# 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 100.51 4.03 21.26 25.47 103.42 -128.08 -78.20 82.64 99.87 0.13 0.00 99.78 0.11 0.02 0.00 0.00 0.00 0.09 0.00 1 I C C 33.12 21.08 10.67 30.60 117.32 -156.05 -96.96 130.90 62.49 37.43 0.08 61.81 0.52 0.13 0.02 0.04 0.00 36.70 0.79 2 V E E 75.82 5.50 22.21 28.34 120.14 -166.31 -115.26 132.30 17.81 82.08 0.11 16.41 1.12 0.16 0.05 0.06 0.00 81.07 1.14 3 M E E 45.81 20.17 13.23 32.60 119.21 -155.88 -105.75 130.55 13.85 86.04 0.11 12.91 0.75 0.14 0.04 0.06 0.00 85.04 1.05 4 T E E 65.58 7.32 21.12 29.08 123.99 -172.80 -120.67 138.69 25.64 74.17 0.19 22.44 2.43 0.37 0.06 0.13 0.00 73.11 1.46 5 Q C E 74.25 13.68 16.07 29.65 126.63 -159.91 -124.72 138.28 56.46 43.31 0.23 40.72 15.15 1.16 0.05 0.22 0.00 41.37 1.33 6 S C C 54.24 10.17 17.34 28.13 121.44 -142.89 -103.09 146.94 83.72 16.14 0.14 50.49 31.82 1.28 0.02 0.14 0.00 15.55 0.71 7 P C C 56.62 9.79 16.88 27.39 115.22 11.85 -71.46 150.33 88.26 11.03 0.71 66.39 17.33 3.55 0.07 0.81 0.00 11.20 0.64 8 A C S 61.50 9.97 16.53 27.14 97.06 -150.73 -82.09 -24.55 80.49 19.06 0.44 26.46 49.92 2.75 0.03 0.45 0.00 19.82 0.58 9 S E E 56.39 6.80 20.60 28.60 136.79 13.34 -149.53 150.91 17.86 81.83 0.32 14.22 3.26 0.52 0.04 0.30 0.00 81.23 0.44 10 L E E 32.22 19.65 14.83 33.91 131.54 -174.32 -138.19 142.53 3.25 96.74 0.01 2.94 0.21 0.01 0.00 0.01 0.00 96.69 0.15 11 S E E 65.59 6.60 23.14 30.97 123.15 -156.80 -118.78 137.81 2.48 97.51 0.00 2.29 0.12 0.00 0.00 0.00 0.00 97.46 0.11 12 V E E 16.80 19.51 14.42 34.09 135.74 171.99 -142.91 155.35 14.51 85.48 0.01 13.43 0.55 0.01 0.00 0.00 0.00 85.72 0.27 13 P E E 64.58 5.11 23.13 28.09 119.00 -105.62 -74.92 154.73 37.23 62.66 0.11 35.04 1.68 0.22 0.04 0.08 0.00 57.89 5.05 14 V C T 59.98 15.34 13.85 29.02 109.69 -86.17 -60.15 135.29 98.93 0.69 0.37 0.32 3.07 95.87 0.01 0.27 0.00 0.38 0.09 15 G C T 46.34 4.03 19.89 24.69 95.84 23.07 88.78 -6.49 99.50 0.26 0.24 0.45 3.66 95.47 0.01 0.21 0.00 0.17 0.03 16 E C C 77.45 8.99 17.03 27.22 122.44 122.68 -81.67 152.37 96.66 3.25 0.09 70.32 26.21 0.33 0.01 0.08 0.00 2.71 0.34 17 T C C 76.79 8.25 19.54 28.80 121.04 -128.86 -101.62 137.72 68.86 31.13 0.01 69.74 0.32 0.01 0.00 0.00 0.00 29.46 0.46 18 V E E 10.86 22.50 14.71 37.30 127.55 -170.28 -126.83 141.82 0.67 99.33 0.00 0.70 0.01 0.00 0.00 0.00 0.00 99.22 0.07 19 T E E 60.84 8.02 25.28 33.77 118.36 -147.07 -107.92 128.80 0.25 99.75 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.00 20 I E E 4.27 25.79 16.83 43.49 120.00 -165.95 -114.34 128.61 1.07 98.93 0.00 1.01 0.02 0.00 0.00 0.00 0.00 98.96 0.01 21 T E E 40.21 9.78 27.16 37.78 120.47 -164.77 -112.63 133.58 6.56 93.44 0.00 6.10 0.11 0.00 0.00 0.00 0.00 93.75 0.04 22 C E E 3.48 26.08 16.92 43.59 125.48 -170.91 -122.62 139.66 9.55 90.45 0.00 8.84 0.26 0.01 0.00 0.00 0.00 90.78 0.11 23 R E E 103.29 7.48 27.62 35.93 119.84 -161.24 -114.89 129.71 5.51 94.48 0.01 5.29 0.22 0.01 0.00 0.00 0.00 93.68 0.79 24 T E E 14.02 23.70 14.23 37.34 125.07 -161.09 -106.73 149.22 34.27 65.66 0.07 33.82 0.91 0.09 0.02 0.04 0.00 62.73 2.39 25 S C C 40.29 8.75 19.31 28.82 120.31 -119.47 -84.39 165.41 77.92 21.81 0.28 71.77 5.07 0.82 0.06 0.24 0.00 19.81 2.23 26 E C T 138.98 3.37 18.33 22.43 100.65 -78.60 -68.01 -11.62 94.91 2.91 2.19 4.11 23.79 67.30 0.27 1.85 0.00 2.13 0.54 27 N C T 103.78 4.48 20.02 24.93 98.03 34.70 -83.37 20.69 96.67 1.72 1.61 10.49 20.91 65.18 0.20 1.52 0.00 1.44 0.27 28 I C C 26.57 21.20 13.89 34.17 115.47 124.49 -91.30 131.47 84.70 13.55 1.76 59.72 19.71 4.60 0.44 1.57 0.00 8.28 5.68 29 Y C C 76.11 13.20 22.16 35.07 120.00 -162.68 -106.45 141.49 85.75 13.42 0.83 74.47 7.86 2.75 0.16 0.79 0.00 12.15 1.82 30 S C S 38.64 14.83 22.26 36.17 101.44 -152.50 -97.22 -20.00 81.36 18.15 0.48 26.39 49.76 4.62 0.04 0.47 0.00 18.06 0.66 31 N E E 47.16 12.71 25.05 37.93 125.36 42.47 -120.40 137.38 31.15 68.38 0.47 22.71 6.58 1.86 0.05 0.44 0.00 67.92 0.44 32 L E E 3.87 26.17 19.39 45.90 125.16 -171.82 -119.31 139.20 5.01 94.97 0.02 4.50 0.36 0.03 0.00 0.01 0.00 94.97 0.13 33 A E E 13.25 16.58 27.94 44.56 128.38 -169.90 -126.32 145.20 0.75 99.25 0.00 0.67 0.03 0.00 0.00 0.00 0.00 99.29 0.01 34 W E E 7.68 24.90 22.30 47.16 124.74 -157.41 -115.13 139.09 0.45 99.55 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.57 0.00 35 Y E E 26.06 16.50 24.21 40.76 132.55 -174.50 -130.96 149.80 0.56 99.44 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.48 0.02 36 Q E E 37.66 15.14 21.15 36.53 121.84 -147.47 -111.62 136.80 2.52 97.47 0.01 2.10 0.23 0.02 0.00 0.00 0.00 97.57 0.08 37 Q E E 52.89 13.52 15.55 29.79 118.62 -142.80 -101.82 133.66 28.76 71.20 0.04 25.98 1.80 0.12 0.01 0.03 0.00 71.28 0.79 38 K C C 96.03 6.50 14.67 22.58 119.62 -142.74 -91.13 149.12 92.37 7.50 0.13 88.68 3.29 0.59 0.03 0.09 0.00 6.11 1.21 39 Q C T 143.00 2.31 11.23 15.37 108.57 -82.22 -59.68 131.88 99.35 0.27 0.38 0.68 5.43 93.28 0.02 0.35 0.00 0.18 0.05 40 G C T 69.54 0.25 12.54 10.02 96.01 16.94 83.49 -2.71 99.58 0.11 0.32 0.77 5.20 93.59 0.01 0.34 0.00 0.07 0.02 41 K C S 110.11 4.33 9.96 16.42 128.97 91.38 -114.87 160.72 93.06 6.63 0.31 31.29 60.76 1.23 0.07 0.22 0.00 2.30 4.13 42 S C C 79.38 1.93 16.67 18.47 117.00 -94.68 -71.97 150.52 97.38 2.59 0.03 85.55 11.87 0.17 0.01 0.02 0.00 2.05 0.32 43 P C C 47.33 17.37 10.87 27.47 115.01 -100.50 -66.62 144.75 92.32 7.64 0.03 89.96 2.26 0.14 0.00 0.03 0.00 7.35 0.26 44 Q E E 85.01 7.46 20.69 28.99 124.17 -156.12 -119.14 138.71 8.39 91.55 0.06 7.31 0.92 0.08 0.02 0.03 0.00 91.18 0.46 45 L E E 66.07 15.16 17.78 32.59 110.92 -115.68 -75.69 126.30 0.81 99.17 0.01 0.72 0.04 0.00 0.00 0.00 0.00 99.21 0.02 46 L E E 25.29 17.74 20.36 38.10 101.26 176.72 -95.93 -34.37 1.98 98.00 0.02 1.36 0.49 0.02 0.01 0.01 0.00 98.11 0.01 47 V E E 16.60 19.42 21.26 40.52 137.05 4.99 -149.41 143.78 0.42 99.57 0.01 0.34 0.03 0.00 0.00 0.00 0.00 99.61 0.01 48 Y E E 59.76 18.02 21.93 38.69 127.51 -171.55 -131.01 135.26 1.85 98.10 0.05 1.61 0.10 0.01 0.02 0.01 0.00 98.18 0.06 49 A E E 24.65 15.43 22.53 37.61 120.33 -168.85 -117.72 129.04 21.14 77.60 1.26 17.21 3.16 0.73 0.62 0.48 0.00 77.21 0.59 50 A C C 22.67 17.79 17.21 34.67 123.44 -170.95 -114.68 139.68 54.96 31.33 13.70 42.54 8.56 4.12 4.52 8.06 0.01 30.74 1.44 51 T C C 80.93 6.88 20.14 27.51 105.92 -160.46 -98.13 -14.78 62.40 13.45 24.15 27.61 20.82 16.29 9.19 13.55 0.17 10.27 2.10 52 N C C 91.01 5.99 19.84 26.30 109.75 24.74 -110.67 104.12 62.27 11.79 25.94 32.74 14.69 16.64 10.38 14.52 0.15 7.92 2.97 53 L C C 44.71 18.58 11.27 28.57 109.03 -128.45 -88.82 105.14 65.63 9.63 24.74 47.77 9.81 7.72 12.90 12.17 0.02 6.36 3.25 54 A C C 63.15 6.71 15.44 23.19 110.96 -112.05 -79.18 126.78 64.31 12.89 22.80 34.65 13.07 17.37 10.70 11.23 0.12 6.99 5.87 55 D C T 113.87 2.80 15.72 19.57 102.55 -12.09 -72.99 80.21 82.34 2.35 15.31 10.45 15.82 55.92 5.74 9.42 0.03 1.42 1.20 56 G C T 50.37 4.56 16.54 22.16 100.55 -27.32 85.71 1.46 92.74 1.99 5.27 15.90 23.38 53.62 1.07 4.07 0.00 1.27 0.68 57 V C C 34.23 17.21 11.56 28.71 116.99 120.82 -96.78 130.61 81.19 17.94 0.86 52.92 27.88 1.51 0.40 0.50 0.00 7.11 9.67 58 P C C 59.02 8.74 18.41 28.12 110.94 -111.80 -67.18 146.21 86.40 9.55 4.04 66.77 11.23 7.81 0.97 3.49 0.00 7.52 2.20 59 S C C 56.04 13.21 16.63 29.30 102.74 -132.32 -81.47 4.94 83.29 9.47 7.24 49.09 19.45 14.86 1.01 6.80 0.00 7.49 1.30 60 R C C 111.41 9.34 21.16 30.60 110.42 84.34 -107.55 80.11 67.58 25.89 6.53 38.63 20.27 9.50 1.05 5.23 0.01 23.93 1.38 61 F E E 29.61 22.65 13.60 35.40 122.71 142.11 -109.25 139.37 26.01 73.06 0.93 21.91 3.87 0.95 0.36 0.58 0.00 70.82 1.52 62 S E E 54.62 6.81 23.86 31.84 135.14 -176.71 -138.73 155.09 9.53 90.29 0.19 8.37 0.98 0.20 0.08 0.09 0.00 89.58 0.71 63 G E E 24.08 17.20 16.16 32.35 140.81 156.06 -161.76 170.19 9.74 90.16 0.10 8.17 1.26 0.22 0.03 0.06 0.00 89.80 0.47 64 S E E 64.42 5.34 21.52 28.46 135.64 -160.92 -146.35 156.14 16.91 82.97 0.13 14.57 1.84 0.33 0.03 0.09 0.00 82.56 0.58 65 G E E 29.91 11.89 15.30 27.69 139.04 135.30 112.13 166.69 35.03 64.77 0.21 24.16 10.40 1.64 0.03 0.21 0.00 62.60 0.96 66 S C C 77.79 3.10 20.86 24.46 115.21 -112.17 -120.40 111.29 60.06 39.34 0.60 38.68 17.97 5.10 0.10 0.65 0.00 34.46 3.03 67 G C S 33.71 9.72 19.05 28.93 109.26 -48.05 66.70 -129.03 98.09 1.23 0.67 2.73 55.28 40.25 0.02 0.65 0.00 0.91 0.16 68 T C S 53.44 14.84 16.63 31.29 97.36 -9.79 -97.68 0.12 98.07 1.39 0.54 2.56 55.94 39.76 0.02 0.50 0.00 1.09 0.14 69 Q E E 76.84 8.52 22.46 32.14 120.44 86.55 -106.90 132.37 34.50 65.32 0.19 23.82 10.73 1.25 0.03 0.21 0.00 61.62 2.34 70 Y E E 9.33 24.48 15.97 40.77 129.17 -174.56 -128.18 143.12 13.30 86.69 0.01 12.62 0.44 0.03 0.00 0.01 0.00 86.42 0.48 71 S E E 26.49 10.58 27.07 38.73 125.74 -166.43 -122.83 140.71 5.46 94.54 0.00 4.63 0.39 0.01 0.00 0.00 0.00 94.89 0.08 72 L E E 3.40 26.11 18.53 45.49 121.63 -162.72 -116.55 130.29 0.52 99.48 0.00 0.52 0.01 0.00 0.00 0.00 0.00 99.46 0.00 73 K E E 78.52 9.24 27.30 37.11 119.58 -163.69 -115.62 128.35 0.14 99.86 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.83 0.01 74 I E E 7.12 24.46 15.86 40.96 116.56 -163.60 -111.66 125.03 2.11 97.89 0.00 2.20 0.02 0.00 0.00 0.00 0.00 97.46 0.32 75 N C C 73.02 6.69 23.35 30.22 120.17 -168.23 -103.77 151.47 92.88 7.06 0.07 46.76 40.06 4.78 0.00 0.11 0.00 8.06 0.23 76 S C S 61.62 5.06 24.29 29.39 108.26 11.31 61.57 98.19 98.99 0.98 0.03 10.23 83.87 4.93 0.00 0.04 0.00 0.83 0.09 77 L C C 17.65 24.07 10.73 34.38 113.20 -141.38 -76.82 130.38 99.17 0.81 0.01 97.95 1.32 0.03 0.00 0.01 0.00 0.28 0.40 78 Q C C 79.13 4.55 23.62 28.09 131.20 -172.70 -125.52 159.48 99.84 0.14 0.02 99.48 0.38 0.01 0.01 0.00 0.00 0.02 0.10 79 S H G 65.39 10.29 15.30 26.30 90.99 -103.77 -58.89 -31.98 3.30 0.02 96.69 0.19 0.21 2.09 0.37 97.12 0.00 0.01 0.00 80 E H G 129.92 3.08 20.93 24.60 89.87 63.06 -69.87 -16.92 2.59 0.02 97.39 0.10 0.15 1.76 0.30 97.67 0.00 0.02 0.00 81 D H G 10.52 21.93 14.95 37.29 93.69 60.94 -85.95 -5.57 3.37 0.03 96.59 0.44 0.32 1.54 0.43 97.24 0.00 0.03 0.00 82 F C C 59.26 16.85 18.30 34.97 116.24 107.82 -71.72 138.10 92.72 6.83 0.44 87.44 5.24 0.32 0.08 0.39 0.00 5.98 0.56 83 G E E 16.59 8.86 23.64 34.20 141.25 86.93 148.89 -168.86 15.25 84.68 0.07 11.83 3.42 0.38 0.01 0.06 0.00 83.42 0.88 84 S E E 37.61 11.21 24.48 36.22 119.33 -39.95 -98.11 136.84 3.20 96.77 0.03 2.80 0.31 0.03 0.00 0.01 0.00 96.73 0.12 85 Y E E 9.34 24.87 18.78 43.76 125.60 -166.28 -119.58 140.56 1.91 98.06 0.02 1.63 0.18 0.02 0.01 0.01 0.00 98.07 0.09 86 Y E E 36.47 15.97 27.37 43.21 129.78 -170.59 -127.18 145.17 4.14 95.76 0.10 3.44 0.43 0.08 0.03 0.05 0.00 95.82 0.16 87 C E E 3.48 25.19 21.61 46.95 121.66 -156.46 -111.91 134.34 11.83 87.52 0.66 9.84 1.29 0.40 0.27 0.29 0.00 87.60 0.32 88 Q E E 33.55 15.18 25.71 40.73 126.46 -170.98 -122.89 140.08 10.42 88.61 0.98 8.81 1.14 0.41 0.43 0.40 0.00 88.39 0.43 89 H E E 31.13 19.10 19.22 37.86 120.42 -152.99 -108.43 132.85 13.90 84.98 1.12 10.74 2.54 0.98 0.37 0.56 0.00 84.29 0.51 90 F E E 68.86 11.58 19.13 31.36 117.77 -162.63 -110.32 129.15 23.60 75.18 1.22 17.73 5.02 1.90 0.37 0.73 0.00 73.03 1.22 91 W C E 111.11 10.66 14.79 26.11 113.26 -169.11 -106.07 115.72 54.77 44.05 1.18 30.59 17.21 8.54 0.21 0.92 0.01 41.23 1.30 92 S C S 70.24 4.64 15.60 21.18 118.73 -5.86 -113.32 154.97 88.78 10.63 0.59 24.97 46.08 17.22 0.06 0.64 0.00 10.28 0.75 93 T C S 84.67 4.56 14.78 20.70 119.36 -6.72 -103.32 138.49 89.90 9.63 0.47 26.95 52.98 9.58 0.05 0.51 0.00 9.04 0.89 94 P C C 72.19 7.72 15.63 24.41 113.74 -74.50 -71.14 147.91 77.35 22.17 0.48 53.14 17.62 4.84 0.07 0.48 0.00 23.11 0.74 95 W E E 81.19 15.28 14.20 29.52 118.34 -141.62 -101.79 136.27 42.70 56.95 0.34 37.02 3.87 0.93 0.08 0.25 0.00 56.82 1.03 96 T E E 58.28 10.65 20.14 31.21 123.48 -162.25 -119.34 135.66 17.11 82.61 0.28 14.99 1.57 0.38 0.13 0.15 0.00 79.57 3.22 97 F E E 54.97 17.68 15.81 32.81 118.64 -161.68 -108.48 136.26 29.66 69.55 0.79 22.34 6.11 2.76 0.26 0.59 0.00 65.59 2.35 98 G C T 28.75 10.51 18.44 29.06 120.82 -109.85 78.04 -160.70 73.28 24.73 2.00 23.74 24.50 25.62 0.21 1.79 0.00 22.85 1.28 99 E C T 130.99 4.64 19.93 25.15 102.90 -30.18 -82.01 26.44 82.35 14.38 3.27 16.39 29.71 36.63 0.31 2.92 0.01 12.79 1.24 100 G C S 23.73 12.98 17.88 30.60 120.47 -37.77 100.02 -143.66 72.09 26.31 1.60 24.47 30.53 17.32 0.14 1.56 0.00 24.95 1.03 101 T E E 26.99 19.14 16.47 35.06 120.45 -80.14 -109.04 136.49 43.21 56.59 0.21 37.77 3.24 0.53 0.04 0.15 0.00 57.74 0.52 102 K E E 95.23 8.95 23.72 33.01 122.33 -159.10 -113.95 134.16 6.89 92.99 0.12 6.10 0.63 0.11 0.05 0.04 0.00 92.68 0.39 103 L E E 20.16 22.34 15.13 37.10 120.60 -161.94 -113.13 129.10 3.69 96.23 0.08 3.50 0.16 0.04 0.03 0.02 0.00 96.08 0.17 104 E E E 90.69 6.18 22.87 29.61 118.60 -161.29 -110.61 128.65 5.23 94.68 0.10 5.00 0.24 0.06 0.05 0.03 0.00 94.25 0.37 105 I E E 37.87 18.84 11.57 29.84 116.50 -157.44 -103.62 126.08 22.81 77.03 0.16 22.57 0.37 0.12 0.08 0.06 0.00 75.72 1.08 106 K C C 125.14 4.32 18.75 24.07 116.72 -162.57 -100.60 131.78 99.14 0.85 0.01 99.20 0.06 0.02 0.00 0.00 0.00 0.71 0.01