9.64 22.72 32.67 119.86 -137.57 -101.93 134.04 1.22 98.78 0.00 1.07 0.07 0.00 0.00 0.00 0.00 98.82 0.03 102 V E E 12.12 22.53 14.75 37.33 120.36 -163.63 -114.79 131.02 1.15 98.85 0.00 1.09 0.03 0.00 0.00 0.00 0.00 98.86 0.02 103 E E E 94.90 5.62 23.75 29.70 117.32 -157.17 -106.70 128.02 2.21 97.78 0.01 2.17 0.06 0.01 0.00 0.00 0.00 97.67 0.09 104 I E E 28.68 20.55 10.99 30.73 115.67 -154.06 -97.35 126.13 13.98 85.96 0.06 14.24 0.22 0.04 0.03 0.02 0.00 84.65 0.81 105 K C C 127.76 4.14 19.49 24.49 114.75 -160.16 -98.62 131.94 99.43 0.57 0.00 99.48 0.05 0.01 0.00 0.00 0.00 0.44 0.01