# 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 114.39 5.21 12.56 19.12 116.68 -158.39 -96.37 131.69 99.87 0.11 0.02 99.83 0.07 0.03 0.01 0.00 0.00 0.05 0.01 1 V C C 94.38 5.47 9.18 16.39 115.63 -144.79 -92.17 136.15 81.04 6.67 12.29 75.59 1.55 4.02 10.21 2.01 0.00 4.21 2.41 2 K C C 133.36 3.81 9.69 15.37 115.23 -147.10 -95.74 135.82 71.10 11.56 17.34 52.14 12.28 5.95 14.45 3.90 0.03 7.11 4.14 3 K C C 132.89 4.02 10.28 16.03 112.57 -125.19 -81.30 135.74 66.82 11.19 22.00 49.98 9.98 5.99 17.15 5.77 0.03 7.71 3.41 4 R C C 142.16 5.72 10.59 17.79 101.60 -123.56 -78.78 -19.12 62.08 8.24 29.68 42.24 10.41 9.06 20.67 9.49 0.05 5.18 2.91 5 K C C 129.15 4.29 12.73 18.49 106.74 59.51 -85.79 67.88 61.30 6.85 31.85 32.94 13.42 15.83 19.42 11.67 0.13 3.90 2.69 6 N C C 80.43 8.19 11.63 20.98 104.86 52.04 -92.28 65.31 67.52 5.68 26.80 30.62 15.82 22.31 13.60 11.89 0.12 2.76 2.87 7 N C T 95.71 5.84 14.51 21.42 99.67 -111.00 -80.62 15.31 80.81 3.13 16.06 25.55 20.46 35.69 6.65 8.43 0.03 1.50 1.69 8 G C T 35.11 9.27 13.11 23.07 101.94 -100.49 77.20 4.43 86.43 3.81 9.76 28.83 27.11 31.42 2.44 6.60 0.01 1.98 1.61 9 R C C 126.75 6.11 15.06 22.28 112.70 118.82 -92.46 136.65 73.83 17.77 8.41 44.84 20.81 7.12 3.86 4.19 0.05 6.02 13.10 10 N C C 58.25 10.06 10.33 21.53 112.29 -117.86 -87.55 122.25 85.56 7.99 6.45 69.68 8.87 5.97 2.64 3.96 0.00 3.96 4.92 11 K C T 152.90 2.77 12.81 17.03 95.94 -148.50 -72.70 -21.20 80.25 4.07 15.68 18.83 22.55 38.96 2.81 12.61 0.02 2.02 2.21 12 K C T 153.72 1.61 12.66 14.65 100.20 53.12 -91.19 4.99 84.30 2.11 13.59 6.02 21.99 55.63 1.49 12.46 0.02 1.10 1.29 13 G C T 44.99 4.94 11.70 18.10 103.56 -88.44 84.64 10.58 87.73 2.53 9.75 17.06 34.70 34.88 0.87 9.86 0.00 1.23 1.40 14 R C T 145.47 4.31 12.79 18.48 105.84 110.18 -86.93 70.18 86.99 5.62 7.39 29.32 23.23 34.23 0.98 6.69 0.01 2.52 3.03 15 G C T 39.83 7.87 13.68 22.41 100.04 -32.63 80.44 -0.07 88.21 6.33 5.46 27.44 29.58 31.21 0.67 5.07 0.01 3.08 2.93 16 H C C 101.31 7.38 15.25 23.70 106.19 108.02 -87.73 73.70 84.70 12.11 3.19 48.43 26.90 8.92 0.70 2.72 0.00 4.65 7.66 17 V C C 55.76 13.13 13.42 26.91 117.26 112.07 -98.50 134.02 85.62 13.69 0.69 66.30 17.07 1.67 0.24 0.46 0.00 5.01 9.24 18 K C C 119.75 5.29 19.78 25.97 118.78 -135.36 -95.37 139.38 93.85 6.10 0.05 80.59 13.31 0.25 0.01 0.04 0.00 4.80 1.00 19 P C C 55.43 12.64 17.23 30.05 116.34 -101.07 -69.32 147.79 87.62 12.34 0.04 83.11 4.17 0.17 0.00 0.04 0.00 11.76 0.75 20 I E E 27.03 17.47 16.85 34.75 122.51 -153.64 -113.87 137.09 10.08 89.91 0.01 9.35 0.58 0.01 0.00 0.01 0.00 87.01 3.03 21 R E E 111.66 7.98 22.25 30.74 116.99 -135.02 -97.32 132.31 4.30 95.69 0.01 4.36 0.11 0.01 0.01 0.00 0.00 82.29 13.22 22 C C C 11.02 20.25 12.11 33.03 110.46 -117.69 -72.24 128.13 74.58 25.36 0.07 75.38 0.64 0.08 0.01 0.04 0.00 22.06 1.79 23 S C T 60.16 7.22 18.74 27.05 93.32 -149.80 -70.04 -25.77 98.89 0.50 0.61 1.40 12.73 84.62 0.02 0.74 0.00 0.38 0.10 24 N C T 93.55 5.84 17.88 24.36 100.31 41.08 -88.11 -36.68 99.01 0.23 0.76 0.41 9.15 89.38 0.02 0.85 0.00 0.14 0.05 25 C C T 50.71 8.87 15.63 25.49 104.32 17.44 -113.87 -8.77 98.48 0.55 0.97 6.07 28.37 63.63 0.05 1.34 0.00 0.32 0.23 26 A C C 62.99 8.51 16.58 25.99 94.56 -130.57 66.88 9.01 98.84 0.98 0.17 73.92 18.50 6.38 0.03 0.18 0.00 0.62 0.38 27 R C C 107.53 6.37 20.42 27.87 122.14 123.12 -87.95 150.67 83.55 16.41 0.04 74.01 9.77 0.20 0.01 0.04 0.00 14.37 1.60 28 C E E 46.06 14.86 17.78 32.58 116.35 -114.00 -81.36 136.10 4.06 95.93 0.01 3.66 0.40 0.01 0.01 0.00 0.00 72.71 23.20 29 T E E 16.10 16.78 16.27 33.88 132.20 -176.42 -134.26 151.38 25.33 74.66 0.00 23.82 1.18 0.02 0.00 0.00 0.00 73.38 1.60 30 P E E 51.74 6.02 21.00 27.93 113.37 -96.12 -63.94 143.95 45.87 54.10 0.02 46.73 0.74 0.02 0.01 0.01 0.00 49.80 2.69 31 K H G 90.97 14.80 12.47 26.99 91.40 -118.01 -58.02 -36.12 26.86 0.39 72.75 0.81 2.28 23.02 1.66 71.91 0.00 0.27 0.05 32 D H G 119.83 1.33 19.17 19.77 90.34 61.03 -69.52 -16.87 27.31 0.45 72.24 0.49 1.91 24.71 2.33 70.19 0.00 0.29 0.07 33 K H G 106.64 6.86 17.46 25.30 96.81 53.26 -97.19 -1.36 24.18 0.93 74.89 2.03 3.38 18.38 4.00 71.43 0.00 0.67 0.10 34 A C C 15.34 21.09 10.98 31.20 114.98 100.06 -82.32 138.42 64.23 31.03 4.73 51.76 10.32 1.98 2.26 2.51 0.00 28.22 2.95 35 I E E 65.45 10.68 17.93 29.40 119.63 -153.32 -105.32 130.20 14.00 85.83 0.17 12.60 1.28 0.14 0.11 0.09 0.00 83.20 2.57 36 K E E 112.19 9.09 16.60 26.63 117.15 -153.25 -98.43 132.59 11.40 88.51 0.09 9.55 1.40 0.12 0.03 0.05 0.00 88.62 0.24 37 R E E 118.27 7.46 15.85 24.65 124.55 -168.95 -122.20 138.44 9.88 90.00 0.12 8.69 0.76 0.10 0.03 0.06 0.00 90.20 0.17 38 F E E 94.21 10.85 12.91 24.70 123.77 -162.17 -117.43 139.77 5.58 94.35 0.06 5.23 0.23 0.03 0.02 0.02 0.00 94.30 0.16 39 T E E 70.39 6.22 15.52 23.36 121.49 -160.56 -115.86 133.22 3.75 96.21 0.04 3.39 0.21 0.03 0.02 0.02 0.00 96.16 0.17 40 I E E 80.10 9.49 12.05 22.96 117.64 -152.69 -103.88 130.14 9.82 90.08 0.10 9.07 0.50 0.07 0.04 0.04 0.00 89.91 0.36 41 R E E 128.15 5.22 13.45 20.34 118.12 -164.48 -105.30 138.35 32.60 66.39 1.01 27.83 3.37 0.59 0.48 0.43 0.00 66.47 0.82 42 N C C 86.95 5.65 11.82 19.05 113.85 -120.61 -85.39 132.57 64.25 30.56 5.20 52.24 8.77 1.94 4.33 1.32 0.00 29.61 1.77 43 M H H 118.58 3.53 12.52 17.32 95.89 -136.24 -67.83 -31.62 25.05 1.65 73.30 11.65 6.51 8.29 68.83 3.11 0.09 1.11 0.40 44 V H H 90.72 2.80 13.82 17.25 95.76 55.28 -69.99 -39.11 11.34 0.67 87.98 5.41 2.32 4.53 84.41 2.66 0.04 0.47 0.15 45 E H H 95.11 4.65 13.97 19.86 94.25 52.12 -67.87 -39.01 6.45 0.36 93.19 3.74 1.18 2.34 89.74 2.66 0.02 0.25 0.08 46 S H H 50.89 4.32 14.28 20.02 93.41 51.92 -65.61 -40.38 4.14 0.17 95.69 2.20 0.65 1.64 93.88 1.47 0.01 0.11 0.04 47 A H H 54.13 2.89 15.75 19.16 92.35 51.40 -65.10 -40.72 3.12 0.13 96.75 1.18 0.48 1.61 95.47 1.15 0.01 0.08 0.03 48 A H H 49.05 4.27 14.68 20.30 92.57 51.46 -65.17 -40.65 4.02 0.24 95.74 1.53 0.52 2.16 94.38 1.19 0.02 0.16 0.04 49 I H H 81.64 4.89 14.54 20.71 92.80 50.40 -65.72 -40.61 3.91 0.31 95.78 1.48 0.56 2.00 94.69 1.00 0.02 0.20 0.05 50 R H H 135.08 2.58 15.53 18.51 92.68 52.32 -65.23 -40.03 6.56 0.37 93.08 2.40 0.88 3.45 91.89 1.06 0.02 0.23 0.07 51 D H H 84.85 2.36 14.98 17.54 93.11 50.62 -67.35 -38.34 12.04 0.39 87.57 4.64 1.44 6.24 86.03 1.28 0.03 0.23 0.11 52 I H H 85.38 4.60 12.59 18.65 93.29 52.46 -66.61 -39.51 9.08 0.30 90.62 3.35 1.37 4.84 87.06 3.07 0.04 0.18 0.09 53 S H H 66.19 4.24 12.71 18.25 93.45 53.28 -67.54 -33.60 13.40 0.23 86.37 2.81 1.50 9.00 83.03 3.39 0.05 0.13 0.09 54 D H H 114.06 1.34 13.42 14.68 95.05 51.83 -77.48 -16.54 26.72 0.22 73.06 3.00 2.76 20.76 69.95 3.24 0.08 0.10 0.12 55 A C H 68.13 3.95 10.64 16.10 101.18 67.49 -85.38 -2.90 53.16 1.14 45.70 11.48 12.75 30.01 41.16 3.39 0.13 0.45 0.64 56 S C C 66.00 4.89 10.23 16.69 108.81 132.02 -83.58 114.92 72.64 8.18 19.18 36.54 18.81 18.05 11.66 6.92 0.13 3.69 4.20 57 V C T 98.72 3.61 11.27 16.38 97.78 127.46 -77.03 -21.59 73.11 8.07 18.83 24.34 24.76 25.42 8.42 9.28 0.22 4.10 3.45 58 F C C 105.11 6.88 8.94 17.24 102.69 58.97 -93.08 16.03 71.31 8.87 19.82 34.75 17.05 20.53 7.65 11.25 0.16 4.24 4.37 59 A C T 79.49 2.90 11.41 15.83 96.81 96.67 -69.39 -25.26 71.67 3.06 25.26 17.23 15.47 39.55 5.96 18.55 0.05 1.75 1.43 60 E C T 148.88 1.39 12.82 13.97 98.26 50.09 -86.09 -12.06 72.18 2.73 25.09 13.20 17.01 42.64 4.84 19.41 0.04 1.63 1.22 61 Y C C 107.59 8.68 8.59 18.30 118.36 71.83 -105.46 131.07 75.12 7.77 17.11 44.79 18.99 11.65 3.64 13.46 0.02 4.04 3.42 62 T C C 98.24 3.15 13.87 18.15 102.51 -167.64 -92.78 2.99 86.17 10.90 2.93 61.93 19.36 4.42 1.18 1.85 0.00 5.91 5.35 63 V C C 69.11 9.24 11.17 21.80 118.43 65.11 -101.46 132.16 90.25 9.28 0.48 57.31 32.73 1.03 0.17 0.30 0.00 5.42 3.04 64 P C C 61.41 8.28 13.82 23.70 113.72 -109.38 -67.22 149.04 94.21 4.83 0.96 81.35 9.54 3.27 0.17 0.85 0.00 3.96 0.86 65 K C S 122.95 6.74 15.35 23.23 99.74 -131.90 -76.46 -18.37 86.07 12.32 1.61 29.89 50.23 6.28 0.25 1.29 0.00 10.89 1.17 66 M E E 72.74 10.09 15.58 26.62 126.18 36.91 -122.12 141.50 39.12 59.39 1.49 27.44 9.44 3.46 0.23 1.27 0.00 57.11 1.05 67 Y E E 80.27 12.51 16.32 29.51 128.74 -171.29 -127.80 143.82 12.57 87.05 0.38 10.96 1.38 0.34 0.13 0.21 0.00 86.42 0.56 68 L E E 47.02 14.05 17.62 32.29 120.77 -151.38 -112.36 131.69 4.27 95.63 0.10 3.70 0.38 0.09 0.04 0.05 0.00 95.54 0.19 69 K E E 76.03 11.98 20.60 32.77 120.71 -158.14 -109.91 130.19 2.59 97.32 0.10 2.23 0.18 0.05 0.04 0.03 0.00 97.37 0.10 70 L E E 31.03 17.52 18.90 36.41 121.11 -160.57 -109.84 131.30 3.84 96.00 0.16 3.40 0.23 0.06 0.08 0.05 0.00 96.07 0.11 71 Q E E 46.28 14.15 22.74 36.83 123.75 -165.89 -116.57 135.53 5.80 93.83 0.37 4.97 0.52 0.16 0.21 0.12 0.00 93.74 0.27 72 Y E E 32.99 19.16 20.77 39.47 126.49 -162.51 -117.89 142.06 17.54 81.66 0.79 15.52 1.45 0.32 0.58 0.28 0.00 80.97 0.89 73 C C C 17.93 16.78 22.44 39.30 111.22 -131.10 -90.99 121.32 51.86 46.61 1.52 48.53 2.06 0.44 1.04 0.47 0.00 45.77 1.68 74 V H H 31.04 18.21 20.91 38.82 94.96 -160.63 -67.39 -31.90 30.84 7.93 61.23 13.65 6.80 11.48 46.14 13.30 0.34 7.37 0.93 75 S H H 38.11 10.03 22.69 33.44 91.72 60.84 -64.71 -36.87 23.48 7.50 69.02 8.40 5.05 10.87 51.05 16.35 0.30 7.09 0.90 76 C H H 25.97 12.87 20.36 33.98 92.36 52.52 -66.99 -36.82 14.92 8.04 77.04 7.12 3.17 5.55 57.09 18.29 0.13 7.97 0.68 77 A H H 12.77 17.62 16.58 34.69 92.23 53.69 -64.95 -39.98 12.34 14.96 72.70 7.14 2.32 4.03 60.58 10.05 0.12 14.80 0.97 78 I H H 67.41 10.48 17.84 28.69 92.82 51.16 -65.86 -40.32 11.48 23.85 64.67 5.64 2.18 4.84 56.41 7.28 0.27 21.80 1.58 79 H H H 114.37 5.44 17.69 23.90 92.41 51.34 -68.86 -29.84 23.54 12.55 63.91 5.68 3.52 15.06 55.14 7.28 1.01 10.40 1.91 80 G C T 32.34 8.62 14.59 24.33 94.36 48.54 -88.12 -0.41 83.01 0.44 16.55 3.91 5.78 72.35 14.92 2.56 0.02 0.23 0.24 81 K C T 144.55 4.16 16.71 22.24 94.53 -121.51 62.88 30.82 91.21 1.44 7.35 5.80 9.24 76.01 5.97 1.54 0.01 0.95 0.47 82 I C S 67.53 10.78 15.56 27.00 102.15 130.24 -93.06 -16.17 60.94 32.54 6.53 22.78 32.65 6.87 5.54 1.77 0.20 21.88 8.32 83 V C C 44.58 15.75 13.68 29.07 126.97 41.51 -126.05 144.32 70.97 23.02 6.01 34.92 30.82 5.59 4.88 1.76 0.04 19.13 2.87 84 R C C 130.52 6.34 19.33 26.67 120.70 -149.76 -111.67 132.56 74.65 20.68 4.66 61.15 10.28 2.49 3.78 1.42 0.01 17.95 2.93 85 V C C 56.72 14.86 13.12 27.92 115.85 -145.38 -96.07 128.36 77.51 16.39 6.10 68.43 6.31 2.11 4.87 1.64 0.01 13.00 3.64 86 R C C 118.47 7.17 15.01 23.33 118.01 -161.04 -97.43 143.41 86.50 7.38 6.12 72.04 10.80 3.06 4.96 1.58 0.00 5.33 2.23 87 S C C 51.05 6.36 13.57 21.35 116.77 -106.77 -82.32 149.44 87.25 4.74 8.01 73.83 9.34 3.67 6.07 2.17 0.00 2.90 2.02 88 R C H 145.76 5.60 11.81 18.84 94.40 -122.97 -65.49 -31.16 53.85 2.29 43.85 23.49 19.08 13.62 32.30 9.05 0.14 0.94 1.37 89 E H H 132.42 1.75 14.48 16.19 95.11 56.84 -67.90 -36.57 48.50 0.84 50.66 7.26 10.04 30.34 36.05 15.08 0.23 0.44 0.57 90 G H H 29.75 6.02 12.47 20.24 94.58 43.89 -66.62 -27.47 49.45 0.95 49.61 11.62 9.29 27.89 33.29 16.70 0.14 0.48 0.59 91 R H H 89.70 11.49 10.49 22.35 93.47 63.97 -69.07 -30.63 42.04 2.22 55.74 21.98 7.77 12.75 36.02 19.21 0.07 1.08 1.10 92 R C H 150.69 3.68 14.23 19.23 92.91 62.67 -68.56 -27.88 49.65 2.98 47.38 17.63 10.45 22.10 29.58 16.90 0.31 1.55 1.48 93 N C T 113.14 2.37 14.89 17.74 97.52 49.64 -91.88 -0.05 62.63 3.54 33.83 22.54 14.07 27.14 19.82 12.74 0.16 1.79 1.75 94 R C C 108.80 9.99 10.57 21.38 110.84 97.21 -83.86 125.33 84.13 7.37 8.51 53.99 22.38 7.40 5.34 2.85 0.01 2.51 5.51 95 A C C 64.18 5.04 14.05 20.46 119.38 -137.06 -91.88 141.64 96.05 3.67 0.28 73.88 21.78 0.48 0.17 0.11 0.00 1.29 2.29 96 P C C 79.47 6.79 13.25 21.56 117.13 -102.07 -66.86 150.76 99.45 0.50 0.04 92.99 6.33 0.16 0.01 0.02 0.00 0.18 0.30 97 P C C 63.98 9.48 11.66 22.38 116.58 -100.74 -65.56 151.97 99.58 0.27 0.15 94.34 4.63 0.62 0.03 0.09 0.00 0.10 0.18 98 P C C 86.64 5.04 14.17 20.68 112.61 -99.32 -66.41 148.01 98.14 0.91 0.95 83.57 10.87 3.53 0.16 0.90 0.00 0.45 0.51 99 R C C 144.77 5.80 13.01 20.57 114.01 -125.69 -87.53 132.56 93.97 4.97 1.06 76.36 15.09 2.25 0.24 0.91 0.00 2.40 2.76 100 V C C 69.14 9.13 11.10 21.61 117.95 -136.92 -100.23 136.53 89.11 10.27 0.62 80.64 7.41 0.98 0.18 0.44 0.00 7.43 2.94 101 R C C 129.55 5.32 13.58 20.45 119.46 -161.80 -107.84 141.13 80.62 18.98 0.40 70.90 8.50 0.89 0.10 0.30 0.00 17.22 2.09 102 Y E B 113.40 7.11 9.74 18.56 120.48 -137.40 -100.88 145.15 14.88 84.93 0.18 11.26 0.77 0.06 0.15 0.03 0.00 16.58 71.15 103 N C C 66.56 4.78 9.50 16.32 121.71 -127.08 -81.68 170.84 96.17 3.66 0.17 95.76 0.89 0.22 0.04 0.08 0.00 2.03 0.98 104 K C T 179.55 0.81 9.06 10.30 90.87 -94.29 -63.92 -21.90 96.78 1.64 1.57 1.70 5.29 89.61 0.08 1.69 0.00 1.36 0.27 105 D C T 123.35 0.58 9.71 9.64 93.55 54.44 -87.45 1.06 98.55 0.13 1.32 0.59 4.03 93.78 0.04 1.45 0.00 0.08 0.03 106 G C S 50.88 3.07 9.29 14.22 95.86 -105.71 82.52 7.57 98.39 0.61 1.00 12.56 82.95 3.00 0.06 0.91 0.00 0.32 0.20 107 K C C 124.36 2.17 11.10 14.87 118.65 135.97 -85.89 144.79 96.66 3.25 0.09 88.50 7.48 0.69 0.02 0.07 0.00 2.58 0.66 108 K E B 131.15 4.37 12.02 18.40 114.16 -110.55 -74.02 137.37 10.46 89.42 0.12 8.08 0.66 0.05 0.10 0.02 0.00 24.65 66.44 109 I C C 58.26 11.88 9.52 22.30 116.68 -142.23 -93.59 133.79 76.26 23.62 0.12 70.99 4.71 0.25 0.04 0.08 0.00 21.21 2.72 110 V C C 89.23 4.25 15.26 20.83 118.21 -151.30 -106.77 131.26 95.96 3.88 0.16 89.99 5.95 0.32 0.06 0.08 0.00 2.61 0.97 111 P C C 64.53 10.35 9.81 20.95 108.72 -112.39 -65.99 145.60 73.45 2.33 24.22 37.28 10.09 26.29 5.19 18.87 0.00 1.38 0.89 112 T C T 105.55 2.62 12.46 16.19 102.21 -130.41 -80.92 -6.64 73.11 2.09 24.81 27.01 15.50 31.64 6.24 17.49 0.01 1.07 1.04 113 Q C C 125.92 2.72 11.96 15.94 112.51 63.30 -99.24 105.33 68.05 3.54 28.42 33.91 19.16 15.97 8.49 18.86 0.02 1.68 1.91 114 A C C 59.39 7.64 8.65 17.60 115.87 -146.01 -83.27 142.40 78.54 2.94 18.52 52.75 18.25 7.87 9.61 8.55 0.01 1.53 1.42 115 P C C 89.40 4.78 9.38 16.05 112.31 -108.32 -71.63 145.24 78.83 4.52 16.65 58.82 10.28 9.70 7.67 8.94 0.00 3.01 1.57 116 K C C 155.31 2.19 9.91 13.86 112.80 -131.31 -91.89 133.82 76.52 9.73 13.75 54.57 11.97 9.82 6.39 7.37 0.02 6.44 3.43 117 T C C 103.54 2.72 8.20 12.98 115.64 -134.05 -95.43 136.10 84.43 8.73 6.84 77.48 1.99 5.36 3.82 2.39 0.00 5.47 3.49 118 A C C 82.45 3.48 9.97 15.20 108.13 -125.77 -84.44 127.14 99.83 0.15 0.02 99.77 0.08 0.04 0.01 0.00 0.00 0.08 0.01