# 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 102.13 7.12 12.96 21.25 117.61 -160.81 -96.06 131.25 99.93 0.06 0.01 99.87 0.08 0.01 0.00 0.00 0.00 0.03 0.01 1 P C C 83.08 5.67 10.43 17.79 113.69 -114.57 -68.32 149.66 86.74 2.27 11.00 82.01 1.02 4.67 8.07 1.97 0.00 1.21 1.05 2 K C C 140.56 3.75 10.07 15.58 111.78 -124.33 -87.28 131.92 75.24 6.45 18.32 54.17 13.16 7.43 14.37 4.55 0.01 3.31 3.01 3 K C C 136.58 3.52 11.07 16.19 112.64 -116.84 -84.72 133.76 65.43 8.35 26.22 47.10 11.48 6.59 19.83 6.94 0.03 5.11 2.92 4 R C C 137.07 6.16 11.49 18.98 100.79 -121.44 -75.36 -23.81 57.78 8.28 33.94 39.89 9.82 8.27 24.64 9.29 0.05 5.12 2.91 5 A C C 61.17 6.77 12.68 20.76 107.75 57.53 -80.81 99.29 57.76 7.15 35.09 33.26 11.98 13.20 23.75 10.80 0.11 4.25 2.63 6 S C C 56.33 8.45 12.74 22.28 105.45 -122.55 -90.50 59.84 64.80 6.41 28.79 31.68 14.60 19.60 16.81 10.82 0.14 3.30 3.04 7 N C T 93.79 6.16 15.09 22.27 99.01 79.55 -80.54 13.61 78.24 3.42 18.34 24.77 19.81 34.56 8.67 8.65 0.05 1.62 1.87 8 G C T 35.56 9.52 13.32 23.42 101.82 -104.04 75.90 2.85 84.57 3.17 12.26 24.70 26.78 34.22 3.24 7.97 0.01 1.61 1.48 9 R C C 131.67 5.75 15.51 22.26 104.61 115.25 -88.07 9.51 72.43 15.32 12.25 37.74 22.98 11.89 4.84 6.66 0.09 5.69 10.10 10 N C C 58.66 10.29 10.51 21.84 112.46 79.82 -91.75 121.43 81.79 9.67 8.54 60.10 12.02 8.68 3.09 5.59 0.00 4.90 5.62 11 K C T 149.80 3.14 13.21 17.84 96.85 -157.43 -72.93 -20.62 78.10 5.00 16.90 22.07 22.86 33.93 3.10 12.96 0.03 2.43 2.61 12 K C T 150.79 1.88 13.07 15.49 100.67 53.20 -90.16 7.78 82.50 2.87 14.63 7.54 23.01 51.50 1.82 12.93 0.02 1.55 1.62 13 G C T 44.83 5.35 12.01 18.78 104.76 -84.09 84.34 10.02 86.97 2.34 10.69 17.09 30.73 38.38 0.97 10.45 0.00 1.16 1.21 14 R C C 141.23 4.91 13.24 19.46 103.66 108.80 -89.57 22.87 86.76 5.69 7.56 32.47 23.97 30.24 1.04 6.71 0.01 2.51 3.06 15 G C C 38.66 8.07 14.04 22.89 104.28 -55.01 80.10 -2.82 88.09 6.59 5.32 30.53 30.01 27.66 0.65 4.96 0.01 3.24 2.96 16 H C C 103.21 7.71 15.99 24.50 106.24 101.19 -87.79 87.13 84.62 12.30 3.08 48.15 27.21 9.10 0.65 2.67 0.00 4.96 7.26 17 V C C 51.74 13.85 13.57 27.67 117.75 142.17 -98.31 134.02 84.29 15.06 0.65 65.29 17.04 1.55 0.23 0.45 0.00 5.77 9.69 18 K C C 118.28 5.57 20.28 26.68 119.16 -138.31 -94.78 139.15 93.00 6.94 0.06 79.96 13.07 0.28 0.02 0.05 0.00 5.50 1.13 19 P C C 54.33 13.38 17.22 30.63 116.18 -103.29 -68.78 148.68 85.66 14.26 0.08 80.31 4.84 0.26 0.01 0.07 0.00 13.46 1.04 20 V E E 25.60 17.24 17.04 34.71 123.47 -152.92 -112.97 139.42 14.26 85.71 0.03 12.86 0.91 0.04 0.01 0.02 0.00 81.04 5.12 21 R E E 111.33 8.29 21.96 30.72 116.49 -132.27 -94.53 132.75 8.64 91.32 0.04 8.25 0.28 0.02 0.03 0.02 0.00 77.58 13.82 22 C C C 11.61 20.31 12.51 33.35 111.77 -118.08 -73.73 133.31 71.03 28.83 0.14 70.40 1.26 0.21 0.03 0.11 0.00 25.15 2.84 23 V C T 77.34 8.01 19.09 27.98 93.50 -137.39 -67.87 -25.80 98.33 0.84 0.82 2.00 17.54 78.66 0.03 0.94 0.00 0.66 0.16 24 N C T 90.90 6.73 18.10 25.23 100.23 40.89 -91.88 -23.35 98.68 0.39 0.94 0.90 15.85 81.85 0.04 1.03 0.00 0.25 0.09 25 C C S 45.29 10.62 14.70 26.06 111.03 21.81 -115.59 -4.16 96.27 2.28 1.45 17.15 47.45 31.23 0.09 1.89 0.00 1.30 0.89 26 S C C 69.65 7.14 16.86 24.94 95.21 -132.00 -31.46 3.34 97.88 1.86 0.26 49.28 38.63 10.04 0.03 0.31 0.00 1.22 0.49 27 K C C 97.33 6.46 19.91 27.48 121.31 117.45 -87.09 148.50 81.73 18.12 0.15 60.47 20.70 0.93 0.03 0.14 0.00 16.38 1.34 28 S E E 39.93 15.03 17.18 32.03 118.07 -122.72 -86.16 138.92 11.50 88.40 0.10 10.09 1.10 0.10 0.08 0.04 0.00 63.44 25.14 29 I E E 20.81 16.77 16.16 33.83 129.44 -172.46 -129.34 146.11 24.54 75.43 0.03 22.83 1.42 0.04 0.02 0.01 0.00 71.02 4.65 30 P E C 50.21 6.14 21.09 28.17 113.27 -99.66 -64.18 143.61 49.81 50.11 0.09 49.85 0.97 0.06 0.04 0.04 0.00 46.15 2.89 31 K H G 85.91 15.16 12.48 27.34 91.29 -117.72 -57.95 -35.98 26.92 0.47 72.61 2.59 3.27 20.10 26.94 46.54 0.08 0.31 0.17 32 D H G 117.31 1.61 18.85 20.09 90.79 61.53 -69.79 -19.57 25.08 0.53 74.40 1.82 2.72 19.32 31.59 43.92 0.09 0.33 0.21 33 K H G 109.84 6.38 17.32 24.61 97.03 54.33 -93.79 -4.64 20.60 1.30 78.10 4.21 3.55 12.71 34.97 43.28 0.09 0.84 0.34 34 A C C 18.16 20.53 10.74 30.11 113.19 94.48 -83.58 134.89 46.23 17.78 35.99 30.19 10.18 6.78 28.75 6.94 0.15 13.84 3.18 35 I E E 70.43 10.69 15.59 27.02 118.18 -138.94 -98.95 130.90 36.49 46.55 16.96 27.17 6.25 3.10 15.62 2.40 0.06 41.51 3.89 36 K E E 127.38 6.02 15.81 23.22 113.86 -148.20 -93.35 131.00 31.51 52.94 15.56 24.84 3.18 2.13 13.86 1.88 0.01 52.95 1.15 37 R E E 137.00 6.33 13.67 21.53 121.69 -153.43 -113.59 136.56 27.20 54.58 18.23 20.57 3.16 2.13 16.03 2.18 0.02 54.99 0.92 38 M E E 99.37 7.89 11.22 20.61 123.36 -166.45 -116.06 138.02 26.40 56.48 17.12 21.05 2.28 1.75 15.15 1.96 0.01 56.67 1.12 39 A E E 67.74 5.26 12.43 19.38 120.10 -158.64 -111.55 134.96 29.31 54.16 16.53 22.49 3.19 2.05 14.87 1.98 0.01 54.21 1.20 40 I E E 96.93 6.80 10.20 18.66 116.02 -151.64 -100.92 129.53 36.17 45.23 18.60 28.55 3.48 2.35 16.90 2.18 0.02 44.94 1.59 41 R C C 153.48 3.52 11.52 16.69 111.67 -159.07 -93.46 126.27 55.82 23.88 20.30 38.70 10.10 4.53 19.24 2.47 0.04 23.43 1.49 42 N C C 96.64 4.35 10.75 16.50 109.48 -136.97 -91.71 119.88 66.84 11.35 21.82 49.78 9.90 4.96 21.81 2.32 0.01 9.84 1.38 43 I H H 114.52 3.24 11.74 16.22 97.78 -146.57 -70.40 -32.30 23.70 3.04 73.25 16.08 4.28 4.28 70.61 2.04 0.02 2.26 0.43 44 V H H 91.99 3.09 13.38 17.15 96.28 53.96 -70.21 -38.50 12.56 2.27 85.17 7.89 2.13 3.48 81.99 2.16 0.05 2.01 0.29 45 E H H 92.40 5.80 13.74 20.72 95.83 52.42 -69.28 -37.84 9.28 1.73 89.00 6.25 1.40 2.61 85.56 2.31 0.04 1.62 0.21 46 A H H 48.18 5.50 14.07 21.15 93.95 54.13 -65.60 -40.45 5.96 0.89 93.15 3.61 0.86 2.03 90.66 1.89 0.02 0.81 0.12 47 A H H 54.47 3.48 16.26 20.42 93.01 51.63 -65.55 -39.84 5.95 0.96 93.09 2.96 0.83 2.50 90.66 2.01 0.03 0.89 0.14 48 A H H 48.68 5.31 15.12 21.78 93.12 51.62 -66.16 -39.02 8.44 1.36 90.20 3.91 1.07 3.75 87.64 2.14 0.04 1.26 0.20 49 V H H 68.19 6.56 14.77 22.60 93.60 50.81 -67.34 -39.17 9.85 2.18 87.97 4.86 1.43 3.83 85.78 1.86 0.04 1.90 0.29 50 R H H 131.25 3.52 16.32 20.56 93.54 53.38 -65.99 -39.94 14.30 2.33 83.37 7.25 2.03 5.30 81.21 1.88 0.04 1.96 0.34 51 D H H 80.21 3.46 16.13 20.13 93.63 50.32 -67.67 -37.55 19.76 1.62 78.61 10.66 2.37 7.29 76.04 2.06 0.03 1.23 0.32 52 L H H 73.54 7.93 13.18 22.27 93.60 53.88 -66.26 -39.23 11.45 0.74 87.81 5.65 1.90 4.98 82.25 4.43 0.05 0.53 0.20 53 S H H 63.64 5.13 14.41 20.77 93.05 53.66 -67.16 -35.66 13.87 0.61 85.52 4.59 1.98 7.76 79.90 5.08 0.09 0.40 0.20 54 E H H 135.00 1.92 15.34 17.41 93.66 51.89 -73.12 -25.44 21.76 0.52 77.71 4.26 3.07 14.87 72.92 4.25 0.13 0.28 0.23 55 A H H 58.83 6.49 11.90 19.72 99.76 59.22 -81.12 -7.46 45.28 1.26 53.46 11.13 9.16 26.42 48.78 3.18 0.15 0.53 0.65 56 S C C 58.54 7.61 10.78 19.74 112.34 119.34 -87.14 124.31 79.04 6.81 14.15 42.19 16.12 21.10 10.63 3.39 0.04 3.09 3.42 57 V C S 97.55 4.54 12.57 18.39 99.57 -160.21 -83.26 -20.82 86.92 7.42 5.66 34.69 40.81 11.94 3.39 2.15 0.02 3.45 3.54 58 Y C C 106.78 6.63 9.78 18.10 111.94 53.64 -108.96 103.87 92.82 4.90 2.28 59.12 30.89 2.83 1.26 1.01 0.00 1.99 2.90 59 P C G 98.40 3.66 11.41 16.83 96.04 -159.26 -65.67 -25.43 50.63 1.15 48.22 10.42 7.87 31.57 9.30 39.65 0.02 0.67 0.50 60 E H G 145.04 1.79 12.77 14.93 97.08 59.24 -79.33 -15.04 48.47 1.56 49.97 6.36 7.62 33.35 10.93 40.03 0.05 0.96 0.69 61 Y H G 115.59 7.54 10.37 19.09 107.10 48.74 -101.90 38.72 43.62 6.79 49.59 17.45 10.73 18.56 10.87 35.95 0.13 4.37 1.95 62 A C C 56.73 7.43 12.48 21.28 109.32 128.53 -87.03 121.55 67.45 13.00 19.56 39.66 20.39 7.56 13.46 6.03 0.15 6.16 6.58 63 L C C 75.13 9.51 11.52 22.20 117.48 -124.53 -94.25 136.07 69.12 8.32 22.56 37.23 24.81 7.77 16.01 6.27 0.11 4.59 3.21 64 P C C 65.24 7.44 13.08 22.05 111.28 -107.21 -66.71 147.09 67.42 3.68 28.91 48.36 7.67 10.79 16.37 13.17 0.01 2.49 1.14 65 K C T 140.64 4.33 13.81 19.75 96.64 -120.81 -69.11 -23.37 54.19 4.74 41.07 19.96 13.31 21.25 20.34 20.54 0.17 2.93 1.51 66 T C H 77.28 6.32 14.34 21.68 98.86 61.51 -83.57 -13.61 49.21 13.03 37.77 18.96 11.98 18.99 19.51 18.02 0.42 9.64 2.47 67 Y C C 89.13 12.26 13.71 26.22 104.99 69.97 -91.07 30.54 47.85 25.31 26.84 28.07 10.50 10.25 16.59 10.21 0.27 20.61 3.51 68 N C C 64.96 12.45 16.27 28.70 108.73 96.76 -90.67 91.19 51.80 32.33 15.86 35.02 10.93 5.51 12.67 3.85 0.06 29.30 2.66 69 K E E 93.97 11.04 19.82 30.56 112.13 95.92 -95.99 123.91 37.64 45.79 16.56 24.14 9.27 4.19 13.41 3.30 0.04 43.90 1.76 70 L E E 42.65 17.03 19.03 35.51 116.66 -158.98 -98.87 131.27 28.64 54.92 16.44 20.03 4.95 3.11 13.76 3.05 0.04 53.71 1.35 71 H E E 47.78 16.72 22.22 38.21 120.34 -161.44 -107.65 132.76 22.91 62.24 14.85 16.54 3.20 2.59 12.60 2.88 0.06 59.79 2.36 72 Y E E 35.99 19.14 22.84 41.02 121.48 -165.79 -111.95 133.30 26.63 59.88 13.49 21.20 2.63 1.87 11.86 2.25 0.03 57.16 3.00 73 C C C 16.27 19.79 24.05 42.70 114.56 -136.77 -88.74 138.79 50.59 34.35 15.07 45.77 2.68 1.47 14.84 1.18 0.00 32.02 2.05 74 V H H 21.47 20.92 23.13 43.00 94.36 -122.64 -65.36 -36.98 12.71 1.48 85.81 4.70 2.48 6.23 83.06 1.89 0.15 1.29 0.20 75 S H H 28.08 13.12 24.64 38.00 91.79 55.20 -63.71 -40.98 5.44 0.78 93.78 2.30 0.80 2.55 92.05 1.42 0.03 0.77 0.09 76 C H H 19.99 14.66 23.00 38.00 92.11 51.17 -65.21 -41.25 2.15 0.52 97.33 0.94 0.33 1.00 95.47 1.64 0.02 0.56 0.05 77 A H H 7.34 19.34 19.05 38.97 92.15 51.98 -64.23 -41.99 1.55 0.59 97.86 0.62 0.19 0.77 96.48 1.26 0.01 0.64 0.04 78 I H H 47.47 13.18 19.57 32.77 92.65 49.98 -65.31 -42.46 1.76 0.76 97.49 0.43 0.17 1.15 96.43 1.01 0.03 0.73 0.05 79 H H H 95.37 8.69 19.62 28.64 91.45 51.69 -66.33 -33.15 6.23 0.22 93.54 0.38 0.32 5.65 92.49 0.87 0.10 0.12 0.07 80 A C T 40.55 10.33 16.00 27.55 92.67 50.02 -87.14 -2.06 84.23 0.03 15.74 0.43 1.06 81.42 16.64 0.42 0.00 0.01 0.02 81 R C T 158.53 5.00 18.35 24.64 92.82 -120.80 61.41 31.36 97.99 0.05 1.97 0.85 2.04 95.09 1.85 0.14 0.00 0.02 0.02 82 I C S 54.29 12.62 17.11 30.22 98.94 128.05 -91.59 -16.31 91.84 6.70 1.45 30.32 57.79 4.15 1.19 0.43 0.00 3.44 2.68 83 V C S 26.84 19.01 13.96 32.46 132.13 38.04 -131.30 147.81 87.33 11.33 1.34 38.32 47.45 2.60 0.87 0.57 0.01 7.68 2.51 84 R C C 125.16 6.82 21.57 29.07 120.47 -143.38 -106.21 133.33 86.14 12.84 1.02 73.45 11.20 1.27 0.67 0.49 0.00 9.92 3.00 85 V C C 52.23 16.42 14.45 30.50 115.73 -136.42 -93.14 127.54 88.80 10.03 1.16 82.53 5.43 0.99 0.67 0.50 0.00 6.76 3.12 86 R C C 89.06 9.47 14.73 25.35 123.36 -152.47 -106.92 154.87 95.26 3.55 1.19 83.33 10.84 1.11 0.74 0.42 0.00 2.00 1.56 87 S C C 50.98 4.57 15.83 21.39 117.96 -101.39 -74.23 157.62 95.67 2.02 2.31 87.40 7.11 1.20 1.75 0.50 0.00 0.83 1.21 88 R H H 138.75 6.43 11.29 19.26 92.30 -111.65 -60.39 -36.19 23.87 0.36 75.76 7.07 7.89 10.75 65.83 7.98 0.10 0.14 0.23 89 E H H 134.29 1.14 14.57 14.89 92.32 54.44 -65.38 -38.66 20.61 0.18 79.21 2.81 3.34 14.14 68.25 11.13 0.14 0.09 0.10 90 D H H 66.28 4.76 12.65 19.09 93.28 48.06 -70.10 -33.09 19.23 0.38 80.40 5.16 3.07 11.04 66.78 13.48 0.09 0.22 0.16 91 R H H 78.38 12.64 9.70 22.52 92.42 58.62 -65.94 -34.79 15.87 0.50 83.63 6.43 2.80 7.38 71.07 11.77 0.07 0.27 0.21 92 K H H 137.42 2.93 14.11 18.22 91.92 57.43 -68.73 -27.59 31.80 0.60 67.59 5.70 4.45 21.63 57.28 10.10 0.20 0.31 0.34 93 N C H 118.74 1.59 14.81 16.20 96.47 49.23 -91.81 -1.22 55.68 0.75 43.57 10.27 8.32 37.00 37.13 6.39 0.08 0.32 0.48 94 R C C 95.73 11.18 9.28 20.99 114.15 103.36 -82.43 139.37 89.86 4.05 6.09 58.45 25.21 5.46 4.86 1.21 0.00 1.06 3.74 95 A C C 71.11 3.53 14.82 19.44 119.67 -132.77 -90.71 143.17 97.57 2.25 0.18 83.44 13.64 0.34 0.10 0.06 0.00 0.74 1.67 96 P C C 75.61 8.28 12.07 21.80 116.34 -100.88 -66.09 148.96 99.72 0.23 0.06 95.32 4.22 0.20 0.02 0.02 0.00 0.09 0.13 97 P C C 65.37 9.38 11.67 22.26 115.33 -102.94 -66.14 151.86 99.45 0.24 0.31 94.74 3.74 1.01 0.08 0.17 0.00 0.09 0.17 98 Q C C 132.16 2.83 15.10 19.17 112.64 -101.02 -71.27 141.71 98.42 1.16 0.42 89.70 7.51 0.99 0.13 0.24 0.00 0.36 1.06 99 R C C 126.54 9.23 11.56 21.96 118.25 -126.04 -93.77 134.45 98.65 1.05 0.31 87.60 10.69 0.35 0.14 0.12 0.00 0.40 0.69 100 P C C 61.38 9.34 11.60 22.27 113.23 -111.23 -70.25 147.13 94.91 1.63 3.46 86.86 5.55 2.68 1.28 1.89 0.00 0.76 0.98 101 R C C 153.06 3.75 14.53 19.48 114.73 -134.54 -95.11 134.21 88.19 6.27 5.54 74.32 9.16 3.99 2.49 2.92 0.00 2.84 4.28 102 F C C 95.74 9.94 9.39 20.16 113.55 -136.51 -87.62 133.41 80.95 9.52 9.52 60.86 12.39 6.43 4.65 4.99 0.01 4.71 5.98 103 N C C 87.21 5.12 10.01 16.79 111.71 -138.53 -91.02 129.34 86.15 5.62 8.23 65.56 11.39 8.60 3.55 4.74 0.00 3.04 3.11 104 R C T 177.17 2.11 9.86 13.42 97.83 -142.64 -75.29 -15.38 82.41 2.81 14.78 31.09 18.04 34.33 3.80 9.89 0.01 1.39 1.46 105 D C T 116.84 1.25 10.61 12.15 99.31 52.40 -83.69 5.95 88.31 0.74 10.95 18.22 18.84 51.32 2.41 8.40 0.00 0.38 0.43 106 N C C 113.60 4.36 9.61 15.66 97.74 -111.87 57.14 27.03 89.07 2.26 8.68 36.11 24.00 29.19 1.40 7.18 0.00 1.22 0.89 107 K C C 139.62 2.29 12.34 15.81 113.66 122.47 -92.81 131.59 88.76 9.00 2.24 65.63 17.33 5.57 0.75 1.55 0.00 5.35 3.81 108 V C C 67.02 9.99 9.48 20.47 116.11 -126.64 -93.40 133.67 85.51 13.84 0.65 73.27 10.83 0.68 0.38 0.28 0.00 5.35 9.20 109 S C C 50.58 5.29 14.50 21.24 116.07 -136.66 -90.36 139.38 99.01 0.77 0.22 97.43 1.70 0.07 0.19 0.02 0.00 0.30 0.29 110 P H H 77.88 6.07 13.39 21.17 93.05 -127.38 -59.05 -37.41 3.30 0.02 96.69 1.23 0.35 1.63 95.69 1.08 0.00 0.01 0.01 111 A H H 59.06 3.94 15.37 20.18 92.45 52.27 -64.96 -40.24 1.83 0.03 98.14 0.45 0.18 1.10 97.10 1.16 0.00 0.02 0.00 112 A H H 45.74 4.10 14.95 20.40 91.92 49.77 -64.86 -41.13 0.70 0.02 99.27 0.20 0.08 0.37 98.34 0.98 0.00 0.02 0.00 113 A H H 37.38 5.80 13.30 21.21 91.78 50.92 -64.04 -41.05 0.76 0.02 99.23 0.22 0.07 0.40 98.74 0.55 0.00 0.01 0.00 114 A H H 51.67 4.51 13.19 19.30 91.99 51.27 -65.26 -38.90 2.86 0.03 97.11 0.63 0.23 1.85 96.55 0.71 0.01 0.02 0.01 115 K H H 131.38 2.47 13.42 16.82 92.48 51.86 -67.07 -36.20 8.79 0.04 91.17 1.50 0.67 6.10 90.57 1.11 0.01 0.01 0.02 116 K H H 137.89 2.38 12.70 15.98 93.58 53.90 -69.17 -32.47 26.69 0.23 73.08 5.19 2.99 18.02 72.11 1.44 0.03 0.09 0.13 117 A C H 73.32 3.47 11.25 16.01 95.67 57.69 -72.99 -21.24 56.95 0.53 42.52 23.49 1.82 28.93 43.66 1.58 0.00 0.20 0.33 118 L C C 99.69 5.83 11.39 18.47 98.59 64.61 -78.58 -11.04 99.69 0.11 0.20 99.21 0.22 0.30 0.17 0.01 0.00 0.05 0.03