# 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 M C C 89.15 11.40 16.73 28.15 115.55 -172.71 -100.18 129.38 99.63 0.37 0.00 99.64 0.08 0.01 0.00 0.00 0.00 0.25 0.01 1 G C E 29.72 8.49 17.76 27.12 127.12 -108.10 144.60 -173.06 50.04 49.92 0.04 46.74 1.36 0.34 0.00 0.04 0.00 50.86 0.66 2 V E E 53.90 16.39 12.31 28.44 124.20 -120.16 -114.93 137.29 11.12 88.87 0.01 9.91 0.71 0.04 0.00 0.01 0.00 89.17 0.17 3 Q E E 91.17 6.12 19.82 27.11 123.58 -165.18 -117.07 138.25 0.96 99.04 0.00 0.88 0.03 0.00 0.00 0.00 0.00 99.08 0.01 4 V E E 55.63 17.89 13.12 30.39 124.81 -163.40 -121.20 135.08 0.52 99.48 0.00 0.50 0.01 0.00 0.00 0.00 0.00 99.48 0.01 5 E E E 90.47 6.25 20.17 27.55 127.52 -173.07 -128.93 141.23 0.49 99.51 0.00 0.47 0.01 0.00 0.00 0.00 0.00 99.51 0.01 6 T E E 64.30 13.02 15.01 28.18 111.80 -129.53 -83.64 124.84 1.86 98.13 0.01 1.80 0.04 0.01 0.00 0.00 0.00 98.08 0.07 7 I E E 72.79 10.19 16.99 28.08 100.43 175.28 -93.44 -32.26 27.54 72.42 0.04 14.93 12.57 0.57 0.00 0.04 0.00 71.53 0.35 8 S C S 48.89 8.10 18.33 27.48 128.06 6.65 -143.48 130.28 59.02 40.93 0.04 18.86 39.83 0.85 0.00 0.04 0.00 39.78 0.64 9 P C C 74.53 9.37 17.39 27.36 112.75 -116.81 -69.61 146.63 88.41 11.14 0.45 73.91 10.09 3.39 0.06 0.50 0.00 11.19 0.86 10 G C C 20.63 16.93 12.24 28.24 119.01 -127.58 -77.98 167.56 93.79 4.57 1.64 61.41 20.91 11.14 0.23 1.83 0.00 2.45 2.04 11 D C S 101.32 3.55 19.92 23.63 99.92 -117.87 -91.00 7.14 90.88 4.27 4.84 29.22 33.23 28.17 0.52 4.83 0.00 1.95 2.09 12 G C S 33.19 12.96 13.14 26.05 97.10 -108.20 78.01 4.93 91.52 2.51 5.97 20.35 37.49 33.21 0.48 6.15 0.00 1.34 0.98 13 R C C 150.81 3.64 18.80 23.29 96.25 103.00 -82.14 -19.91 89.19 5.01 5.79 40.72 32.48 15.37 0.69 5.92 0.00 2.90 1.91 14 T C C 65.94 9.51 18.65 28.47 110.29 50.26 -106.23 18.18 85.85 11.43 2.73 59.69 19.43 5.68 0.55 2.53 0.00 5.69 6.43 15 F C C 56.78 18.71 16.95 34.80 123.62 90.54 -105.34 140.36 93.06 6.88 0.06 76.57 16.45 0.16 0.02 0.03 0.00 4.42 2.35 16 P C C 14.37 21.28 14.66 36.10 116.24 -106.83 -67.79 150.58 96.11 3.87 0.02 96.23 0.53 0.04 0.01 0.01 0.00 1.68 1.51 17 K C C 119.78 3.96 22.71 27.10 121.28 -125.00 -89.22 153.93 96.53 3.42 0.06 94.76 0.96 0.10 0.02 0.02 0.00 0.43 3.72 18 R C T 141.72 8.07 14.93 24.44 110.07 -82.15 -59.96 134.45 99.42 0.30 0.29 0.17 1.78 97.66 0.02 0.15 0.00 0.11 0.11 19 G C T 47.28 3.49 18.99 23.29 95.50 23.68 87.22 -5.84 99.77 0.10 0.13 0.29 1.86 97.68 0.01 0.09 0.00 0.07 0.01 20 Q C C 54.74 11.66 15.97 28.81 120.96 125.82 -78.60 152.19 94.08 5.89 0.02 90.13 3.85 0.09 0.00 0.03 0.00 5.61 0.28 21 T E E 56.87 10.24 21.84 32.45 123.79 -137.03 -109.90 141.70 3.68 96.32 0.00 3.71 0.08 0.00 0.00 0.00 0.00 95.90 0.31 22 C E E 5.02 23.95 16.76 41.07 132.70 -173.99 -133.53 151.00 0.23 99.77 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 23 V E E 40.10 10.44 25.98 37.41 117.84 -140.24 -107.93 128.45 0.11 99.89 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 24 V E E 3.13 25.86 18.14 44.89 121.36 -164.92 -114.66 131.53 0.32 99.68 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.68 0.00 25 H E E 52.42 10.35 26.46 37.57 117.91 -159.39 -107.49 129.13 2.02 97.98 0.00 1.84 0.08 0.00 0.00 0.00 0.00 98.06 0.01 26 Y E E 9.28 24.51 17.60 42.15 131.60 -175.70 -130.03 149.77 3.92 96.08 0.01 3.45 0.39 0.01 0.00 0.00 0.00 96.11 0.04 27 T E E 35.36 10.56 26.20 37.50 126.76 -160.87 -122.66 141.98 3.12 96.87 0.00 2.79 0.20 0.01 0.00 0.00 0.00 96.95 0.04 28 G E E 4.07 21.53 18.25 39.73 138.27 165.31 -139.49 167.57 1.05 98.95 0.00 0.87 0.09 0.00 0.00 0.00 0.00 99.02 0.01 29 M E E 51.55 9.68 22.90 33.72 127.60 -135.16 -124.42 143.57 0.44 99.55 0.00 0.45 0.01 0.00 0.00 0.00 0.00 98.94 0.59 30 L E E 23.43 15.38 14.20 30.38 121.68 -127.92 -80.47 165.12 47.18 52.77 0.06 46.61 0.61 0.08 0.01 0.03 0.00 51.22 1.44 31 E C T 119.24 7.71 13.79 22.79 91.15 -99.84 -62.37 -25.56 98.07 1.22 0.71 0.57 3.28 94.49 0.02 0.62 0.00 0.91 0.10 32 D C T 112.59 1.30 14.41 15.27 93.15 56.19 -86.51 1.65 99.15 0.15 0.70 0.32 2.90 96.00 0.02 0.65 0.00 0.08 0.03 33 G C S 45.74 5.09 11.94 18.72 96.91 -103.15 86.57 5.21 98.96 0.41 0.62 15.13 82.36 1.70 0.06 0.40 0.00 0.19 0.16 34 K C C 117.87 3.06 15.01 19.55 117.10 137.79 -79.74 142.14 97.94 2.03 0.04 96.83 1.38 0.10 0.01 0.01 0.00 1.39 0.27 35 K E E 116.77 8.53 15.06 24.91 113.33 -115.33 -78.58 132.14 2.68 97.29 0.03 2.53 0.16 0.02 0.02 0.01 0.00 88.24 9.02 36 F E E 56.22 14.91 15.90 30.95 103.77 -172.10 -98.66 -19.60 12.82 87.02 0.17 10.60 2.07 0.33 0.04 0.11 0.00 86.31 0.53 37 D E E 45.21 12.78 19.22 32.28 132.51 2.72 -136.83 146.90 45.04 53.77 1.19 31.97 11.77 2.32 0.28 0.87 0.00 51.57 1.22 38 S C C 28.06 13.09 18.09 31.97 121.15 -162.60 -117.79 141.92 74.04 17.32 8.63 58.02 10.93 5.38 3.16 5.17 0.01 15.00 2.32 39 S C C 27.19 14.82 14.68 29.96 95.95 -148.98 -72.84 -18.17 66.10 8.49 25.41 40.78 11.41 14.46 9.36 15.59 0.08 5.12 3.20 40 R C T 126.85 7.13 15.90 24.05 93.80 70.18 -67.78 -30.55 63.67 3.23 33.09 18.19 15.96 30.77 9.96 21.55 0.12 1.64 1.82 41 D C T 92.83 4.25 14.90 20.08 97.48 52.57 -86.05 -5.92 65.24 2.53 32.24 17.48 16.20 32.60 9.51 21.27 0.09 1.24 1.63 42 R C T 111.96 8.55 11.61 21.03 99.16 60.63 -88.41 5.65 77.14 1.36 21.49 13.54 20.23 43.59 7.84 13.00 0.03 0.65 1.12 43 N C T 127.72 2.30 15.23 18.51 96.05 -120.22 55.48 24.02 95.72 0.91 3.37 22.43 26.05 47.28 0.67 2.65 0.00 0.51 0.41 44 K C C 112.98 4.15 17.00 22.58 126.02 90.15 -122.58 142.17 94.46 5.41 0.12 52.94 41.92 0.57 0.03 0.09 0.00 3.07 1.38 45 P C C 64.55 11.36 15.96 27.72 114.84 -106.07 -67.27 148.19 92.42 7.52 0.06 86.13 5.66 0.36 0.01 0.05 0.00 7.23 0.56 46 F E E 30.22 19.80 15.33 34.86 121.66 -135.29 -108.44 137.94 14.87 85.08 0.05 13.76 0.88 0.09 0.02 0.03 0.00 83.22 2.00 47 K E E 103.52 9.21 23.39 33.24 123.71 -156.86 -117.17 135.68 4.78 95.21 0.01 4.38 0.27 0.01 0.00 0.01 0.00 94.96 0.37 48 F E E 16.51 22.11 16.91 38.81 130.63 -174.21 -133.22 146.52 4.00 95.96 0.04 3.62 0.22 0.03 0.01 0.02 0.00 95.75 0.35 49 T E E 48.39 8.59 24.80 34.04 117.73 -140.03 -103.35 131.30 8.66 91.18 0.16 7.97 0.54 0.11 0.07 0.08 0.00 90.41 0.80 50 L C E 15.01 22.92 14.48 37.27 113.29 -140.68 -86.72 130.36 49.52 47.15 3.33 20.94 16.21 16.62 0.98 2.32 0.08 40.14 2.70 51 G C T 31.70 9.96 18.75 28.97 105.64 12.92 84.50 -17.54 80.51 14.06 5.43 15.31 30.63 35.74 1.16 4.08 0.05 10.31 2.72 52 K C T 129.56 4.51 17.42 22.62 99.88 33.24 -82.29 1.77 85.84 1.75 12.41 7.84 31.30 47.59 2.91 8.43 0.02 0.95 0.96 53 Q C T 128.55 4.84 16.73 22.81 97.14 -70.80 36.19 11.82 81.48 4.76 13.76 10.05 29.06 43.74 3.99 8.35 0.11 2.90 1.81 54 E C C 92.07 9.11 17.95 27.53 103.89 104.43 -96.48 2.97 59.10 28.33 12.57 24.19 19.57 18.42 5.78 6.27 0.56 19.18 6.01 55 V C C 33.82 18.98 14.74 32.96 123.89 75.84 -106.12 141.28 53.27 41.66 5.07 37.22 12.69 2.33 4.27 1.34 0.05 21.45 20.66 56 I C C 31.55 16.99 17.04 34.28 113.28 -111.59 -76.83 137.46 83.87 11.81 4.32 77.47 4.29 1.56 4.26 0.65 0.00 8.44 3.33 57 R C T 146.89 5.44 21.85 28.01 107.34 -98.23 -59.77 135.24 76.14 0.39 23.47 1.13 3.20 70.77 21.59 2.82 0.05 0.18 0.25 58 G C T 23.03 12.42 20.80 33.24 95.96 21.33 83.79 -5.88 73.04 0.09 26.87 1.09 2.26 68.77 25.88 1.90 0.01 0.04 0.06 59 W H H 8.70 25.37 17.86 43.05 94.01 90.47 -68.25 -39.60 6.80 0.08 93.12 2.16 0.97 3.91 90.33 2.53 0.03 0.03 0.04 60 E H H 58.21 17.65 22.27 38.29 92.04 53.91 -63.23 -42.72 1.29 0.02 98.69 0.27 0.12 0.84 97.53 1.22 0.00 0.01 0.00 61 E H H 96.53 5.63 27.16 33.31 91.85 49.47 -64.96 -40.57 0.56 0.01 99.43 0.07 0.04 0.41 97.74 1.74 0.00 0.00 0.00 62 G H H 5.67 18.34 22.41 40.78 92.24 50.16 -64.92 -41.93 1.07 0.01 98.92 0.09 0.05 0.84 96.86 2.14 0.00 0.00 0.00 63 V H H 1.51 27.56 20.42 48.41 91.57 49.77 -65.37 -40.77 3.03 0.01 96.95 0.16 0.13 2.69 91.99 5.01 0.00 0.01 0.00 64 A H H 30.24 15.97 23.59 39.09 91.02 56.47 -67.98 -26.42 24.43 0.02 75.55 0.30 0.47 25.03 69.42 4.75 0.02 0.01 0.01 65 Q C T 91.73 7.30 25.51 33.95 96.45 50.02 -94.80 -5.14 57.77 0.03 42.20 0.69 1.11 56.43 38.68 3.04 0.00 0.01 0.02 66 M C C 7.88 25.08 13.70 39.13 121.89 104.64 -79.18 148.11 95.79 3.60 0.61 77.90 17.21 0.54 0.47 0.16 0.00 2.31 1.42 67 S C C 43.94 7.03 25.46 32.74 128.01 -144.48 -104.46 162.06 68.30 31.41 0.29 65.71 1.10 0.28 0.18 0.07 0.00 10.93 21.73 68 V C T 64.23 14.56 16.12 30.62 108.92 -77.25 -59.99 133.91 94.63 4.98 0.39 0.39 1.81 94.25 0.03 0.15 0.00 1.59 1.78 69 G C T 41.35 5.60 20.56 27.09 95.49 23.18 88.00 -5.98 99.35 0.56 0.09 0.39 2.32 96.83 0.00 0.06 0.00 0.36 0.03 70 Q C C 67.74 10.38 18.76 29.91 122.05 119.73 -82.32 152.75 95.73 4.23 0.03 84.45 10.95 0.27 0.00 0.03 0.00 4.07 0.22 71 R E E 115.72 10.83 20.19 31.57 124.18 -137.51 -112.58 141.09 6.75 93.24 0.00 6.96 0.13 0.01 0.00 0.00 0.00 90.76 2.14 72 A E E 9.37 21.44 16.71 38.01 133.84 -175.55 -135.23 154.53 0.83 99.17 0.00 0.77 0.03 0.00 0.00 0.00 0.00 99.19 0.01 73 K E E 99.23 8.63 25.19 34.36 119.18 -136.86 -108.32 131.47 0.31 99.69 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.71 0.00 74 L E E 5.81 25.41 17.21 43.06 122.43 -166.17 -115.63 133.81 0.33 99.67 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 75 I E E 52.17 10.75 27.10 38.42 118.52 -159.42 -112.06 126.45 0.38 99.62 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.01 76 I E E 4.27 25.40 17.97 43.97 125.40 -172.80 -122.66 137.50 4.68 95.32 0.00 4.56 0.10 0.00 0.00 0.00 0.00 95.17 0.17 77 S C C 27.55 8.85 25.77 35.61 121.40 -130.16 -82.70 156.37 88.75 11.23 0.02 88.71 0.51 0.02 0.01 0.01 0.00 10.51 0.24 78 S H H 19.10 20.69 16.71 37.15 91.08 -112.51 -59.67 -35.92 18.29 0.10 81.61 0.96 1.37 14.97 52.89 29.65 0.05 0.06 0.05 79 D H H 91.66 5.34 23.22 29.56 91.38 59.66 -66.92 -29.25 12.90 0.05 87.05 0.45 0.72 11.33 57.27 30.13 0.04 0.03 0.03 80 Y H H 78.75 12.90 21.56 34.11 97.39 43.72 -84.51 -31.23 10.39 0.08 89.53 0.64 0.96 8.25 58.54 31.49 0.04 0.05 0.04 81 A H H 5.49 23.84 17.69 41.22 100.40 38.39 -88.54 -39.45 33.45 0.67 65.88 2.23 5.18 25.91 52.26 12.92 0.63 0.33 0.53 82 Y C T 65.90 14.59 19.90 34.18 103.07 19.99 -106.92 -5.18 59.11 2.59 38.29 6.39 11.85 40.36 31.48 5.35 1.18 0.92 2.47 83 G C C 23.05 10.23 18.12 29.23 120.12 -127.43 83.01 -173.83 82.79 2.54 14.67 40.98 15.50 26.09 2.65 12.07 0.00 1.14 1.55 84 A C T 74.12 6.94 17.32 25.00 96.21 -43.90 -78.22 -12.65 80.46 2.97 16.57 21.55 26.20 33.05 2.13 14.02 0.01 1.38 1.66 85 T C C 94.47 3.17 19.70 23.08 105.64 59.75 -98.39 15.26 81.15 4.68 14.17 30.08 25.11 26.34 1.97 11.88 0.01 2.16 2.45 86 G C C 21.10 14.81 13.13 27.60 125.02 -94.67 86.42 -174.11 92.27 5.68 2.05 59.27 27.14 5.38 0.45 1.71 0.00 2.47 3.58 87 H C C 81.65 9.62 15.32 26.14 116.09 -69.73 -96.07 129.62 85.20 14.28 0.51 70.06 12.17 1.09 0.21 0.28 0.00 4.20 11.98 88 P C T 98.42 4.74 14.90 21.44 109.02 -98.52 -59.09 134.47 95.41 1.22 3.36 3.67 8.20 82.81 0.20 3.73 0.00 0.70 0.69 89 G C T 61.08 1.61 16.49 17.88 96.19 17.20 84.21 -2.91 96.67 0.28 3.05 2.16 7.44 86.44 0.14 3.52 0.00 0.17 0.13 90 I C T 66.16 10.57 16.24 27.58 102.11 65.91 -94.25 -36.30 91.08 5.60 3.33 15.75 36.07 38.47 0.35 3.40 0.01 2.82 3.13 91 I C S 11.77 22.44 12.23 34.72 123.21 27.87 -127.20 126.06 79.05 20.82 0.13 26.19 51.79 0.32 0.08 0.05 0.00 4.29 17.28 92 P C C 59.48 5.33 22.26 27.89 118.02 -121.26 -68.54 152.99 99.23 0.73 0.04 98.12 1.03 0.23 0.01 0.03 0.00 0.32 0.26 93 P C T 57.26 12.55 15.99 28.81 111.49 -88.34 -62.35 142.75 99.49 0.17 0.34 1.25 4.70 93.55 0.02 0.31 0.00 0.10 0.06 94 H C T 123.82 5.66 21.62 28.02 92.99 12.97 64.32 27.59 99.50 0.21 0.29 1.41 4.18 93.92 0.02 0.29 0.00 0.15 0.03 95 A C C 16.64 16.10 16.86 33.84 119.51 147.51 -79.51 147.55 94.94 4.98 0.08 78.34 16.66 0.28 0.01 0.08 0.00 4.00 0.63 96 T E E 44.42 11.25 24.63 36.28 117.08 -128.04 -93.52 133.81 42.05 57.93 0.01 41.43 0.93 0.04 0.00 0.01 0.00 56.55 1.04 97 L E E 3.36 25.90 18.27 44.93 122.95 -163.72 -115.26 135.32 2.01 97.99 0.00 1.90 0.05 0.00 0.00 0.00 0.00 97.99 0.05 98 V E E 30.78 12.10 26.67 39.75 117.58 -153.24 -109.82 125.90 0.30 99.70 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.00 99 F E E 5.14 25.44 18.98 44.89 122.42 -169.51 -115.51 133.24 0.17 99.83 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.84 0.00 100 D E E 40.59 9.77 27.51 38.46 115.03 -151.98 -101.05 125.30 0.33 99.67 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.70 0.00 101 V E E 2.61 26.74 17.19 45.13 122.75 -168.92 -119.56 132.57 0.47 99.53 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.54 0.00 102 E E E 69.02 7.75 27.36 35.85 120.14 -163.36 -114.14 129.92 0.44 99.56 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.55 0.00 103 L E E 17.29 22.43 15.01 37.73 110.55 -128.43 -79.19 124.36 1.14 98.86 0.00 1.19 0.02 0.00 0.00 0.00 0.00 98.72 0.06 104 L E E 73.77 6.86 20.60 28.40 100.62 175.90 -90.03 -35.23 8.30 91.63 0.07 5.75 2.01 0.37 0.01 0.05 0.00 91.70 0.11 105 K E E 104.28 4.09 21.61 26.35 136.00 -2.07 -151.15 150.13 10.02 89.88 0.09 7.66 1.85 0.39 0.01 0.08 0.00 89.84 0.17 106 L E E 57.52 18.59 10.45 27.64 119.41 -151.61 -114.71 127.15 23.24 76.59 0.17 23.03 0.35 0.13 0.05 0.08 0.00 75.41 0.94 107 E C C 118.14 3.88 19.38 23.87 115.00 -171.30 -109.26 125.64 97.26 2.74 0.01 97.38 0.06 0.01 0.00 0.00 0.00 2.51 0.03