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BMP-binding endothelial regulator protein

Inhibitor of bone morphogenetic protein (BMP) function, it may regulate BMP responsiveness of osteoblasts and chondrocytes.

AlphaFold DB , UniProt , Accession Q8N8U9, Species HUMAN (Homo sapiens, Human), Gene BMPER, Length 685 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.7	Very low	31	Very low	190 Å²	190	135.5 Å²	135.5	94%	0.936	81%	0.808	S	S	*	*				0	127.2	0	-74.6	176.4	-171.2	0	0	107	L43	M1-L43 HydrophobicContact CB-CD1 4.24Å
2	L	31	Very low	30.8	Very low	140 Å²	140	136.2 Å²	136.2	73%	0.733	80%	0.797	S	S	*	*			trans	-168.4	99.9	151.8	-97.9	163.4	0	0	0	104.8	L43	L2-L43 HydrophobicContact CD2-CD1 4.35Å; L2-L43 HydrophobicContact CG-CD1 4.46Å
3	W	26.9	Very low	30.6	Very low	196 Å²	196	140.4 Å²	140.4	74%	0.742	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-81.1	132.7	171.8	-88.1	50.4	0	0	0	108.2	F517	W3-F517 HydrophobicContact CZ2-CZ 4.23Å; W3-F517 AromaticContact NE1-CZ 3.95Å
4	F	35.6	Very low	30.4	Very low	205 Å²	205	144.7 Å²	144.7	90%	0.899	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-94.4	122.2	161.2	-83.9	-84.8	0	0	0	108.4
5	S	28.7	Very low	30.4	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-102.8	155.6	167.9	-59	0	0	0	0	109.6
6	G	32.5	Very low	30.4	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	79%	0.793	S	S	*	*			trans	105.8	131	175.9	0	0	0	0	0	111
7	V	35.2	Very low	30.7	Very low	149 Å²	149	152.8 Å²	152.8	90%	0.903	80%	0.799	S	S	*	*			cis	-153.9	146.1	27.3	172.8	0	0	0	0	108.1
8	G	27.8	Very low	30.8	Very low	73 Å²	73	150.4 Å²	150.4	75%	0.753	80%	0.798	S	S	*	*			trans	-81.9	162.7	-176.8	0	0	0	0	0	116.1
9	A	34.1	Very low	31.5	Very low	94 Å²	94	149.3 Å²	149.3	78%	0.777	80%	0.8	S	S	*	*			trans	-152.6	104.6	153.7	0	0	0	0	0	105.3
10	L	26.9	Very low	31.8	Very low	175 Å²	175	144.8 Å²	144.8	92%	0.916	79%	0.79	S	S	*	*				50.5	97.1	85.8	-83.7	163.9	0	0	0	114.7
11	A	33.2	Very low	32.3	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	79%	0.791	S	S	*	*			trans	177.2	109.5	136.2	0	0	0	0	0	107
12	E	27.7	Very low	32.7	Very low	143 Å²	143	142 Å²	142	67%	0.668	78%	0.781	S	S	*	*				50.1	134.1	80.2	-66.4	-158.7	141.4	0	0	112.2
13	R	28.7	Very low	32.9	Very low	191 Å²	191	140.8 Å²	140.8	72%	0.721	78%	0.783	S	S	*	*			cis	-176.8	141.8	8.6	-112.6	173.4	-163.1	-152.9	11.1	105.6
14	Y	27.4	Very low	33.5	Very low	201 Å²	201	136.6 Å²	136.6	79%	0.788	78%	0.782	S	S	*	*			trans	46	129.4	134	-82.2	-106.2	0	0	0	122.2
15	C	30.6	Very low	33.7	Very low	123 Å²	123	132.1 Å²	132.1	83%	0.831	77%	0.772	S	S	*	*				-163.7	108.7	122.8	-97.5	0	0	0	0	109.2
16	R	30.1	Very low	34.1	Very low	210 Å²	210	133.5 Å²	133.5	79%	0.792	77%	0.77	S	S	*	*				72.8	113.5	78.1	-90.8	-169.2	172.2	-171.1	-1.5	114.7
17	R	36.4	Very low	34.4	Very low	238 Å²	238	136.9 Å²	136.9	90%	0.898	77%	0.77	S	S	*	*				156.3	97.5	125.1	-87.5	173.7	174.2	-168.6	-1.8	108.2
18	S	32.8	Very low	34.4	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	76%	0.757	S	S	*	*				60.8	151.9	71.3	-62.5	0	0	0	0	114.7
19	P	42.6	Very low	34.9	Very low	129 Å²	129	138.4 Å²	138.4	84%	0.838	76%	0.755	S	S	*	*			cis	-145.7	177.3	-38	39.1	-20.8	0	0	0	114.3
20	G	39.3	Very low	34.8	Very low	58 Å²	58	140.5 Å²	140.5	60%	0.598	75%	0.753	S	S	*	*			trans	-178.3	92.4	161.9	0	0	0	0	0	112.5
21	I	40.8	Very low	35.2	Very low	160 Å²	160	137.5 Å²	137.5	82%	0.821	75%	0.745	S	S	*	*				76.6	117.2	108.5	-66	162.1	0	0	0	111.3
22	T	38	Very low	35.1	Very low	117 Å²	117	139 Å²	139	72%	0.718	75%	0.751	S	S	*	*			cis	-173.4	153.3	24.6	-1.1	0	0	0	0	111.5
23	C	36.2	Very low	35.3	Very low	114 Å²	114	135.8 Å²	135.8	77%	0.77	76%	0.755	S	S	*	*			trans	59.4	140.2	147.1	-76	0	0	0	0	119.8
24	C	39.3	Very low	35.6	Very low	108 Å²	108	132.7 Å²	132.7	73%	0.73	76%	0.758	S	S	*	*			cis	-176.9	130.3	14.7	-113.6	0	0	0	0	104
25	V	40.5	Very low	35.8	Very low	112 Å²	112	129.1 Å²	129.1	68%	0.679	76%	0.759	S	S	*	*				152.4	114	79.1	150.3	0	0	0	0	103.7
26	L	35.2	Very low	36.1	Very low	136 Å²	136	131.6 Å²	131.6	71%	0.712	76%	0.76	S	S	*	*				49.1	121.1	109.7	-72.2	143.2	0	0	0	113.3
27	L	39.3	Very low	36.2	Very low	142 Å²	142	127 Å²	127	74%	0.743	76%	0.76	S	S	*	*				-168.4	125.7	63.8	-93.5	112.6	0	0	0	107.2
28	L	35.4	Very low	36.1	Very low	121 Å²	121	124 Å²	124	63%	0.634	76%	0.761	S	S	*	*				81.6	119.7	81.1	-80.3	176.2	0	0	0	114.8
29	L	37.7	Very low	36.2	Very low	134 Å²	134	123.1 Å²	123.1	70%	0.702	76%	0.761	S	S	*	*			trans	75.2	140.7	139.4	-56.5	160.6	0	0	0	116
30	N	33.7	Very low	35.7	Very low	138 Å²	138	121.5 Å²	121.5	74%	0.738	75%	0.752	S	S	*	*			cis	-164.1	146.2	8.9	-119.3	-21.7	0	0	0	110
31	C	33.9	Very low	35.8	Very low	111 Å²	111	124.4 Å²	124.4	75%	0.75	76%	0.764	S	S	*	*			trans	-41.7	148.5	154.3	-67.2	0	0	0	0	113.3
32	S	31.8	Very low	35.6	Very low	123 Å²	123	125.2 Å²	125.2	86%	0.86	76%	0.762	S	S	*	*				156.7	143.6	106.5	49.5	0	0	0	0	114.1
33	G	31.3	Very low	36	Very low	74 Å²	74	125.5 Å²	125.5	76%	0.763	76%	0.758	S	S	*	*			trans	89.8	121.6	165.7	0	0	0	0	0	113.6
34	V	36.2	Very low	36.1	Very low	127 Å²	127	126.7 Å²	126.7	77%	0.77	76%	0.762	S	S	*	*			cis	-160.8	142.7	43.3	172.5	0	0	0	0	109.1
35	P	31.4	Very low	36.9	Very low	125 Å²	125	124.9 Å²	124.9	81%	0.812	76%	0.762	S	S	*	*			trans	-89.1	128.9	169.1	33.9	-26.3	0	0	0	110.2
36	M	36.5	Very low	37.9	Very low	175 Å²	175	125.4 Å²	125.4	86%	0.862	77%	0.771	S	S	*	*			trans	-134.7	112.9	166.9	-106	-169.8	-159.1	0	0	111.3
37	S	32.1	Very low	39.6	Very low	113 Å²	113	122.9 Å²	122.9	79%	0.79	76%	0.76	S	S	*	*			trans	61.2	100.4	141.3	-169.5	0	0	0	0	118.5	A39	S37-A39 PolarHBondContact O-N 2.84Å
38	L	34.2	Very low	41.4	Very low	175 Å²	175	118.8 Å²	118.8	92%	0.916	75%	0.747	S	S	*	*			trans	-66.7	116	157.7	-84.5	144.1	0	0	0	110.2
39	A	34.4	Very low	43.7	Very low	93 Å²	93	121.7 Å²	121.7	77%	0.769	76%	0.755	S	S	*	*			trans	-93.9	108.5	156.8	0	0	0	0	0	108.4	S37	S37-A39 PolarHBondContact O-N 2.84Å
40	S	33.4	Very low	46	Very low	95 Å²	95	116.1 Å²	116.1	66%	0.664	73%	0.727	S	S	*	*			trans	-80.6	113.7	172.7	47.4	0	0	0	0	110.7
41	S	40.6	Very low	48.3	Very low	120 Å²	120	117.9 Å²	117.9	84%	0.839	73%	0.73	S	S	*	*			trans	-94.3	108	168.7	34.8	0	0	0	0	110.4
42	F	37	Very low	50.8	Low	176 Å²	176	117 Å²	117	77%	0.772	72%	0.719	S	S	*	*			trans	-71.7	132.6	174.8	-75.8	-93.9	0	0	0	111.3	T44	F42-T44 PolarHBondContact O-N 2.85Å
43	L	45.2	Very low	53.4	Low	123 Å²	123	116 Å²	116	64%	0.644	70%	0.7	S	S	*	*			trans	-73.3	109.9	164.2	-83.2	159.5	0	0	0	108.8	M1 L2	M1-L43 HydrophobicContact CB-CD1 4.24Å; L2-L43 HydrophobicContact CD2-CD1 4.35Å; L2-L43 HydrophobicContact CG-CD1 4.46Å
44	T	39.4	Very low	55.9	Low	139 Å²	139	114.8 Å²	114.8	85%	0.853	69%	0.688	S	S	*	*			trans	-92	121.4	174.6	49.9	0	0	0	0	110.8	F42	F42-T44 PolarHBondContact O-N 2.85Å
45	G	55.9	Low	58.4	Low	70 Å²	70	112.7 Å²	112.7	72%	0.722	67%	0.67	S	S	*	*			trans	-141.6	145.8	164.3	0	0	0	0	0	108.6
46	S	62	Low	61.1	Low	124 Å²	124	110.5 Å²	110.5	87%	0.867	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-73	133.1	178.2	53.1	0	0	0	0	110.7	A48	S46-A48 PolarHBondContact O-N 2.96Å
47	V	70.3	Confident	63.4	Low	82 Å²	82	103.4 Å²	103.4	50%	0.497	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-65.6	125.4	172.7	-174	0	0	0	0	109	E76	V47-E76 HydrophobicContact CG1-CB 3.7Å; V47-E76 HydrophobicContact CG1-CG 3.62Å
48	A	77.7	Confident	65.9	Low	57 Å²	57	104.9 Å²	104.9	47%	0.471	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-69.1	134	175.1	0	0	0	0	0	109.3	S46 E76 V77	S46-A48 PolarHBondContact O-N 2.96Å; A48-E76 WeakPolarHBondContact O-CA 3.41Å; A48-V77 HydrophobicContact CB-CB 4Å; A48-V77 HydrophobicContact CB-CG2 3.73Å; A48-V77 WeakPolarHBondContact O-CG2 2.98Å; A48-V77 PolarHBondContact O-N 2.61Å
49	K	84.3	Confident	68.1	Low	182 Å²	182	98.6 Å²	98.6	79%	0.791	58%	0.58	S	S	*	*	B	Isolated β-bridge	trans	-96.4	154.9	179.6	-64.7	-173	178.9	-177	0	111.2	K75	K49-K75 VanDerWaalsContact CA-O 3.23Å; K49-K75 WeakPolarHBondContact CA-O 3.47Å
50	C	84.7	Confident	70.1	Confident	16 Å²	16	98.3 Å²	98.3	11%	0.108	57%	0.571	C	S	.	*			trans	-141.5	156.9	176.2	52.1	0	0	0	0	109.8	L57 C72 K75 V77	C50-L57 HydrophobicContact CB-CD1 3.78Å; C50-L57 HydrophobicContact CB-CD2 4.43Å; C50-C72 HydrophobicContact CB-CB 3.7Å; C50-C72 WeakPolarHBondContact CB-SG 3.5Å; C50-C72 WeakPolarHBondContact SG-CA 3.13Å; C50-C72 WeakPolarHBondContact SG-CB 3.49Å; C50-C72 CovalentContact SG-SG 2.01Å; C50-C72 PolarHBondContact SG-SG 2.04Å; C50-K75 PolarHBondContact N-O 2.9Å; C50-K75 VanDerWaalsContact N-O 3.08Å; C50-K75 VanDerWaalsContact SG-C 3.51Å; C50-V77 HydrophobicContact CB-CG2 4.12Å
51	E	83.2	Confident	72.2	Confident	175 Å²	175	102.8 Å²	102.8	82%	0.818	58%	0.579	S	S	*	*	S	Bend	trans	-97.5	-37.9	-171.8	-63.8	-175	164.3	0	0	112.9
52	N	85.2	Confident	74	Confident	94 Å²	94	100.5 Å²	100.5	50%	0.503	56%	0.556	S	S	.	*	S	Bend	trans	-105.1	109.9	-172.7	-52.7	-52	0	0	0	111.5	G54 E55 C72	N52-G54 PolarHBondContact O-N 3.33Å; N52-E55 HydrophobicContact CB-CB 3.97Å; N52-E55 WeakPolarHBondContact CB-OE2 3.42Å; N52-E55 PolarHBondContact ND2-OE2 3.3Å; N52-E55 VanDerWaalsContact O-CB 3.24Å; N52-E55 WeakPolarHBondContact O-CB 3.2Å; N52-E55 PolarHBondContact O-N 3.03Å; N52-C72 WeakPolarHBondContact O-CB 3.41Å; N52-C72 PolarHBondContact O-SG 3.35Å
53	E	86.8	Confident	76.1	Confident	101 Å²	101	92.9 Å²	92.9	47%	0.472	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	133.7	175.2	-68.1	-60.8	144.1	0	0	112.2	E55 L73 N74 K75	E53-E55 VanDerWaalsContact C-N 3.26Å; E53-E55 PolarHBondContact O-N 2.78Å; E53-L73 WeakPolarHBondContact OE2-CA 3.43Å; E53-N74 WeakPolarHBondContact OE1-CA 3.32Å; E53-N74 PolarHBondContact OE1-N 3.27Å; E53-N74 PolarHBondContact OE2-N 2.8Å; E53-K75 WeakPolarHBondContact OE1-CG 3.28Å; E53-K75 PolarHBondContact OE1-N 3.28Å
54	G	84.3	Confident	77.7	Confident	49 Å²	49	92.3 Å²	92.3	51%	0.505	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-5.2	-179.6	0	0	0	0	0	115.2	N52 V56 C72	N52-G54 PolarHBondContact O-N 3.33Å; G54-V56 PolarHBondContact O-N 3.02Å; G54-C72 PolarHBondContact N-O 2.89Å
55	E	89	Confident	79.7	Confident	83 Å²	83	88.3 Å²	88.3	39%	0.388	50%	0.495	S	S	.	.			trans	-64.9	130.1	177.2	-174.4	-178.4	176.8	0	0	111.2	N52 E53 L57 V71 C72	N52-E55 HydrophobicContact CB-CB 3.97Å; N52-E55 WeakPolarHBondContact CB-OE2 3.42Å; N52-E55 PolarHBondContact ND2-OE2 3.3Å; N52-E55 VanDerWaalsContact O-CB 3.24Å; N52-E55 WeakPolarHBondContact O-CB 3.2Å; N52-E55 PolarHBondContact O-N 3.03Å; E53-E55 VanDerWaalsContact C-N 3.26Å; E53-E55 PolarHBondContact O-N 2.78Å; E55-L57 HydrophobicContact CB-CD2 4.46Å; E55-L57 HydrophobicContact CG-CD2 4.1Å; E55-L57 PolarHBondContact O-N 2.9Å; E55-V71 CarbonylContact O-C 3.55Å; E55-V71 WeakPolarHBondContact O-CA 3.28Å; E55-C72 HydrophobicContact CB-CB 4.46Å; E55-C72 PolarHBondContact O-N 2.82Å
56	V	86.9	Confident	81	Confident	79 Å²	79	88 Å²	88	48%	0.479	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-78.4	110.8	169.5	-179.9	0	0	0	0	108.3	G54 M69 C70 V71	G54-V56 PolarHBondContact O-N 3.02Å; V56-M69 HydrophobicContact CG1-CG 4.22Å; V56-C70 CarbonylContact C-O 3.55Å; V56-C70 WeakPolarHBondContact CA-O 3.42Å; V56-V71 HydrophobicContact CG2-CG2 4.39Å
57	L	85.4	Confident	82.3	Confident	26 Å²	26	82.9 Å²	82.9	14%	0.136	44%	0.444	C	S	.	.			trans	-88.8	127.3	-173.4	-62.4	168.5	0	0	0	110.5	C50 E55 I59 T63 C70 C72 V77	C50-L57 HydrophobicContact CB-CD1 3.78Å; C50-L57 HydrophobicContact CB-CD2 4.43Å; E55-L57 HydrophobicContact CB-CD2 4.46Å; E55-L57 HydrophobicContact CG-CD2 4.1Å; E55-L57 PolarHBondContact O-N 2.9Å; L57-I59 HydrophobicContact CB-CD1 4.43Å; L57-I59 HydrophobicContact CB-CG1 4.15Å; L57-I59 PolarHBondContact O-N 3.35Å; L57-T63 WeakPolarHBondContact O-CG2 3Å; L57-C70 HydrophobicContact CB-CB 4.4Å; L57-C70 PolarHBondContact N-O 3.25Å; L57-C72 HydrophobicContact CD1-CB 4.18Å; L57-V77 HydrophobicContact CD1-CB 4.17Å; L57-V77 HydrophobicContact CD1-CG1 3.97Å; L57-V77 HydrophobicContact CD1-CG2 3.51Å
58	Q	83.3	Confident	83.2	Confident	144 Å²	144	80.8 Å²	80.8	67%	0.673	43%	0.43	S	S	*	.			trans	-85.2	107.3	168.9	-67.1	-61.4	-35.2	0	0	109.1	T63	Q58-T63 WeakPolarHBondContact CA-OG1 3.43Å; Q58-T63 PolarHBondContact OE1-OG1 2.89Å
59	I	81.6	Confident	83.7	Confident	42 Å²	42	83.3 Å²	83.3	22%	0.215	43%	0.433	C	S	.	.			trans	-110.4	110.9	-178.7	-53.9	175.2	0	0	0	107.7	L57 F61 I62 T63 C70 V77	L57-I59 HydrophobicContact CB-CD1 4.43Å; L57-I59 HydrophobicContact CB-CG1 4.15Å; L57-I59 PolarHBondContact O-N 3.35Å; I59-F61 PolarHBondContact O-N 3.35Å; I59-I62 HydrophobicContact CB-CB 4.08Å; I59-I62 HydrophobicContact CB-CD1 4.48Å; I59-I62 HydrophobicContact CG2-CB 4.08Å; I59-I62 HydrophobicContact CG2-CD1 3.75Å; I59-I62 HydrophobicContact CG2-CG1 3.97Å; I59-I62 PolarHBondContact O-N 2.83Å; I59-T63 HydrophobicContact CB-CG2 4.39Å; I59-T63 PolarHBondContact N-OG1 3.03Å; I59-T63 PolarHBondContact O-N 2.88Å; I59-T63 PolarHBondContact O-OG1 3.18Å; I59-C70 HydrophobicContact CD1-CB 3.8Å; I59-C70 HydrophobicContact CG1-CB 4.47Å; I59-V77 HydrophobicContact CD1-CG1 3.39Å
60	P	76.9	Confident	84	Confident	87 Å²	87	74.7 Å²	74.7	57%	0.565	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	138.2	179.1	-27.9	34.5	0	0	0	111.4	I62	P60-I62 PolarHBondContact O-N 2Å
61	F	77.5	Confident	84.3	Confident	190 Å²	190	75.3 Å²	75.3	83%	0.833	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	-13	-177.5	-43	-75.2	0	0	0	116.4	I59 D64	I59-F61 PolarHBondContact O-N 3.35Å; F61-D64 WeakPolarHBondContact CA-OD2 3.24Å; F61-D64 PolarHBondContact N-OD2 3.09Å
62	I	78.1	Confident	84.7	Confident	71 Å²	71	67 Å²	67	36%	0.364	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-59.3	176.3	-57.8	-172.9	0	0	0	110.2	I59 P60 D64 N65 I68	I59-I62 HydrophobicContact CB-CB 4.08Å; I59-I62 HydrophobicContact CB-CD1 4.48Å; I59-I62 HydrophobicContact CG2-CB 4.08Å; I59-I62 HydrophobicContact CG2-CD1 3.75Å; I59-I62 HydrophobicContact CG2-CG1 3.97Å; I59-I62 PolarHBondContact O-N 2.83Å; P60-I62 PolarHBondContact O-N 2Å; I62-D64 VanDerWaalsContact C-N 3.26Å; I62-D64 PolarHBondContact O-N 3.31Å; I62-N65 PolarHBondContact O-N 3.03Å; I62-I68 HydrophobicContact CG2-CG2 3.68Å
63	T	80.3	Confident	84.9	Confident	16 Å²	16	66.1 Å²	66.1	10%	0.098	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.4	-178.3	60.6	0	0	0	0	113.6	L57 Q58 I59 N65 C70	L57-T63 WeakPolarHBondContact O-CG2 3Å; Q58-T63 WeakPolarHBondContact CA-OG1 3.43Å; Q58-T63 PolarHBondContact OE1-OG1 2.89Å; I59-T63 HydrophobicContact CB-CG2 4.39Å; I59-T63 PolarHBondContact N-OG1 3.03Å; I59-T63 PolarHBondContact O-N 2.88Å; I59-T63 PolarHBondContact O-OG1 3.18Å; T63-N65 PolarHBondContact O-N 3.05Å; T63-C70 HydrophobicContact CG2-CB 4.05Å
64	D	79.4	Confident	84.9	Confident	112 Å²	112	68.1 Å²	68.1	60%	0.599	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.6	165.5	-62.2	-19.9	0	0	0	111.6	F61 I62 P66	F61-D64 WeakPolarHBondContact CA-OD2 3.24Å; F61-D64 PolarHBondContact N-OD2 3.09Å; I62-D64 VanDerWaalsContact C-N 3.26Å; I62-D64 PolarHBondContact O-N 3.31Å; D64-P66 WeakPolarHBondContact O-CD 3.32Å
65	N	81.9	Confident	85	Confident	54 Å²	54	72.5 Å²	72.5	29%	0.289	37%	0.374	S	S	.	.	S	Bend	trans	-85.9	114.8	168.9	-174.4	-16.3	0	0	0	109.3	I62 T63 C67 I68	I62-N65 PolarHBondContact O-N 3.03Å; T63-N65 PolarHBondContact O-N 3.05Å; N65-C67 PolarHBondContact O-N 3.44Å; N65-C67 VanDerWaalsContact OD1-CB 3.31Å; N65-C67 WeakPolarHBondContact OD1-CB 3.49Å; N65-C67 PolarHBondContact OD1-N 2.75Å; N65-I68 HydrophobicContact CB-CD1 4.02Å; N65-I68 HydrophobicContact CB-CG1 4.1Å; N65-I68 PolarHBondContact O-N 2.82Å
66	P	83.1	Confident	84.9	Confident	65 Å²	65	72.9 Å²	72.9	42%	0.422	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.9	-178.3	27.1	-35.8	0	0	0	113.5	D64 I68 G99	D64-P66 WeakPolarHBondContact O-CD 3.32Å; P66-I68 VanDerWaalsContact C-N 3.33Å; P66-G99 WeakPolarHBondContact CB-O 3.33Å
67	C	89.1	Confident	85	Confident	16 Å²	16	70.6 Å²	70.6	11%	0.108	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.6	173.2	-65.3	0	0	0	0	114.5	N65 R81 E82 C101	N65-C67 PolarHBondContact O-N 3.44Å; N65-C67 VanDerWaalsContact OD1-CB 3.31Å; N65-C67 WeakPolarHBondContact OD1-CB 3.49Å; N65-C67 PolarHBondContact OD1-N 2.75Å; C67-R81 CarbonylContact O-C 3.57Å; C67-R81 VanDerWaalsContact O-CA 3.22Å; C67-R81 WeakPolarHBondContact O-CA 3.05Å; C67-E82 PolarHBondContact O-N 2.92Å; C67-C101 WeakPolarHBondContact CA-SG 3.49Å; C67-C101 HydrophobicContact CB-CB 3.9Å; C67-C101 WeakPolarHBondContact CB-SG 3.5Å; C67-C101 WeakPolarHBondContact SG-CA 2.96Å; C67-C101 WeakPolarHBondContact SG-CB 3.08Å; C67-C101 PolarHBondContact SG-O 3.11Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 2.93Å
68	I	88.6	Confident	85.1	Confident	37 Å²	37	71.7 Å²	71.7	19%	0.19	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.2	-179.7	-56.6	178.4	0	0	0	108.4	I62 N65 P66 C79 K80 R81	I62-I68 HydrophobicContact CG2-CG2 3.68Å; N65-I68 HydrophobicContact CB-CD1 4.02Å; N65-I68 HydrophobicContact CB-CG1 4.1Å; N65-I68 PolarHBondContact O-N 2.82Å; P66-I68 VanDerWaalsContact C-N 3.33Å; I68-C79 HydrophobicContact CG2-CB 4.23Å; I68-K80 WeakPolarHBondContact CA-O 3.32Å; I68-R81 HydrophobicContact CG1-CB 4.35Å; I68-R81 HydrophobicContact CG1-CG 4.21Å
69	M	87.9	Confident	85.4	Confident	111 Å²	111	67.6 Å²	67.6	55%	0.547	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.9	175.6	-174.7	171.6	62.3	0	0	109	V56 V71 C79 K80	V56-M69 HydrophobicContact CG1-CG 4.22Å; M69-V71 HydrophobicContact CG-CG2 4.16Å; M69-C79 CarbonylContact O-C 3.43Å; M69-C79 WeakPolarHBondContact O-CA 3.39Å; M69-K80 PolarHBondContact N-O 2.71Å; M69-K80 PolarHBondContact O-N 3.22Å
70	C	90.6	Very high	85.7	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.6	177.3	-60.2	0	0	0	0	109.2	V56 L57 I59 T63 V77 T78 C79	V56-C70 CarbonylContact C-O 3.55Å; V56-C70 WeakPolarHBondContact CA-O 3.42Å; L57-C70 HydrophobicContact CB-CB 4.4Å; L57-C70 PolarHBondContact N-O 3.25Å; I59-C70 HydrophobicContact CD1-CB 3.8Å; I59-C70 HydrophobicContact CG1-CB 4.47Å; T63-C70 HydrophobicContact CG2-CB 4.05Å; C70-V77 HydrophobicContact CB-CG1 4.27Å; C70-T78 WeakPolarHBondContact CA-O 3.37Å; C70-C79 HydrophobicContact CB-CB 4.11Å; C70-C79 WeakPolarHBondContact CB-SG 3.5Å; C70-C79 WeakPolarHBondContact SG-CB 3.49Å; C70-C79 CovalentContact SG-SG 2.04Å; C70-C79 PolarHBondContact SG-SG 3.34Å
71	V	91.8	Very high	86.3	Confident	30 Å²	30	77 Å²	77	18%	0.182	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.8	-179.1	-176.1	0	0	0	0	108.6	E55 V56 M69 L73 T78	E55-V71 CarbonylContact O-C 3.55Å; E55-V71 WeakPolarHBondContact O-CA 3.28Å; V56-V71 HydrophobicContact CG2-CG2 4.39Å; M69-V71 HydrophobicContact CG-CG2 4.16Å; V71-L73 HydrophobicContact CG1-CD2 4.24Å; V71-L73 HydrophobicContact CG1-CG 4.29Å; V71-L73 PolarHBondContact O-N 2.65Å; V71-T78 PolarHBondContact N-O 2.99Å; V71-T78 PolarHBondContact O-N 2.81Å
72	C	90.9	Very high	86.8	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117.9	170.8	-171.5	0	0	0	0	110.2	C50 N52 G54 E55 L57	C50-C72 HydrophobicContact CB-CB 3.7Å; C50-C72 WeakPolarHBondContact CB-SG 3.5Å; C50-C72 WeakPolarHBondContact SG-CA 3.13Å; C50-C72 WeakPolarHBondContact SG-CB 3.49Å; C50-C72 CovalentContact SG-SG 2.01Å; C50-C72 PolarHBondContact SG-SG 2.04Å; N52-C72 WeakPolarHBondContact O-CB 3.41Å; N52-C72 PolarHBondContact O-SG 3.35Å; G54-C72 PolarHBondContact N-O 2.89Å; E55-C72 HydrophobicContact CB-CB 4.46Å; E55-C72 PolarHBondContact O-N 2.82Å; L57-C72 HydrophobicContact CD1-CB 4.18Å
73	L	88.7	Confident	87.2	Confident	76 Å²	76	79.1 Å²	79.1	40%	0.398	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	123.6	177.4	-64.8	175.6	0	0	0	108.9	E53 V71 K75 E76 T78	E53-L73 WeakPolarHBondContact OE2-CA 3.43Å; V71-L73 HydrophobicContact CG1-CD2 4.24Å; V71-L73 HydrophobicContact CG1-CG 4.29Å; V71-L73 PolarHBondContact O-N 2.65Å; L73-K75 VanDerWaalsContact C-N 3.28Å; L73-K75 PolarHBondContact O-N 3.47Å; L73-E76 PolarHBondContact N-O 3.3Å; L73-E76 PolarHBondContact O-N 3.47Å; L73-T78 HydrophobicContact CD1-CG2 4.01Å
74	N	87.9	Confident	87.5	Confident	142 Å²	142	81.3 Å²	81.3	76%	0.759	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	40.6	-178.9	-59	-35.3	0	0	0	113.4	E53 E76	E53-N74 WeakPolarHBondContact OE1-CA 3.32Å; E53-N74 PolarHBondContact OE1-N 3.27Å; E53-N74 PolarHBondContact OE2-N 2.8Å; N74-E76 PolarHBondContact O-N 3.24Å
75	K	85.8	Confident	87.7	Confident	141 Å²	141	80.5 Å²	80.5	61%	0.613	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	16.4	-176.6	-53.8	-175	176.6	-173.9	0	113.8	K49 C50 E53 L73	K49-K75 VanDerWaalsContact CA-O 3.23Å; K49-K75 WeakPolarHBondContact CA-O 3.47Å; C50-K75 PolarHBondContact N-O 2.9Å; C50-K75 VanDerWaalsContact N-O 3.08Å; C50-K75 VanDerWaalsContact SG-C 3.51Å; E53-K75 WeakPolarHBondContact OE1-CG 3.28Å; E53-K75 PolarHBondContact OE1-N 3.28Å; L73-K75 VanDerWaalsContact C-N 3.28Å; L73-K75 PolarHBondContact O-N 3.47Å
76	E	87.6	Confident	87.8	Confident	91 Å²	91	84.9 Å²	84.9	43%	0.425	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.6	179	-65.7	-175.2	168.5	0	0	110.5	V47 A48 L73 N74 T78	V47-E76 HydrophobicContact CG1-CB 3.7Å; V47-E76 HydrophobicContact CG1-CG 3.62Å; A48-E76 WeakPolarHBondContact O-CA 3.41Å; L73-E76 PolarHBondContact N-O 3.3Å; L73-E76 PolarHBondContact O-N 3.47Å; N74-E76 PolarHBondContact O-N 3.24Å; E76-T78 PolarHBondContact O-N 3.06Å
77	V	88.2	Confident	87.9	Confident	31 Å²	31	83.7 Å²	83.7	19%	0.188	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	113.2	177.5	178	0	0	0	0	109.7	A48 C50 L57 I59 C70	A48-V77 HydrophobicContact CB-CB 4Å; A48-V77 HydrophobicContact CB-CG2 3.73Å; A48-V77 WeakPolarHBondContact O-CG2 2.98Å; A48-V77 PolarHBondContact O-N 2.61Å; C50-V77 HydrophobicContact CB-CG2 4.12Å; L57-V77 HydrophobicContact CD1-CB 4.17Å; L57-V77 HydrophobicContact CD1-CG1 3.97Å; L57-V77 HydrophobicContact CD1-CG2 3.51Å; I59-V77 HydrophobicContact CD1-CG1 3.39Å; C70-V77 HydrophobicContact CB-CG1 4.27Å
78	T	88.5	Confident	87.6	Confident	50 Å²	50	86.3 Å²	86.3	31%	0.307	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112.8	176.7	-60.4	0	0	0	0	111	C70 V71 L73 E76	C70-T78 WeakPolarHBondContact CA-O 3.37Å; V71-T78 PolarHBondContact N-O 2.99Å; V71-T78 PolarHBondContact O-N 2.81Å; L73-T78 HydrophobicContact CD1-CG2 4.01Å; E76-T78 PolarHBondContact O-N 3.06Å
79	C	88.7	Confident	87.2	Confident	58 Å²	58	96.6 Å²	96.6	39%	0.392	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.3	177.2	-57.9	0	0	0	0	112	I68 M69 C70	I68-C79 HydrophobicContact CG2-CB 4.23Å; M69-C79 CarbonylContact O-C 3.43Å; M69-C79 WeakPolarHBondContact O-CA 3.39Å; C70-C79 HydrophobicContact CB-CB 4.11Å; C70-C79 WeakPolarHBondContact CB-SG 3.5Å; C70-C79 WeakPolarHBondContact SG-CB 3.49Å; C70-C79 CovalentContact SG-SG 2.04Å; C70-C79 PolarHBondContact SG-SG 3.34Å
80	K	88.3	Confident	86.8	Confident	150 Å²	150	96.4 Å²	96.4	65%	0.652	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.2	172.3	-68.7	-176.2	-179.2	176.6	0	110	I68 M69	I68-K80 WeakPolarHBondContact CA-O 3.32Å; M69-K80 PolarHBondContact N-O 2.71Å; M69-K80 PolarHBondContact O-N 3.22Å
81	R	89.2	Confident	86.8	Confident	175 Å²	175	96.6 Å²	96.6	66%	0.66	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.4	174.5	-177.3	173.9	177.5	157.1	-1	110.5	C67 I68	C67-R81 CarbonylContact O-C 3.57Å; C67-R81 VanDerWaalsContact O-CA 3.22Å; C67-R81 WeakPolarHBondContact O-CA 3.05Å; I68-R81 HydrophobicContact CG1-CB 4.35Å; I68-R81 HydrophobicContact CG1-CG 4.21Å
82	E	88.1	Confident	86.6	Confident	109 Å²	109	95.4 Å²	95.4	51%	0.509	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-67.7	134.7	172.2	-173.4	179.2	170.5	0	0	110.2	C67 C101	C67-E82 PolarHBondContact O-N 2.92Å; E82-C101 HydrophobicContact CB-CB 4.45Å; E82-C101 VanDerWaalsContact OE2-CB 3.29Å; E82-C101 WeakPolarHBondContact OE2-CB 3.08Å
83	K	85.7	Confident	86.6	Confident	198 Å²	198	95.7 Å²	95.7	86%	0.861	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-101.8	119.6	175.1	-69	-176.9	-178.1	178.2	0	108.6
84	C	86.7	Confident	86.7	Confident	61 Å²	61	92.1 Å²	92.1	41%	0.412	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-76.8	139.4	-178.9	-61.4	0	0	0	0	112.8	C101 C102	C84-C101 PolarHBondContact SG-SG 2.92Å; C84-C102 WeakPolarHBondContact CA-SG 3.33Å; C84-C102 HydrophobicContact CB-CB 3.7Å; C84-C102 WeakPolarHBondContact CB-SG 3.36Å; C84-C102 WeakPolarHBondContact SG-CA 3.3Å; C84-C102 WeakPolarHBondContact SG-CB 3.33Å; C84-C102 CovalentContact SG-SG 2.04Å; C84-C102 PolarHBondContact SG-SG 2.83Å
85	P	85.5	Confident	86.7	Confident	96 Å²	96	86.9 Å²	86.9	62%	0.623	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-65.3	145.7	170.5	28.4	-33.4	0	0	0	110.3	L87	P85-L87 PolarHBondContact O-N 3.41Å
86	V	83.4	Confident	86.6	Confident	146 Å²	146	82.9 Å²	82.9	89%	0.885	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-71.6	121.3	174	-178.8	0	0	0	0	108.2
87	L	83.8	Confident	86.1	Confident	39 Å²	39	82.9 Å²	82.9	20%	0.204	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-65.7	140	175.8	-71.3	176.5	0	0	0	110.9	P85 R89 A94 E103 C105	P85-L87 PolarHBondContact O-N 3.41Å; L87-R89 PolarHBondContact O-N 2.04Å; L87-A94 HydrophobicContact CD1-CB 3.74Å; L87-E103 HydrophobicContact CD1-CB 3.74Å; L87-C105 HydrophobicContact CD2-CB 4.47Å
88	S	83.4	Confident	85.4	Confident	71 Å²	71	92 Å²	92	50%	0.497	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-55.5	139.6	174.9	178.3	0	0	0	0	110.8	D90 C91	S88-D90 PolarHBondContact O-N 2.85Å; S88-D90 PolarHBondContact OG-N 2.86Å; S88-C91 VanDerWaalsContact O-CB 3.23Å; S88-C91 WeakPolarHBondContact O-CB 3.36Å; S88-C91 PolarHBondContact O-N 3.27Å
89	R	79.5	Confident	84.7	Confident	254 Å²	254	92.6 Å²	92.6	96%	0.958	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.2	174.5	-69.1	-172.7	175.7	-170	-0.5	112.6	L87 C91	L87-R89 PolarHBondContact O-N 2.04Å; R89-C91 VanDerWaalsContact C-N 3.27Å
90	D	81.4	Confident	84.5	Confident	107 Å²	107	91.6 Å²	91.6	57%	0.572	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.8	174.7	-68.3	-61.5	0	0	0	113.1	S88 A92 K223	S88-D90 PolarHBondContact O-N 2.85Å; S88-D90 PolarHBondContact OG-N 2.86Å; D90-A92 PolarHBondContact O-N 3.09Å; D90-K223 IonicContact OD1-NZ 2.63Å
91	C	88.9	Confident	84.4	Confident	4 Å²	4	84.9 Å²	84.9	3%	0.027	43%	0.427	C	S	.	.			trans	-75.9	106.7	177.5	-178.6	0	0	0	0	111	S88 R89 L93 C105 Q227	S88-C91 VanDerWaalsContact O-CB 3.23Å; S88-C91 WeakPolarHBondContact O-CB 3.36Å; S88-C91 PolarHBondContact O-N 3.27Å; R89-C91 VanDerWaalsContact C-N 3.27Å; C91-L93 PolarHBondContact SG-O 3.06Å; C91-L93 VanDerWaalsContact SG-O 3.4Å; C91-C105 HydrophobicContact CB-CB 3.9Å; C91-C105 WeakPolarHBondContact CB-SG 3.49Å; C91-C105 WeakPolarHBondContact SG-CA 3.04Å; C91-C105 WeakPolarHBondContact SG-CB 3.15Å; C91-C105 CovalentContact SG-SG 2.03Å; C91-C105 PolarHBondContact SG-SG 3.29Å; C91-Q227 WeakPolarHBondContact O-CG 3.31Å; C91-Q227 PolarHBondContact O-NE2 2.81Å
92	A	89.3	Confident	84.4	Confident	5 Å²	5	77.1 Å²	77.1	4%	0.041	40%	0.4	C	S	.	.			trans	-84.4	-17.8	-179	0	0	0	0	0	114.7	D90 E135 C224 R228	D90-A92 PolarHBondContact O-N 3.09Å; A92-E135 HydrophobicContact CB-CG 4.35Å; A92-E135 WeakPolarHBondContact CB-OE1 3.02Å; A92-E135 PolarHBondContact N-OE1 3.43Å; A92-C224 HydrophobicContact CB-CB 3.33Å; A92-R228 PolarHBondContact O-N 3.43Å
93	L	90.6	Very high	84.4	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	103.9	178.7	-174.4	60.2	0	0	0	110.7	C91 K106 E135 R228 V230 L239	C91-L93 PolarHBondContact SG-O 3.06Å; C91-L93 VanDerWaalsContact SG-O 3.4Å; L93-K106 HydrophobicContact CB-CB 4.21Å; L93-K106 HydrophobicContact CD2-CB 3.92Å; L93-K106 HydrophobicContact CD2-CG 3.94Å; L93-K106 HydrophobicContact CG-CB 3.93Å; L93-K106 HydrophobicContact CG-CG 4.47Å; L93-K106 WeakPolarHBondContact O-CB 3.46Å; L93-K106 PolarHBondContact O-N 2.88Å; L93-E135 HydrophobicContact CB-CB 3.88Å; L93-E135 HydrophobicContact CB-CG 4.04Å; L93-E135 WeakPolarHBondContact CD2-O 3.23Å; L93-R228 WeakPolarHBondContact CA-O 3.21Å; L93-R228 HydrophobicContact CD1-CB 4.11Å; L93-V230 HydrophobicContact CD1-CG2 3.61Å; L93-L239 HydrophobicContact CD1-CD2 4.08Å; L93-L239 HydrophobicContact CD2-CD2 4.43Å
94	A	90.3	Very high	84.6	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.008	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.6	173.6	0	0	0	0	0	110.1	L87 Q104 Q227 R228 K229 V230	L87-A94 HydrophobicContact CD1-CB 3.74Å; A94-Q104 WeakPolarHBondContact CA-O 3.46Å; A94-Q227 HydrophobicContact CB-CG 4.12Å; A94-R228 PolarHBondContact N-O 3.29Å; A94-K229 HydrophobicContact CB-CG 4.3Å; A94-K229 WeakPolarHBondContact O-CA 3.32Å; A94-V230 PolarHBondContact O-N 2.77Å
95	I	87.3	Confident	84.8	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.169	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	141.5	176.5	53.7	161.3	0	0	0	110.6	E103 Q104 K106 V230	I95-E103 WeakPolarHBondContact O-CA 3.33Å; I95-Q104 WeakPolarHBondContact CG1-O 3.29Å; I95-Q104 PolarHBondContact N-O 2.97Å; I95-Q104 PolarHBondContact O-N 2.03Å; I95-K106 HydrophobicContact CD1-CD 3.88Å; I95-K106 HydrophobicContact CG1-CD 4.44Å; I95-K106 HydrophobicContact CG2-CB 4.19Å; I95-K106 HydrophobicContact CG2-CD 4.06Å; I95-K106 HydrophobicContact CG2-CG 4.48Å; I95-V230 WeakPolarHBondContact CA-O 3.44Å; I95-V230 HydrophobicContact CG2-CB 4.48Å
96	K	84.4	Confident	85.1	Confident	57 Å²	57	67 Å²	67	25%	0.248	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	111.1	169.4	-168.2	-179.6	-174.7	168.7	0	109.2	A100 C101 E103 V230 F231 D232	K96-A100 WeakPolarHBondContact CE-O 2.99Å; K96-C101 VanDerWaalsContact CE-O 3.3Å; K96-C101 WeakPolarHBondContact CE-O 3.33Å; K96-C101 PolarHBondContact NZ-O 2.77Å; K96-C101 VanDerWaalsContact NZ-O 3.13Å; K96-E103 HydrophobicContact CB-CG 4.1Å; K96-E103 HydrophobicContact CD-CG 4.02Å; K96-E103 HydrophobicContact CG-CG 4.3Å; K96-V230 PolarHBondContact N-O 3.31Å; K96-V230 VanDerWaalsContact N-O 3.1Å; K96-F231 HydrophobicContact CB-CD1 3.85Å; K96-F231 HydrophobicContact CB-CE1 3.93Å; K96-F231 HydrophobicContact CD-CD1 4.39Å; K96-F231 HydrophobicContact CD-CE1 4.04Å; K96-F231 WeakPolarHBondContact O-CA 3.41Å; K96-D232 PolarHBondContact O-N 3.06Å
97	Q	76.7	Confident	85.5	Confident	90 Å²	90	60.8 Å²	60.8	42%	0.421	31%	0.311	S	S	.	.			trans	-79.3	148.8	176.5	-65	-64.8	-19	0	0	110.5	G99 A100	Q97-G99 PolarHBondContact O-N 3.2Å; Q97-A100 VanDerWaalsContact O-CB 3.27Å; Q97-A100 WeakPolarHBondContact O-CB 3.23Å; Q97-A100 PolarHBondContact O-N 3.27Å
98	R	74.5	Confident	86	Confident	223 Å²	223	59 Å²	59	84%	0.842	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	128.6	174	-159	167.2	177.2	-178.2	-1.5	110.7	A100 D232	R98-A100 VanDerWaalsContact C-N 3.31Å; R98-A100 PolarHBondContact O-N 3.45Å; R98-D232 WeakPolarHBondContact CA-OD1 3.01Å; R98-D232 VanDerWaalsContact CB-OD1 3.26Å; R98-D232 WeakPolarHBondContact CB-OD1 3.39Å; R98-D232 PolarHBondContact N-OD1 2.89Å
99	G	73.8	Confident	86.5	Confident	63 Å²	63	58 Å²	58	65%	0.649	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-11.6	-178.1	0	0	0	0	0	115.2	P66 Q97	P66-G99 WeakPolarHBondContact CB-O 3.33Å; Q97-G99 PolarHBondContact O-N 3.2Å
100	A	83.6	Confident	87.2	Confident	36 Å²	36	46.6 Å²	46.6	30%	0.298	25%	0.25	S	C	.	.			trans	-74.7	137.4	173.6	0	0	0	0	0	111.3	K96 Q97 R98	K96-A100 WeakPolarHBondContact CE-O 2.99Å; Q97-A100 VanDerWaalsContact O-CB 3.27Å; Q97-A100 WeakPolarHBondContact O-CB 3.23Å; Q97-A100 PolarHBondContact O-N 3.27Å; R98-A100 VanDerWaalsContact C-N 3.31Å; R98-A100 PolarHBondContact O-N 3.45Å
101	C	87	Confident	87.5	Confident	9 Å²	9	48.8 Å²	48.8	6%	0.061	26%	0.256	C	S	.	.	S	Bend	trans	-66.4	-53.6	171.5	170.4	0	0	0	0	111.1	C67 E82 C84 K96	C67-C101 WeakPolarHBondContact CA-SG 3.49Å; C67-C101 HydrophobicContact CB-CB 3.9Å; C67-C101 WeakPolarHBondContact CB-SG 3.5Å; C67-C101 WeakPolarHBondContact SG-CA 2.96Å; C67-C101 WeakPolarHBondContact SG-CB 3.08Å; C67-C101 PolarHBondContact SG-O 3.11Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 2.93Å; E82-C101 HydrophobicContact CB-CB 4.45Å; E82-C101 VanDerWaalsContact OE2-CB 3.29Å; E82-C101 WeakPolarHBondContact OE2-CB 3.08Å; C84-C101 PolarHBondContact SG-SG 2.92Å; K96-C101 VanDerWaalsContact CE-O 3.3Å; K96-C101 WeakPolarHBondContact CE-O 3.33Å; K96-C101 PolarHBondContact NZ-O 2.77Å; K96-C101 VanDerWaalsContact NZ-O 3.13Å
102	C	87.9	Confident	87.5	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.081	29%	0.291	C	S	.	.	S	Bend	trans	-105.7	147.8	-167.2	-57.9	0	0	0	0	113.9	C84	C84-C102 WeakPolarHBondContact CA-SG 3.33Å; C84-C102 HydrophobicContact CB-CB 3.7Å; C84-C102 WeakPolarHBondContact CB-SG 3.36Å; C84-C102 WeakPolarHBondContact SG-CA 3.3Å; C84-C102 WeakPolarHBondContact SG-CB 3.33Å; C84-C102 CovalentContact SG-SG 2.04Å; C84-C102 PolarHBondContact SG-SG 2.83Å
103	E	89.2	Confident	87.6	Confident	49 Å²	49	56.1 Å²	56.1	23%	0.229	31%	0.312	C	S	.	.			trans	-79.6	144.8	170	-53.4	-179.2	-178.7	0	0	109.3	L87 I95 K96 K229	L87-E103 HydrophobicContact CD1-CB 3.74Å; I95-E103 WeakPolarHBondContact O-CA 3.33Å; K96-E103 HydrophobicContact CB-CG 4.1Å; K96-E103 HydrophobicContact CD-CG 4.02Å; K96-E103 HydrophobicContact CG-CG 4.3Å; E103-K229 VanDerWaalsContact CD-NZ 3.25Å; E103-K229 IonicContact OE1-NZ 2.76Å; E103-K229 PolarHBondContact OE1-NZ 2.8Å; E103-K229 WeakPolarHBondContact OE2-CE 3.43Å; E103-K229 IonicContact OE2-NZ 3.43Å; E103-K229 PolarHBondContact OE2-NZ 2.87Å
104	Q	88.8	Confident	87.7	Confident	132 Å²	132	61.2 Å²	61.2	62%	0.617	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	149.5	177.9	-64.3	-175.9	6.5	0	0	110.5	A94 I95	A94-Q104 WeakPolarHBondContact CA-O 3.46Å; I95-Q104 WeakPolarHBondContact CG1-O 3.29Å; I95-Q104 PolarHBondContact N-O 2.97Å; I95-Q104 PolarHBondContact O-N 2.03Å
105	C	91.2	Very high	87.9	Confident	43 Å²	43	63 Å²	63	29%	0.291	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.9	172.3	-158.1	0	0	0	0	109.8	L87 C91 G107	L87-C105 HydrophobicContact CD2-CB 4.47Å; C91-C105 HydrophobicContact CB-CB 3.9Å; C91-C105 WeakPolarHBondContact CB-SG 3.49Å; C91-C105 WeakPolarHBondContact SG-CA 3.04Å; C91-C105 WeakPolarHBondContact SG-CB 3.15Å; C91-C105 CovalentContact SG-SG 2.03Å; C91-C105 PolarHBondContact SG-SG 3.29Å; C105-G107 PolarHBondContact O-N 2.7Å
106	K	91.6	Very high	88.1	Confident	27 Å²	27	67.7 Å²	67.7	12%	0.117	38%	0.376	C	S	.	.			trans	-63.5	112.1	-177	-179.3	62.6	178.9	175.7	0	110.5	L93 I95 E135 G136 S264	L93-K106 HydrophobicContact CB-CB 4.21Å; L93-K106 HydrophobicContact CD2-CB 3.92Å; L93-K106 HydrophobicContact CD2-CG 3.94Å; L93-K106 HydrophobicContact CG-CB 3.93Å; L93-K106 HydrophobicContact CG-CG 4.47Å; L93-K106 WeakPolarHBondContact O-CB 3.46Å; L93-K106 PolarHBondContact O-N 2.88Å; I95-K106 HydrophobicContact CD1-CD 3.88Å; I95-K106 HydrophobicContact CG1-CD 4.44Å; I95-K106 HydrophobicContact CG2-CB 4.19Å; I95-K106 HydrophobicContact CG2-CD 4.06Å; I95-K106 HydrophobicContact CG2-CG 4.48Å; K106-E135 CarbonylContact O-C 3.54Å; K106-E135 VanDerWaalsContact O-CA 3.22Å; K106-E135 WeakPolarHBondContact O-CA 3.07Å; K106-G136 PolarHBondContact O-N 3.27Å; K106-S264 VanDerWaalsContact CE-O 3.23Å; K106-S264 WeakPolarHBondContact CE-O 3.5Å; K106-S264 PolarHBondContact NZ-O 2.79Å
107	G	92.6	Very high	88.4	Confident	17 Å²	17	66.3 Å²	66.3	18%	0.175	37%	0.373	C	S	.	.			trans	-83.3	-174.7	168.2	0	0	0	0	0	112.5	C105 Y115 G136	C105-G107 PolarHBondContact O-N 2.7Å; G107-Y115 CarbonylContact C-O 3.5Å; G107-Y115 WeakPolarHBondContact CA-O 3.43Å; G107-G136 WeakPolarHBondContact O-CA 3.41Å
108	C	95.1	Very high	89	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	144.3	176.6	-51.4	0	0	0	0	110.3	T114 Y115 C133 V138 T265	C108-T114 CarbonylContact O-C 3.56Å; C108-T114 WeakPolarHBondContact O-CA 3.35Å; C108-Y115 PolarHBondContact N-O 2.84Å; C108-Y115 PolarHBondContact O-N 2.83Å; C108-C133 HydrophobicContact CB-CB 3.73Å; C108-C133 WeakPolarHBondContact CB-SG 3.26Å; C108-C133 PolarHBondContact N-SG 3.44Å; C108-C133 WeakPolarHBondContact SG-CA 3.34Å; C108-C133 WeakPolarHBondContact SG-CB 3.11Å; C108-C133 CovalentContact SG-SG 2.04Å; C108-C133 PolarHBondContact SG-SG 2.89Å; C108-V138 HydrophobicContact CB-CG2 3.54Å; C108-T265 HydrophobicContact CB-CG2 3.68Å
109	T	93.5	Very high	89.9	Confident	50 Å²	50	59.9 Å²	59.9	31%	0.307	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.2	169.2	-51.6	0	0	0	0	108	N113 T265	T109-N113 CarbonylContact C-O 3.49Å; T109-N113 WeakPolarHBondContact CA-O 3.45Å; T109-T265 PolarHBondContact N-OG1 2.98Å; T109-T265 WeakPolarHBondContact O-CB 3.34Å; T109-T265 WeakPolarHBondContact O-CG2 3.41Å; T109-T265 PolarHBondContact O-OG1 3.03Å
110	Y	92.9	Very high	90.9	Very high	16 Å²	16	61 Å²	61	6%	0.063	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	123.1	-179.4	-174.5	-87.5	0	0	0	109.4	G112 N113 W121 R131 V138 E140 V267	Y110-G112 VanDerWaalsContact C-N 3.29Å; Y110-G112 PolarHBondContact O-N 3.01Å; Y110-N113 PolarHBondContact N-O 2.87Å; Y110-N113 PolarHBondContact O-N 3.36Å; Y110-W121 HydrophobicContact CD1-CZ2 4.18Å; Y110-W121 HydrophobicContact CG-CZ2 4.18Å; Y110-R131 PolarHBondContact OH-NE 3.31Å; Y110-V138 HydrophobicContact CD2-CB 4.36Å; Y110-V138 HydrophobicContact CD2-CG1 3.94Å; Y110-V138 HydrophobicContact CD2-CG2 4.32Å; Y110-V138 HydrophobicContact CE2-CG1 4.21Å; Y110-E140 PolarHBondContact OH-OE2 3.24Å; Y110-V267 HydrophobicContact CD2-CG1 4.2Å; Y110-V267 HydrophobicContact CD2-CG2 3.91Å; Y110-V267 HydrophobicContact CE2-CG1 3.71Å; Y110-V267 HydrophobicContact CE2-CG2 4.24Å
111	E	89.1	Confident	91.4	Very high	152 Å²	152	60.8 Å²	60.8	71%	0.71	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	45.5	-179.3	-63.8	-178.7	157.8	0	0	113.3	N113	E111-N113 PolarHBondContact O-N 2.79Å; E111-N113 PolarHBondContact O-ND2 2.63Å
112	G	87.7	Confident	91.5	Very high	74 Å²	74	65 Å²	65	76%	0.763	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-9.8	179.8	0	0	0	0	0	115.4	Y110	Y110-G112 VanDerWaalsContact C-N 3.29Å; Y110-G112 PolarHBondContact O-N 3.01Å
113	N	92.6	Very high	91.2	Very high	90 Å²	90	66.4 Å²	66.4	48%	0.481	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147	178.2	-65.1	-61	0	0	0	111.6	T109 Y110 E111 Y115	T109-N113 CarbonylContact C-O 3.49Å; T109-N113 WeakPolarHBondContact CA-O 3.45Å; Y110-N113 PolarHBondContact N-O 2.87Å; Y110-N113 PolarHBondContact O-N 3.36Å; E111-N113 PolarHBondContact O-N 2.79Å; E111-N113 PolarHBondContact O-ND2 2.63Å; N113-Y115 HydrophobicContact CB-CE2 3.68Å
114	T	92.3	Very high	91	Very high	111 Å²	111	70.3 Å²	70.3	68%	0.681	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.7	177.9	-49.9	0	0	0	0	110.4	C108	C108-T114 CarbonylContact O-C 3.56Å; C108-T114 WeakPolarHBondContact O-CA 3.35Å
115	Y	93.9	Very high	90.8	Very high	39 Å²	39	68.1 Å²	68.1	15%	0.153	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.4	-177	-59.8	-84.7	0	0	0	110.4	G107 C108 N113 F119 W121	G107-Y115 CarbonylContact C-O 3.5Å; G107-Y115 WeakPolarHBondContact CA-O 3.43Å; C108-Y115 PolarHBondContact N-O 2.84Å; C108-Y115 PolarHBondContact O-N 2.83Å; N113-Y115 HydrophobicContact CB-CE2 3.68Å; Y115-F119 AromaticContact CD1-CD1 3.49Å; Y115-F119 HydrophobicContact CD1-CD1 3.49Å; Y115-F119 VanDerWaalsContact CD1-CD1 3.49Å; Y115-F119 AromaticContact CD1-CE1 3.76Å; Y115-F119 HydrophobicContact CD1-CE1 3.76Å; Y115-F119 HydrophobicContact CD1-CG 4.49Å; Y115-F119 HydrophobicContact CE1-CD1 4.17Å; Y115-F119 HydrophobicContact CE1-CE1 4.04Å; Y115-F119 HydrophobicContact CG-CD1 4.41Å; Y115-W121 HydrophobicContact CD1-CD2 4.15Å; Y115-W121 AromaticContact CD1-CE3 3.98Å; Y115-W121 HydrophobicContact CD1-CE3 3.98Å; Y115-W121 HydrophobicContact CD1-CH2 4.45Å; Y115-W121 HydrophobicContact CD1-CZ3 4.12Å; Y115-W121 AromaticContact CD2-CH2 3.92Å; Y115-W121 HydrophobicContact CD2-CH2 3.92Å; Y115-W121 HydrophobicContact CD2-CZ2 4.01Å; Y115-W121 HydrophobicContact CD2-CZ3 4.34Å; Y115-W121 AromaticContact CE1-CD2 3.83Å; Y115-W121 HydrophobicContact CE1-CD2 3.83Å; Y115-W121 AromaticContact CE1-CE2 3.96Å; Y115-W121 HydrophobicContact CE1-CE3 4.16Å; Y115-W121 HydrophobicContact CE1-CG 4.1Å; Y115-W121 HydrophobicContact CE1-CZ2 4.41Å; Y115-W121 HydrophobicContact CE2-CH2 4.21Å; Y115-W121 AromaticContact CE2-CZ2 3.82Å; Y115-W121 HydrophobicContact CE2-CZ2 3.82Å; Y115-W121 HydrophobicContact CG-CE3 4.31Å; Y115-W121 HydrophobicContact CG-CH2 4.03Å; Y115-W121 HydrophobicContact CG-CZ2 4.4Å; Y115-W121 AromaticContact CG-CZ3 3.97Å; Y115-W121 HydrophobicContact CG-CZ3 3.97Å; Y115-W121 AromaticContact CZ-CE2 3.74Å; Y115-W121 AromaticContact CZ-NE1 3.84Å
116	N	91.9	Very high	90.6	Very high	132 Å²	132	70.3 Å²	70.3	71%	0.706	41%	0.407	S	S	*	.			trans	-68.2	152	172.7	-69.9	-27.4	0	0	0	110.7	F119	N116-F119 WeakPolarHBondContact O-CB 3.44Å; N116-F119 PolarHBondContact O-N 2.98Å
117	S	91.1	Very high	90.3	Very high	27 Å²	27	71.8 Å²	71.8	19%	0.189	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	144.8	173.5	-169.9	0	0	0	0	110.8	F119 E135	S117-F119 VanDerWaalsContact C-N 3.27Å; S117-F119 PolarHBondContact O-N 2.95Å; S117-E135 PolarHBondContact OG-N 2.86Å
118	S	89.2	Confident	90.1	Very high	74 Å²	74	73.3 Å²	73.3	52%	0.517	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	0.9	-174.5	-49.7	0	0	0	0	116.3	C133	S118-C133 VanDerWaalsContact CA-O 3.26Å; S118-C133 WeakPolarHBondContact CA-O 3.13Å; S118-C133 PolarHBondContact N-O 2.05Å
119	F	93.4	Very high	89.8	Confident	104 Å²	104	74.8 Å²	74.8	46%	0.456	44%	0.436	S	S	.	.			trans	-74.8	135	177.3	-165.3	-102.3	0	0	0	111.9	Y115 N116 S117 W121 Q132 C133	Y115-F119 AromaticContact CD1-CD1 3.49Å; Y115-F119 HydrophobicContact CD1-CD1 3.49Å; Y115-F119 VanDerWaalsContact CD1-CD1 3.49Å; Y115-F119 AromaticContact CD1-CE1 3.76Å; Y115-F119 HydrophobicContact CD1-CE1 3.76Å; Y115-F119 HydrophobicContact CD1-CG 4.49Å; Y115-F119 HydrophobicContact CE1-CD1 4.17Å; Y115-F119 HydrophobicContact CE1-CE1 4.04Å; Y115-F119 HydrophobicContact CG-CD1 4.41Å; N116-F119 WeakPolarHBondContact O-CB 3.44Å; N116-F119 PolarHBondContact O-N 2.98Å; S117-F119 VanDerWaalsContact C-N 3.27Å; S117-F119 PolarHBondContact O-N 2.95Å; F119-W121 HydrophobicContact CD1-CB 4.35Å; F119-W121 HydrophobicContact CD1-CD2 4.48Å; F119-W121 AromaticContact CD1-CE3 3.8Å; F119-W121 HydrophobicContact CD1-CE3 3.8Å; F119-W121 HydrophobicContact CE1-CB 3.9Å; F119-W121 HydrophobicContact CE1-CE3 4.43Å; F119-Q132 WeakPolarHBondContact O-CA 3.22Å; F119-C133 PolarHBondContact O-N 2.79Å
120	K	93.8	Very high	89.7	Confident	86 Å²	86	74.3 Å²	74.3	37%	0.374	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.1	176.3	-67.7	179.3	177.6	-179.2	0	109.3	L130 R131 Q132 E201	K120-L130 HydrophobicContact CB-CD1 4.49Å; K120-R131 CarbonylContact C-O 3.5Å; K120-R131 WeakPolarHBondContact CA-O 2.99Å; K120-Q132 VanDerWaalsContact CE-NE2 3.29Å; K120-Q132 VanDerWaalsContact CE-OE1 3.27Å; K120-Q132 HydrophobicContact CG-CB 3.99Å; K120-Q132 HydrophobicContact CG-CG 3.65Å; K120-E201 IonicContact NZ-OE1 3.57Å; K120-E201 PolarHBondContact NZ-OE1 3.21Å
121	W	93.9	Very high	89.8	Confident	32 Å²	32	74.1 Å²	74.1	12%	0.121	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	163.2	178.6	72.3	103.2	0	0	0	112.6	Y110 Y115 F119 R131 C133 V138	Y110-W121 HydrophobicContact CD1-CZ2 4.18Å; Y110-W121 HydrophobicContact CG-CZ2 4.18Å; Y115-W121 HydrophobicContact CD1-CD2 4.15Å; Y115-W121 AromaticContact CD1-CE3 3.98Å; Y115-W121 HydrophobicContact CD1-CE3 3.98Å; Y115-W121 HydrophobicContact CD1-CH2 4.45Å; Y115-W121 HydrophobicContact CD1-CZ3 4.12Å; Y115-W121 AromaticContact CD2-CH2 3.92Å; Y115-W121 HydrophobicContact CD2-CH2 3.92Å; Y115-W121 HydrophobicContact CD2-CZ2 4.01Å; Y115-W121 HydrophobicContact CD2-CZ3 4.34Å; Y115-W121 AromaticContact CE1-CD2 3.83Å; Y115-W121 HydrophobicContact CE1-CD2 3.83Å; Y115-W121 AromaticContact CE1-CE2 3.96Å; Y115-W121 HydrophobicContact CE1-CE3 4.16Å; Y115-W121 HydrophobicContact CE1-CG 4.1Å; Y115-W121 HydrophobicContact CE1-CZ2 4.41Å; Y115-W121 HydrophobicContact CE2-CH2 4.21Å; Y115-W121 AromaticContact CE2-CZ2 3.82Å; Y115-W121 HydrophobicContact CE2-CZ2 3.82Å; Y115-W121 HydrophobicContact CG-CE3 4.31Å; Y115-W121 HydrophobicContact CG-CH2 4.03Å; Y115-W121 HydrophobicContact CG-CZ2 4.4Å; Y115-W121 AromaticContact CG-CZ3 3.97Å; Y115-W121 HydrophobicContact CG-CZ3 3.97Å; Y115-W121 AromaticContact CZ-CE2 3.74Å; Y115-W121 AromaticContact CZ-NE1 3.84Å; F119-W121 HydrophobicContact CD1-CB 4.35Å; F119-W121 HydrophobicContact CD1-CD2 4.48Å; F119-W121 AromaticContact CD1-CE3 3.8Å; F119-W121 HydrophobicContact CD1-CE3 3.8Å; F119-W121 HydrophobicContact CE1-CB 3.9Å; F119-W121 HydrophobicContact CE1-CE3 4.43Å; W121-R131 HydrophobicContact CD2-CB 3.72Å; W121-R131 HydrophobicContact CE3-CB 4.17Å; W121-R131 HydrophobicContact CG-CB 4.25Å; W121-R131 HydrophobicContact CH2-CB 4.08Å; W121-R131 HydrophobicContact CZ2-CB 3.59Å; W121-R131 HydrophobicContact CZ2-CG 4.4Å; W121-R131 HydrophobicContact CZ3-CB 4.34Å; W121-R131 PolarHBondContact N-O 2.9Å; W121-R131 PolarHBondContact O-N 3.25Å; W121-C133 HydrophobicContact CH2-CB 4.27Å; W121-C133 HydrophobicContact CZ3-CB 3.82Å; W121-V138 HydrophobicContact CH2-CG1 3.84Å; W121-V138 HydrophobicContact CH2-CG2 4.01Å; W121-V138 HydrophobicContact CZ2-CG1 4.08Å
122	Q	89.6	Confident	90	Very high	99 Å²	99	67.6 Å²	67.6	46%	0.463	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152.2	175.2	-67.1	175.6	-34.7	0	0	108.1	P127 L130	Q122-P127 PolarHBondContact NE2-O 3.04Å; Q122-L130 HydrophobicContact CG-CD1 3.92Å
123	S	82.8	Confident	90.4	Very high	40 Å²	40	64.1 Å²	64.1	28%	0.28	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.5	173.4	174.8	0	0	0	0	109.1	A125 E126	S123-A125 PolarHBondContact O-N 2.74Å; S123-A125 VanDerWaalsContact O-N 3.16Å; S123-A125 PolarHBondContact OG-N 3.28Å; S123-E126 CarbonylContact O-C 3.49Å; S123-E126 PolarHBondContact O-N 2.03Å
124	P	83.3	Confident	90.5	Very high	131 Å²	131	60.7 Å²	60.7	85%	0.851	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.4	170.6	-25.1	34.4	0	0	0	113.4
125	A	85.6	Confident	90.5	Very high	87 Å²	87	55.6 Å²	55.6	72%	0.719	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-23	176.9	0	0	0	0	0	113.2	S123	S123-A125 PolarHBondContact O-N 2.74Å; S123-A125 VanDerWaalsContact O-N 3.16Å; S123-A125 PolarHBondContact OG-N 3.28Å
126	E	86.4	Confident	90.5	Very high	88 Å²	88	53.9 Å²	53.9	41%	0.411	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	69.4	-178.2	-63.7	-177	137.4	0	0	110	S123 C128 V129 R131	S123-E126 CarbonylContact O-C 3.49Å; S123-E126 PolarHBondContact O-N 2.03Å; E126-C128 PolarHBondContact O-N 2.85Å; E126-C128 VanDerWaalsContact O-N 3.08Å; E126-V129 HydrophobicContact CB-CB 4.08Å; E126-V129 HydrophobicContact CB-CG2 3.99Å; E126-V129 PolarHBondContact O-N 2.85Å; E126-V129 VanDerWaalsContact O-N 3.09Å; E126-R131 IonicContact OE2-CZ 2.68Å; E126-R131 IonicContact OE2-NH1 2.74Å; E126-R131 PolarHBondContact OE2-NH1 3.34Å; E126-R131 IonicContact OE2-NH2 3.94Å; E126-R131 PolarHBondContact OE2-NH2 2.74Å
127	P	86	Confident	90.7	Very high	59 Å²	59	47.6 Å²	47.6	38%	0.383	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	-22.7	-173.3	24.1	-34.1	0	0	0	113.1	Q122	Q122-P127 PolarHBondContact NE2-O 3.04Å
128	C	88	Confident	91	Very high	49 Å²	49	46.3 Å²	46.3	33%	0.331	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	5.5	-178.4	-53.2	0	0	0	0	114.5	E126 G142 V143 C159	E126-C128 PolarHBondContact O-N 2.85Å; E126-C128 VanDerWaalsContact O-N 3.08Å; C128-G142 CarbonylContact O-C 3.6Å; C128-G142 VanDerWaalsContact O-CA 3.28Å; C128-G142 WeakPolarHBondContact O-CA 3.47Å; C128-V143 PolarHBondContact O-N 2.04Å; C128-C159 WeakPolarHBondContact CA-SG 3.45Å; C128-C159 HydrophobicContact CB-CB 3.75Å; C128-C159 WeakPolarHBondContact CB-SG 3.47Å; C128-C159 PolarHBondContact N-SG 2.05Å; C128-C159 VanDerWaalsContact N-SG 3.44Å; C128-C159 WeakPolarHBondContact SG-CA 2.98Å; C128-C159 WeakPolarHBondContact SG-CB 3.22Å; C128-C159 CovalentContact SG-SG 2.05Å; C128-C159 PolarHBondContact SG-SG 3.31Å
129	V	89.4	Confident	91.2	Very high	31 Å²	31	43 Å²	43	19%	0.188	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	109.9	173.6	-180	0	0	0	0	109	E126 R131 E140	E126-V129 HydrophobicContact CB-CB 4.08Å; E126-V129 HydrophobicContact CB-CG2 3.99Å; E126-V129 PolarHBondContact O-N 2.85Å; E126-V129 VanDerWaalsContact O-N 3.09Å; V129-R131 HydrophobicContact CG1-CG 4.48Å; V129-E140 HydrophobicContact CG1-CG 3.5Å; V129-E140 VanDerWaalsContact CG1-CG 3.5Å
130	L	90.9	Very high	91.2	Very high	39 Å²	39	39.1 Å²	39.1	20%	0.204	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	129	173.9	-174.4	67.4	0	0	0	110	K120 Q122 S141	K120-L130 HydrophobicContact CB-CD1 4.49Å; Q122-L130 HydrophobicContact CG-CD1 3.92Å; L130-S141 PolarHBondContact N-O 2.79Å; L130-S141 PolarHBondContact O-N 2.82Å
131	R	94.5	Very high	91.1	Very high	12 Å²	12	35.4 Å²	35.4	5%	0.045	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.7	172.5	-64.9	174.7	177.9	89.1	-2.5	109.4	Y110 K120 W121 E126 V129 T139 E140	Y110-R131 PolarHBondContact OH-NE 3.31Å; K120-R131 CarbonylContact C-O 3.5Å; K120-R131 WeakPolarHBondContact CA-O 2.99Å; W121-R131 HydrophobicContact CD2-CB 3.72Å; W121-R131 HydrophobicContact CE3-CB 4.17Å; W121-R131 HydrophobicContact CG-CB 4.25Å; W121-R131 HydrophobicContact CH2-CB 4.08Å; W121-R131 HydrophobicContact CZ2-CB 3.59Å; W121-R131 HydrophobicContact CZ2-CG 4.4Å; W121-R131 HydrophobicContact CZ3-CB 4.34Å; W121-R131 PolarHBondContact N-O 2.9Å; W121-R131 PolarHBondContact O-N 3.25Å; E126-R131 IonicContact OE2-CZ 2.68Å; E126-R131 IonicContact OE2-NH1 2.74Å; E126-R131 PolarHBondContact OE2-NH1 3.34Å; E126-R131 IonicContact OE2-NH2 3.94Å; E126-R131 PolarHBondContact OE2-NH2 2.74Å; V129-R131 HydrophobicContact CG1-CG 4.48Å; R131-T139 WeakPolarHBondContact CA-O 3.02Å; R131-E140 HydrophobicContact CG-CB 4.34Å; R131-E140 HydrophobicContact CG-CG 4.14Å; R131-E140 IonicContact CZ-OE2 2.83Å; R131-E140 IonicContact NE-OE2 2.69Å; R131-E140 PolarHBondContact NE-OE2 3.27Å; R131-E140 IonicContact NH2-OE2 3.16Å; R131-E140 PolarHBondContact NH2-OE2 2.58Å
132	Q	94.9	Very high	90.6	Very high	16 Å²	16	35.8 Å²	35.8	8%	0.075	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130.5	177.5	-177.8	172.9	7	0	0	110.9	F119 K120 V138 T139 P204	F119-Q132 WeakPolarHBondContact O-CA 3.22Å; K120-Q132 VanDerWaalsContact CE-NE2 3.29Å; K120-Q132 VanDerWaalsContact CE-OE1 3.27Å; K120-Q132 HydrophobicContact CG-CB 3.99Å; K120-Q132 HydrophobicContact CG-CG 3.65Å; Q132-V138 CarbonylContact O-C 3.54Å; Q132-V138 WeakPolarHBondContact O-CA 2.98Å; Q132-T139 PolarHBondContact N-O 3.07Å; Q132-T139 PolarHBondContact O-N 2.81Å; Q132-P204 HydrophobicContact CG-CB 4.29Å
133	C	95.4	Very high	90.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	130.7	171.4	175.2	0	0	0	0	110	C108 S118 F119 W121 V137	C108-C133 HydrophobicContact CB-CB 3.73Å; C108-C133 WeakPolarHBondContact CB-SG 3.26Å; C108-C133 PolarHBondContact N-SG 3.44Å; C108-C133 WeakPolarHBondContact SG-CA 3.34Å; C108-C133 WeakPolarHBondContact SG-CB 3.11Å; C108-C133 CovalentContact SG-SG 2.04Å; C108-C133 PolarHBondContact SG-SG 2.89Å; S118-C133 VanDerWaalsContact CA-O 3.26Å; S118-C133 WeakPolarHBondContact CA-O 3.13Å; S118-C133 PolarHBondContact N-O 2.05Å; F119-C133 PolarHBondContact O-N 2.79Å; W121-C133 HydrophobicContact CH2-CB 4.27Å; W121-C133 HydrophobicContact CZ3-CB 3.82Å; C133-V137 CarbonylContact C-O 3.55Å; C133-V137 WeakPolarHBondContact CA-O 3.35Å
134	Q	94.4	Very high	90.4	Very high	19 Å²	19	35.5 Å²	35.5	9%	0.089	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	105.4	173	-169.9	64	39.4	0	0	109.3	G136 V137 P204 L206	Q134-G136 VanDerWaalsContact C-N 3.32Å; Q134-G136 PolarHBondContact O-N 2.01Å; Q134-G136 VanDerWaalsContact O-N 3.16Å; Q134-V137 PolarHBondContact N-O 3.08Å; Q134-V137 WeakPolarHBondContact O-CB 3.11Å; Q134-V137 PolarHBondContact O-N 3.42Å; Q134-P204 HydrophobicContact CB-CB 3.91Å; Q134-P204 HydrophobicContact CG-CB 4.25Å; Q134-P204 HydrophobicContact CG-CG 4.38Å; Q134-L206 HydrophobicContact CG-CD2 3.91Å
135	E	92.6	Very high	90.4	Very high	3 Å²	3	30.5 Å²	30.5	1%	0.014	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	44.8	173.2	-70.8	123	-177.1	0	0	115.2	A92 L93 K106 S117	A92-E135 HydrophobicContact CB-CG 4.35Å; A92-E135 WeakPolarHBondContact CB-OE1 3.02Å; A92-E135 PolarHBondContact N-OE1 3.43Å; L93-E135 HydrophobicContact CB-CB 3.88Å; L93-E135 HydrophobicContact CB-CG 4.04Å; L93-E135 WeakPolarHBondContact CD2-O 3.23Å; K106-E135 CarbonylContact O-C 3.54Å; K106-E135 VanDerWaalsContact O-CA 3.22Å; K106-E135 WeakPolarHBondContact O-CA 3.07Å; S117-E135 PolarHBondContact OG-N 2.86Å
136	G	92.9	Very high	90.2	Very high	4 Å²	4	28.5 Å²	28.5	4%	0.041	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	6.6	-179.4	0	0	0	0	0	115.4	K106 G107 Q134 T265 V266	K106-G136 PolarHBondContact O-N 3.27Å; G107-G136 WeakPolarHBondContact O-CA 3.41Å; Q134-G136 VanDerWaalsContact C-N 3.32Å; Q134-G136 PolarHBondContact O-N 2.01Å; Q134-G136 VanDerWaalsContact O-N 3.16Å; G136-T265 WeakPolarHBondContact O-CA 3.39Å; G136-V266 PolarHBondContact O-N 2.78Å
137	V	96.2	Very high	89.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	124.7	174.2	-173.6	0	0	0	0	109.6	C133 Q134 I205 F240 V266	C133-V137 CarbonylContact C-O 3.55Å; C133-V137 WeakPolarHBondContact CA-O 3.35Å; Q134-V137 PolarHBondContact N-O 3.08Å; Q134-V137 WeakPolarHBondContact O-CB 3.11Å; Q134-V137 PolarHBondContact O-N 3.42Å; V137-I205 HydrophobicContact CG1-CB 4.08Å; V137-I205 HydrophobicContact CG1-CG2 4.12Å; V137-I205 WeakPolarHBondContact CG1-O 3.21Å; V137-F240 HydrophobicContact CG1-CE2 4.26Å; V137-F240 HydrophobicContact CG2-CD2 3.76Å; V137-F240 HydrophobicContact CG2-CE2 3.82Å; V137-V266 CarbonylContact C-O 3.52Å; V137-V266 WeakPolarHBondContact CA-O 3.32Å; V137-V266 HydrophobicContact CG1-CB 4.31Å; V137-V266 HydrophobicContact CG1-CG1 4.46Å; V137-V266 HydrophobicContact CG2-CB 4.2Å
138	V	96.9	Very high	89.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.3	169.5	178.3	0	0	0	0	108.4	C108 Y110 W121 Q132 T265 V266 V267 C268	C108-V138 HydrophobicContact CB-CG2 3.54Å; Y110-V138 HydrophobicContact CD2-CB 4.36Å; Y110-V138 HydrophobicContact CD2-CG1 3.94Å; Y110-V138 HydrophobicContact CD2-CG2 4.32Å; Y110-V138 HydrophobicContact CE2-CG1 4.21Å; W121-V138 HydrophobicContact CH2-CG1 3.84Å; W121-V138 HydrophobicContact CH2-CG2 4.01Å; W121-V138 HydrophobicContact CZ2-CG1 4.08Å; Q132-V138 CarbonylContact O-C 3.54Å; Q132-V138 WeakPolarHBondContact O-CA 2.98Å; V138-T265 HydrophobicContact CG2-CG2 3.67Å; V138-V266 PolarHBondContact N-O 2.04Å; V138-V267 HydrophobicContact CB-CG2 4.43Å; V138-C268 PolarHBondContact O-N 3.02Å
139	T	95.2	Very high	88.6	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.018	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	116.9	171.1	-53.7	0	0	0	0	108.8	R131 Q132 I205	R131-T139 WeakPolarHBondContact CA-O 3.02Å; Q132-T139 PolarHBondContact N-O 3.07Å; Q132-T139 PolarHBondContact O-N 2.81Å; T139-I205 HydrophobicContact CG2-CD1 4.14Å; T139-I205 HydrophobicContact CG2-CG1 4.11Å; T139-I205 PolarHBondContact OG1-N 2.04Å
140	E	93.6	Very high	87.7	Confident	24 Å²	24	34.6 Å²	34.6	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.6	174.4	-175.9	179.1	103.2	0	0	108.9	Y110 V129 R131 C268 K269 R270	Y110-E140 PolarHBondContact OH-OE2 3.24Å; V129-E140 HydrophobicContact CG1-CG 3.5Å; V129-E140 VanDerWaalsContact CG1-CG 3.5Å; R131-E140 HydrophobicContact CG-CB 4.34Å; R131-E140 HydrophobicContact CG-CG 4.14Å; R131-E140 IonicContact CZ-OE2 2.83Å; R131-E140 IonicContact NE-OE2 2.69Å; R131-E140 PolarHBondContact NE-OE2 3.27Å; R131-E140 IonicContact NH2-OE2 3.16Å; R131-E140 PolarHBondContact NH2-OE2 2.58Å; E140-C268 PolarHBondContact N-O 3.12Å; E140-K269 HydrophobicContact CB-CG 4.27Å; E140-K269 WeakPolarHBondContact OE1-CD 3.48Å; E140-K269 VanDerWaalsContact OE1-CE 3.28Å; E140-K269 WeakPolarHBondContact OE1-CE 3Å; E140-K269 IonicContact OE1-NZ 2.98Å; E140-K269 PolarHBondContact OE1-NZ 3.49Å; E140-K269 IonicContact OE2-NZ 2.82Å; E140-K269 PolarHBondContact OE2-NZ 2.8Å; E140-R270 PolarHBondContact O-N 3.02Å
141	S	89.8	Confident	86.8	Confident	7 Å²	7	39.3 Å²	39.3	5%	0.049	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	143.8	-177	57.3	0	0	0	0	112.1	L130 V202	L130-S141 PolarHBondContact N-O 2.79Å; L130-S141 PolarHBondContact O-N 2.82Å; S141-V202 WeakPolarHBondContact OG-CG1 2.93Å
142	G	85.3	Confident	86.2	Confident	41 Å²	41	41.3 Å²	41.3	42%	0.423	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	149.1	168.8	0	0	0	0	0	112.4	C128 R144	C128-G142 CarbonylContact O-C 3.6Å; C128-G142 VanDerWaalsContact O-CA 3.28Å; C128-G142 WeakPolarHBondContact O-CA 3.47Å; G142-R144 PolarHBondContact O-N 2.77Å
143	V	83.9	Confident	85.5	Confident	37 Å²	37	44.2 Å²	44.2	22%	0.224	24%	0.24	C	C	.	.			trans	-58.8	130.7	170.1	177.8	0	0	0	0	109.3	C128 C159 C160 V199	C128-V143 PolarHBondContact O-N 2.04Å; V143-C159 HydrophobicContact CB-CB 4.03Å; V143-C159 HydrophobicContact CG1-CB 4.18Å; V143-C159 HydrophobicContact CG2-CB 4.15Å; V143-C160 VanDerWaalsContact CG1-SG 3.5Å; V143-V199 HydrophobicContact CG1-CG1 3.68Å; V143-V199 HydrophobicContact CG1-CG2 4.5Å
144	R	82.4	Confident	85	Confident	95 Å²	95	51.9 Å²	51.9	36%	0.358	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.7	179.9	-68.4	-169.2	178.9	-171.5	-3.9	110.6	G142 V199 R200 V202 C272	G142-R144 PolarHBondContact O-N 2.77Å; R144-V199 CarbonylContact O-C 3.56Å; R144-V199 WeakPolarHBondContact O-CA 3.04Å; R144-R200 HydrophobicContact CB-CB 4.15Å; R144-R200 PolarHBondContact O-N 3.2Å; R144-V202 HydrophobicContact CB-CG2 4.33Å; R144-V202 HydrophobicContact CG-CG2 3.74Å; R144-C272 PolarHBondContact NH2-SG 3.15Å
145	C	84.7	Confident	84.5	Confident	26 Å²	26	54.1 Å²	54.1	18%	0.176	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	144.4	-177.5	-48.9	0	0	0	0	111.4	C159 C160	C145-C159 PolarHBondContact SG-O 3.09Å; C145-C160 WeakPolarHBondContact CA-SG 3.14Å; C145-C160 HydrophobicContact CB-CB 3.63Å; C145-C160 WeakPolarHBondContact CB-SG 3.07Å; C145-C160 WeakPolarHBondContact SG-CA 2.95Å; C145-C160 WeakPolarHBondContact SG-CB 2.82Å; C145-C160 CovalentContact SG-SG 2.03Å; C145-C160 PolarHBondContact SG-SG 2.93Å
146	V	81.1	Confident	84	Confident	45 Å²	45	63.1 Å²	63.1	27%	0.273	33%	0.333	S	S	.	.			trans	-113.1	105.3	173.5	179.8	0	0	0	0	108.4	T187 C198 R200	V146-T187 HydrophobicContact CB-CG2 4.35Å; V146-T187 HydrophobicContact CG2-CG2 3.94Å; V146-C198 HydrophobicContact CB-CB 3.74Å; V146-C198 HydrophobicContact CG1-CB 4.36Å; V146-C198 PolarHBondContact N-O 3.38Å; V146-C198 WeakPolarHBondContact O-CB 3.2Å; V146-R200 HydrophobicContact CG2-CB 4.05Å
147	V	79.9	Confident	83.2	Confident	69 Å²	69	66.3 Å²	66.3	42%	0.418	37%	0.366	S	S	.	.			trans	-96.2	121.7	179.5	-175.6	0	0	0	0	109.1	P152 P161	V147-P152 HydrophobicContact CG1-CB 3.81Å; V147-P152 HydrophobicContact CG1-CG 3.98Å; V147-P161 HydrophobicContact CG2-CG 3.66Å
148	H	73.2	Confident	82.6	Confident	62 Å²	62	70.6 Å²	70.6	29%	0.287	39%	0.387	S	S	.	.			trans	-120.1	18.3	-174.3	58.2	-79.5	0	0	0	112.5	F168 T196	H148-F168 HydrophobicContact CB-CD2 4.12Å; H148-F168 HydrophobicContact CB-CE2 3.78Å; H148-F168 AromaticContact CD2-CD2 3.55Å; H148-F168 AromaticContact CE1-CD2 3.76Å; H148-F168 AromaticContact CG-CD2 3.5Å; H148-F168 VanDerWaalsContact CG-CD2 3.5Å; H148-F168 AromaticContact CG-CE2 3.55Å; H148-F168 AromaticContact ND1-CD2 3.63Å; H148-F168 AromaticContact ND1-CE2 3.61Å; H148-F168 AromaticContact NE2-CD2 3.72Å; H148-T196 PolarHBondContact CE1-OG1 2.83Å; H148-T196 WeakPolarHBondContact NE2-CB 3.38Å; H148-T196 PolarHBondContact NE2-OG1 2.88Å
149	C	73.3	Confident	82.1	Confident	36 Å²	36	72.6 Å²	72.6	24%	0.243	40%	0.4	C	S	.	.	S	Bend	trans	-133.5	159	178.6	60	0	0	0	0	110.6	C163	C149-C163 HydrophobicContact CB-CB 3.58Å; C149-C163 WeakPolarHBondContact CB-SG 3.28Å; C149-C163 PolarHBondContact N-SG 2.76Å; C149-C163 VanDerWaalsContact N-SG 3.35Å; C149-C163 WeakPolarHBondContact SG-CA 3.32Å; C149-C163 WeakPolarHBondContact SG-CB 3.37Å; C149-C163 CovalentContact SG-SG 2.04Å; C149-C163 PolarHBondContact SG-SG 2.77Å
150	K	71.7	Confident	81.7	Confident	189 Å²	189	72.6 Å²	72.6	82%	0.822	40%	0.401	S	S	*	.	S	Bend	trans	-73.7	-37.3	179.6	-71.2	-175.1	175.8	-177.3	0	113.3	P152	K150-P152 VanDerWaalsContact C-CD 3.42Å; K150-P152 VanDerWaalsContact O-CD 3.24Å; K150-P152 WeakPolarHBondContact O-CD 3.24Å
151	N	71.5	Confident	81.3	Confident	137 Å²	137	72.6 Å²	72.6	73%	0.733	40%	0.403	S	S	*	.	S	Bend	trans	-120.4	75.7	-175.4	-63	-26	0	0	0	109.5
152	P	81.6	Confident	81.3	Confident	54 Å²	54	72.6 Å²	72.6	35%	0.351	40%	0.403	S	S	.	.			trans	-64.3	144	174.7	27.5	-33.9	0	0	0	110.9	V147 K150 P161	V147-P152 HydrophobicContact CG1-CB 3.81Å; V147-P152 HydrophobicContact CG1-CG 3.98Å; K150-P152 VanDerWaalsContact C-CD 3.42Å; K150-P152 VanDerWaalsContact O-CD 3.24Å; K150-P152 WeakPolarHBondContact O-CD 3.24Å; P152-P161 HydrophobicContact CB-CB 3.8Å; P152-P161 HydrophobicContact CB-CG 4.04Å
153	L	80.9	Confident	81.2	Confident	77 Å²	77	70.8 Å²	70.8	40%	0.403	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-99.4	114.2	173.2	-170.3	69	0	0	0	109.3	H155 P161 T162	L153-H155 VanDerWaalsContact CD2-CE1 3.5Å; L153-H155 WeakPolarHBondContact CD2-CE1 3.25Å; L153-P161 WeakPolarHBondContact O-CA 2.92Å; L153-P161 WeakPolarHBondContact O-CB 3.07Å; L153-T162 PolarHBondContact N-O 2.74Å; L153-T162 PolarHBondContact O-N 2.98Å; L153-T162 PolarHBondContact O-OG1 2.97Å
154	E	84.2	Confident	81	Confident	162 Å²	162	73.4 Å²	73.4	76%	0.757	40%	0.401	S	S	*	.			trans	-77.8	138.1	171.7	-68.5	-177.3	-178.5	0	0	110.3	P161	E154-P161 HydrophobicContact CG-CB 4.07Å
155	H	83.2	Confident	81	Confident	66 Å²	66	70.4 Å²	70.4	31%	0.306	40%	0.4	S	S	.	.			trans	-119.5	132.6	177.7	-65	-77.3	0	0	0	109.3	L153 G157 M158 T162	L153-H155 VanDerWaalsContact CD2-CE1 3.5Å; L153-H155 WeakPolarHBondContact CD2-CE1 3.25Å; H155-G157 PolarHBondContact O-N 3.16Å; H155-M158 HydrophobicContact CB-CB 4.08Å; H155-M158 HydrophobicContact CB-CG 3.8Å; H155-M158 HydrophobicContact CB-SD 3.57Å; H155-M158 VanDerWaalsContact CB-SD 3.57Å; H155-M158 PolarHBondContact O-N 3.24Å; H155-M158 VanDerWaalsContact O-N 3.09Å; H155-T162 PolarHBondContact CD2-OG1 2.68Å; H155-T162 PolarHBondContact NE2-OG1 2.8Å
156	L	81.9	Confident	80.9	Confident	191 Å²	191	69.9 Å²	69.9	100%	1	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	126	179.8	-149	98.8	0	0	0	110	M158	L156-M158 VanDerWaalsContact C-N 3.33Å
157	G	78	Confident	80.6	Confident	71 Å²	71	71.4 Å²	71.4	73%	0.732	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-3.6	-179.4	0	0	0	0	0	115.5	H155	H155-G157 PolarHBondContact O-N 3.16Å
158	M	83.3	Confident	80.2	Confident	91 Å²	91	68.6 Å²	68.6	45%	0.448	39%	0.387	S	S	.	.			trans	-96.3	145.1	170.3	-60.9	-171.3	83	0	0	110.9	H155 L156 Q197	H155-M158 HydrophobicContact CB-CB 4.08Å; H155-M158 HydrophobicContact CB-CG 3.8Å; H155-M158 HydrophobicContact CB-SD 3.57Å; H155-M158 VanDerWaalsContact CB-SD 3.57Å; H155-M158 PolarHBondContact O-N 3.24Å; H155-M158 VanDerWaalsContact O-N 3.09Å; L156-M158 VanDerWaalsContact C-N 3.33Å; M158-Q197 VanDerWaalsContact CE-NE2 3.26Å
159	C	85.2	Confident	80.3	Confident	41 Å²	41	72.8 Å²	72.8	28%	0.277	41%	0.407	S	S	.	.	S	Bend	trans	-81.9	-26.8	-179.1	-59.8	0	0	0	0	114.1	C128 V143 C145	C128-C159 WeakPolarHBondContact CA-SG 3.45Å; C128-C159 HydrophobicContact CB-CB 3.75Å; C128-C159 WeakPolarHBondContact CB-SG 3.47Å; C128-C159 PolarHBondContact N-SG 2.05Å; C128-C159 VanDerWaalsContact N-SG 3.44Å; C128-C159 WeakPolarHBondContact SG-CA 2.98Å; C128-C159 WeakPolarHBondContact SG-CB 3.22Å; C128-C159 CovalentContact SG-SG 2.05Å; C128-C159 PolarHBondContact SG-SG 3.31Å; V143-C159 HydrophobicContact CB-CB 4.03Å; V143-C159 HydrophobicContact CG1-CB 4.18Å; V143-C159 HydrophobicContact CG2-CB 4.15Å; C145-C159 PolarHBondContact SG-O 3.09Å
160	C	86.9	Confident	80.2	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.02	43%	0.43	C	S	.	.	S	Bend	trans	-121.7	135.5	-178.3	-66.2	0	0	0	0	111	V143 C145 Q197 V199	V143-C160 VanDerWaalsContact CG1-SG 3.5Å; C145-C160 WeakPolarHBondContact CA-SG 3.14Å; C145-C160 HydrophobicContact CB-CB 3.63Å; C145-C160 WeakPolarHBondContact CB-SG 3.07Å; C145-C160 WeakPolarHBondContact SG-CA 2.95Å; C145-C160 WeakPolarHBondContact SG-CB 2.82Å; C145-C160 CovalentContact SG-SG 2.03Å; C145-C160 PolarHBondContact SG-SG 2.93Å; C160-Q197 HydrophobicContact CB-CG 4.05Å; C160-Q197 PolarHBondContact O-NE2 2.75Å; C160-V199 HydrophobicContact CB-CG2 4.49Å
161	P	86.7	Confident	80.3	Confident	25 Å²	25	69.1 Å²	69.1	16%	0.162	41%	0.414	C	S	.	.			trans	-69.3	164.8	173.4	32.6	-36.4	0	0	0	110.8	V147 P152 L153 E154	V147-P161 HydrophobicContact CG2-CG 3.66Å; P152-P161 HydrophobicContact CB-CB 3.8Å; P152-P161 HydrophobicContact CB-CG 4.04Å; L153-P161 WeakPolarHBondContact O-CA 2.92Å; L153-P161 WeakPolarHBondContact O-CB 3.07Å; E154-P161 HydrophobicContact CG-CB 4.07Å
162	T	88.3	Confident	80.8	Confident	7 Å²	7	70.5 Å²	70.5	4%	0.043	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-112.3	146.3	-179.2	58.4	0	0	0	0	110.6	L153 H155 R195 T196 Q197	L153-T162 PolarHBondContact N-O 2.74Å; L153-T162 PolarHBondContact O-N 2.98Å; L153-T162 PolarHBondContact O-OG1 2.97Å; H155-T162 PolarHBondContact CD2-OG1 2.68Å; H155-T162 PolarHBondContact NE2-OG1 2.8Å; T162-R195 WeakPolarHBondContact OG1-CD 3.05Å; T162-T196 CarbonylContact C-O 3.54Å; T162-T196 WeakPolarHBondContact CA-O 3.02Å; T162-Q197 HydrophobicContact CG2-CB 4.24Å
163	C	83.3	Confident	80.9	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.02	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	138.7	175.6	-75.8	0	0	0	0	110.6	C149 R195 T196	C149-C163 HydrophobicContact CB-CB 3.58Å; C149-C163 WeakPolarHBondContact CB-SG 3.28Å; C149-C163 PolarHBondContact N-SG 2.76Å; C149-C163 VanDerWaalsContact N-SG 3.35Å; C149-C163 WeakPolarHBondContact SG-CA 3.32Å; C149-C163 WeakPolarHBondContact SG-CB 3.37Å; C149-C163 CovalentContact SG-SG 2.04Å; C149-C163 PolarHBondContact SG-SG 2.77Å; C163-R195 CarbonylContact O-C 3.6Å; C163-R195 WeakPolarHBondContact O-CA 3.38Å; C163-R195 VanDerWaalsContact O-CB 3.28Å; C163-R195 WeakPolarHBondContact O-CB 3.46Å; C163-T196 WeakPolarHBondContact CB-OG1 3.32Å; C163-T196 PolarHBondContact N-O 3.25Å; C163-T196 PolarHBondContact O-N 3.28Å; C163-T196 PolarHBondContact O-OG1 2.04Å
164	P	79.7	Confident	81.2	Confident	91 Å²	91	73.2 Å²	73.2	59%	0.591	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.2	178.7	27.2	-33.1	0	0	0	111.3
165	G	81.6	Confident	81.5	Confident	32 Å²	32	71.2 Å²	71.2	33%	0.33	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	86.7	159.8	-177.1	0	0	0	0	0	112.8	G194 T196	G165-G194 CarbonylContact C-O 3.59Å; G165-G194 WeakPolarHBondContact CA-O 3.49Å; G165-G194 PolarHBondContact N-O 3.43Å; G165-T196 WeakPolarHBondContact O-CG2 3.42Å; G165-T196 PolarHBondContact O-N 2.88Å; G165-T196 PolarHBondContact O-OG1 2.88Å
166	C	84.4	Confident	81.8	Confident	16 Å²	16	70.6 Å²	70.6	11%	0.108	42%	0.422	C	S	.	.	S	Bend	trans	-104	56	174	-66.4	0	0	0	0	111.5	Q172 Y173 C191 T196	C166-Q172 CarbonylContact O-C 3.45Å; C166-Q172 WeakPolarHBondContact O-CA 3.22Å; C166-Y173 WeakPolarHBondContact CB-O 3.27Å; C166-Y173 PolarHBondContact O-N 3.42Å; C166-C191 HydrophobicContact CB-CB 3.72Å; C166-C191 WeakPolarHBondContact CB-SG 3.29Å; C166-C191 WeakPolarHBondContact SG-CB 3.22Å; C166-C191 CovalentContact SG-SG 2Å; C166-C191 PolarHBondContact SG-SG 2.99Å; C166-T196 HydrophobicContact CB-CG2 4.35Å
167	V	74.5	Confident	82.2	Confident	76 Å²	76	64.9 Å²	64.9	46%	0.461	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123	-179.9	-177.2	0	0	0	0	109.2	V171	V167-V171 VanDerWaalsContact CA-O 3.28Å; V167-V171 WeakPolarHBondContact CA-O 3.42Å
168	F	71.8	Confident	82.9	Confident	10 Å²	10	67.4 Å²	67.4	4%	0.044	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.4	175.5	-169.3	-80.4	0	0	0	108.8	H148 G170 V171 Y173 F179 P181 C198	H148-F168 HydrophobicContact CB-CD2 4.12Å; H148-F168 HydrophobicContact CB-CE2 3.78Å; H148-F168 AromaticContact CD2-CD2 3.55Å; H148-F168 AromaticContact CE1-CD2 3.76Å; H148-F168 AromaticContact CG-CD2 3.5Å; H148-F168 VanDerWaalsContact CG-CD2 3.5Å; H148-F168 AromaticContact CG-CE2 3.55Å; H148-F168 AromaticContact ND1-CD2 3.63Å; H148-F168 AromaticContact ND1-CE2 3.61Å; H148-F168 AromaticContact NE2-CD2 3.72Å; F168-G170 PolarHBondContact O-N 2.87Å; F168-V171 PolarHBondContact N-O 2.93Å; F168-V171 PolarHBondContact O-N 3.13Å; F168-Y173 HydrophobicContact CB-CD2 4.39Å; F168-Y173 HydrophobicContact CB-CE2 3.8Å; F168-F179 HydrophobicContact CB-CE2 3.6Å; F168-F179 HydrophobicContact CB-CZ 3.6Å; F168-F179 HydrophobicContact CD1-CE2 4.09Å; F168-F179 HydrophobicContact CD2-CE2 4.28Å; F168-F179 HydrophobicContact CD2-CZ 4.39Å; F168-F179 AromaticContact CG-CE2 3.74Å; F168-F179 HydrophobicContact CG-CE2 3.74Å; F168-F179 HydrophobicContact CG-CZ 4.06Å; F168-P181 HydrophobicContact CD1-CB 4.21Å; F168-P181 HydrophobicContact CD1-CG 4.01Å; F168-P181 HydrophobicContact CE1-CB 3.56Å; F168-P181 HydrophobicContact CE1-CG 3.43Å; F168-P181 VanDerWaalsContact CE1-CG 3.43Å; F168-P181 HydrophobicContact CZ-CB 4.23Å; F168-P181 HydrophobicContact CZ-CG 3.73Å; F168-C198 VanDerWaalsContact CE2-SG 3.53Å
169	E	73.7	Confident	83.2	Confident	150 Å²	150	63.8 Å²	63.8	70%	0.701	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	31.5	-177.3	-69	178.9	157.6	0	0	114.4	V171	E169-V171 VanDerWaalsContact C-N 3.34Å
170	G	72.2	Confident	83.3	Confident	71 Å²	71	67.7 Å²	67.7	73%	0.732	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-2.8	179.3	0	0	0	0	0	115.1	F168	F168-G170 PolarHBondContact O-N 2.87Å
171	V	73.7	Confident	83	Confident	77 Å²	77	67.9 Å²	67.9	47%	0.467	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132	174.8	-176.8	0	0	0	0	109.7	V167 F168 E169 Y173	V167-V171 VanDerWaalsContact CA-O 3.28Å; V167-V171 WeakPolarHBondContact CA-O 3.42Å; F168-V171 PolarHBondContact N-O 2.93Å; F168-V171 PolarHBondContact O-N 3.13Å; E169-V171 VanDerWaalsContact C-N 3.34Å; V171-Y173 HydrophobicContact CB-CE2 3.76Å; V171-Y173 HydrophobicContact CG1-CD2 4.45Å; V171-Y173 HydrophobicContact CG1-CE1 4.16Å; V171-Y173 HydrophobicContact CG1-CE2 3.84Å; V171-Y173 WeakPolarHBondContact O-CD2 3.02Å; V171-Y173 WeakPolarHBondContact O-CE2 3.27Å
172	Q	81.5	Confident	82.4	Confident	167 Å²	167	75.7 Å²	75.7	78%	0.78	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.7	175.9	-175.2	171.3	9.5	0	0	110.6	C166	C166-Q172 CarbonylContact O-C 3.45Å; C166-Q172 WeakPolarHBondContact O-CA 3.22Å
173	Y	84.9	Confident	81.7	Confident	36 Å²	36	79.8 Å²	79.8	14%	0.141	46%	0.459	C	S	.	.			trans	-108.5	153.1	-179.1	-62.6	-87.3	0	0	0	111.1	C166 F168 V171 E177 F179	C166-Y173 WeakPolarHBondContact CB-O 3.27Å; C166-Y173 PolarHBondContact O-N 3.42Å; F168-Y173 HydrophobicContact CB-CD2 4.39Å; F168-Y173 HydrophobicContact CB-CE2 3.8Å; V171-Y173 HydrophobicContact CB-CE2 3.76Å; V171-Y173 HydrophobicContact CG1-CD2 4.45Å; V171-Y173 HydrophobicContact CG1-CE1 4.16Å; V171-Y173 HydrophobicContact CG1-CE2 3.84Å; V171-Y173 WeakPolarHBondContact O-CD2 3.02Å; V171-Y173 WeakPolarHBondContact O-CE2 3.27Å; Y173-E177 WeakPolarHBondContact CA-OE2 3Å; Y173-E177 HydrophobicContact CD1-CG 4.38Å; Y173-F179 HydrophobicContact CD1-CB 3.85Å; Y173-F179 AromaticContact CD1-CD1 3.38Å; Y173-F179 HydrophobicContact CD1-CD1 3.38Å; Y173-F179 HydrophobicContact CD1-CD2 4.22Å; Y173-F179 AromaticContact CD1-CE1 3.89Å; Y173-F179 HydrophobicContact CD1-CE1 3.89Å; Y173-F179 AromaticContact CD1-CG 3.57Å; Y173-F179 HydrophobicContact CD1-CG 3.57Å; Y173-F179 HydrophobicContact CD1-CZ 4.49Å; Y173-F179 HydrophobicContact CD2-CD1 4.01Å; Y173-F179 HydrophobicContact CD2-CD2 4.48Å; Y173-F179 AromaticContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE2 4.13Å; Y173-F179 HydrophobicContact CD2-CG 4.42Å; Y173-F179 AromaticContact CD2-CZ 3.68Å; Y173-F179 HydrophobicContact CD2-CZ 3.68Å; Y173-F179 HydrophobicContact CE1-CB 3.43Å; Y173-F179 VanDerWaalsContact CE1-CB 3.43Å; Y173-F179 AromaticContact CE1-CD1 3.6Å; Y173-F179 HydrophobicContact CE1-CD1 3.6Å; Y173-F179 AromaticContact CE1-CD2 3.56Å; Y173-F179 HydrophobicContact CE1-CD2 3.56Å; Y173-F179 HydrophobicContact CE1-CE1 4.18Å; Y173-F179 HydrophobicContact CE1-CE2 4.14Å; Y173-F179 AromaticContact CE1-CG 3.24Å; Y173-F179 HydrophobicContact CE1-CG 3.24Å; Y173-F179 HydrophobicContact CE1-CZ 4.42Å; Y173-F179 HydrophobicContact CE2-CD1 4.22Å; Y173-F179 AromaticContact CE2-CD2 3.87Å; Y173-F179 HydrophobicContact CE2-CD2 3.87Å; Y173-F179 AromaticContact CE2-CE1 3.96Å; Y173-F179 HydrophobicContact CE2-CE1 3.96Å; Y173-F179 AromaticContact CE2-CE2 3.59Å; Y173-F179 HydrophobicContact CE2-CE2 3.59Å; Y173-F179 HydrophobicContact CE2-CG 4.18Å; Y173-F179 AromaticContact CE2-CZ 3.63Å; Y173-F179 HydrophobicContact CE2-CZ 3.63Å; Y173-F179 AromaticContact CG-CD1 3.59Å; Y173-F179 HydrophobicContact CG-CD1 3.59Å; Y173-F179 AromaticContact CG-CE1 3.59Å; Y173-F179 HydrophobicContact CG-CE1 3.59Å; Y173-F179 HydrophobicContact CG-CG 4.14Å; Y173-F179 HydrophobicContact CG-CZ 4.13Å; Y173-F179 AromaticContact CZ-CD2 3.33Å; Y173-F179 AromaticContact CZ-CE2 3.56Å; Y173-F179 AromaticContact CZ-CG 3.57Å; Y173-F179 AromaticContact CZ-CZ 3.99Å; Y173-F179 WeakPolarHBondContact OH-CD2 3.35Å
174	Q	87.3	Confident	81.3	Confident	151 Å²	151	81.1 Å²	81.1	71%	0.706	47%	0.468	S	S	*	.			trans	-82.7	155.2	179.8	-61.6	-170.4	-10.5	0	0	112.1	G176 E177 C191	Q174-G176 PolarHBondContact O-N 3.28Å; Q174-E177 HydrophobicContact CB-CB 4.38Å; Q174-E177 PolarHBondContact N-OE2 2.04Å; Q174-E177 WeakPolarHBondContact O-CB 3.48Å; Q174-E177 PolarHBondContact O-N 2.85Å; Q174-C191 WeakPolarHBondContact O-CB 3.24Å; Q174-C191 PolarHBondContact O-SG 3.43Å
175	E	89.5	Confident	81.5	Confident	120 Å²	120	82.7 Å²	82.7	56%	0.561	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	127.2	173.8	-179.3	60.6	-148.1	0	0	110.7	E177 T192 G193 G194	E175-E177 VanDerWaalsContact C-N 3.34Å; E175-T192 VanDerWaalsContact OE1-CA 3.3Å; E175-T192 WeakPolarHBondContact OE1-CA 3.42Å; E175-G193 VanDerWaalsContact CD-N 3.28Å; E175-G193 PolarHBondContact OE1-N 2.72Å; E175-G193 PolarHBondContact OE2-N 2.84Å; E175-G193 VanDerWaalsContact OE2-N 3.09Å; E175-G194 PolarHBondContact OE2-N 2.81Å
176	G	88.9	Confident	81.8	Confident	53 Å²	53	82.5 Å²	82.5	55%	0.546	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-2.9	-174.4	0	0	0	0	0	114.8	Q174 C191	Q174-G176 PolarHBondContact O-N 3.28Å; G176-C191 WeakPolarHBondContact CA-O 3.34Å; G176-C191 PolarHBondContact N-O 3.23Å
177	E	90.7	Very high	82	Confident	72 Å²	72	82 Å²	82	34%	0.336	46%	0.455	S	S	.	.			trans	-75.2	132.5	-178.2	-166.7	173.8	169.5	0	0	111.9	Y173 Q174 E175 S190 C191	Y173-E177 WeakPolarHBondContact CA-OE2 3Å; Y173-E177 HydrophobicContact CD1-CG 4.38Å; Q174-E177 HydrophobicContact CB-CB 4.38Å; Q174-E177 PolarHBondContact N-OE2 2.04Å; Q174-E177 WeakPolarHBondContact O-CB 3.48Å; Q174-E177 PolarHBondContact O-N 2.85Å; E175-E177 VanDerWaalsContact C-N 3.34Å; E177-S190 WeakPolarHBondContact O-CA 3.32Å; E177-C191 PolarHBondContact O-N 3.01Å
178	E	92.5	Very high	82.7	Confident	123 Å²	123	83 Å²	83	58%	0.575	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.8	168.9	-63.3	-171.1	133.9	0	0	109.8	K188 C189	E178-K188 VanDerWaalsContact CD-CE 3.42Å; E178-K188 WeakPolarHBondContact OE1-CE 3.4Å; E178-K188 IonicContact OE1-NZ 2.75Å; E178-K188 PolarHBondContact OE1-NZ 3Å; E178-K188 WeakPolarHBondContact OE2-CE 3.35Å; E178-K188 IonicContact OE2-NZ 3.18Å; E178-K188 PolarHBondContact OE2-NZ 2.87Å; E178-C189 CarbonylContact C-O 3.57Å; E178-C189 VanDerWaalsContact CA-O 3.29Å; E178-C189 WeakPolarHBondContact CA-O 3.16Å
179	F	89.6	Confident	83.6	Confident	15 Å²	15	82.7 Å²	82.7	7%	0.066	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	159	-176.1	63.3	-87.6	0	0	0	112.5	F168 Y173 P181 C189 T196	F168-F179 HydrophobicContact CB-CE2 3.6Å; F168-F179 HydrophobicContact CB-CZ 3.6Å; F168-F179 HydrophobicContact CD1-CE2 4.09Å; F168-F179 HydrophobicContact CD2-CE2 4.28Å; F168-F179 HydrophobicContact CD2-CZ 4.39Å; F168-F179 AromaticContact CG-CE2 3.74Å; F168-F179 HydrophobicContact CG-CE2 3.74Å; F168-F179 HydrophobicContact CG-CZ 4.06Å; Y173-F179 HydrophobicContact CD1-CB 3.85Å; Y173-F179 AromaticContact CD1-CD1 3.38Å; Y173-F179 HydrophobicContact CD1-CD1 3.38Å; Y173-F179 HydrophobicContact CD1-CD2 4.22Å; Y173-F179 AromaticContact CD1-CE1 3.89Å; Y173-F179 HydrophobicContact CD1-CE1 3.89Å; Y173-F179 AromaticContact CD1-CG 3.57Å; Y173-F179 HydrophobicContact CD1-CG 3.57Å; Y173-F179 HydrophobicContact CD1-CZ 4.49Å; Y173-F179 HydrophobicContact CD2-CD1 4.01Å; Y173-F179 HydrophobicContact CD2-CD2 4.48Å; Y173-F179 AromaticContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE1 3.63Å; Y173-F179 HydrophobicContact CD2-CE2 4.13Å; Y173-F179 HydrophobicContact CD2-CG 4.42Å; Y173-F179 AromaticContact CD2-CZ 3.68Å; Y173-F179 HydrophobicContact CD2-CZ 3.68Å; Y173-F179 HydrophobicContact CE1-CB 3.43Å; Y173-F179 VanDerWaalsContact CE1-CB 3.43Å; Y173-F179 AromaticContact CE1-CD1 3.6Å; Y173-F179 HydrophobicContact CE1-CD1 3.6Å; Y173-F179 AromaticContact CE1-CD2 3.56Å; Y173-F179 HydrophobicContact CE1-CD2 3.56Å; Y173-F179 HydrophobicContact CE1-CE1 4.18Å; Y173-F179 HydrophobicContact CE1-CE2 4.14Å; Y173-F179 AromaticContact CE1-CG 3.24Å; Y173-F179 HydrophobicContact CE1-CG 3.24Å; Y173-F179 HydrophobicContact CE1-CZ 4.42Å; Y173-F179 HydrophobicContact CE2-CD1 4.22Å; Y173-F179 AromaticContact CE2-CD2 3.87Å; Y173-F179 HydrophobicContact CE2-CD2 3.87Å; Y173-F179 AromaticContact CE2-CE1 3.96Å; Y173-F179 HydrophobicContact CE2-CE1 3.96Å; Y173-F179 AromaticContact CE2-CE2 3.59Å; Y173-F179 HydrophobicContact CE2-CE2 3.59Å; Y173-F179 HydrophobicContact CE2-CG 4.18Å; Y173-F179 AromaticContact CE2-CZ 3.63Å; Y173-F179 HydrophobicContact CE2-CZ 3.63Å; Y173-F179 AromaticContact CG-CD1 3.59Å; Y173-F179 HydrophobicContact CG-CD1 3.59Å; Y173-F179 AromaticContact CG-CE1 3.59Å; Y173-F179 HydrophobicContact CG-CE1 3.59Å; Y173-F179 HydrophobicContact CG-CG 4.14Å; Y173-F179 HydrophobicContact CG-CZ 4.13Å; Y173-F179 AromaticContact CZ-CD2 3.33Å; Y173-F179 AromaticContact CZ-CE2 3.56Å; Y173-F179 AromaticContact CZ-CG 3.57Å; Y173-F179 AromaticContact CZ-CZ 3.99Å; Y173-F179 WeakPolarHBondContact OH-CD2 3.35Å; F179-P181 HydrophobicContact CE2-CG 4.44Å; F179-C189 HydrophobicContact CD1-CB 3.96Å; F179-C189 HydrophobicContact CD2-CB 3.76Å; F179-C189 HydrophobicContact CE1-CB 3.52Å; F179-C189 HydrophobicContact CE2-CB 3.31Å; F179-C189 HydrophobicContact CG-CB 4.08Å; F179-C189 HydrophobicContact CZ-CB 3.18Å; F179-C189 PolarHBondContact N-O 2.89Å; F179-C189 PolarHBondContact O-N 3.44Å; F179-T196 HydrophobicContact CE1-CG2 4.41Å; F179-T196 HydrophobicContact CZ-CG2 4.36Å
180	Q	88	Confident	84.6	Confident	123 Å²	123	76.7 Å²	76.7	58%	0.575	43%	0.427	S	S	*	.			trans	-116.7	119.7	172.7	-68.6	-175	-22.7	0	0	108.6	T187	Q180-T187 WeakPolarHBondContact CA-O 3.14Å
181	P	80.5	Confident	85.5	Confident	8 Å²	8	73.3 Å²	73.3	5%	0.052	39%	0.392	C	S	.	.			trans	-58.6	142.4	178.9	-25.9	35.3	0	0	0	113.2	F168 F179 G183 S184 T187	F168-P181 HydrophobicContact CD1-CB 4.21Å; F168-P181 HydrophobicContact CD1-CG 4.01Å; F168-P181 HydrophobicContact CE1-CB 3.56Å; F168-P181 HydrophobicContact CE1-CG 3.43Å; F168-P181 VanDerWaalsContact CE1-CG 3.43Å; F168-P181 HydrophobicContact CZ-CB 4.23Å; F168-P181 HydrophobicContact CZ-CG 3.73Å; F179-P181 HydrophobicContact CE2-CG 4.44Å; P181-G183 PolarHBondContact O-N 3.33Å; P181-S184 PolarHBondContact O-N 2.77Å; P181-T187 VanDerWaalsContact CD-O 3.32Å; P181-T187 WeakPolarHBondContact CD-O 3.34Å; P181-T187 HydrophobicContact CG-CG2 4.14Å
182	E	74.4	Confident	86.3	Confident	189 Å²	189	73.3 Å²	73.3	88%	0.883	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	135.6	175	-73.5	-166.2	160.2	0	0	110.5	S184	E182-S184 PolarHBondContact O-N 2.88Å
183	G	72.1	Confident	86.5	Confident	93 Å²	93	67.9 Å²	67.9	96%	0.959	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-12.8	-175.3	0	0	0	0	0	115.4	P181	P181-G183 PolarHBondContact O-N 3.33Å
184	S	76.5	Confident	86.4	Confident	30 Å²	30	67.9 Å²	67.9	21%	0.21	39%	0.392	C	S	.	.			trans	-121.8	74.1	-178.6	-160.1	0	0	0	0	113	P181 E182 C186 T187	P181-S184 PolarHBondContact O-N 2.77Å; E182-S184 PolarHBondContact O-N 2.88Å; S184-C186 PolarHBondContact O-N 2.87Å; S184-T187 PolarHBondContact O-N 3.2Å; S184-T187 WeakPolarHBondContact OG-CB 3.43Å; S184-T187 PolarHBondContact OG-OG1 2.84Å
185	K	83.2	Confident	86.4	Confident	124 Å²	124	65.4 Å²	65.4	54%	0.539	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-21.5	178.5	-63.1	-177.3	-177.4	173.4	0	114.3	C220	K185-C220 HydrophobicContact CB-CB 4.46Å; K185-C220 WeakPolarHBondContact O-CB 2.97Å
186	C	87.7	Confident	86.2	Confident	29 Å²	29	59.7 Å²	59.7	20%	0.196	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-3	-177.9	-63.4	0	0	0	0	113.8	S184 R200 E201 C220	S184-C186 PolarHBondContact O-N 2.87Å; C186-R200 HydrophobicContact CB-CG 4.21Å; C186-R200 CarbonylContact O-C 3.47Å; C186-R200 WeakPolarHBondContact O-CA 3.34Å; C186-E201 PolarHBondContact O-N 3.37Å; C186-C220 WeakPolarHBondContact CA-SG 3.26Å; C186-C220 HydrophobicContact CB-CB 3.91Å; C186-C220 WeakPolarHBondContact CB-SG 2.96Å; C186-C220 WeakPolarHBondContact SG-CB 3.47Å; C186-C220 CovalentContact SG-SG 2.01Å; C186-C220 PolarHBondContact SG-SG 3.31Å
187	T	88.1	Confident	86.3	Confident	5 Å²	5	59 Å²	59	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127	-178.7	-56.3	0	0	0	0	109.1	V146 Q180 P181 S184 C198	V146-T187 HydrophobicContact CB-CG2 4.35Å; V146-T187 HydrophobicContact CG2-CG2 3.94Å; Q180-T187 WeakPolarHBondContact CA-O 3.14Å; P181-T187 VanDerWaalsContact CD-O 3.32Å; P181-T187 WeakPolarHBondContact CD-O 3.34Å; P181-T187 HydrophobicContact CG-CG2 4.14Å; S184-T187 PolarHBondContact O-N 3.2Å; S184-T187 WeakPolarHBondContact OG-CB 3.43Å; S184-T187 PolarHBondContact OG-OG1 2.84Å; T187-C198 HydrophobicContact CG2-CB 4.26Å
188	K	90.1	Very high	86.2	Confident	98 Å²	98	55.6 Å²	55.6	43%	0.426	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.9	172.3	-164.9	-176.7	-174	-161.5	0	108.3	E178 C198 V199	E178-K188 VanDerWaalsContact CD-CE 3.42Å; E178-K188 WeakPolarHBondContact OE1-CE 3.4Å; E178-K188 IonicContact OE1-NZ 2.75Å; E178-K188 PolarHBondContact OE1-NZ 3Å; E178-K188 WeakPolarHBondContact OE2-CE 3.35Å; E178-K188 IonicContact OE2-NZ 3.18Å; E178-K188 PolarHBondContact OE2-NZ 2.87Å; K188-C198 WeakPolarHBondContact O-CA 3.35Å; K188-V199 PolarHBondContact N-O 3.13Å; K188-V199 PolarHBondContact O-N 2.68Å
189	C	91.1	Very high	86	Confident	2 Å²	2	52 Å²	52	1%	0.014	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	150.4	176.3	-63.5	0	0	0	0	109.9	E178 F179 Q197 C198	E178-C189 CarbonylContact C-O 3.57Å; E178-C189 VanDerWaalsContact CA-O 3.29Å; E178-C189 WeakPolarHBondContact CA-O 3.16Å; F179-C189 HydrophobicContact CD1-CB 3.96Å; F179-C189 HydrophobicContact CD2-CB 3.76Å; F179-C189 HydrophobicContact CE1-CB 3.52Å; F179-C189 HydrophobicContact CE2-CB 3.31Å; F179-C189 HydrophobicContact CG-CB 4.08Å; F179-C189 HydrophobicContact CZ-CB 3.18Å; F179-C189 PolarHBondContact N-O 2.89Å; F179-C189 PolarHBondContact O-N 3.44Å; C189-Q197 CarbonylContact C-O 3.57Å; C189-Q197 WeakPolarHBondContact CA-O 3.33Å; C189-C198 HydrophobicContact CB-CB 4.08Å; C189-C198 WeakPolarHBondContact CB-SG 3.08Å; C189-C198 WeakPolarHBondContact SG-CB 3.26Å; C189-C198 CovalentContact SG-SG 2.04Å; C189-C198 PolarHBondContact SG-SG 3.47Å
190	S	93.2	Very high	85.9	Confident	24 Å²	24	56 Å²	56	17%	0.168	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.4	171.3	57.2	0	0	0	0	110.5	E177 T196 Q197	E177-S190 WeakPolarHBondContact O-CA 3.32Å; S190-T196 WeakPolarHBondContact O-CA 3.28Å; S190-Q197 PolarHBondContact N-O 3.43Å; S190-Q197 PolarHBondContact O-N 2.76Å
191	C	91.8	Very high	85.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.3	170	166	0	0	0	0	108.9	C166 Q174 G176 E177 R195	C166-C191 HydrophobicContact CB-CB 3.72Å; C166-C191 WeakPolarHBondContact CB-SG 3.29Å; C166-C191 WeakPolarHBondContact SG-CB 3.22Å; C166-C191 CovalentContact SG-SG 2Å; C166-C191 PolarHBondContact SG-SG 2.99Å; Q174-C191 WeakPolarHBondContact O-CB 3.24Å; Q174-C191 PolarHBondContact O-SG 3.43Å; G176-C191 WeakPolarHBondContact CA-O 3.34Å; G176-C191 PolarHBondContact N-O 3.23Å; E177-C191 PolarHBondContact O-N 3.01Å; C191-R195 WeakPolarHBondContact CA-O 3.1Å
192	T	90.2	Very high	86.2	Confident	76 Å²	76	54.2 Å²	54.2	47%	0.466	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.1	175.6	55.1	0	0	0	0	111.3	E175 G194 R195	E175-T192 VanDerWaalsContact OE1-CA 3.3Å; E175-T192 WeakPolarHBondContact OE1-CA 3.42Å; T192-G194 PolarHBondContact O-N 2.73Å; T192-R195 PolarHBondContact N-O 3.1Å; T192-R195 PolarHBondContact O-N 3.05Å; T192-R195 VanDerWaalsContact O-O 3.12Å
193	G	86.1	Confident	87	Confident	53 Å²	53	46.5 Å²	46.5	55%	0.546	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	36.6	-177.1	0	0	0	0	0	113.4	E175 R195	E175-G193 VanDerWaalsContact CD-N 3.28Å; E175-G193 PolarHBondContact OE1-N 2.72Å; E175-G193 PolarHBondContact OE2-N 2.84Å; E175-G193 VanDerWaalsContact OE2-N 3.09Å; G193-R195 PolarHBondContact O-N 2.04Å; G193-R195 PolarHBondContact O-NH1 2.8Å
194	G	83.4	Confident	88	Confident	37 Å²	37	42.6 Å²	42.6	38%	0.381	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	23.8	-175.6	0	0	0	0	0	114.2	G165 E175 T192	G165-G194 CarbonylContact C-O 3.59Å; G165-G194 WeakPolarHBondContact CA-O 3.49Å; G165-G194 PolarHBondContact N-O 3.43Å; E175-G194 PolarHBondContact OE2-N 2.81Å; T192-G194 PolarHBondContact O-N 2.73Å
195	R	86.6	Confident	88.8	Confident	98 Å²	98	41.2 Å²	41.2	37%	0.37	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.9	179.1	-61.9	-177.7	173.5	76.4	-4.4	111.3	T162 C163 C191 T192 G193	T162-R195 WeakPolarHBondContact OG1-CD 3.05Å; C163-R195 CarbonylContact O-C 3.6Å; C163-R195 WeakPolarHBondContact O-CA 3.38Å; C163-R195 VanDerWaalsContact O-CB 3.28Å; C163-R195 WeakPolarHBondContact O-CB 3.46Å; C191-R195 WeakPolarHBondContact CA-O 3.1Å; T192-R195 PolarHBondContact N-O 3.1Å; T192-R195 PolarHBondContact O-N 3.05Å; T192-R195 VanDerWaalsContact O-O 3.12Å; G193-R195 PolarHBondContact O-N 2.04Å; G193-R195 PolarHBondContact O-NH1 2.8Å
196	T	86.3	Confident	89.3	Confident	1 Å²	1	36 Å²	36	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.4	177	39.2	0	0	0	0	111.8	H148 T162 C163 G165 C166 F179 S190	H148-T196 PolarHBondContact CE1-OG1 2.83Å; H148-T196 WeakPolarHBondContact NE2-CB 3.38Å; H148-T196 PolarHBondContact NE2-OG1 2.88Å; T162-T196 CarbonylContact C-O 3.54Å; T162-T196 WeakPolarHBondContact CA-O 3.02Å; C163-T196 WeakPolarHBondContact CB-OG1 3.32Å; C163-T196 PolarHBondContact N-O 3.25Å; C163-T196 PolarHBondContact O-N 3.28Å; C163-T196 PolarHBondContact O-OG1 2.04Å; G165-T196 WeakPolarHBondContact O-CG2 3.42Å; G165-T196 PolarHBondContact O-N 2.88Å; G165-T196 PolarHBondContact O-OG1 2.88Å; C166-T196 HydrophobicContact CB-CG2 4.35Å; F179-T196 HydrophobicContact CE1-CG2 4.41Å; F179-T196 HydrophobicContact CZ-CG2 4.36Å; S190-T196 WeakPolarHBondContact O-CA 3.28Å
197	Q	90.2	Very high	89.5	Confident	37 Å²	37	34.7 Å²	34.7	17%	0.173	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.3	169.5	-172.2	176.2	65	0	0	109.1	M158 C160 T162 C189 S190	M158-Q197 VanDerWaalsContact CE-NE2 3.26Å; C160-Q197 HydrophobicContact CB-CG 4.05Å; C160-Q197 PolarHBondContact O-NE2 2.75Å; T162-Q197 HydrophobicContact CG2-CB 4.24Å; C189-Q197 CarbonylContact C-O 3.57Å; C189-Q197 WeakPolarHBondContact CA-O 3.33Å; S190-Q197 PolarHBondContact N-O 3.43Å; S190-Q197 PolarHBondContact O-N 2.76Å
198	C	89.2	Confident	89.7	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.5	178.8	-62.9	0	0	0	0	111	V146 F168 T187 K188 C189	V146-C198 HydrophobicContact CB-CB 3.74Å; V146-C198 HydrophobicContact CG1-CB 4.36Å; V146-C198 PolarHBondContact N-O 3.38Å; V146-C198 WeakPolarHBondContact O-CB 3.2Å; F168-C198 VanDerWaalsContact CE2-SG 3.53Å; T187-C198 HydrophobicContact CG2-CB 4.26Å; K188-C198 WeakPolarHBondContact O-CA 3.35Å; C189-C198 HydrophobicContact CB-CB 4.08Å; C189-C198 WeakPolarHBondContact CB-SG 3.08Å; C189-C198 WeakPolarHBondContact SG-CB 3.26Å; C189-C198 CovalentContact SG-SG 2.04Å; C189-C198 PolarHBondContact SG-SG 3.47Å
199	V	87.9	Confident	89.6	Confident	48 Å²	48	30.7 Å²	30.7	29%	0.291	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.1	179.2	-174.3	0	0	0	0	108.9	V143 R144 C160 K188	V143-V199 HydrophobicContact CG1-CG1 3.68Å; V143-V199 HydrophobicContact CG1-CG2 4.5Å; R144-V199 CarbonylContact O-C 3.56Å; R144-V199 WeakPolarHBondContact O-CA 3.04Å; C160-V199 HydrophobicContact CB-CG2 4.49Å; K188-V199 PolarHBondContact N-O 3.13Å; K188-V199 PolarHBondContact O-N 2.68Å
200	R	86.9	Confident	89.3	Confident	98 Å²	98	38.5 Å²	38.5	37%	0.37	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.9	173.3	-168.9	169.4	-179.2	150.1	-4.9	109.7	R144 V146 C186 V202	R144-R200 HydrophobicContact CB-CB 4.15Å; R144-R200 PolarHBondContact O-N 3.2Å; V146-R200 HydrophobicContact CG2-CB 4.05Å; C186-R200 HydrophobicContact CB-CG 4.21Å; C186-R200 CarbonylContact O-C 3.47Å; C186-R200 WeakPolarHBondContact O-CA 3.34Å; R200-V202 PolarHBondContact O-N 3.23Å
201	E	86.9	Confident	89	Confident	84 Å²	84	44.4 Å²	44.4	39%	0.393	24%	0.238	S	C	.	.			trans	-62.8	129.3	175.8	-175.5	168.2	-163.7	0	0	110.4	K120 C186	K120-E201 IonicContact NZ-OE1 3.57Å; K120-E201 PolarHBondContact NZ-OE1 3.21Å; C186-E201 PolarHBondContact O-N 3.37Å
202	V	87.3	Confident	88.8	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	25%	0.25	C	C	.	.			trans	-95.7	113.8	176.8	179.7	0	0	0	0	108.3	S141 R144 R200	S141-V202 WeakPolarHBondContact OG-CG1 2.93Å; R144-V202 HydrophobicContact CB-CG2 4.33Å; R144-V202 HydrophobicContact CG-CG2 3.74Å; R200-V202 PolarHBondContact O-N 3.23Å
203	C	91.3	Very high	88.8	Confident	26 Å²	26	45.1 Å²	45.1	18%	0.176	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-71.1	141.4	-175.5	-63.3	0	0	0	0	113.1	C221 R270	C203-C221 WeakPolarHBondContact CA-SG 3.28Å; C203-C221 HydrophobicContact CB-CB 3.63Å; C203-C221 WeakPolarHBondContact CB-SG 3.43Å; C203-C221 WeakPolarHBondContact SG-CA 3.43Å; C203-C221 WeakPolarHBondContact SG-CB 3.32Å; C203-C221 CovalentContact SG-SG 2.05Å; C203-C221 PolarHBondContact SG-SG 3.36Å; C203-R270 PolarHBondContact O-NH1 2.81Å; C203-R270 PolarHBondContact O-NH2 3.42Å
204	P	93.1	Very high	89	Confident	12 Å²	12	45.8 Å²	45.8	8%	0.078	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-63.5	148.1	177.4	27.5	-34.5	0	0	0	110.9	Q132 Q134 L206	Q132-P204 HydrophobicContact CG-CB 4.29Å; Q134-P204 HydrophobicContact CB-CB 3.91Å; Q134-P204 HydrophobicContact CG-CB 4.25Å; Q134-P204 HydrophobicContact CG-CG 4.38Å; P204-L206 HydrophobicContact CG-CD2 4.43Å
205	I	93.9	Very high	89.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-77.1	122.8	168.3	-65.3	169.6	0	0	0	107.8	V137 T139 F240 Y253 T257 C268 R270	V137-I205 HydrophobicContact CG1-CB 4.08Å; V137-I205 HydrophobicContact CG1-CG2 4.12Å; V137-I205 WeakPolarHBondContact CG1-O 3.21Å; T139-I205 HydrophobicContact CG2-CD1 4.14Å; T139-I205 HydrophobicContact CG2-CG1 4.11Å; T139-I205 PolarHBondContact OG1-N 2.04Å; I205-F240 HydrophobicContact CG2-CE2 3.78Å; I205-F240 HydrophobicContact CG2-CZ 3.63Å; I205-Y253 HydrophobicContact CD1-CD1 4.37Å; I205-Y253 HydrophobicContact CD1-CG 4.47Å; I205-Y253 HydrophobicContact CG2-CD2 3.83Å; I205-Y253 HydrophobicContact CG2-CE2 3.61Å; I205-T257 HydrophobicContact CD1-CG2 3.4Å; I205-T257 VanDerWaalsContact CD1-CG2 3.4Å; I205-C268 HydrophobicContact CD1-CB 3.42Å; I205-C268 VanDerWaalsContact CD1-CB 3.42Å; I205-R270 VanDerWaalsContact CG1-NH2 3.32Å
206	L	94	Very high	89.3	Confident	14 Å²	14	44.9 Å²	44.9	7%	0.073	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-83.6	144.7	-176.2	-58.4	-175.6	0	0	0	111.6	Q134 P204 C208 P222 F240	Q134-L206 HydrophobicContact CG-CD2 3.91Å; P204-L206 HydrophobicContact CG-CD2 4.43Å; L206-C208 VanDerWaalsContact C-N 3.27Å; L206-C208 PolarHBondContact O-N 3.3Å; L206-P222 HydrophobicContact CD1-CB 3.91Å; L206-P222 HydrophobicContact CD1-CG 4.08Å; L206-F240 WeakPolarHBondContact O-CE2 3.23Å
207	S	92.2	Very high	89.2	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.014	26%	0.264	C	S	.	.	S	Bend	trans	-76.1	-12.6	175.2	68.4	0	0	0	0	113.5	R228 R241	S207-R228 PolarHBondContact O-NH1 3.21Å; S207-R241 WeakPolarHBondContact O-CA 3.46Å; S207-R241 PolarHBondContact O-N 2.99Å
208	C	91.7	Very high	88.9	Confident	6 Å²	6	52 Å²	52	4%	0.041	29%	0.285	C	S	.	.	S	Bend	trans	-86.2	153.4	179	58.7	0	0	0	0	113.3	L206 L212 C224	L206-C208 VanDerWaalsContact C-N 3.27Å; L206-C208 PolarHBondContact O-N 3.3Å; C208-L212 HydrophobicContact CB-CB 4.13Å; C208-C224 HydrophobicContact CB-CB 3.8Å; C208-C224 WeakPolarHBondContact CB-SG 3.42Å; C208-C224 WeakPolarHBondContact SG-CA 3.22Å; C208-C224 WeakPolarHBondContact SG-CB 3.16Å; C208-C224 CovalentContact SG-SG 2.03Å; C208-C224 PolarHBondContact SG-SG 2.89Å
209	P	88.6	Confident	88.9	Confident	12 Å²	12	55.6 Å²	55.6	8%	0.078	30%	0.302	C	S	.	.			trans	-55.9	149.7	167.8	-26.3	35.5	0	0	0	112.7	H211 L212 R241 S242	P209-H211 WeakPolarHBondContact CB-CE1 2.97Å; P209-H211 WeakPolarHBondContact CB-ND1 3.26Å; P209-H211 PolarHBondContact O-N 2.86Å; P209-H211 VanDerWaalsContact O-N 3.1Å; P209-L212 PolarHBondContact O-N 2.99Å; P209-R241 HydrophobicContact CG-CB 4.31Å; P209-S242 WeakPolarHBondContact CG-OG 3.04Å
210	Q	85.6	Confident	88.9	Confident	167 Å²	167	54.1 Å²	54.1	78%	0.78	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-56.5	-31.8	-175.8	-168.6	176.5	11.2	0	0	114	L212 S213	Q210-L212 PolarHBondContact O-N 2.04Å; Q210-S213 VanDerWaalsContact O-CB 3.29Å; Q210-S213 WeakPolarHBondContact O-CB 3.49Å; Q210-S213 PolarHBondContact O-N 3.16Å
211	H	85.1	Confident	89.2	Confident	147 Å²	147	50.2 Å²	50.2	68%	0.681	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-70.4	-13.5	177.3	68.4	-92.7	0	0	0	114.1	P209	P209-H211 WeakPolarHBondContact CB-CE1 2.97Å; P209-H211 WeakPolarHBondContact CB-ND1 3.26Å; P209-H211 PolarHBondContact O-N 2.86Å; P209-H211 VanDerWaalsContact O-N 3.1Å
212	L	88	Confident	89.4	Confident	48 Å²	48	47.6 Å²	47.6	25%	0.251	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-101.3	1.2	171.2	-60.5	-178.7	0	0	0	111.9	C208 P209 Q210 C224 L225	C208-L212 HydrophobicContact CB-CB 4.13Å; P209-L212 PolarHBondContact O-N 2.99Å; Q210-L212 PolarHBondContact O-N 2.04Å; L212-C224 CarbonylContact O-C 3.56Å; L212-C224 WeakPolarHBondContact O-CA 3.45Å; L212-L225 WeakPolarHBondContact O-CB 3.45Å; L212-L225 PolarHBondContact O-N 3.05Å
213	S	89.8	Confident	89.6	Confident	44 Å²	44	50.8 Å²	50.8	31%	0.308	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.9	175.5	-178.7	0	0	0	0	109.5	Q210 P222	Q210-S213 VanDerWaalsContact O-CB 3.29Å; Q210-S213 WeakPolarHBondContact O-CB 3.49Å; Q210-S213 PolarHBondContact O-N 3.16Å; S213-P222 VanDerWaalsContact OG-CB 3.24Å; S213-P222 WeakPolarHBondContact OG-CB 3.41Å
214	H	90.1	Very high	89.6	Confident	67 Å²	67	50.4 Å²	50.4	31%	0.31	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.7	170	94	-62.2	0	0	0	110.5	P216 P222 K223 L225	H214-P216 WeakPolarHBondContact O-CD 3.49Å; H214-P222 CarbonylContact O-C 3.53Å; H214-P222 VanDerWaalsContact O-CA 3.22Å; H214-P222 WeakPolarHBondContact O-CA 3.44Å; H214-K223 PolarHBondContact N-O 3.46Å; H214-K223 PolarHBondContact ND1-O 2.95Å; H214-K223 PolarHBondContact O-N 2.03Å; H214-L225 HydrophobicContact CB-CD1 3.85Å; H214-L225 HydrophobicContact CB-CD2 4.23Å; H214-L225 HydrophobicContact CB-CG 3.94Å; H214-L225 VanDerWaalsContact ND1-CD2 3.26Å; H214-L225 WeakPolarHBondContact ND1-CD2 3.38Å
215	I	89.6	Confident	89.3	Confident	101 Å²	101	53.9 Å²	53.9	52%	0.518	30%	0.299	S	S	.	.			trans	-96.2	112.9	171.9	-58.5	173	0	0	0	107.1	Q219 P222	I215-Q219 VanDerWaalsContact CG2-O 3.24Å; I215-Q219 WeakPolarHBondContact CG2-O 3.02Å; I215-P222 HydrophobicContact CG1-CB 3.95Å
216	P	87.5	Confident	88.7	Confident	15 Å²	15	56.7 Å²	56.7	10%	0.097	33%	0.328	C	S	.	.			trans	-58.9	148.9	176.4	-21.5	31.2	0	0	0	111.6	H214 G218 Q219 K223	H214-P216 WeakPolarHBondContact O-CD 3.49Å; P216-G218 PolarHBondContact O-N 2.82Å; P216-Q219 HydrophobicContact CB-CB 4.32Å; P216-Q219 HydrophobicContact CB-CG 4.1Å; P216-Q219 HydrophobicContact CG-CG 4.49Å; P216-Q219 PolarHBondContact O-N 2.76Å; P216-K223 HydrophobicContact CG-CB 4.44Å; P216-K223 HydrophobicContact CG-CD 4.19Å; P216-K223 HydrophobicContact CG-CG 4.27Å
217	P	85.4	Confident	88.2	Confident	127 Å²	127	59.8 Å²	59.8	83%	0.825	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	132	175.3	-25.6	34.4	0	0	0	111.8	Q219	P217-Q219 VanDerWaalsContact C-N 3.27Å; P217-Q219 PolarHBondContact O-N 2.87Å
218	G	83.8	Confident	88	Confident	60 Å²	60	62.5 Å²	62.5	62%	0.619	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-5.5	-179.4	0	0	0	0	0	116	P216	P216-G218 PolarHBondContact O-N 2.82Å
219	Q	88.1	Confident	87.7	Confident	78 Å²	78	67.1 Å²	67.1	36%	0.364	37%	0.371	S	S	.	.			trans	-97.1	154.3	178.2	-62.7	-173.7	18.4	0	0	112	I215 P216 P217	I215-Q219 VanDerWaalsContact CG2-O 3.24Å; I215-Q219 WeakPolarHBondContact CG2-O 3.02Å; P216-Q219 HydrophobicContact CB-CB 4.32Å; P216-Q219 HydrophobicContact CB-CG 4.1Å; P216-Q219 HydrophobicContact CG-CG 4.49Å; P216-Q219 PolarHBondContact O-N 2.76Å; P217-Q219 VanDerWaalsContact C-N 3.27Å; P217-Q219 PolarHBondContact O-N 2.87Å
220	C	89.2	Confident	87.3	Confident	17 Å²	17	68 Å²	68	12%	0.115	38%	0.376	C	S	.	.	S	Bend	trans	-79	-48.6	172.1	161.3	0	0	0	0	111.5	K185 C186	K185-C220 HydrophobicContact CB-CB 4.46Å; K185-C220 WeakPolarHBondContact O-CB 2.97Å; C186-C220 WeakPolarHBondContact CA-SG 3.26Å; C186-C220 HydrophobicContact CB-CB 3.91Å; C186-C220 WeakPolarHBondContact CB-SG 2.96Å; C186-C220 WeakPolarHBondContact SG-CB 3.47Å; C186-C220 CovalentContact SG-SG 2.01Å; C186-C220 PolarHBondContact SG-SG 3.31Å
221	C	91.5	Very high	86.9	Confident	17 Å²	17	65.8 Å²	65.8	12%	0.115	36%	0.364	C	S	.	.	S	Bend	trans	-98.2	145.5	-166.4	-65.3	0	0	0	0	113.5	C203	C203-C221 WeakPolarHBondContact CA-SG 3.28Å; C203-C221 HydrophobicContact CB-CB 3.63Å; C203-C221 WeakPolarHBondContact CB-SG 3.43Å; C203-C221 WeakPolarHBondContact SG-CA 3.43Å; C203-C221 WeakPolarHBondContact SG-CB 3.32Å; C203-C221 CovalentContact SG-SG 2.05Å; C203-C221 PolarHBondContact SG-SG 3.36Å
222	P	91.6	Very high	86.2	Confident	29 Å²	29	62.7 Å²	62.7	19%	0.188	35%	0.353	C	S	.	.			trans	-69.4	153.5	176.1	30	-34.7	0	0	0	111.6	L206 S213 H214 I215	L206-P222 HydrophobicContact CD1-CB 3.91Å; L206-P222 HydrophobicContact CD1-CG 4.08Å; S213-P222 VanDerWaalsContact OG-CB 3.24Å; S213-P222 WeakPolarHBondContact OG-CB 3.41Å; H214-P222 CarbonylContact O-C 3.53Å; H214-P222 VanDerWaalsContact O-CA 3.22Å; H214-P222 WeakPolarHBondContact O-CA 3.44Å; I215-P222 HydrophobicContact CG1-CB 3.95Å
223	K	91.7	Very high	85.6	Confident	77 Å²	77	61.3 Å²	61.3	34%	0.335	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.2	169.5	-66	-169.1	176.6	-169.4	0	110	D90 H214 P216	D90-K223 IonicContact OD1-NZ 2.63Å; H214-K223 PolarHBondContact N-O 3.46Å; H214-K223 PolarHBondContact ND1-O 2.95Å; H214-K223 PolarHBondContact O-N 2.03Å; P216-K223 HydrophobicContact CG-CB 4.44Å; P216-K223 HydrophobicContact CG-CD 4.19Å; P216-K223 HydrophobicContact CG-CG 4.27Å
224	C	91.5	Very high	85.2	Confident	18 Å²	18	62.9 Å²	62.9	12%	0.122	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	139.5	173	-66.2	0	0	0	0	111.4	A92 C208 L212	A92-C224 HydrophobicContact CB-CB 3.33Å; C208-C224 HydrophobicContact CB-CB 3.8Å; C208-C224 WeakPolarHBondContact CB-SG 3.42Å; C208-C224 WeakPolarHBondContact SG-CA 3.22Å; C208-C224 WeakPolarHBondContact SG-CB 3.16Å; C208-C224 CovalentContact SG-SG 2.03Å; C208-C224 PolarHBondContact SG-SG 2.89Å; L212-C224 CarbonylContact O-C 3.56Å; L212-C224 WeakPolarHBondContact O-CA 3.45Å
225	L	86.3	Confident	84.8	Confident	85 Å²	85	69.7 Å²	69.7	45%	0.445	38%	0.384	S	S	.	.	S	Bend	trans	-89.6	122.2	175.2	-74.2	173.9	0	0	0	110.3	L212 H214	L212-L225 WeakPolarHBondContact O-CB 3.45Å; L212-L225 PolarHBondContact O-N 3.05Å; H214-L225 HydrophobicContact CB-CD1 3.85Å; H214-L225 HydrophobicContact CB-CD2 4.23Å; H214-L225 HydrophobicContact CB-CG 3.94Å; H214-L225 VanDerWaalsContact ND1-CD2 3.26Å; H214-L225 WeakPolarHBondContact ND1-CD2 3.38Å
226	G	81.6	Confident	84.6	Confident	59 Å²	59	65.1 Å²	65.1	61%	0.608	36%	0.362	S	S	*	.	S	Bend	trans	78.5	166.4	178.8	0	0	0	0	0	113.6
227	Q	83.5	Confident	84.7	Confident	79 Å²	79	64.8 Å²	64.8	37%	0.369	36%	0.36	S	S	.	.			trans	-100.6	121.3	177.7	-178.5	172.3	82.2	0	0	110.1	C91 A94	C91-Q227 WeakPolarHBondContact O-CG 3.31Å; C91-Q227 PolarHBondContact O-NE2 2.81Å; A94-Q227 HydrophobicContact CB-CG 4.12Å
228	R	87.3	Confident	85.1	Confident	59 Å²	59	58.7 Å²	58.7	22%	0.223	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	131.7	172.3	-60.3	171.4	64.4	-160.6	4.4	108.2	A92 L93 A94 S207 R241	A92-R228 PolarHBondContact O-N 3.43Å; L93-R228 WeakPolarHBondContact CA-O 3.21Å; L93-R228 HydrophobicContact CD1-CB 4.11Å; A94-R228 PolarHBondContact N-O 3.29Å; S207-R228 PolarHBondContact O-NH1 3.21Å; R228-R241 PolarHBondContact NH1-O 3.4Å; R228-R241 PolarHBondContact NH2-O 3.32Å
229	K	85.1	Confident	85.4	Confident	103 Å²	103	57 Å²	57	45%	0.448	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.6	176	-59.6	-165.8	177.9	-162.1	0	109.8	A94 E103 F231	A94-K229 HydrophobicContact CB-CG 4.3Å; A94-K229 WeakPolarHBondContact O-CA 3.32Å; E103-K229 VanDerWaalsContact CD-NZ 3.25Å; E103-K229 IonicContact OE1-NZ 2.76Å; E103-K229 PolarHBondContact OE1-NZ 2.8Å; E103-K229 WeakPolarHBondContact OE2-CE 3.43Å; E103-K229 IonicContact OE2-NZ 3.43Å; E103-K229 PolarHBondContact OE2-NZ 2.87Å; K229-F231 HydrophobicContact CB-CE2 4.19Å; K229-F231 HydrophobicContact CB-CZ 4.29Å
230	V	81.2	Confident	85.5	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.9	178.3	-178.2	0	0	0	0	108.8	L93 A94 I95 K96 L233 L239	L93-V230 HydrophobicContact CD1-CG2 3.61Å; A94-V230 PolarHBondContact O-N 2.77Å; I95-V230 WeakPolarHBondContact CA-O 3.44Å; I95-V230 HydrophobicContact CG2-CB 4.48Å; K96-V230 PolarHBondContact N-O 3.31Å; K96-V230 VanDerWaalsContact N-O 3.1Å; V230-L233 HydrophobicContact CG1-CB 4.2Å; V230-L233 HydrophobicContact CG1-CD1 4.43Å; V230-L239 HydrophobicContact CG2-CD2 3.47Å; V230-L239 VanDerWaalsContact CG2-CD2 3.47Å
231	F	76.1	Confident	85.5	Confident	121 Å²	121	56.6 Å²	56.6	53%	0.531	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.7	175.8	-56.2	-81.6	0	0	0	108.1	K96 K229 L233	K96-F231 HydrophobicContact CB-CD1 3.85Å; K96-F231 HydrophobicContact CB-CE1 3.93Å; K96-F231 HydrophobicContact CD-CD1 4.39Å; K96-F231 HydrophobicContact CD-CE1 4.04Å; K96-F231 WeakPolarHBondContact O-CA 3.41Å; K229-F231 HydrophobicContact CB-CE2 4.19Å; K229-F231 HydrophobicContact CB-CZ 4.29Å; F231-L233 PolarHBondContact O-N 2.9Å
232	D	71.2	Confident	85.2	Confident	82 Å²	82	59.8 Å²	59.8	44%	0.439	31%	0.312	S	S	.	.			trans	54.5	49.4	168.6	-56.3	-19.3	0	0	0	114.8	K96 R98	K96-D232 PolarHBondContact O-N 3.06Å; R98-D232 WeakPolarHBondContact CA-OD1 3.01Å; R98-D232 VanDerWaalsContact CB-OD1 3.26Å; R98-D232 WeakPolarHBondContact CB-OD1 3.39Å; R98-D232 PolarHBondContact N-OD1 2.89Å
233	L	75.8	Confident	85	Confident	19 Å²	19	62.7 Å²	62.7	10%	0.099	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.4	126	169.9	-170.6	69.4	0	0	0	108.7	V230 F231 S237 L239 V244	V230-L233 HydrophobicContact CG1-CB 4.2Å; V230-L233 HydrophobicContact CG1-CD1 4.43Å; F231-L233 PolarHBondContact O-N 2.9Å; L233-S237 VanDerWaalsContact CD2-O 3.25Å; L233-S237 WeakPolarHBondContact CD2-O 3.26Å; L233-L239 HydrophobicContact CD1-CB 4.18Å; L233-L239 HydrophobicContact CD2-CB 4.37Å; L233-V244 HydrophobicContact CD1-CG1 4.09Å; L233-V244 HydrophobicContact CD1-CG2 4.18Å
234	P	81	Confident	84.8	Confident	77 Å²	77	62.8 Å²	62.8	50%	0.5	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-55.1	143.8	-177.3	-23.6	32	0	0	0	111.8	G236 S237	P234-G236 PolarHBondContact O-N 3.2Å; P234-S237 VanDerWaalsContact O-CB 3.31Å; P234-S237 WeakPolarHBondContact O-CB 3.31Å; P234-S237 PolarHBondContact O-N 2.8Å
235	F	81.5	Confident	84.8	Confident	210 Å²	210	64.7 Å²	64.7	92%	0.921	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.7	-174.2	-172.1	-95	0	0	0	111.3	S237	F235-S237 PolarHBondContact O-N 2.87Å
236	G	85.3	Confident	85	Confident	5 Å²	5	66 Å²	66	5%	0.052	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-13.5	-178.6	0	0	0	0	0	115.3	P234 N247 S264	P234-G236 PolarHBondContact O-N 3.2Å; G236-N247 WeakPolarHBondContact O-CB 3.19Å; G236-S264 WeakPolarHBondContact CA-OG 3.23Å; G236-S264 PolarHBondContact N-OG 2.87Å; G236-S264 PolarHBondContact O-N 3.28Å
237	S	91	Very high	85.5	Confident	8 Å²	8	67.1 Å²	67.1	6%	0.056	34%	0.337	C	S	.	.			trans	-76.3	147.5	-179.7	-59.8	0	0	0	0	112	L233 P234 F235 Y245 S264	L233-S237 VanDerWaalsContact CD2-O 3.25Å; L233-S237 WeakPolarHBondContact CD2-O 3.26Å; P234-S237 VanDerWaalsContact O-CB 3.31Å; P234-S237 WeakPolarHBondContact O-CB 3.31Å; P234-S237 PolarHBondContact O-N 2.8Å; F235-S237 PolarHBondContact O-N 2.87Å; S237-Y245 CarbonylContact C-O 3.49Å; S237-Y245 WeakPolarHBondContact CA-O 3.27Å; S237-S264 WeakPolarHBondContact O-CA 3.47Å
238	C	91.9	Very high	86	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.4	-179.3	-51.3	0	0	0	0	111	V244 Y245 C261 S264 T265 V266	C238-V244 WeakPolarHBondContact O-CA 3.35Å; C238-Y245 PolarHBondContact N-O 3.25Å; C238-Y245 PolarHBondContact O-N 2.84Å; C238-C261 HydrophobicContact CB-CB 3.7Å; C238-C261 WeakPolarHBondContact CB-SG 3.42Å; C238-C261 PolarHBondContact N-SG 2.77Å; C238-C261 WeakPolarHBondContact SG-CA 3.11Å; C238-C261 WeakPolarHBondContact SG-CB 3.37Å; C238-C261 CovalentContact SG-SG 2.03Å; C238-C261 PolarHBondContact SG-SG 2.84Å; C238-S264 VanDerWaalsContact SG-C 3.59Å; C238-T265 VanDerWaalsContact SG-C 3.54Å; C238-T265 PolarHBondContact SG-N 2.85Å; C238-T265 PolarHBondContact SG-O 2.82Å; C238-T265 VanDerWaalsContact SG-O 3.4Å; C238-V266 HydrophobicContact CB-CG2 3.64Å
239	L	90.3	Very high	86.2	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.126	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.2	167.7	177.8	68.1	0	0	0	109.5	L93 V230 L233 V244	L93-L239 HydrophobicContact CD1-CD2 4.08Å; L93-L239 HydrophobicContact CD2-CD2 4.43Å; V230-L239 HydrophobicContact CG2-CD2 3.47Å; V230-L239 VanDerWaalsContact CG2-CD2 3.47Å; L233-L239 HydrophobicContact CD1-CB 4.18Å; L233-L239 HydrophobicContact CD2-CB 4.37Å; L239-V244 HydrophobicContact CD1-CG2 4.05Å
240	F	91.8	Very high	86.7	Confident	2 Å²	2	64 Å²	64	1%	0.009	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.2	172.8	-168.9	-111	0	0	0	110.4	V137 I205 L206 S242 D243 Y245 F251 Y253 V266	V137-F240 HydrophobicContact CG1-CE2 4.26Å; V137-F240 HydrophobicContact CG2-CD2 3.76Å; V137-F240 HydrophobicContact CG2-CE2 3.82Å; I205-F240 HydrophobicContact CG2-CE2 3.78Å; I205-F240 HydrophobicContact CG2-CZ 3.63Å; L206-F240 WeakPolarHBondContact O-CE2 3.23Å; F240-S242 PolarHBondContact O-N 2.9Å; F240-D243 PolarHBondContact N-O 3.06Å; F240-D243 PolarHBondContact O-N 2.95Å; F240-Y245 HydrophobicContact CB-CD2 4.04Å; F240-Y245 HydrophobicContact CB-CE2 3.86Å; F240-F251 HydrophobicContact CB-CZ 4.16Å; F240-F251 HydrophobicContact CD1-CE1 4.48Å; F240-F251 AromaticContact CD1-CE2 3.47Å; F240-F251 HydrophobicContact CD1-CE2 3.47Å; F240-F251 VanDerWaalsContact CD1-CE2 3.47Å; F240-F251 AromaticContact CD1-CZ 3.36Å; F240-F251 HydrophobicContact CD1-CZ 3.36Å; F240-F251 AromaticContact CE1-CE2 3.54Å; F240-F251 HydrophobicContact CE1-CE2 3.54Å; F240-F251 AromaticContact CE1-CZ 3.84Å; F240-F251 HydrophobicContact CE1-CZ 3.84Å; F240-F251 HydrophobicContact CG-CE2 4.3Å; F240-F251 AromaticContact CG-CZ 3.76Å; F240-F251 HydrophobicContact CG-CZ 3.76Å; F240-F251 HydrophobicContact CZ-CE2 4.42Å; F240-Y253 AromaticContact CE1-CD2 3.92Å; F240-Y253 HydrophobicContact CE1-CD2 3.92Å; F240-Y253 HydrophobicContact CE1-CE2 4.48Å; F240-Y253 AromaticContact CZ-CD2 3.66Å; F240-Y253 HydrophobicContact CZ-CD2 3.66Å; F240-Y253 AromaticContact CZ-CE2 3.99Å; F240-Y253 HydrophobicContact CZ-CE2 3.99Å; F240-V266 HydrophobicContact CB-CG2 3.9Å; F240-V266 HydrophobicContact CD2-CB 4.35Å; F240-V266 HydrophobicContact CD2-CG1 4.11Å; F240-V266 HydrophobicContact CD2-CG2 4.05Å; F240-V266 HydrophobicContact CG-CG1 4.42Å; F240-V266 HydrophobicContact CG-CG2 4.26Å
241	R	88.3	Confident	87.2	Confident	85 Å²	85	64.1 Å²	64.1	32%	0.321	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	-109.9	-170.5	-60	174.6	175.7	175.1	0.6	110.2	S207 P209 R228 Y253	S207-R241 WeakPolarHBondContact O-CA 3.46Å; S207-R241 PolarHBondContact O-N 2.99Å; P209-R241 HydrophobicContact CG-CB 4.31Å; R228-R241 PolarHBondContact NH1-O 3.4Å; R228-R241 PolarHBondContact NH2-O 3.32Å; R241-Y253 VanDerWaalsContact NH2-CD2 3.3Å
242	S	85	Confident	87.9	Confident	84 Å²	84	64.4 Å²	64.4	59%	0.587	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-3.7	179.1	-61.8	0	0	0	0	113.1	P209 F240	P209-S242 WeakPolarHBondContact CG-OG 3.04Å; F240-S242 PolarHBondContact O-N 2.9Å
243	D	86.8	Confident	88.7	Confident	89 Å²	89	64 Å²	64	48%	0.476	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.8	-167.7	-54.3	-60	0	0	0	110.6	F240 Y245	F240-D243 PolarHBondContact N-O 3.06Å; F240-D243 PolarHBondContact O-N 2.95Å; D243-Y245 HydrophobicContact CB-CD2 4.43Å; D243-Y245 HydrophobicContact CB-CE2 3.78Å
244	V	89.4	Confident	89.1	Confident	80 Å²	80	66 Å²	66	49%	0.485	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.7	174.2	-178.8	0	0	0	0	107.5	L233 C238 L239	L233-V244 HydrophobicContact CD1-CG1 4.09Å; L233-V244 HydrophobicContact CD1-CG2 4.18Å; C238-V244 WeakPolarHBondContact O-CA 3.35Å; L239-V244 HydrophobicContact CD1-CG2 4.05Å
245	Y	90.7	Very high	89.1	Confident	58 Å²	58	69.7 Å²	69.7	23%	0.227	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.4	179	-68.1	-92.8	0	0	0	109.7	S237 C238 F240 D243 F251 C261	S237-Y245 CarbonylContact C-O 3.49Å; S237-Y245 WeakPolarHBondContact CA-O 3.27Å; C238-Y245 PolarHBondContact N-O 3.25Å; C238-Y245 PolarHBondContact O-N 2.84Å; F240-Y245 HydrophobicContact CB-CD2 4.04Å; F240-Y245 HydrophobicContact CB-CE2 3.86Å; D243-Y245 HydrophobicContact CB-CD2 4.43Å; D243-Y245 HydrophobicContact CB-CE2 3.78Å; Y245-F251 AromaticContact CD1-CD1 3.65Å; Y245-F251 HydrophobicContact CD1-CD1 3.65Å; Y245-F251 HydrophobicContact CD1-CE1 4Å; Y245-F251 HydrophobicContact CD2-CD1 4.42Å; Y245-F251 AromaticContact CD2-CE1 3.98Å; Y245-F251 HydrophobicContact CD2-CE1 3.98Å; Y245-F251 HydrophobicContact CE1-CB 4.1Å; Y245-F251 AromaticContact CE1-CD1 3.33Å; Y245-F251 HydrophobicContact CE1-CD1 3.33Å; Y245-F251 AromaticContact CE1-CE1 3.88Å; Y245-F251 HydrophobicContact CE1-CE1 3.88Å; Y245-F251 AromaticContact CE1-CG 3.83Å; Y245-F251 HydrophobicContact CE1-CG 3.83Å; Y245-F251 HydrophobicContact CE2-CD1 4.16Å; Y245-F251 AromaticContact CE2-CE1 3.86Å; Y245-F251 HydrophobicContact CE2-CE1 3.86Å; Y245-F251 HydrophobicContact CE2-CZ 4.23Å; Y245-F251 HydrophobicContact CG-CD1 4.18Å; Y245-F251 HydrophobicContact CG-CE1 4.05Å; Y245-F251 AromaticContact CZ-CD1 3.61Å; Y245-F251 AromaticContact CZ-CE1 3.79Å; Y245-F251 AromaticContact CZ-CG 3.95Å; Y245-C261 PolarHBondContact O-SG 2.88Å
246	D	90.1	Very high	89.2	Confident	111 Å²	111	61 Å²	61	59%	0.594	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-66.3	151.4	172.5	-63.2	-41.8	0	0	0	111	G248 S249	D246-G248 PolarHBondContact O-N 3.14Å; D246-S249 WeakPolarHBondContact O-CB 3.49Å; D246-S249 PolarHBondContact O-N 3.49Å; D246-S249 PolarHBondContact O-OG 3.46Å
247	N	92.8	Very high	89.4	Confident	83 Å²	83	60.9 Å²	60.9	44%	0.444	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	129.5	177.4	-164.2	21.5	0	0	0	110.8	G236 R262 D263	G236-N247 WeakPolarHBondContact O-CB 3.19Å; N247-R262 VanDerWaalsContact OD1-CA 3.3Å; N247-R262 WeakPolarHBondContact OD1-CA 3.48Å; N247-D263 PolarHBondContact ND2-OD1 3.23Å; N247-D263 PolarHBondContact OD1-N 3.02Å
248	G	92.7	Very high	89.5	Confident	51 Å²	51	62.7 Å²	62.7	53%	0.526	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-15	-175.4	0	0	0	0	0	115.2	D246 C261	D246-G248 PolarHBondContact O-N 3.14Å; G248-C261 WeakPolarHBondContact CA-O 3.4Å; G248-C261 PolarHBondContact N-O 2.87Å
249	S	92.6	Very high	89.7	Confident	40 Å²	40	62.7 Å²	62.7	28%	0.28	36%	0.357	S	S	.	.			trans	-62.5	138.2	178.4	-63.7	0	0	0	0	111.8	D246 T260 C261	D246-S249 WeakPolarHBondContact O-CB 3.49Å; D246-S249 PolarHBondContact O-N 3.49Å; D246-S249 PolarHBondContact O-OG 3.46Å; S249-T260 CarbonylContact O-C 3.57Å; S249-T260 WeakPolarHBondContact O-CA 3.46Å; S249-C261 PolarHBondContact O-N 3.05Å
250	S	94.6	Very high	90	Very high	85 Å²	85	63 Å²	63	59%	0.594	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.4	177.3	-61.7	0	0	0	0	111.9	C259 T260	S250-C259 CarbonylContact C-O 3.59Å; S250-C259 VanDerWaalsContact CA-O 3.26Å; S250-C259 WeakPolarHBondContact CA-O 3.21Å; S250-T260 VanDerWaalsContact OG-CG2 3.31Å; S250-T260 WeakPolarHBondContact OG-CG2 3.34Å; S250-T260 PolarHBondContact OG-OG1 3.4Å
251	F	93.2	Very high	90.2	Very high	32 Å²	32	62.9 Å²	62.9	14%	0.14	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.3	179.6	60.9	-89.8	0	0	0	111.1	F240 Y245 C259 V266	F240-F251 HydrophobicContact CB-CZ 4.16Å; F240-F251 HydrophobicContact CD1-CE1 4.48Å; F240-F251 AromaticContact CD1-CE2 3.47Å; F240-F251 HydrophobicContact CD1-CE2 3.47Å; F240-F251 VanDerWaalsContact CD1-CE2 3.47Å; F240-F251 AromaticContact CD1-CZ 3.36Å; F240-F251 HydrophobicContact CD1-CZ 3.36Å; F240-F251 AromaticContact CE1-CE2 3.54Å; F240-F251 HydrophobicContact CE1-CE2 3.54Å; F240-F251 AromaticContact CE1-CZ 3.84Å; F240-F251 HydrophobicContact CE1-CZ 3.84Å; F240-F251 HydrophobicContact CG-CE2 4.3Å; F240-F251 AromaticContact CG-CZ 3.76Å; F240-F251 HydrophobicContact CG-CZ 3.76Å; F240-F251 HydrophobicContact CZ-CE2 4.42Å; Y245-F251 AromaticContact CD1-CD1 3.65Å; Y245-F251 HydrophobicContact CD1-CD1 3.65Å; Y245-F251 HydrophobicContact CD1-CE1 4Å; Y245-F251 HydrophobicContact CD2-CD1 4.42Å; Y245-F251 AromaticContact CD2-CE1 3.98Å; Y245-F251 HydrophobicContact CD2-CE1 3.98Å; Y245-F251 HydrophobicContact CE1-CB 4.1Å; Y245-F251 AromaticContact CE1-CD1 3.33Å; Y245-F251 HydrophobicContact CE1-CD1 3.33Å; Y245-F251 AromaticContact CE1-CE1 3.88Å; Y245-F251 HydrophobicContact CE1-CE1 3.88Å; Y245-F251 AromaticContact CE1-CG 3.83Å; Y245-F251 HydrophobicContact CE1-CG 3.83Å; Y245-F251 HydrophobicContact CE2-CD1 4.16Å; Y245-F251 AromaticContact CE2-CE1 3.86Å; Y245-F251 HydrophobicContact CE2-CE1 3.86Å; Y245-F251 HydrophobicContact CE2-CZ 4.23Å; Y245-F251 HydrophobicContact CG-CD1 4.18Å; Y245-F251 HydrophobicContact CG-CE1 4.05Å; Y245-F251 AromaticContact CZ-CD1 3.61Å; Y245-F251 AromaticContact CZ-CE1 3.79Å; Y245-F251 AromaticContact CZ-CG 3.95Å; F251-C259 HydrophobicContact CD1-CB 4.35Å; F251-C259 HydrophobicContact CD2-CB 3.94Å; F251-C259 HydrophobicContact CE1-CB 3.91Å; F251-C259 HydrophobicContact CE2-CB 3.44Å; F251-C259 VanDerWaalsContact CE2-CB 3.44Å; F251-C259 HydrophobicContact CG-CB 4.37Å; F251-C259 HydrophobicContact CZ-CB 3.43Å; F251-C259 VanDerWaalsContact CZ-CB 3.43Å; F251-C259 PolarHBondContact N-O 2.03Å; F251-C259 PolarHBondContact O-N 2.99Å; F251-C259 VanDerWaalsContact O-O 3.12Å; F251-V266 HydrophobicContact CE1-CG1 4.16Å; F251-V266 HydrophobicContact CZ-CG1 3.73Å
252	L	90.7	Very high	90.5	Very high	127 Å²	127	65.5 Å²	65.5	67%	0.665	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	127.1	173	-65.6	174	0	0	0	109.4	A258	L252-A258 HydrophobicContact CD2-CB 4.13Å
253	Y	87.3	Confident	90.7	Very high	74 Å²	74	66.2 Å²	66.2	29%	0.29	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-41.3	173.7	169.5	-88.7	0	0	0	111.3	I205 F240 R241 T257	I205-Y253 HydrophobicContact CD1-CD1 4.37Å; I205-Y253 HydrophobicContact CD1-CG 4.47Å; I205-Y253 HydrophobicContact CG2-CD2 3.83Å; I205-Y253 HydrophobicContact CG2-CE2 3.61Å; F240-Y253 AromaticContact CE1-CD2 3.92Å; F240-Y253 HydrophobicContact CE1-CD2 3.92Å; F240-Y253 HydrophobicContact CE1-CE2 4.48Å; F240-Y253 AromaticContact CZ-CD2 3.66Å; F240-Y253 HydrophobicContact CZ-CD2 3.66Å; F240-Y253 AromaticContact CZ-CE2 3.99Å; F240-Y253 HydrophobicContact CZ-CE2 3.99Å; R241-Y253 VanDerWaalsContact NH2-CD2 3.3Å; Y253-T257 HydrophobicContact CD1-CG2 4.32Å; Y253-T257 HydrophobicContact CG-CG2 4.47Å; Y253-T257 PolarHBondContact N-O 3.5Å
254	D	85.3	Confident	90.9	Very high	61 Å²	61	63.4 Å²	63.4	33%	0.326	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	-177	168.8	57	36.6	0	0	0	107.8	C256 T257	D254-C256 PolarHBondContact O-N 3.48Å; D254-C256 VanDerWaalsContact OD1-C 3.31Å; D254-C256 WeakPolarHBondContact OD1-CA 3.44Å; D254-C256 WeakPolarHBondContact OD1-CB 3.23Å; D254-C256 PolarHBondContact OD1-N 3.19Å; D254-T257 PolarHBondContact O-N 2.91Å; D254-T257 WeakPolarHBondContact OD1-CB 3.35Å; D254-T257 PolarHBondContact OD1-N 2.8Å; D254-T257 PolarHBondContact OD1-OG1 2.58Å; D254-T257 PolarHBondContact OD2-OG1 2.85Å
255	N	79.4	Confident	91.1	Very high	154 Å²	154	59.6 Å²	59.6	82%	0.824	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-14.8	-179.3	-70.2	-1.1	0	0	0	113.5	C285	N255-C285 PolarHBondContact O-SG 2.91Å
256	C	83.3	Confident	91.4	Very high	28 Å²	28	56.8 Å²	56.8	19%	0.189	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-5.2	-163.6	-50.7	0	0	0	0	113.2	D254 R270 K271 C285	D254-C256 PolarHBondContact O-N 3.48Å; D254-C256 VanDerWaalsContact OD1-C 3.31Å; D254-C256 WeakPolarHBondContact OD1-CA 3.44Å; D254-C256 WeakPolarHBondContact OD1-CB 3.23Å; D254-C256 PolarHBondContact OD1-N 3.19Å; C256-R270 WeakPolarHBondContact O-CA 3.35Å; C256-K271 PolarHBondContact O-N 2.84Å; C256-C285 WeakPolarHBondContact CA-SG 3.25Å; C256-C285 HydrophobicContact CB-CB 3.41Å; C256-C285 VanDerWaalsContact CB-CB 3.41Å; C256-C285 WeakPolarHBondContact CB-O 3.39Å; C256-C285 WeakPolarHBondContact CB-SG 3Å; C256-C285 PolarHBondContact N-SG 2.97Å; C256-C285 WeakPolarHBondContact SG-CA 3.45Å; C256-C285 WeakPolarHBondContact SG-CB 3.47Å; C256-C285 PolarHBondContact SG-O 3.25Å; C256-C285 CovalentContact SG-SG 2.04Å; C256-C285 PolarHBondContact SG-SG 2.63Å
257	T	89.6	Confident	91.7	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	111.3	-175	-47.5	0	0	0	0	109.2	I205 Y253 D254 C268 K269 R270	I205-T257 HydrophobicContact CD1-CG2 3.4Å; I205-T257 VanDerWaalsContact CD1-CG2 3.4Å; Y253-T257 HydrophobicContact CD1-CG2 4.32Å; Y253-T257 HydrophobicContact CG-CG2 4.47Å; Y253-T257 PolarHBondContact N-O 3.5Å; D254-T257 PolarHBondContact O-N 2.91Å; D254-T257 WeakPolarHBondContact OD1-CB 3.35Å; D254-T257 PolarHBondContact OD1-N 2.8Å; D254-T257 PolarHBondContact OD1-OG1 2.58Å; D254-T257 PolarHBondContact OD2-OG1 2.85Å; T257-C268 HydrophobicContact CG2-CB 3.91Å; T257-K269 WeakPolarHBondContact CA-O 2.93Å; T257-R270 HydrophobicContact CG2-CG 3.91Å
258	A	93.6	Very high	91.9	Very high	46 Å²	46	47.9 Å²	47.9	38%	0.38	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.8	171.4	0	0	0	0	0	109.5	L252 C268 K269	L252-A258 HydrophobicContact CD2-CB 4.13Å; A258-C268 CarbonylContact O-C 3.57Å; A258-C268 WeakPolarHBondContact O-CA 3.22Å; A258-K269 PolarHBondContact N-O 2.82Å; A258-K269 VanDerWaalsContact N-O 3.13Å; A258-K269 PolarHBondContact O-N 2.81Å
259	C	96.4	Very high	91.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.5	179.6	-60.5	0	0	0	0	110.8	S250 F251 V266 V267 C268	S250-C259 CarbonylContact C-O 3.59Å; S250-C259 VanDerWaalsContact CA-O 3.26Å; S250-C259 WeakPolarHBondContact CA-O 3.21Å; F251-C259 HydrophobicContact CD1-CB 4.35Å; F251-C259 HydrophobicContact CD2-CB 3.94Å; F251-C259 HydrophobicContact CE1-CB 3.91Å; F251-C259 HydrophobicContact CE2-CB 3.44Å; F251-C259 VanDerWaalsContact CE2-CB 3.44Å; F251-C259 HydrophobicContact CG-CB 4.37Å; F251-C259 HydrophobicContact CZ-CB 3.43Å; F251-C259 VanDerWaalsContact CZ-CB 3.43Å; F251-C259 PolarHBondContact N-O 2.03Å; F251-C259 PolarHBondContact O-N 2.99Å; F251-C259 VanDerWaalsContact O-O 3.12Å; C259-V266 HydrophobicContact CB-CG1 3.9Å; C259-V267 CarbonylContact C-O 3.54Å; C259-V267 VanDerWaalsContact CA-O 3.28Å; C259-V267 WeakPolarHBondContact CA-O 3.46Å; C259-C268 HydrophobicContact CB-CB 4.13Å; C259-C268 WeakPolarHBondContact CB-SG 3.41Å; C259-C268 WeakPolarHBondContact SG-CB 3.46Å; C259-C268 CovalentContact SG-SG 2.04Å; C259-C268 PolarHBondContact SG-SG 3.35Å
260	T	96.8	Very high	91.6	Very high	30 Å²	30	50.5 Å²	50.5	18%	0.184	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.7	177.1	-56.7	0	0	0	0	109.8	S249 S250 R262 V267	S249-T260 CarbonylContact O-C 3.57Å; S249-T260 WeakPolarHBondContact O-CA 3.46Å; S250-T260 VanDerWaalsContact OG-CG2 3.31Å; S250-T260 WeakPolarHBondContact OG-CG2 3.34Å; S250-T260 PolarHBondContact OG-OG1 3.4Å; T260-R262 HydrophobicContact CG2-CG 4.04Å; T260-V267 PolarHBondContact N-O 3.45Å; T260-V267 PolarHBondContact O-N 2.89Å
261	C	96	Very high	90.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124	169.8	175.9	0	0	0	0	110.1	C238 Y245 G248 S249	C238-C261 HydrophobicContact CB-CB 3.7Å; C238-C261 WeakPolarHBondContact CB-SG 3.42Å; C238-C261 PolarHBondContact N-SG 2.77Å; C238-C261 WeakPolarHBondContact SG-CA 3.11Å; C238-C261 WeakPolarHBondContact SG-CB 3.37Å; C238-C261 CovalentContact SG-SG 2.03Å; C238-C261 PolarHBondContact SG-SG 2.84Å; Y245-C261 PolarHBondContact O-SG 2.88Å; G248-C261 WeakPolarHBondContact CA-O 3.4Å; G248-C261 PolarHBondContact N-O 2.87Å; S249-C261 PolarHBondContact O-N 3.05Å
262	R	94.4	Very high	89.2	Confident	140 Å²	140	55.5 Å²	55.5	53%	0.528	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	116.4	175.6	-65.1	-171.8	176.5	-170.6	-3.2	109.6	N247 T260 S264 T265	N247-R262 VanDerWaalsContact OD1-CA 3.3Å; N247-R262 WeakPolarHBondContact OD1-CA 3.48Å; T260-R262 HydrophobicContact CG2-CG 4.04Å; R262-S264 VanDerWaalsContact C-N 3.35Å; R262-S264 PolarHBondContact O-N 3.2Å; R262-T265 PolarHBondContact N-O 2.99Å; R262-T265 WeakPolarHBondContact O-CA 3.5Å; R262-T265 WeakPolarHBondContact O-CB 3.46Å; R262-T265 PolarHBondContact O-N 2.84Å; R262-T265 VanDerWaalsContact O-O 3.05Å
263	D	89.7	Confident	87.4	Confident	100 Å²	100	54.5 Å²	54.5	54%	0.535	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	54.7	172.5	-55.8	-38	0	0	0	112.9	N247 T265	N247-D263 PolarHBondContact ND2-OD1 3.23Å; N247-D263 PolarHBondContact OD1-N 3.02Å; D263-T265 VanDerWaalsContact C-N 3.27Å; D263-T265 PolarHBondContact O-N 3.29Å
264	S	90	Very high	85.7	Confident	29 Å²	29	59.1 Å²	59.1	20%	0.203	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	17.1	-178.5	-35.4	0	0	0	0	116.2	K106 G236 S237 C238 R262	K106-S264 VanDerWaalsContact CE-O 3.23Å; K106-S264 WeakPolarHBondContact CE-O 3.5Å; K106-S264 PolarHBondContact NZ-O 2.79Å; G236-S264 WeakPolarHBondContact CA-OG 3.23Å; G236-S264 PolarHBondContact N-OG 2.87Å; G236-S264 PolarHBondContact O-N 3.28Å; S237-S264 WeakPolarHBondContact O-CA 3.47Å; C238-S264 VanDerWaalsContact SG-C 3.59Å; R262-S264 VanDerWaalsContact C-N 3.35Å; R262-S264 PolarHBondContact O-N 3.2Å
265	T	94.9	Very high	83.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.5	177.3	-56.6	0	0	0	0	111.1	C108 T109 G136 V138 C238 R262 D263	C108-T265 HydrophobicContact CB-CG2 3.68Å; T109-T265 PolarHBondContact N-OG1 2.98Å; T109-T265 WeakPolarHBondContact O-CB 3.34Å; T109-T265 WeakPolarHBondContact O-CG2 3.41Å; T109-T265 PolarHBondContact O-OG1 3.03Å; G136-T265 WeakPolarHBondContact O-CA 3.39Å; V138-T265 HydrophobicContact CG2-CG2 3.67Å; C238-T265 VanDerWaalsContact SG-C 3.54Å; C238-T265 PolarHBondContact SG-N 2.85Å; C238-T265 PolarHBondContact SG-O 2.82Å; C238-T265 VanDerWaalsContact SG-O 3.4Å; R262-T265 PolarHBondContact N-O 2.99Å; R262-T265 WeakPolarHBondContact O-CA 3.5Å; R262-T265 WeakPolarHBondContact O-CB 3.46Å; R262-T265 PolarHBondContact O-N 2.84Å; R262-T265 VanDerWaalsContact O-O 3.05Å; D263-T265 VanDerWaalsContact C-N 3.27Å; D263-T265 PolarHBondContact O-N 3.29Å
266	V	96.5	Very high	82.1	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118	175.3	-175.8	0	0	0	0	108.7	G136 V137 V138 C238 F240 F251 C259	G136-V266 PolarHBondContact O-N 2.78Å; V137-V266 CarbonylContact C-O 3.52Å; V137-V266 WeakPolarHBondContact CA-O 3.32Å; V137-V266 HydrophobicContact CG1-CB 4.31Å; V137-V266 HydrophobicContact CG1-CG1 4.46Å; V137-V266 HydrophobicContact CG2-CB 4.2Å; V138-V266 PolarHBondContact N-O 2.04Å; C238-V266 HydrophobicContact CB-CG2 3.64Å; F240-V266 HydrophobicContact CB-CG2 3.9Å; F240-V266 HydrophobicContact CD2-CB 4.35Å; F240-V266 HydrophobicContact CD2-CG1 4.11Å; F240-V266 HydrophobicContact CD2-CG2 4.05Å; F240-V266 HydrophobicContact CG-CG1 4.42Å; F240-V266 HydrophobicContact CG-CG2 4.26Å; F251-V266 HydrophobicContact CE1-CG1 4.16Å; F251-V266 HydrophobicContact CZ-CG1 3.73Å; C259-V266 HydrophobicContact CB-CG1 3.9Å
267	V	96.7	Very high	80.1	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.042	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	108.9	177.6	-178.3	0	0	0	0	109.1	Y110 V138 C259 T260	Y110-V267 HydrophobicContact CD2-CG1 4.2Å; Y110-V267 HydrophobicContact CD2-CG2 3.91Å; Y110-V267 HydrophobicContact CE2-CG1 3.71Å; Y110-V267 HydrophobicContact CE2-CG2 4.24Å; V138-V267 HydrophobicContact CB-CG2 4.43Å; C259-V267 CarbonylContact C-O 3.54Å; C259-V267 VanDerWaalsContact CA-O 3.28Å; C259-V267 WeakPolarHBondContact CA-O 3.46Å; T260-V267 PolarHBondContact N-O 3.45Å; T260-V267 PolarHBondContact O-N 2.89Å
268	C	95.6	Very high	78	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119	-180	-66.9	0	0	0	0	111.1	V138 E140 I205 T257 A258 C259	V138-C268 PolarHBondContact O-N 3.02Å; E140-C268 PolarHBondContact N-O 3.12Å; I205-C268 HydrophobicContact CD1-CB 3.42Å; I205-C268 VanDerWaalsContact CD1-CB 3.42Å; T257-C268 HydrophobicContact CG2-CB 3.91Å; A258-C268 CarbonylContact O-C 3.57Å; A258-C268 WeakPolarHBondContact O-CA 3.22Å; C259-C268 HydrophobicContact CB-CB 4.13Å; C259-C268 WeakPolarHBondContact CB-SG 3.41Å; C259-C268 WeakPolarHBondContact SG-CB 3.46Å; C259-C268 CovalentContact SG-SG 2.04Å; C259-C268 PolarHBondContact SG-SG 3.35Å
269	K	93.1	Very high	75.7	Confident	91 Å²	91	69 Å²	69	40%	0.396	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.1	178.7	-60.7	-170.3	173.3	-126.1	0	110.2	E140 T257 A258	E140-K269 HydrophobicContact CB-CG 4.27Å; E140-K269 WeakPolarHBondContact OE1-CD 3.48Å; E140-K269 VanDerWaalsContact OE1-CE 3.28Å; E140-K269 WeakPolarHBondContact OE1-CE 3Å; E140-K269 IonicContact OE1-NZ 2.98Å; E140-K269 PolarHBondContact OE1-NZ 3.49Å; E140-K269 IonicContact OE2-NZ 2.82Å; E140-K269 PolarHBondContact OE2-NZ 2.8Å; T257-K269 WeakPolarHBondContact CA-O 2.93Å; A258-K269 PolarHBondContact N-O 2.82Å; A258-K269 VanDerWaalsContact N-O 3.13Å; A258-K269 PolarHBondContact O-N 2.81Å
270	R	87.2	Confident	73.2	Confident	55 Å²	55	78.3 Å²	78.3	21%	0.208	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.4	174.6	-70.4	-174.5	166.5	149.3	0.5	110.3	E140 C203 I205 C256 T257	E140-R270 PolarHBondContact O-N 3.02Å; C203-R270 PolarHBondContact O-NH1 2.81Å; C203-R270 PolarHBondContact O-NH2 3.42Å; I205-R270 VanDerWaalsContact CG1-NH2 3.32Å; C256-R270 WeakPolarHBondContact O-CA 3.35Å; T257-R270 HydrophobicContact CG2-CG 3.91Å
271	K	72.9	Confident	70.9	Confident	164 Å²	164	80.4 Å²	80.4	71%	0.713	47%	0.469	S	S	*	.			trans	-90.1	109.6	172.4	-70.3	-174.7	177	-178.2	0	109.3	C256	C256-K271 PolarHBondContact O-N 2.84Å
272	C	64.5	Low	68.5	Low	58 Å²	58	89.1 Å²	89.1	39%	0.392	51%	0.51	S	S	.	.			trans	-114.8	135.1	161.8	-77.6	0	0	0	0	110.2	R144 C286	R144-C272 PolarHBondContact NH2-SG 3.15Å; C272-C286 WeakPolarHBondContact CA-SG 3.17Å; C272-C286 HydrophobicContact CB-CB 4.1Å; C272-C286 WeakPolarHBondContact CB-SG 3.41Å; C272-C286 WeakPolarHBondContact SG-CB 3.38Å; C272-C286 CovalentContact SG-SG 2.04Å; C272-C286 PolarHBondContact SG-SG 2.79Å
273	S	51.7	Low	66.3	Low	106 Å²	106	92.5 Å²	92.5	74%	0.741	53%	0.532	S	S	*	.			trans	-63.1	147.7	166.9	-49.9	0	0	0	0	109.8
274	H	52.4	Low	64.6	Low	170 Å²	170	90.3 Å²	90.3	79%	0.787	53%	0.533	S	S	*	.			trans	-49.2	145.6	-176.2	-110.3	45.7	0	0	0	113.5	G276	H274-G276 PolarHBondContact O-N 2.9Å
275	P	46.7	Very low	63.1	Low	91 Å²	91	91.2 Å²	91.2	59%	0.591	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	106.8	169.1	27.6	-29.7	0	0	0	108.7
276	G	42.8	Very low	61.4	Low	81 Å²	81	93.1 Å²	93.1	84%	0.835	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.9	-11.8	175.4	0	0	0	0	0	117.4	H274	H274-G276 PolarHBondContact O-N 2.9Å
277	G	39.8	Very low	59.4	Low	65 Å²	65	100.6 Å²	100.6	67%	0.67	59%	0.586	S	S	*	*			trans	-117.2	90.2	-179.8	0	0	0	0	0	112.7	D279	G277-D279 VanDerWaalsContact C-N 3.34Å; G277-D279 PolarHBondContact O-N 2.97Å
278	C	45.4	Very low	57.1	Low	104 Å²	104	107.6 Å²	107.6	70%	0.703	62%	0.619	S	S	*	*			trans	-88.3	74.7	167.1	-66	0	0	0	0	108.9
279	D	46.4	Very low	54.5	Low	159 Å²	159	111.9 Å²	111.9	85%	0.85	65%	0.647	S	S	*	*			trans	-89.5	115.4	172.3	-133.6	-8.7	0	0	0	108.8	G277 G281	G277-D279 VanDerWaalsContact C-N 3.34Å; G277-D279 PolarHBondContact O-N 2.97Å; D279-G281 PolarHBondContact O-N 3.5Å
280	Q	43.7	Very low	52	Low	195 Å²	195	114.3 Å²	114.3	91%	0.911	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	91.4	-175.6	-67.4	-178.5	-8.7	0	0	109.7
281	G	47.7	Very low	49.9	Very low	73 Å²	73	118 Å²	118	75%	0.753	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.7	-2.5	174.4	0	0	0	0	0	120.5	D279	D279-G281 PolarHBondContact O-N 3.5Å
282	Q	46.5	Very low	48.3	Very low	184 Å²	184	121.4 Å²	121.4	86%	0.86	70%	0.696	S	S	*	*	S	Bend	trans	-133.4	136.6	178.6	-73.6	-176.4	-21.6	0	0	110.6	G284	Q282-G284 PolarHBondContact O-N 2.83Å
283	E	47.9	Very low	47.2	Very low	211 Å²	211	123.4 Å²	123.4	99%	0.986	71%	0.706	S	S	*	*			trans	-53	87.5	174.9	-78.2	178.3	142.8	0	0	110
284	G	53.7	Low	47.2	Very low	53 Å²	53	121.7 Å²	121.7	55%	0.546	69%	0.692	S	S	.	*			trans	-82.3	127.9	-169.9	0	0	0	0	0	110.3	Q282 C286	Q282-G284 PolarHBondContact O-N 2.83Å; G284-C286 PolarHBondContact O-N 3.25Å
285	C	60.2	Low	47.3	Very low	48 Å²	48	119 Å²	119	32%	0.324	69%	0.689	S	S	.	*	S	Bend	trans	-70.1	-1.5	-174.3	-111.1	0	0	0	0	116.5	N255 C256	N255-C285 PolarHBondContact O-SG 2.91Å; C256-C285 WeakPolarHBondContact CA-SG 3.25Å; C256-C285 HydrophobicContact CB-CB 3.41Å; C256-C285 VanDerWaalsContact CB-CB 3.41Å; C256-C285 WeakPolarHBondContact CB-O 3.39Å; C256-C285 WeakPolarHBondContact CB-SG 3Å; C256-C285 PolarHBondContact N-SG 2.97Å; C256-C285 WeakPolarHBondContact SG-CA 3.45Å; C256-C285 WeakPolarHBondContact SG-CB 3.47Å; C256-C285 PolarHBondContact SG-O 3.25Å; C256-C285 CovalentContact SG-SG 2.04Å; C256-C285 PolarHBondContact SG-SG 2.63Å
286	C	58.1	Low	47.7	Very low	40 Å²	40	123.3 Å²	123.3	27%	0.27	70%	0.702	S	S	.	*	S	Bend	trans	-127.5	133.3	-180	-57.9	0	0	0	0	106.8	C272 G284 E288	C272-C286 WeakPolarHBondContact CA-SG 3.17Å; C272-C286 HydrophobicContact CB-CB 4.1Å; C272-C286 WeakPolarHBondContact CB-SG 3.41Å; C272-C286 WeakPolarHBondContact SG-CB 3.38Å; C272-C286 CovalentContact SG-SG 2.04Å; C272-C286 PolarHBondContact SG-SG 2.79Å; G284-C286 PolarHBondContact O-N 3.25Å; C286-E288 PolarHBondContact O-N 3.02Å
287	E	54.4	Low	48.3	Very low	157 Å²	157	125.1 Å²	125.1	73%	0.734	69%	0.692	S	S	*	*			trans	-45	132.1	177.8	-79.3	-175.5	158.5	0	0	109	C289	E287-C289 PolarHBondContact O-N 2.9Å
288	E	47.6	Very low	49.2	Very low	155 Å²	155	126.7 Å²	126.7	72%	0.724	68%	0.684	S	S	*	*			trans	-28.9	130.5	161.8	-81.5	170.6	132.9	0	0	109.3	C286 L290	C286-E288 PolarHBondContact O-N 3.02Å; E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.3Å
289	C	41.7	Very low	50.5	Low	89 Å²	89	127.4 Å²	127.4	60%	0.601	68%	0.676	S	S	*	*			trans	-48.5	107.7	158.9	-73.5	0	0	0	0	105.1	E287 L291	E287-C289 PolarHBondContact O-N 2.9Å; C289-L291 PolarHBondContact O-N 2.88Å
290	L	41.8	Very low	52.2	Low	143 Å²	143	122.7 Å²	122.7	75%	0.749	65%	0.653	S	S	*	*			trans	-58	97.6	-172.5	-83.6	168.1	0	0	0	107.7	E288	E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.3Å
291	L	42.1	Very low	53.9	Low	133 Å²	133	113.6 Å²	113.6	70%	0.696	61%	0.61	S	S	*	*			trans	-57.9	134.8	169.2	-76.4	156.7	0	0	0	106.1	C289 V293	C289-L291 PolarHBondContact O-N 2.88Å; L291-V293 PolarHBondContact O-N 2.03Å
292	R	39.1	Very low	55.6	Low	235 Å²	235	117.8 Å²	117.8	89%	0.887	61%	0.608	S	S	*	*			trans	-38.5	110.4	168.4	-72.4	167.9	170.3	-176.1	-7.3	110.2	P294	R292-P294 WeakPolarHBondContact O-CD 3.28Å
293	V	42.4	Very low	57.1	Low	99 Å²	99	112.9 Å²	112.9	60%	0.6	58%	0.584	S	S	*	*			trans	-89.9	113.7	160.7	-177.6	0	0	0	0	106.2	L291 D297 I298	L291-V293 PolarHBondContact O-N 2.03Å; V293-D297 HydrophobicContact CG1-CB 4.4Å; V293-I298 HydrophobicContact CG1-CG1 4.43Å
294	P	51.8	Low	58.5	Low	71 Å²	71	106.3 Å²	106.3	46%	0.461	57%	0.572	S	S	.	*			trans	-55.9	144	170.6	-20.1	32.2	0	0	0	109.6	R292 E296 D297	R292-P294 WeakPolarHBondContact O-CD 3.28Å; P294-E296 PolarHBondContact O-N 3.4Å; P294-D297 PolarHBondContact O-N 2.81Å
295	P	53.1	Low	59.8	Low	112 Å²	112	112.1 Å²	112.1	73%	0.727	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-55.2	-14.5	-178.2	-24.4	32.5	0	0	0	115.1
296	E	55.4	Low	60.6	Low	183 Å²	183	116.9 Å²	116.9	86%	0.855	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-81.1	-14	-170.6	-48.9	-166.6	-157.3	0	0	113.5	P294	P294-E296 PolarHBondContact O-N 3.4Å
297	D	56.4	Low	61.7	Low	118 Å²	118	120.1 Å²	120.1	63%	0.631	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-108.9	3.7	-178.8	-79.7	-36.6	0	0	0	114.7	V293 P294 K299	V293-D297 HydrophobicContact CG1-CB 4.4Å; P294-D297 PolarHBondContact O-N 2.81Å; D297-K299 PolarHBondContact O-N 2.82Å
298	I	58.4	Low	62.7	Low	98 Å²	98	113.8 Å²	113.8	50%	0.503	59%	0.59	S	S	.	*			trans	-74.1	99.7	-179.3	-55.2	175.9	0	0	0	110.2	V293 V300	V293-I298 HydrophobicContact CG1-CG1 4.43Å; I298-V300 HydrophobicContact CG2-CG1 4.07Å
299	K	72.2	Confident	64	Low	119 Å²	119	112 Å²	112	52%	0.517	58%	0.581	S	S	.	*			trans	-81.2	133.7	172.3	-61.6	-173.8	-177.3	178.8	0	110.3	D297 D310	D297-K299 PolarHBondContact O-N 2.82Å; K299-D310 PolarHBondContact O-N 3.24Å
300	V	81.1	Confident	65.6	Low	61 Å²	61	111.6 Å²	111.6	37%	0.37	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.5	152.8	-179.7	-61.6	0	0	0	0	111.1	I298 I307 F308	I298-V300 HydrophobicContact CG2-CG1 4.07Å; V300-I307 HydrophobicContact CB-CG2 3.82Å; V300-I307 HydrophobicContact CG1-CG2 4.24Å; V300-I307 HydrophobicContact CG2-CG2 4.05Å; V300-F308 CarbonylContact C-O 3.53Å; V300-F308 VanDerWaalsContact CA-O 3.32Å; V300-F308 WeakPolarHBondContact CA-O 3.32Å; V300-F308 WeakPolarHBondContact CB-O 3.45Å
301	C	81	Confident	67	Low	3 Å²	3	107.5 Å²	107.5	2%	0.02	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	143.2	172.7	-61.3	0	0	0	0	110.5	I307 F308 W314 C324 R328	C301-I307 CarbonylContact O-C 3.53Å; C301-I307 WeakPolarHBondContact O-CA 3.42Å; C301-F308 HydrophobicContact CB-CB 4.34Å; C301-F308 PolarHBondContact N-O 3.07Å; C301-F308 PolarHBondContact O-N 2.89Å; C301-W314 HydrophobicContact CB-CH2 4.32Å; C301-C324 HydrophobicContact CB-CB 3.67Å; C301-C324 WeakPolarHBondContact CB-SG 3.02Å; C301-C324 PolarHBondContact N-SG 2.81Å; C301-C324 WeakPolarHBondContact SG-CA 3.17Å; C301-C324 WeakPolarHBondContact SG-CB 3.35Å; C301-C324 CovalentContact SG-SG 2.03Å; C301-C324 PolarHBondContact SG-SG 3.35Å; C301-R328 PolarHBondContact SG-N 3.37Å; C301-R328 PolarHBondContact SG-O 2.88Å; C301-R328 VanDerWaalsContact SG-O 3.36Å
302	K	82.7	Confident	68.6	Low	162 Å²	162	105.1 Å²	105.1	70%	0.704	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.5	123.7	172.6	-67.7	-176.2	178.1	176.6	0	109.5	I307	K302-I307 HydrophobicContact CG-CG1 4.32Å
303	F	78	Confident	70.4	Confident	81 Å²	81	99 Å²	99	36%	0.355	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	107.4	174.7	-172.7	-88.9	0	0	0	110.1	N305 K306 F308 W314 T329	F303-N305 PolarHBondContact O-N 2.86Å; F303-K306 PolarHBondContact N-O 2.7Å; F303-K306 PolarHBondContact O-N 2.85Å; F303-F308 HydrophobicContact CB-CD2 4.06Å; F303-F308 HydrophobicContact CB-CE2 3.76Å; F303-W314 HydrophobicContact CB-CH2 4.46Å; F303-W314 HydrophobicContact CB-CZ2 3.53Å; F303-W314 AromaticContact CD1-CD1 3.82Å; F303-W314 HydrophobicContact CD1-CZ2 4.48Å; F303-W314 AromaticContact CD1-NE1 3.13Å; F303-W314 AromaticContact CD2-CE2 3.98Å; F303-W314 AromaticContact CD2-CZ2 3.74Å; F303-W314 HydrophobicContact CD2-CZ2 3.74Å; F303-W314 AromaticContact CD2-NE1 3.6Å; F303-W314 AromaticContact CE1-NE1 3.46Å; F303-W314 AromaticContact CE2-NE1 3.89Å; F303-W314 AromaticContact CG-CE2 3.66Å; F303-W314 AromaticContact CG-CZ2 3.69Å; F303-W314 HydrophobicContact CG-CZ2 3.69Å; F303-W314 AromaticContact CG-NE1 3.21Å; F303-W314 AromaticContact CZ-NE1 3.83Å; F303-T329 HydrophobicContact CD2-CG2 4.27Å
304	G	77.5	Confident	72.3	Confident	72 Å²	72	95.5 Å²	95.5	74%	0.742	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	-128.9	-167.1	0	0	0	0	0	111.1	K306	G304-K306 VanDerWaalsContact C-N 3.33Å
305	N	80.4	Confident	73.3	Confident	176 Å²	176	96.6 Å²	96.6	94%	0.941	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	7.6	177.5	-66.2	-5.8	0	0	0	113.5	F303	F303-N305 PolarHBondContact O-N 2.86Å
306	K	78.2	Confident	73.9	Confident	148 Å²	148	92.3 Å²	92.3	64%	0.643	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.7	-177.5	-65.7	-173.5	179	-173.9	0	110.8	F303 G304 F308	F303-K306 PolarHBondContact N-O 2.7Å; F303-K306 PolarHBondContact O-N 2.85Å; G304-K306 VanDerWaalsContact C-N 3.33Å; K306-F308 HydrophobicContact CB-CD2 4.42Å; K306-F308 HydrophobicContact CB-CE2 3.55Å; K306-F308 HydrophobicContact CB-CZ 3.81Å; K306-F308 HydrophobicContact CD-CZ 4.18Å
307	I	79.8	Confident	74.6	Confident	108 Å²	108	91.8 Å²	91.8	55%	0.554	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.1	175.2	-53.9	179.3	0	0	0	107.2	V300 C301 K302	V300-I307 HydrophobicContact CB-CG2 3.82Å; V300-I307 HydrophobicContact CG1-CG2 4.24Å; V300-I307 HydrophobicContact CG2-CG2 4.05Å; C301-I307 CarbonylContact O-C 3.53Å; C301-I307 WeakPolarHBondContact O-CA 3.42Å; K302-I307 HydrophobicContact CG-CG1 4.32Å
308	F	75.3	Confident	75.2	Confident	24 Å²	24	92.4 Å²	92.4	11%	0.105	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.7	-178.7	-65	-85.7	0	0	0	109.8	V300 C301 F303 K306 E312 W314 C324	V300-F308 CarbonylContact C-O 3.53Å; V300-F308 VanDerWaalsContact CA-O 3.32Å; V300-F308 WeakPolarHBondContact CA-O 3.32Å; V300-F308 WeakPolarHBondContact CB-O 3.45Å; C301-F308 HydrophobicContact CB-CB 4.34Å; C301-F308 PolarHBondContact N-O 3.07Å; C301-F308 PolarHBondContact O-N 2.89Å; F303-F308 HydrophobicContact CB-CD2 4.06Å; F303-F308 HydrophobicContact CB-CE2 3.76Å; K306-F308 HydrophobicContact CB-CD2 4.42Å; K306-F308 HydrophobicContact CB-CE2 3.55Å; K306-F308 HydrophobicContact CB-CZ 3.81Å; K306-F308 HydrophobicContact CD-CZ 4.18Å; F308-E312 WeakPolarHBondContact CA-OE2 3.3Å; F308-E312 HydrophobicContact CB-CB 4.2Å; F308-E312 HydrophobicContact CD1-CB 4.22Å; F308-W314 HydrophobicContact CB-CE3 4.1Å; F308-W314 HydrophobicContact CB-CH2 4.37Å; F308-W314 HydrophobicContact CB-CZ3 3.72Å; F308-W314 HydrophobicContact CD1-CB 4.4Å; F308-W314 AromaticContact CD1-CD2 3.92Å; F308-W314 HydrophobicContact CD1-CD2 3.92Å; F308-W314 AromaticContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CG 4.38Å; F308-W314 AromaticContact CD1-CZ3 3.95Å; F308-W314 HydrophobicContact CD1-CZ3 3.95Å; F308-W314 HydrophobicContact CD2-CD2 4Å; F308-W314 AromaticContact CD2-CE3 3.85Å; F308-W314 HydrophobicContact CD2-CE3 3.85Å; F308-W314 HydrophobicContact CD2-CH2 4.06Å; F308-W314 HydrophobicContact CD2-CZ2 4.19Å; F308-W314 AromaticContact CD2-CZ3 3.88Å; F308-W314 HydrophobicContact CD2-CZ3 3.88Å; F308-W314 HydrophobicContact CE1-CB 3.57Å; F308-W314 AromaticContact CE1-CD2 3.71Å; F308-W314 HydrophobicContact CE1-CD2 3.71Å; F308-W314 AromaticContact CE1-CE3 3.67Å; F308-W314 HydrophobicContact CE1-CE3 3.67Å; F308-W314 AromaticContact CE1-CG 3.7Å; F308-W314 HydrophobicContact CE1-CG 3.7Å; F308-W314 AromaticContact CE2-CD2 3.82Å; F308-W314 HydrophobicContact CE2-CD2 3.82Å; F308-W314 AromaticContact CE2-CE2 3.96Å; F308-W314 HydrophobicContact CE2-CE3 4.12Å; F308-W314 HydrophobicContact CE2-CG 4.13Å; F308-W314 HydrophobicContact CE2-CZ2 4.39Å; F308-W314 HydrophobicContact CG-CD2 4.05Å; F308-W314 AromaticContact CG-CE3 3.47Å; F308-W314 HydrophobicContact CG-CE3 3.47Å; F308-W314 VanDerWaalsContact CG-CE3 3.47Å; F308-W314 HydrophobicContact CG-CH2 4.17Å; F308-W314 AromaticContact CG-CZ3 3.55Å; F308-W314 HydrophobicContact CG-CZ3 3.55Å; F308-W314 HydrophobicContact CZ-CB 3.78Å; F308-W314 AromaticContact CZ-CD2 3.64Å; F308-W314 HydrophobicContact CZ-CD2 3.64Å; F308-W314 HydrophobicContact CZ-CE3 4.02Å; F308-W314 AromaticContact CZ-CG 3.54Å; F308-W314 HydrophobicContact CZ-CG 3.54Å; F308-C324 HydrophobicContact CB-CB 4.27Å
309	Q	76.4	Confident	76	Confident	117 Å²	117	90 Å²	90	55%	0.547	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	157.9	174.2	-64.6	-167.4	-17.6	0	0	111.1	G311 E312 C324	Q309-G311 PolarHBondContact O-N 2.98Å; Q309-E312 HydrophobicContact CB-CG 4.06Å; Q309-E312 PolarHBondContact N-OE2 2.92Å; Q309-E312 WeakPolarHBondContact O-CB 3.46Å; Q309-E312 PolarHBondContact O-N 3.04Å; Q309-C324 VanDerWaalsContact O-CB 3.23Å; Q309-C324 WeakPolarHBondContact O-CB 3.31Å
310	D	74.1	Confident	76.4	Confident	81 Å²	81	85.6 Å²	85.6	43%	0.433	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	128.7	173.2	-147.2	58.5	0	0	0	111	K299 K326 G327	K299-D310 PolarHBondContact O-N 3.24Å; D310-K326 WeakPolarHBondContact OD1-CA 3.5Å; D310-K326 PolarHBondContact OD1-N 3.25Å; D310-G327 PolarHBondContact OD1-N 3.35Å
311	G	72.6	Confident	76.4	Confident	57 Å²	57	85 Å²	85	59%	0.588	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-16.5	-174	0	0	0	0	0	115.6	Q309 C324	Q309-G311 PolarHBondContact O-N 2.98Å; G311-C324 WeakPolarHBondContact CA-O 3.03Å; G311-C324 PolarHBondContact N-O 2.83Å
312	E	74.1	Confident	76.6	Confident	83 Å²	83	85 Å²	85	39%	0.388	47%	0.465	S	S	.	.			trans	-70.3	143.5	179.7	-71.9	-169.9	151.7	0	0	112.6	F308 Q309 A323 C324	F308-E312 WeakPolarHBondContact CA-OE2 3.3Å; F308-E312 HydrophobicContact CB-CB 4.2Å; F308-E312 HydrophobicContact CD1-CB 4.22Å; Q309-E312 HydrophobicContact CB-CG 4.06Å; Q309-E312 PolarHBondContact N-OE2 2.92Å; Q309-E312 WeakPolarHBondContact O-CB 3.46Å; Q309-E312 PolarHBondContact O-N 3.04Å; E312-A323 CarbonylContact O-C 3.49Å; E312-A323 VanDerWaalsContact O-CA 3.26Å; E312-A323 WeakPolarHBondContact O-CA 3.34Å; E312-C324 PolarHBondContact O-N 3.45Å
313	M	78.6	Confident	76.8	Confident	107 Å²	107	78.2 Å²	78.2	53%	0.527	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.2	179.4	-58.7	179.8	69.5	0	0	112.1	I321 C322 A323	M313-I321 HydrophobicContact CE-CD1 3.58Å; M313-I321 HydrophobicContact CE-CG1 3.82Å; M313-C322 CarbonylContact C-O 3.6Å; M313-C322 WeakPolarHBondContact CA-O 3.42Å; M313-A323 HydrophobicContact CG-CB 3.87Å
314	W	82	Confident	77	Confident	24 Å²	24	74.3 Å²	74.3	9%	0.091	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.1	176	66.4	98.8	0	0	0	112.7	C301 F303 F308 I321 C322 C324 T329	C301-W314 HydrophobicContact CB-CH2 4.32Å; F303-W314 HydrophobicContact CB-CH2 4.46Å; F303-W314 HydrophobicContact CB-CZ2 3.53Å; F303-W314 AromaticContact CD1-CD1 3.82Å; F303-W314 HydrophobicContact CD1-CZ2 4.48Å; F303-W314 AromaticContact CD1-NE1 3.13Å; F303-W314 AromaticContact CD2-CE2 3.98Å; F303-W314 AromaticContact CD2-CZ2 3.74Å; F303-W314 HydrophobicContact CD2-CZ2 3.74Å; F303-W314 AromaticContact CD2-NE1 3.6Å; F303-W314 AromaticContact CE1-NE1 3.46Å; F303-W314 AromaticContact CE2-NE1 3.89Å; F303-W314 AromaticContact CG-CE2 3.66Å; F303-W314 AromaticContact CG-CZ2 3.69Å; F303-W314 HydrophobicContact CG-CZ2 3.69Å; F303-W314 AromaticContact CG-NE1 3.21Å; F303-W314 AromaticContact CZ-NE1 3.83Å; F308-W314 HydrophobicContact CB-CE3 4.1Å; F308-W314 HydrophobicContact CB-CH2 4.37Å; F308-W314 HydrophobicContact CB-CZ3 3.72Å; F308-W314 HydrophobicContact CD1-CB 4.4Å; F308-W314 AromaticContact CD1-CD2 3.92Å; F308-W314 HydrophobicContact CD1-CD2 3.92Å; F308-W314 AromaticContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CE3 3.39Å; F308-W314 HydrophobicContact CD1-CG 4.38Å; F308-W314 AromaticContact CD1-CZ3 3.95Å; F308-W314 HydrophobicContact CD1-CZ3 3.95Å; F308-W314 HydrophobicContact CD2-CD2 4Å; F308-W314 AromaticContact CD2-CE3 3.85Å; F308-W314 HydrophobicContact CD2-CE3 3.85Å; F308-W314 HydrophobicContact CD2-CH2 4.06Å; F308-W314 HydrophobicContact CD2-CZ2 4.19Å; F308-W314 AromaticContact CD2-CZ3 3.88Å; F308-W314 HydrophobicContact CD2-CZ3 3.88Å; F308-W314 HydrophobicContact CE1-CB 3.57Å; F308-W314 AromaticContact CE1-CD2 3.71Å; F308-W314 HydrophobicContact CE1-CD2 3.71Å; F308-W314 AromaticContact CE1-CE3 3.67Å; F308-W314 HydrophobicContact CE1-CE3 3.67Å; F308-W314 AromaticContact CE1-CG 3.7Å; F308-W314 HydrophobicContact CE1-CG 3.7Å; F308-W314 AromaticContact CE2-CD2 3.82Å; F308-W314 HydrophobicContact CE2-CD2 3.82Å; F308-W314 AromaticContact CE2-CE2 3.96Å; F308-W314 HydrophobicContact CE2-CE3 4.12Å; F308-W314 HydrophobicContact CE2-CG 4.13Å; F308-W314 HydrophobicContact CE2-CZ2 4.39Å; F308-W314 HydrophobicContact CG-CD2 4.05Å; F308-W314 AromaticContact CG-CE3 3.47Å; F308-W314 HydrophobicContact CG-CE3 3.47Å; F308-W314 VanDerWaalsContact CG-CE3 3.47Å; F308-W314 HydrophobicContact CG-CH2 4.17Å; F308-W314 AromaticContact CG-CZ3 3.55Å; F308-W314 HydrophobicContact CG-CZ3 3.55Å; F308-W314 HydrophobicContact CZ-CB 3.78Å; F308-W314 AromaticContact CZ-CD2 3.64Å; F308-W314 HydrophobicContact CZ-CD2 3.64Å; F308-W314 HydrophobicContact CZ-CE3 4.02Å; F308-W314 AromaticContact CZ-CG 3.54Å; F308-W314 HydrophobicContact CZ-CG 3.54Å; W314-I321 WeakPolarHBondContact O-CA 3.36Å; W314-C322 HydrophobicContact CD2-CB 3.79Å; W314-C322 HydrophobicContact CE3-CB 4.3Å; W314-C322 HydrophobicContact CG-CB 4.28Å; W314-C322 HydrophobicContact CH2-CB 4.09Å; W314-C322 HydrophobicContact CZ2-CB 3.54Å; W314-C322 HydrophobicContact CZ3-CB 4.44Å; W314-C322 PolarHBondContact N-O 3.34Å; W314-C322 PolarHBondContact O-N 2.84Å; W314-C324 HydrophobicContact CZ3-CB 4.16Å; W314-T329 HydrophobicContact CH2-CG2 3.7Å; W314-T329 HydrophobicContact CZ2-CG2 3.43Å; W314-T329 VanDerWaalsContact CZ2-CG2 3.43Å
315	S	72.4	Confident	77.4	Confident	94 Å²	94	73.5 Å²	73.5	66%	0.657	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	131	172.3	58.3	0	0	0	0	111.1	T320	S315-T320 CarbonylContact C-O 3.52Å; S315-T320 WeakPolarHBondContact CA-O 3.26Å
316	S	66.5	Low	77.4	Confident	22 Å²	22	72.7 Å²	72.7	15%	0.154	39%	0.39	C	S	.	.			trans	-87.6	169.6	172.4	90.5	0	0	0	0	112.3	N318 T320	S316-N318 PolarHBondContact O-N 2.96Å; S316-N318 PolarHBondContact OG-N 2.99Å; S316-T320 VanDerWaalsContact CB-OG1 3.32Å; S316-T320 WeakPolarHBondContact CB-OG1 3.27Å; S316-T320 PolarHBondContact N-O 2.9Å; S316-T320 PolarHBondContact OG-OG1 2.82Å
317	I	68.2	Low	77.5	Confident	173 Å²	173	67 Å²	67	89%	0.887	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.8	178.7	-60.7	167.6	0	0	0	111.9	C319	I317-C319 PolarHBondContact O-N 3.31Å
318	N	69	Low	77.8	Confident	130 Å²	130	71.1 Å²	71.1	70%	0.695	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	33.5	-173.5	-66.8	-8.7	0	0	0	113.3	S316 T320	S316-N318 PolarHBondContact O-N 2.96Å; S316-N318 PolarHBondContact OG-N 2.99Å; N318-T320 PolarHBondContact O-N 2.97Å; N318-T320 VanDerWaalsContact O-N 3.15Å
319	C	75.3	Confident	78.4	Confident	48 Å²	48	72.7 Å²	72.7	32%	0.324	39%	0.394	S	S	.	.	S	Bend	trans	58.7	25.3	-178.6	-89.3	0	0	0	0	115.1	I317 K334 C353	I317-C319 PolarHBondContact O-N 3.31Å; C319-K334 VanDerWaalsContact O-CB 3.26Å; C319-K334 WeakPolarHBondContact O-CB 3.44Å; C319-K334 PolarHBondContact O-N 2.87Å; C319-C353 WeakPolarHBondContact CA-SG 3.1Å; C319-C353 HydrophobicContact CB-CB 4.32Å; C319-C353 WeakPolarHBondContact CB-SG 3.3Å; C319-C353 WeakPolarHBondContact SG-CA 3.4Å; C319-C353 WeakPolarHBondContact SG-CB 3.36Å; C319-C353 CovalentContact SG-SG 2.04Å; C319-C353 PolarHBondContact SG-SG 3.36Å
320	T	81.7	Confident	78.9	Confident	26 Å²	26	72.3 Å²	72.3	16%	0.16	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	144.1	172.1	67.6	0	0	0	0	110.7	S315 S316 N318 R332	S315-T320 CarbonylContact C-O 3.52Å; S315-T320 WeakPolarHBondContact CA-O 3.26Å; S316-T320 VanDerWaalsContact CB-OG1 3.32Å; S316-T320 WeakPolarHBondContact CB-OG1 3.27Å; S316-T320 PolarHBondContact N-O 2.9Å; S316-T320 PolarHBondContact OG-OG1 2.82Å; N318-T320 PolarHBondContact O-N 2.97Å; N318-T320 VanDerWaalsContact O-N 3.15Å; T320-R332 CarbonylContact C-O 3.44Å; T320-R332 VanDerWaalsContact CA-O 3.22Å; T320-R332 WeakPolarHBondContact CA-O 3.36Å; T320-R332 WeakPolarHBondContact CB-O 3.13Å
321	I	80.6	Confident	79.6	Confident	50 Å²	50	71.7 Å²	71.7	26%	0.256	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.6	166.6	-169.1	167	0	0	0	107.6	M313 W314 C331 R332	M313-I321 HydrophobicContact CE-CD1 3.58Å; M313-I321 HydrophobicContact CE-CG1 3.82Å; W314-I321 WeakPolarHBondContact O-CA 3.36Å; I321-C331 WeakPolarHBondContact O-CA 3.02Å; I321-R332 HydrophobicContact CG2-CG 3.52Å; I321-R332 PolarHBondContact N-O 2.76Å; I321-R332 PolarHBondContact O-N 3.39Å
322	C	85	Confident	80.3	Confident	1 Å²	1	77 Å²	77	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	149.1	-177.7	-59.3	0	0	0	0	110	M313 W314 T329 E330 C331	M313-C322 CarbonylContact C-O 3.6Å; M313-C322 WeakPolarHBondContact CA-O 3.42Å; W314-C322 HydrophobicContact CD2-CB 3.79Å; W314-C322 HydrophobicContact CE3-CB 4.3Å; W314-C322 HydrophobicContact CG-CB 4.28Å; W314-C322 HydrophobicContact CH2-CB 4.09Å; W314-C322 HydrophobicContact CZ2-CB 3.54Å; W314-C322 HydrophobicContact CZ3-CB 4.44Å; W314-C322 PolarHBondContact N-O 3.34Å; W314-C322 PolarHBondContact O-N 2.84Å; C322-T329 HydrophobicContact CB-CG2 4.16Å; C322-E330 CarbonylContact C-O 3.55Å; C322-E330 VanDerWaalsContact CA-O 3.23Å; C322-E330 WeakPolarHBondContact CA-O 3.44Å; C322-C331 HydrophobicContact CB-CB 4.08Å; C322-C331 WeakPolarHBondContact CB-SG 2.98Å; C322-C331 WeakPolarHBondContact SG-CB 3.37Å; C322-C331 CovalentContact SG-SG 2.04Å; C322-C331 PolarHBondContact SG-SG 3.18Å
323	A	86.5	Confident	80.7	Confident	20 Å²	20	79.1 Å²	79.1	17%	0.165	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	147.8	174.6	0	0	0	0	0	109.9	E312 M313 V325 T329 E330	E312-A323 CarbonylContact O-C 3.49Å; E312-A323 VanDerWaalsContact O-CA 3.26Å; E312-A323 WeakPolarHBondContact O-CA 3.34Å; M313-A323 HydrophobicContact CG-CB 3.87Å; A323-V325 HydrophobicContact CB-CG2 4.18Å; A323-T329 WeakPolarHBondContact O-CA 3.37Å; A323-E330 PolarHBondContact N-O 2.04Å; A323-E330 PolarHBondContact O-N 3.47Å
324	C	83.3	Confident	80.6	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.6	168.4	-171.1	0	0	0	0	109.4	C301 F308 Q309 G311 E312 W314	C301-C324 HydrophobicContact CB-CB 3.67Å; C301-C324 WeakPolarHBondContact CB-SG 3.02Å; C301-C324 PolarHBondContact N-SG 2.81Å; C301-C324 WeakPolarHBondContact SG-CA 3.17Å; C301-C324 WeakPolarHBondContact SG-CB 3.35Å; C301-C324 CovalentContact SG-SG 2.03Å; C301-C324 PolarHBondContact SG-SG 3.35Å; F308-C324 HydrophobicContact CB-CB 4.27Å; Q309-C324 VanDerWaalsContact O-CB 3.23Å; Q309-C324 WeakPolarHBondContact O-CB 3.31Å; G311-C324 WeakPolarHBondContact CA-O 3.03Å; G311-C324 PolarHBondContact N-O 2.83Å; E312-C324 PolarHBondContact O-N 3.45Å; W314-C324 HydrophobicContact CZ3-CB 4.16Å
325	V	85.8	Confident	80.5	Confident	54 Å²	54	86.7 Å²	86.7	33%	0.327	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	110.5	-177.3	-174.7	0	0	0	0	108.9	A323 G327 R328 E330	A323-V325 HydrophobicContact CB-CG2 4.18Å; V325-G327 PolarHBondContact O-N 2Å; V325-R328 PolarHBondContact N-O 3.02Å; V325-R328 WeakPolarHBondContact O-CB 3.4Å; V325-R328 PolarHBondContact O-N 2.99Å; V325-E330 HydrophobicContact CB-CG 4.2Å; V325-E330 HydrophobicContact CG2-CB 4.26Å; V325-E330 HydrophobicContact CG2-CG 4.14Å
326	K	80.8	Confident	80.8	Confident	159 Å²	159	84.4 Å²	84.4	69%	0.691	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	42	-175	-58.8	-179.9	179.5	179.8	0	113	D310 R328	D310-K326 WeakPolarHBondContact OD1-CA 3.5Å; D310-K326 PolarHBondContact OD1-N 3.25Å; K326-R328 VanDerWaalsContact C-N 3.31Å; K326-R328 PolarHBondContact O-N 3.34Å
327	G	79.5	Confident	81.4	Confident	29 Å²	29	90.3 Å²	90.3	30%	0.299	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	7.4	-176.6	0	0	0	0	0	115.7	D310 V325	D310-G327 PolarHBondContact OD1-N 3.35Å; V325-G327 PolarHBondContact O-N 2Å
328	R	85.9	Confident	82	Confident	194 Å²	194	87.8 Å²	87.8	73%	0.732	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.6	172.3	-67.5	-175.3	177.3	-171.8	-0.4	111.3	C301 V325 K326	C301-R328 PolarHBondContact SG-N 3.37Å; C301-R328 PolarHBondContact SG-O 2.88Å; C301-R328 VanDerWaalsContact SG-O 3.36Å; V325-R328 PolarHBondContact N-O 3.02Å; V325-R328 WeakPolarHBondContact O-CB 3.4Å; V325-R328 PolarHBondContact O-N 2.99Å; K326-R328 VanDerWaalsContact C-N 3.31Å; K326-R328 PolarHBondContact O-N 3.34Å
329	T	87.2	Confident	82.5	Confident	57 Å²	57	84.3 Å²	84.3	35%	0.35	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.9	173.1	-63.5	0	0	0	0	110.2	F303 W314 C322 A323 C331	F303-T329 HydrophobicContact CD2-CG2 4.27Å; W314-T329 HydrophobicContact CH2-CG2 3.7Å; W314-T329 HydrophobicContact CZ2-CG2 3.43Å; W314-T329 VanDerWaalsContact CZ2-CG2 3.43Å; C322-T329 HydrophobicContact CB-CG2 4.16Å; A323-T329 WeakPolarHBondContact O-CA 3.37Å; T329-C331 VanDerWaalsContact CG2-SG 3.6Å
330	E	88.7	Confident	82.7	Confident	110 Å²	110	88 Å²	88	51%	0.514	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117.3	174.6	-66.3	-171.1	-174.4	0	0	110.1	C322 A323 V325	C322-E330 CarbonylContact C-O 3.55Å; C322-E330 VanDerWaalsContact CA-O 3.23Å; C322-E330 WeakPolarHBondContact CA-O 3.44Å; A323-E330 PolarHBondContact N-O 2.04Å; A323-E330 PolarHBondContact O-N 3.47Å; V325-E330 HydrophobicContact CB-CG 4.2Å; V325-E330 HydrophobicContact CG2-CB 4.26Å; V325-E330 HydrophobicContact CG2-CG 4.14Å
331	C	87.5	Confident	82.8	Confident	68 Å²	68	91.2 Å²	91.2	46%	0.459	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.8	-177.5	-57.9	0	0	0	0	112.1	I321 C322 T329	I321-C331 WeakPolarHBondContact O-CA 3.02Å; C322-C331 HydrophobicContact CB-CB 4.08Å; C322-C331 WeakPolarHBondContact CB-SG 2.98Å; C322-C331 WeakPolarHBondContact SG-CB 3.37Å; C322-C331 CovalentContact SG-SG 2.04Å; C322-C331 PolarHBondContact SG-SG 3.18Å; T329-C331 VanDerWaalsContact CG2-SG 3.6Å
332	R	86.9	Confident	82.9	Confident	167 Å²	167	90.3 Å²	90.3	63%	0.63	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	154.9	171.3	64.2	-176.3	179	-179.6	-1.4	111.2	T320 I321	T320-R332 CarbonylContact C-O 3.44Å; T320-R332 VanDerWaalsContact CA-O 3.22Å; T320-R332 WeakPolarHBondContact CA-O 3.36Å; T320-R332 WeakPolarHBondContact CB-O 3.13Å; I321-R332 HydrophobicContact CG2-CG 3.52Å; I321-R332 PolarHBondContact N-O 2.76Å; I321-R332 PolarHBondContact O-N 3.39Å
333	N	82.5	Confident	82.9	Confident	129 Å²	129	94.1 Å²	94.1	69%	0.69	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	135.1	174.3	-70	-25.4	0	0	0	110.4	Q335	N333-Q335 PolarHBondContact O-N 2.81Å
334	K	77.9	Confident	82.4	Confident	102 Å²	102	102.9 Å²	102.9	44%	0.443	54%	0.541	S	S	.	.			trans	-69.9	116.9	177.6	-172.9	176.9	-176.2	179.8	0	109.4	C319 C336	C319-K334 VanDerWaalsContact O-CB 3.26Å; C319-K334 WeakPolarHBondContact O-CB 3.44Å; C319-K334 PolarHBondContact O-N 2.87Å; K334-C336 PolarHBondContact O-N 3Å
335	Q	79.6	Confident	81.9	Confident	188 Å²	188	105 Å²	105	88%	0.879	56%	0.563	S	S	*	*			trans	-78.9	115	171.4	-68.4	178.3	-5.9	0	0	109.1	N333	N333-Q335 PolarHBondContact O-N 2.81Å
336	C	78.4	Confident	81.9	Confident	45 Å²	45	106.9 Å²	106.9	30%	0.304	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-90.4	139.2	177.9	-60.9	0	0	0	0	110.6	K334 P338 C353 C354	K334-C336 PolarHBondContact O-N 3Å; C336-P338 WeakPolarHBondContact O-CD 3.09Å; C336-C353 PolarHBondContact SG-O 2.89Å; C336-C353 VanDerWaalsContact SG-O 3.38Å; C336-C354 HydrophobicContact CB-CB 3.68Å; C336-C354 WeakPolarHBondContact CB-SG 3.48Å; C336-C354 WeakPolarHBondContact SG-CA 3.2Å; C336-C354 WeakPolarHBondContact SG-CB 3.21Å; C336-C354 CovalentContact SG-SG 2.04Å; C336-C354 PolarHBondContact SG-SG 3.47Å
337	I	79.4	Confident	81.8	Confident	146 Å²	146	102.8 Å²	102.8	75%	0.749	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-69.1	123	171.4	-57.4	172.9	0	0	0	107.8	I339	I337-I339 PolarHBondContact O-N 2.78Å
338	P	79.5	Confident	81.8	Confident	121 Å²	121	104.1 Å²	104.1	79%	0.786	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-61.6	130.5	175.1	-21	32.7	0	0	0	110.8	C336	C336-P338 WeakPolarHBondContact O-CD 3.09Å
339	I	80	Confident	81.3	Confident	57 Å²	57	97.2 Å²	97.2	29%	0.292	53%	0.529	S	S	.	.			trans	-104.8	113.8	173	-58.2	179.5	0	0	0	107.8	I337 S341 L348 P355	I337-I339 PolarHBondContact O-N 2.78Å; I339-S341 WeakPolarHBondContact CG2-O 3.3Å; I339-L348 HydrophobicContact CB-CD1 3.79Å; I339-L348 HydrophobicContact CD1-CD1 4.06Å; I339-L348 HydrophobicContact CG1-CD1 4.49Å; I339-L348 HydrophobicContact CG2-CD1 3.7Å; I339-P355 WeakPolarHBondContact CD1-O 3.34Å
340	S	80	Confident	80.7	Confident	126 Å²	126	104 Å²	104	88%	0.881	55%	0.548	S	S	*	.			trans	-77	-41.1	179.1	52.8	0	0	0	0	112.6
341	S	83.7	Confident	79.9	Confident	92 Å²	92	107.5 Å²	107.5	64%	0.643	56%	0.562	S	S	*	*			trans	-151.9	160.2	177.5	64.4	0	0	0	0	111.3	I339	I339-S341 WeakPolarHBondContact CG2-O 3.3Å
342	C	82.8	Confident	79	Confident	31 Å²	31	107.5 Å²	107.5	21%	0.209	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-102.4	150	175.5	-72	0	0	0	0	111.4	K346 I347 L348 C357	C342-K346 HydrophobicContact CB-CB 4.07Å; C342-I347 VanDerWaalsContact SG-C 3.55Å; C342-L348 VanDerWaalsContact SG-CA 3.54Å; C342-L348 PolarHBondContact SG-N 3.19Å; C342-L348 VanDerWaalsContact SG-N 3.41Å; C342-C357 WeakPolarHBondContact CA-SG 3.21Å; C342-C357 HydrophobicContact CB-CB 3.75Å; C342-C357 WeakPolarHBondContact CB-SG 3.25Å; C342-C357 WeakPolarHBondContact SG-CA 3.23Å; C342-C357 WeakPolarHBondContact SG-CB 3.22Å; C342-C357 CovalentContact SG-SG 2.04Å; C342-C357 PolarHBondContact SG-SG 2.88Å
343	P	84.2	Confident	78.5	Confident	81 Å²	81	102 Å²	102	53%	0.526	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-55.1	155.9	172.2	-24.2	33.5	0	0	0	112.4	G345 K346	P343-G345 PolarHBondContact O-N 2.85Å; P343-K346 WeakPolarHBondContact O-CB 3.22Å; P343-K346 PolarHBondContact O-N 3.33Å
344	Q	76.1	Confident	78.2	Confident	205 Å²	205	97.1 Å²	97.1	96%	0.958	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	135.2	178.6	-167.6	178.9	4.2	0	0	111.5	K346	Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 2.74Å
345	G	74.4	Confident	78.3	Confident	44 Å²	44	94 Å²	94	45%	0.454	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-2.2	-175.6	0	0	0	0	0	115.1	P343 K360	P343-G345 PolarHBondContact O-N 2.85Å; G345-K360 PolarHBondContact O-N 2.91Å
346	K	84	Confident	78.5	Confident	93 Å²	93	89.4 Å²	89.4	40%	0.404	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.5	173.3	-61.1	-170.7	177.2	-173.3	0	111.8	C342 P343 Q344 C357 T358	C342-K346 HydrophobicContact CB-CB 4.07Å; P343-K346 WeakPolarHBondContact O-CB 3.22Å; P343-K346 PolarHBondContact O-N 3.33Å; Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 2.74Å; K346-C357 HydrophobicContact CB-CB 4.16Å; K346-C357 HydrophobicContact CD-CB 4.2Å; K346-T358 CarbonylContact C-O 3.56Å; K346-T358 WeakPolarHBondContact CA-O 3.36Å; K346-T358 VanDerWaalsContact CB-O 3.28Å; K346-T358 WeakPolarHBondContact CB-O 3.33Å
347	I	78.9	Confident	78.8	Confident	74 Å²	74	88.9 Å²	88.9	38%	0.379	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.5	176.8	51.4	167.6	0	0	0	110.5	C342 N349 C357 T358 K360	C342-I347 VanDerWaalsContact SG-C 3.55Å; I347-N349 PolarHBondContact O-N 2.76Å; I347-C357 WeakPolarHBondContact O-CA 3.44Å; I347-T358 PolarHBondContact N-O 2.81Å; I347-T358 PolarHBondContact O-N 2.93Å; I347-K360 HydrophobicContact CG1-CG 4.42Å; I347-K360 HydrophobicContact CG2-CD 4.2Å; I347-K360 HydrophobicContact CG2-CG 3.54Å
348	L	79.8	Confident	79	Confident	57 Å²	57	83.8 Å²	83.8	30%	0.298	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	105.5	179	-172	68.2	0	0	0	109.8	I339 C342 R350 P355	I339-L348 HydrophobicContact CB-CD1 3.79Å; I339-L348 HydrophobicContact CD1-CD1 4.06Å; I339-L348 HydrophobicContact CG1-CD1 4.49Å; I339-L348 HydrophobicContact CG2-CD1 3.7Å; C342-L348 VanDerWaalsContact SG-CA 3.54Å; C342-L348 PolarHBondContact SG-N 3.19Å; C342-L348 VanDerWaalsContact SG-N 3.41Å; L348-R350 HydrophobicContact CD2-CG 4.26Å; L348-R350 HydrophobicContact CG-CG 4.25Å; L348-P355 HydrophobicContact CD1-CB 3.87Å; L348-P355 HydrophobicContact CG-CB 4.34Å
349	N	75.1	Confident	79.3	Confident	48 Å²	48	82 Å²	82	26%	0.257	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111.8	172	-171	-5.7	0	0	0	109.5	I347 K351 P355 I356 T358	I347-N349 PolarHBondContact O-N 2.76Å; N349-K351 WeakPolarHBondContact OD1-CB 3.42Å; N349-K351 WeakPolarHBondContact OD1-CG 3.42Å; N349-K351 PolarHBondContact OD1-N 2.86Å; N349-P355 WeakPolarHBondContact O-CA 3.49Å; N349-I356 HydrophobicContact CB-CG1 4.24Å; N349-I356 PolarHBondContact N-O 2.77Å; N349-I356 PolarHBondContact O-N 2.94Å; N349-T358 HydrophobicContact CB-CG2 3.77Å
350	R	76.4	Confident	79.6	Confident	200 Å²	200	83.1 Å²	83.1	76%	0.755	46%	0.462	S	S	*	.			trans	-91.3	3.3	176.1	-61.4	-175.6	178.3	177.4	-0.1	113.1	L348 P355	L348-R350 HydrophobicContact CD2-CG 4.26Å; L348-R350 HydrophobicContact CG-CG 4.25Å; R350-P355 HydrophobicContact CG-CB 4.36Å
351	K	69.9	Low	80.2	Confident	183 Å²	183	78.9 Å²	78.9	80%	0.796	43%	0.432	S	S	*	.			trans	-76.9	126.3	174.7	-60.7	-177.5	177.2	178.8	0	109.1	N349	N349-K351 WeakPolarHBondContact OD1-CB 3.42Å; N349-K351 WeakPolarHBondContact OD1-CG 3.42Å; N349-K351 PolarHBondContact OD1-N 2.86Å
352	G	69.3	Low	80.7	Confident	69 Å²	69	74.8 Å²	74.8	71%	0.711	40%	0.404	S	S	*	.	S	Bend	trans	110	-172.2	-174.5	0	0	0	0	0	111.5
353	C	75.9	Confident	81.3	Confident	50 Å²	50	74.1 Å²	74.1	34%	0.338	40%	0.399	S	S	.	.	S	Bend	trans	-75.7	-40.9	-172.7	-174.3	0	0	0	0	114.1	C319 C336	C319-C353 WeakPolarHBondContact CA-SG 3.1Å; C319-C353 HydrophobicContact CB-CB 4.32Å; C319-C353 WeakPolarHBondContact CB-SG 3.3Å; C319-C353 WeakPolarHBondContact SG-CA 3.4Å; C319-C353 WeakPolarHBondContact SG-CB 3.36Å; C319-C353 CovalentContact SG-SG 2.04Å; C319-C353 PolarHBondContact SG-SG 3.36Å; C336-C353 PolarHBondContact SG-O 2.89Å; C336-C353 VanDerWaalsContact SG-O 3.38Å
354	C	77.8	Confident	81.9	Confident	27 Å²	27	70.3 Å²	70.3	18%	0.182	38%	0.375	C	S	.	.	S	Bend	trans	-120.3	143.8	175.9	-63.3	0	0	0	0	109.5	C336	C336-C354 HydrophobicContact CB-CB 3.68Å; C336-C354 WeakPolarHBondContact CB-SG 3.48Å; C336-C354 WeakPolarHBondContact SG-CA 3.2Å; C336-C354 WeakPolarHBondContact SG-CB 3.21Å; C336-C354 CovalentContact SG-SG 2.04Å; C336-C354 PolarHBondContact SG-SG 3.47Å
355	P	80	Confident	82.9	Confident	37 Å²	37	61.1 Å²	61.1	24%	0.24	33%	0.333	C	S	.	.			trans	-63.4	141.9	175.7	28.8	-35	0	0	0	110.5	I339 L348 N349 R350	I339-P355 WeakPolarHBondContact CD1-O 3.34Å; L348-P355 HydrophobicContact CD1-CB 3.87Å; L348-P355 HydrophobicContact CG-CB 4.34Å; N349-P355 WeakPolarHBondContact O-CA 3.49Å; R350-P355 HydrophobicContact CG-CB 4.36Å
356	I	83.7	Confident	83.8	Confident	91 Å²	91	59 Å²	59	47%	0.467	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.5	176.8	59.8	168	0	0	0	110.6	N349 T358	N349-I356 HydrophobicContact CB-CG1 4.24Å; N349-I356 PolarHBondContact N-O 2.77Å; N349-I356 PolarHBondContact O-N 2.94Å; I356-T358 HydrophobicContact CD1-CG2 3.85Å; I356-T358 HydrophobicContact CG1-CG2 4.01Å
357	C	84.9	Confident	84.1	Confident	35 Å²	35	54.6 Å²	54.6	24%	0.236	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114	173	-66	0	0	0	0	110.8	C342 K346 I347	C342-C357 WeakPolarHBondContact CA-SG 3.21Å; C342-C357 HydrophobicContact CB-CB 3.75Å; C342-C357 WeakPolarHBondContact CB-SG 3.25Å; C342-C357 WeakPolarHBondContact SG-CA 3.23Å; C342-C357 WeakPolarHBondContact SG-CB 3.22Å; C342-C357 CovalentContact SG-SG 2.04Å; C342-C357 PolarHBondContact SG-SG 2.88Å; K346-C357 HydrophobicContact CB-CB 4.16Å; K346-C357 HydrophobicContact CD-CB 4.2Å; I347-C357 WeakPolarHBondContact O-CA 3.44Å
358	T	82.5	Confident	84.1	Confident	38 Å²	38	51.1 Å²	51.1	23%	0.233	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	158.4	176.9	58.4	0	0	0	0	111.1	K346 I347 N349 I356	K346-T358 CarbonylContact C-O 3.56Å; K346-T358 WeakPolarHBondContact CA-O 3.36Å; K346-T358 VanDerWaalsContact CB-O 3.28Å; K346-T358 WeakPolarHBondContact CB-O 3.33Å; I347-T358 PolarHBondContact N-O 2.81Å; I347-T358 PolarHBondContact O-N 2.93Å; N349-T358 HydrophobicContact CB-CG2 3.77Å; I356-T358 HydrophobicContact CD1-CG2 3.85Å; I356-T358 HydrophobicContact CG1-CG2 4.01Å
359	E	86.4	Confident	83.9	Confident	84 Å²	84	48.5 Å²	48.5	39%	0.393	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	148.9	173.6	-66	-169.6	-168.6	0	0	111.8	P487 K490	E359-P487 HydrophobicContact CB-CB 3.93Å; E359-P487 HydrophobicContact CB-CG 3.84Å; E359-P487 VanDerWaalsContact O-CG 3.26Å; E359-P487 WeakPolarHBondContact O-CG 3.29Å; E359-K490 IonicContact OE2-NZ 3.56Å; E359-K490 PolarHBondContact OE2-NZ 3.14Å
360	K	86	Confident	83.9	Confident	80 Å²	80	46.2 Å²	46.2	35%	0.348	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-64.7	141.5	170.4	-77.5	-175.4	176.5	-170.3	0	110.5	G345 I347 E612	G345-K360 PolarHBondContact O-N 2.91Å; I347-K360 HydrophobicContact CG1-CG 4.42Å; I347-K360 HydrophobicContact CG2-CD 4.2Å; I347-K360 HydrophobicContact CG2-CG 3.54Å; K360-E612 IonicContact NZ-OE2 3.01Å; K360-E612 PolarHBondContact NZ-OE2 3.32Å
361	P	91.6	Very high	84.6	Confident	38 Å²	38	36.7 Å²	36.7	25%	0.247	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-64	147.9	171.2	28.6	-34	0	0	0	110.8	M484 A485	P361-M484 HydrophobicContact CB-CE 4.31Å; P361-M484 HydrophobicContact CG-CE 3.58Å; P361-A485 CarbonylContact C-O 3.48Å; P361-A485 WeakPolarHBondContact CA-O 3.38Å; P361-A485 WeakPolarHBondContact CB-O 3.4Å
362	G	94.3	Very high	85.8	Confident	6 Å²	6	28 Å²	28	6%	0.062	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	144.4	171	0	0	0	0	0	109.8	M484 A485 Y500	G362-M484 CarbonylContact O-C 3.47Å; G362-M484 WeakPolarHBondContact O-CA 3.48Å; G362-A485 PolarHBondContact N-O 3.4Å; G362-A485 PolarHBondContact O-N 2.9Å; G362-Y500 VanDerWaalsContact CA-CE2 3.4Å; G362-Y500 PolarHBondContact N-OH 3.15Å
363	V	95.8	Very high	87	Confident	17 Å²	17	25.5 Å²	25.5	10%	0.103	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.1	-177.4	-174.2	0	0	0	0	110.5	T365 E482 M484	V363-T365 HydrophobicContact CG1-CG2 4.11Å; V363-E482 HydrophobicContact CG1-CG 3.55Å; V363-M484 HydrophobicContact CG1-CG 4.31Å; V363-M484 HydrophobicContact CG2-CE 4.23Å; V363-M484 HydrophobicContact CG2-CG 4.01Å
364	C	97.7	Very high	88	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.007	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.5	170.9	177.6	0	0	0	0	109.4	N373 F375 E482 V483 C497	C364-N373 CarbonylContact C-O 3.56Å; C364-N373 WeakPolarHBondContact CA-O 3.34Å; C364-N373 PolarHBondContact SG-O 2.88Å; C364-F375 HydrophobicContact CB-CD1 3.72Å; C364-F375 HydrophobicContact CB-CD2 4.5Å; C364-F375 HydrophobicContact CB-CE1 3.53Å; C364-F375 HydrophobicContact CB-CE2 4.34Å; C364-F375 HydrophobicContact CB-CG 4.22Å; C364-F375 HydrophobicContact CB-CZ 3.86Å; C364-E482 CarbonylContact O-C 3.54Å; C364-E482 WeakPolarHBondContact O-CA 3.37Å; C364-V483 HydrophobicContact CB-CB 4.48Å; C364-V483 PolarHBondContact N-O 2.93Å; C364-V483 PolarHBondContact O-N 2.86Å; C364-C497 HydrophobicContact CB-CB 3.58Å; C364-C497 WeakPolarHBondContact CB-SG 3.31Å; C364-C497 WeakPolarHBondContact SG-CB 3.46Å; C364-C497 CovalentContact SG-SG 2.02Å; C364-C497 PolarHBondContact SG-SG 3.02Å
365	T	95.8	Very high	89	Confident	12 Å²	12	22.7 Å²	22.7	7%	0.074	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	142.5	179.7	63.1	0	0	0	0	111.9	V363 Y372 N373 F480 V481 E482	V363-T365 HydrophobicContact CG1-CG2 4.11Å; T365-Y372 WeakPolarHBondContact O-CA 3.47Å; T365-N373 PolarHBondContact N-O 2.84Å; T365-N373 PolarHBondContact O-N 3.34Å; T365-N373 WeakPolarHBondContact OG1-CB 3.05Å; T365-N373 PolarHBondContact OG1-ND2 3Å; T365-F480 HydrophobicContact CG2-CZ 4.45Å; T365-V481 CarbonylContact C-O 3.49Å; T365-V481 VanDerWaalsContact CA-O 3.29Å; T365-V481 WeakPolarHBondContact CA-O 3.35Å; T365-E482 HydrophobicContact CG2-CB 4.25Å; T365-E482 HydrophobicContact CG2-CG 4.02Å
366	V	95.1	Very high	89.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.5	170.5	-169.4	0	0	0	0	108.3	P370 H371 Y372 L390 F480 V481	V366-P370 HydrophobicContact CG1-CB 3.7Å; V366-H371 VanDerWaalsContact CA-O 3.29Å; V366-H371 WeakPolarHBondContact CA-O 3.31Å; V366-Y372 HydrophobicContact CB-CE1 4.48Å; V366-Y372 HydrophobicContact CG1-CD1 4.22Å; V366-Y372 HydrophobicContact CG1-CE1 3.9Å; V366-Y372 HydrophobicContact CG2-CD1 3.63Å; V366-Y372 HydrophobicContact CG2-CE1 3.71Å; V366-L390 HydrophobicContact CG2-CD1 3.63Å; V366-L390 HydrophobicContact CG2-CD2 4.26Å; V366-F480 CarbonylContact O-C 3.01Å; V366-F480 WeakPolarHBondContact O-CA 3.31Å; V366-V481 HydrophobicContact CB-CB 4.07Å; V366-V481 HydrophobicContact CB-CG2 4.21Å; V366-V481 HydrophobicContact CG2-CB 4.33Å; V366-V481 PolarHBondContact N-O 2.95Å; V366-V481 PolarHBondContact O-N 3.38Å
367	F	89.2	Confident	90	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	160.6	-176.7	65.2	-82.5	0	0	0	112	H371 N373 F480 F580 A604	F367-H371 HydrophobicContact CD1-CB 4.3Å; F367-H371 HydrophobicContact CD2-CB 4.41Å; F367-H371 HydrophobicContact CE1-CB 3.89Å; F367-H371 HydrophobicContact CE2-CB 4.03Å; F367-H371 AromaticContact CE2-CD2 3.78Å; F367-H371 HydrophobicContact CZ-CB 3.74Å; F367-H371 PolarHBondContact N-O 3.02Å; F367-H371 VanDerWaalsContact N-O 3.11Å; F367-H371 PolarHBondContact O-CD2 2.82Å; F367-H371 PolarHBondContact O-N 2.79Å; F367-N373 WeakPolarHBondContact CE1-ND2 3.16Å; F367-F480 HydrophobicContact CB-CD2 3.79Å; F367-F480 HydrophobicContact CB-CE2 4.42Å; F367-F580 HydrophobicContact CE1-CD1 4.4Å; F367-F580 HydrophobicContact CE1-CE1 4.2Å; F367-F580 HydrophobicContact CE2-CD1 4.17Å; F367-F580 AromaticContact CZ-CD1 3.83Å; F367-F580 HydrophobicContact CZ-CD1 3.83Å; F367-F580 HydrophobicContact CZ-CE1 4.09Å; F367-A604 HydrophobicContact CB-CB 3.97Å; F367-A604 HydrophobicContact CD1-CB 4.03Å; F367-A604 HydrophobicContact CD2-CB 3.69Å; F367-A604 HydrophobicContact CE1-CB 4.49Å; F367-A604 HydrophobicContact CE2-CB 4.17Å; F367-A604 HydrophobicContact CG-CB 3.61Å
368	G	79.7	Confident	90.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	-144.3	178.6	0	0	0	0	0	113.1
369	D	74.9	Confident	90.8	Very high	3 Å²	3	22 Å²	22	2%	0.016	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	89.7	176.2	71.2	-29.5	0	0	0	112.7	H371 Q383 F415 D587	D369-H371 IonicContact OD1-CD2 3.94Å; D369-H371 IonicContact OD1-CE1 3.06Å; D369-H371 PolarHBondContact OD1-CE1 2.86Å; D369-H371 IonicContact OD1-ND1 3.02Å; D369-H371 IonicContact OD1-NE2 2.71Å; D369-H371 PolarHBondContact OD1-NE2 3.24Å; D369-Q383 PolarHBondContact O-NE2 2.95Å; D369-Q383 PolarHBondContact OD2-NE2 3.46Å; D369-F415 HydrophobicContact CB-CB 4.28Å; D369-F415 HydrophobicContact CB-CD1 3.7Å; D369-F415 HydrophobicContact CB-CE1 4.33Å; D369-F415 HydrophobicContact CB-CG 4.18Å; D369-F415 WeakPolarHBondContact OD2-CD1 3.5Å; D369-F415 WeakPolarHBondContact OD2-CE1 3.43Å; D369-D587 PolarHBondContact N-OD1 2.8Å
370	P	75.9	Confident	91.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn		-48.9	120.6	-110.6	35.4	-32.6	0	0	0	114.1	V366 Y372 F382 S416	V366-P370 HydrophobicContact CG1-CB 3.7Å; P370-Y372 HydrophobicContact CB-CE2 3.85Å; P370-Y372 HydrophobicContact CG-CE2 3.89Å; P370-Y372 WeakPolarHBondContact O-CE2 3.31Å; P370-F382 WeakPolarHBondContact CG-O 2.79Å; P370-F382 PolarHBondContact O-N 2.92Å; P370-S416 VanDerWaalsContact CD-O 3.25Å; P370-S416 WeakPolarHBondContact CD-O 3.28Å; P370-S416 WeakPolarHBondContact CD-OG 3.4Å; P370-S416 WeakPolarHBondContact CG-OG 3.49Å
371	H	91.3	Very high	91.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.6	164.5	-53.8	-62.7	0	0	0	109.6	V366 F367 D369 N381 S583 D587	V366-H371 VanDerWaalsContact CA-O 3.29Å; V366-H371 WeakPolarHBondContact CA-O 3.31Å; F367-H371 HydrophobicContact CD1-CB 4.3Å; F367-H371 HydrophobicContact CD2-CB 4.41Å; F367-H371 HydrophobicContact CE1-CB 3.89Å; F367-H371 HydrophobicContact CE2-CB 4.03Å; F367-H371 AromaticContact CE2-CD2 3.78Å; F367-H371 HydrophobicContact CZ-CB 3.74Å; F367-H371 PolarHBondContact N-O 3.02Å; F367-H371 VanDerWaalsContact N-O 3.11Å; F367-H371 PolarHBondContact O-CD2 2.82Å; F367-H371 PolarHBondContact O-N 2.79Å; D369-H371 IonicContact OD1-CD2 3.94Å; D369-H371 IonicContact OD1-CE1 3.06Å; D369-H371 PolarHBondContact OD1-CE1 2.86Å; D369-H371 IonicContact OD1-ND1 3.02Å; D369-H371 IonicContact OD1-NE2 2.71Å; D369-H371 PolarHBondContact OD1-NE2 3.24Å; H371-N381 VanDerWaalsContact ND1-CG 3.28Å; H371-N381 PolarHBondContact ND1-OD1 3.16Å; H371-S583 VanDerWaalsContact CD2-CB 3.42Å; H371-S583 WeakPolarHBondContact CD2-CB 3.11Å; H371-S583 WeakPolarHBondContact NE2-CB 3.4Å; H371-S583 PolarHBondContact NE2-O 3.43Å; H371-D587 IonicContact CD2-OD2 2.64Å; H371-D587 IonicContact NE2-OD1 2.64Å; H371-D587 IonicContact NE2-OD2 2.97Å; H371-D587 PolarHBondContact NE2-OD2 2.83Å
372	Y	94.8	Very high	91	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.8	178.8	-63.6	-100	0	0	0	109.6	T365 V366 P370 T379 F380 F382 L390 N407 L496	T365-Y372 WeakPolarHBondContact O-CA 3.47Å; V366-Y372 HydrophobicContact CB-CE1 4.48Å; V366-Y372 HydrophobicContact CG1-CD1 4.22Å; V366-Y372 HydrophobicContact CG1-CE1 3.9Å; V366-Y372 HydrophobicContact CG2-CD1 3.63Å; V366-Y372 HydrophobicContact CG2-CE1 3.71Å; P370-Y372 HydrophobicContact CB-CE2 3.85Å; P370-Y372 HydrophobicContact CG-CE2 3.89Å; P370-Y372 WeakPolarHBondContact O-CE2 3.31Å; Y372-T379 CarbonylContact O-C 3.58Å; Y372-T379 VanDerWaalsContact O-CA 3.24Å; Y372-T379 WeakPolarHBondContact O-CA 2.98Å; Y372-F380 VanDerWaalsContact CB-CE1 3.5Å; Y372-F380 HydrophobicContact CD1-CE2 4.41Å; Y372-F380 HydrophobicContact CD1-CZ 4.09Å; Y372-F380 HydrophobicContact CD2-CD2 4.06Å; Y372-F380 AromaticContact CD2-CE2 3.49Å; Y372-F380 HydrophobicContact CD2-CE2 3.49Å; Y372-F380 VanDerWaalsContact CD2-CE2 3.49Å; Y372-F380 AromaticContact CD2-CZ 3.95Å; Y372-F380 HydrophobicContact CD2-CZ 3.95Å; Y372-F380 HydrophobicContact CE2-CE2 4.27Å; Y372-F380 HydrophobicContact CG-CD2 4.36Å; Y372-F380 HydrophobicContact CG-CE1 4.25Å; Y372-F380 AromaticContact CG-CE2 3.59Å; Y372-F380 HydrophobicContact CG-CE2 3.59Å; Y372-F380 AromaticContact CG-CZ 3.51Å; Y372-F380 HydrophobicContact CG-CZ 3.51Å; Y372-F380 PolarHBondContact N-O 3.36Å; Y372-F380 PolarHBondContact O-N 2.04Å; Y372-F382 HydrophobicContact CD2-CB 4.35Å; Y372-F382 HydrophobicContact CE2-CB 3.96Å; Y372-F382 HydrophobicContact CE2-CD1 4.43Å; Y372-L390 HydrophobicContact CD1-CD1 4.13Å; Y372-L390 HydrophobicContact CE1-CD1 4.06Å; Y372-N407 PolarHBondContact OH-ND2 2.94Å; Y372-L496 HydrophobicContact CD1-CB 4.23Å; Y372-L496 HydrophobicContact CD1-CD1 4.34Å; Y372-L496 HydrophobicContact CE1-CB 4.32Å; Y372-L496 HydrophobicContact CE1-CD1 3.65Å
373	N	94.4	Very high	90.4	Very high	17 Å²	17	17.8 Å²	17.8	9%	0.091	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.1	162.2	-64.3	-39.1	0	0	0	108.7	C364 T365 F367 R378 T379	C364-N373 CarbonylContact C-O 3.56Å; C364-N373 WeakPolarHBondContact CA-O 3.34Å; C364-N373 PolarHBondContact SG-O 2.88Å; T365-N373 PolarHBondContact N-O 2.84Å; T365-N373 PolarHBondContact O-N 3.34Å; T365-N373 WeakPolarHBondContact OG1-CB 3.05Å; T365-N373 PolarHBondContact OG1-ND2 3Å; F367-N373 WeakPolarHBondContact CE1-ND2 3.16Å; N373-R378 CarbonylContact C-O 3.58Å; N373-R378 VanDerWaalsContact CA-O 3.32Å; N373-R378 WeakPolarHBondContact CA-O 3.17Å; N373-T379 WeakPolarHBondContact OD1-CB 3.15Å; N373-T379 VanDerWaalsContact OD1-CG2 3.27Å; N373-T379 WeakPolarHBondContact OD1-CG2 3.18Å; N373-T379 PolarHBondContact OD1-OG1 3.2Å
374	T	97.1	Very high	89.8	Confident	2 Å²	2	17.3 Å²	17.3	1%	0.012	10%	0.1	C	C	.	.			trans	-73.2	167.7	177.6	65.9	0	0	0	0	111.9	D376 G377 R378 F380 C497 D507	T374-D376 PolarHBondContact O-N 3.41Å; T374-D376 VanDerWaalsContact O-N 3.14Å; T374-G377 PolarHBondContact O-N 3.18Å; T374-G377 VanDerWaalsContact O-N 3.09Å; T374-G377 PolarHBondContact OG1-N 2.77Å; T374-R378 HydrophobicContact CG2-CB 3.99Å; T374-R378 PolarHBondContact N-O 3.31Å; T374-R378 VanDerWaalsContact OG1-CB 3.3Å; T374-R378 WeakPolarHBondContact OG1-CB 2.96Å; T374-R378 PolarHBondContact OG1-N 2.96Å; T374-R378 PolarHBondContact OG1-O 3.4Å; T374-F380 HydrophobicContact CG2-CD1 4.4Å; T374-F380 HydrophobicContact CG2-CE1 3.9Å; T374-C497 WeakPolarHBondContact CA-O 3.36Å; T374-C497 VanDerWaalsContact CB-O 3.23Å; T374-C497 WeakPolarHBondContact CB-O 3.33Å; T374-D507 VanDerWaalsContact CB-OD2 3.31Å; T374-D507 WeakPolarHBondContact CB-OD2 3.48Å; T374-D507 HydrophobicContact CG2-CB 4.04Å; T374-D507 PolarHBondContact OG1-OD2 2.96Å
375	F	97	Very high	89.2	Confident	16 Å²	16	18.9 Å²	18.9	7%	0.07	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.5	177.1	-64.7	-64.7	0	0	0	113.6	C364 T391 V483 A485 L493 C497 Y500	C364-F375 HydrophobicContact CB-CD1 3.72Å; C364-F375 HydrophobicContact CB-CD2 4.5Å; C364-F375 HydrophobicContact CB-CE1 3.53Å; C364-F375 HydrophobicContact CB-CE2 4.34Å; C364-F375 HydrophobicContact CB-CG 4.22Å; C364-F375 HydrophobicContact CB-CZ 3.86Å; F375-T391 HydrophobicContact CZ-CG2 4.22Å; F375-V483 HydrophobicContact CE1-CG1 4.45Å; F375-V483 WeakPolarHBondContact CE1-O 3.41Å; F375-V483 HydrophobicContact CZ-CG1 4.27Å; F375-A485 HydrophobicContact CD1-CB 4.31Å; F375-A485 HydrophobicContact CE1-CB 3.79Å; F375-A485 HydrophobicContact CZ-CB 4.13Å; F375-L493 HydrophobicContact CD2-CD1 4.07Å; F375-L493 HydrophobicContact CE2-CB 4.42Å; F375-L493 HydrophobicContact CE2-CD1 3.48Å; F375-L493 VanDerWaalsContact CE2-CD1 3.48Å; F375-L493 HydrophobicContact CZ-CD1 3.77Å; F375-C497 HydrophobicContact CD2-CB 3.64Å; F375-C497 WeakPolarHBondContact CD2-O 3.04Å; F375-C497 HydrophobicContact CE2-CB 3.31Å; F375-C497 HydrophobicContact CG-CB 4.45Å; F375-C497 HydrophobicContact CZ-CB 3.91Å; F375-C497 PolarHBondContact N-O 3.21Å; F375-Y500 HydrophobicContact CB-CD2 3.59Å; F375-Y500 HydrophobicContact CB-CE2 4.48Å; F375-Y500 HydrophobicContact CB-CG 3.84Å; F375-Y500 HydrophobicContact CD2-CG 4.33Å; F375-Y500 HydrophobicContact CG-CD2 4.25Å; F375-Y500 HydrophobicContact CG-CG 4.07Å
376	D	94.6	Very high	88.9	Confident	29 Å²	29	18.3 Å²	18.3	16%	0.155	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	5.1	-177.4	-63	-23.5	0	0	0	113.1	T374 N501 G502 H503 K504	T374-D376 PolarHBondContact O-N 3.41Å; T374-D376 VanDerWaalsContact O-N 3.14Å; D376-N501 PolarHBondContact OD2-N 3.05Å; D376-N501 PolarHBondContact OD2-OD1 3.39Å; D376-G502 VanDerWaalsContact OD1-CA 3.31Å; D376-G502 WeakPolarHBondContact OD1-CA 3.18Å; D376-G502 PolarHBondContact OD1-N 3.39Å; D376-G502 PolarHBondContact OD2-N 2.94Å; D376-H503 PolarHBondContact OD2-N 2.03Å; D376-H503 VanDerWaalsContact OD2-N 3.12Å; D376-K504 HydrophobicContact CB-CB 4.4Å
377	G	91.3	Very high	88.8	Confident	46 Å²	46	19.4 Å²	19.4	47%	0.474	11%	0.111	S	C	.	.	S	Bend	trans	87.5	21.4	172.4	0	0	0	0	0	115.3	T374	T374-G377 PolarHBondContact O-N 3.18Å; T374-G377 VanDerWaalsContact O-N 3.09Å; T374-G377 PolarHBondContact OG1-N 2.77Å
378	R	92.6	Very high	89.1	Confident	67 Å²	67	19.5 Å²	19.5	25%	0.253	11%	0.111	S	C	.	.			trans	-79.1	132.3	166.4	-171.7	180	-175	111.1	1.9	109.6	N373 T374 K504 D507 L508	N373-R378 CarbonylContact C-O 3.58Å; N373-R378 VanDerWaalsContact CA-O 3.32Å; N373-R378 WeakPolarHBondContact CA-O 3.17Å; T374-R378 HydrophobicContact CG2-CB 3.99Å; T374-R378 PolarHBondContact N-O 3.31Å; T374-R378 VanDerWaalsContact OG1-CB 3.3Å; T374-R378 WeakPolarHBondContact OG1-CB 2.96Å; T374-R378 PolarHBondContact OG1-N 2.96Å; T374-R378 PolarHBondContact OG1-O 3.4Å; R378-K504 HydrophobicContact CB-CB 4.09Å; R378-K504 PolarHBondContact NH1-O 3.3Å; R378-D507 HydrophobicContact CB-CB 4.15Å; R378-D507 VanDerWaalsContact CB-OD2 3.31Å; R378-D507 WeakPolarHBondContact CB-OD2 3.15Å; R378-L508 VanDerWaalsContact CZ-CD1 3.5Å; R378-L508 VanDerWaalsContact CZ-CG 3.45Å
379	T	92.2	Very high	89.9	Confident	43 Å²	43	20 Å²	20	26%	0.264	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.7	172.2	-51.2	0	0	0	0	110.9	Y372 N373 T579	Y372-T379 CarbonylContact O-C 3.58Å; Y372-T379 VanDerWaalsContact O-CA 3.24Å; Y372-T379 WeakPolarHBondContact O-CA 2.98Å; N373-T379 WeakPolarHBondContact OD1-CB 3.15Å; N373-T379 VanDerWaalsContact OD1-CG2 3.27Å; N373-T379 WeakPolarHBondContact OD1-CG2 3.18Å; N373-T379 PolarHBondContact OD1-OG1 3.2Å; T379-T579 WeakPolarHBondContact OG1-CB 3.4Å; T379-T579 WeakPolarHBondContact OG1-CG2 3.45Å
380	F	91.2	Very high	91	Very high	10 Å²	10	19.8 Å²	19.8	4%	0.044	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	161.6	171.1	67.6	-90.4	0	0	0	111.5	Y372 T374 F382 L496 V519 F522	Y372-F380 VanDerWaalsContact CB-CE1 3.5Å; Y372-F380 HydrophobicContact CD1-CE2 4.41Å; Y372-F380 HydrophobicContact CD1-CZ 4.09Å; Y372-F380 HydrophobicContact CD2-CD2 4.06Å; Y372-F380 AromaticContact CD2-CE2 3.49Å; Y372-F380 HydrophobicContact CD2-CE2 3.49Å; Y372-F380 VanDerWaalsContact CD2-CE2 3.49Å; Y372-F380 AromaticContact CD2-CZ 3.95Å; Y372-F380 HydrophobicContact CD2-CZ 3.95Å; Y372-F380 HydrophobicContact CE2-CE2 4.27Å; Y372-F380 HydrophobicContact CG-CD2 4.36Å; Y372-F380 HydrophobicContact CG-CE1 4.25Å; Y372-F380 AromaticContact CG-CE2 3.59Å; Y372-F380 HydrophobicContact CG-CE2 3.59Å; Y372-F380 AromaticContact CG-CZ 3.51Å; Y372-F380 HydrophobicContact CG-CZ 3.51Å; Y372-F380 PolarHBondContact N-O 3.36Å; Y372-F380 PolarHBondContact O-N 2.04Å; T374-F380 HydrophobicContact CG2-CD1 4.4Å; T374-F380 HydrophobicContact CG2-CE1 3.9Å; F380-F382 HydrophobicContact CD2-CB 4.25Å; F380-F382 HydrophobicContact CE2-CB 4.14Å; F380-L496 WeakPolarHBondContact CE1-O 3.31Å; F380-L496 HydrophobicContact CZ-CB 4.3Å; F380-L496 HydrophobicContact CZ-CD2 4.44Å; F380-L496 WeakPolarHBondContact CZ-O 3.43Å; F380-V519 HydrophobicContact CB-CG1 3.85Å; F380-V519 HydrophobicContact CB-CG2 4.16Å; F380-V519 HydrophobicContact CD2-CG1 3.47Å; F380-V519 VanDerWaalsContact CD2-CG1 3.47Å; F380-V519 HydrophobicContact CE2-CG1 4.37Å; F380-V519 HydrophobicContact CG-CG1 3.96Å; F380-F522 AromaticContact CE1-CE1 3.88Å; F380-F522 HydrophobicContact CE1-CE1 3.88Å; F380-F522 HydrophobicContact CE2-CD1 4.42Å; F380-F522 AromaticContact CE2-CE1 3.98Å; F380-F522 HydrophobicContact CE2-CE1 3.98Å; F380-F522 HydrophobicContact CZ-CD1 4.41Å; F380-F522 AromaticContact CZ-CE1 3.56Å; F380-F522 HydrophobicContact CZ-CE1 3.56Å; F380-F522 HydrophobicContact CZ-CZ 4.44Å
381	N	88.5	Confident	92.1	Very high	62 Å²	62	19.8 Å²	19.8	33%	0.332	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.9	179.1	-57.2	-11.4	0	0	0	108.5	H371 V519	H371-N381 VanDerWaalsContact ND1-CG 3.28Å; H371-N381 PolarHBondContact ND1-OD1 3.16Å; N381-V519 WeakPolarHBondContact O-CG1 3.09Å
382	F	87	Confident	92.3	Very high	7 Å²	7	22.7 Å²	22.7	3%	0.031	13%	0.126	C	C	.	.			trans	-148.9	120.2	179	172.5	-116.3	0	0	0	111.5	P370 Y372 F380 G384 Y388 D520 A523	P370-F382 WeakPolarHBondContact CG-O 2.79Å; P370-F382 PolarHBondContact O-N 2.92Å; Y372-F382 HydrophobicContact CD2-CB 4.35Å; Y372-F382 HydrophobicContact CE2-CB 3.96Å; Y372-F382 HydrophobicContact CE2-CD1 4.43Å; F380-F382 HydrophobicContact CD2-CB 4.25Å; F380-F382 HydrophobicContact CE2-CB 4.14Å; F382-G384 PolarHBondContact O-N 3.15Å; F382-Y388 HydrophobicContact CE1-CD1 4.02Å; F382-Y388 HydrophobicContact CE1-CD2 4.12Å; F382-Y388 AromaticContact CE1-CE1 3.56Å; F382-Y388 HydrophobicContact CE1-CE1 3.56Å; F382-Y388 AromaticContact CE1-CE2 3.66Å; F382-Y388 HydrophobicContact CE1-CE2 3.66Å; F382-Y388 HydrophobicContact CE1-CG 4.3Å; F382-Y388 AromaticContact CE1-CZ 3.38Å; F382-Y388 HydrophobicContact CZ-CD1 4.47Å; F382-Y388 AromaticContact CZ-CE1 3.66Å; F382-Y388 HydrophobicContact CZ-CE1 3.66Å; F382-Y388 HydrophobicContact CZ-CE2 4.28Å; F382-Y388 AromaticContact CZ-CZ 3.55Å; F382-Y388 WeakPolarHBondContact CZ-OH 3.47Å; F382-D520 WeakPolarHBondContact CD2-OD1 3.31Å; F382-A523 HydrophobicContact CB-CB 4.08Å; F382-A523 HydrophobicContact CD1-CB 3.44Å; F382-A523 VanDerWaalsContact CD1-CB 3.44Å; F382-A523 HydrophobicContact CD2-CB 3.42Å; F382-A523 VanDerWaalsContact CD2-CB 3.42Å; F382-A523 HydrophobicContact CE1-CB 3.54Å; F382-A523 HydrophobicContact CE2-CB 3.55Å; F382-A523 HydrophobicContact CG-CB 3.34Å; F382-A523 HydrophobicContact CZ-CB 3.59Å
383	Q	83	Confident	92.3	Very high	41 Å²	41	23.2 Å²	23.2	19%	0.192	13%	0.129	C	C	.	.			trans	-99.5	31.3	-170.9	-60.1	-61.9	-21.4	0	0	114.4	D369 S416 R536	D369-Q383 PolarHBondContact O-NE2 2.95Å; D369-Q383 PolarHBondContact OD2-NE2 3.46Å; Q383-S416 WeakPolarHBondContact CA-OG 3.34Å; Q383-S416 PolarHBondContact OE1-OG 2.99Å; Q383-R536 PolarHBondContact O-NH1 2.98Å
384	G	83	Confident	92.2	Very high	8 Å²	8	25 Å²	25	8%	0.082	14%	0.142	C	C	.	.			trans	-67.4	143.3	177.5	0	0	0	0	0	113.1	F382 Y388 N407 S416	F382-G384 PolarHBondContact O-N 3.15Å; G384-Y388 VanDerWaalsContact CA-OH 3.28Å; G384-Y388 WeakPolarHBondContact CA-OH 3.4Å; G384-N407 WeakPolarHBondContact O-CB 2.98Å; G384-S416 VanDerWaalsContact O-CB 3.22Å; G384-S416 WeakPolarHBondContact O-CB 3.24Å; G384-S416 PolarHBondContact O-OG 2.89Å
385	T	85.3	Confident	91.7	Very high	33 Å²	33	28.6 Å²	28.6	20%	0.202	17%	0.167	C	C	.	.			trans	-112.9	33.3	-173.3	54.4	0	0	0	0	113.2	N407 A409	T385-N407 CarbonylContact C-O 3.57Å; T385-N407 WeakPolarHBondContact CA-O 3.33Å; T385-N407 VanDerWaalsContact O-O 3.13Å; T385-A409 HydrophobicContact CG2-CB 4.03Å
386	C	89.6	Confident	90.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-128.7	-171.5	-172.3	-61.5	0	0	0	0	111.8	Y388 N407 R527 C534	C386-Y388 HydrophobicContact CB-CD2 4.43Å; C386-Y388 HydrophobicContact CB-CE2 3.67Å; C386-Y388 WeakPolarHBondContact O-CD2 3.44Å; C386-Y388 WeakPolarHBondContact O-CE2 3.37Å; C386-N407 PolarHBondContact N-O 2.93Å; C386-N407 PolarHBondContact O-N 2.91Å; C386-R527 HydrophobicContact CB-CG 4.35Å; C386-C534 HydrophobicContact CB-CB 4.19Å; C386-C534 WeakPolarHBondContact CB-SG 3.32Å; C386-C534 WeakPolarHBondContact SG-CA 3.44Å; C386-C534 WeakPolarHBondContact SG-CB 3.37Å; C386-C534 CovalentContact SG-SG 2.01Å; C386-C534 PolarHBondContact SG-SG 3.45Å
387	Q	93	Very high	89.9	Confident	24 Å²	24	35.9 Å²	35.9	11%	0.112	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.1	169.4	-171	159.9	-22.6	0	0	110.8	L404 V405 E422 V528 E529	Q387-L404 HydrophobicContact CG-CB 4.09Å; Q387-V405 CarbonylContact C-O 3.43Å; Q387-V405 WeakPolarHBondContact CA-O 3.34Å; Q387-E422 PolarHBondContact NE2-OE2 2.72Å; Q387-E422 VanDerWaalsContact NE2-OE2 3.11Å; Q387-V528 PolarHBondContact O-N 3.46Å; Q387-E529 HydrophobicContact CB-CG 3.95Å; Q387-E529 PolarHBondContact OE1-OE1 3.03Å
388	Y	95.3	Very high	89.1	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.1	-176.3	-59.6	-86.7	0	0	0	111.1	F382 G384 C386 L390 L404 V405 L496 A523 E524 W526 R527	F382-Y388 HydrophobicContact CE1-CD1 4.02Å; F382-Y388 HydrophobicContact CE1-CD2 4.12Å; F382-Y388 AromaticContact CE1-CE1 3.56Å; F382-Y388 HydrophobicContact CE1-CE1 3.56Å; F382-Y388 AromaticContact CE1-CE2 3.66Å; F382-Y388 HydrophobicContact CE1-CE2 3.66Å; F382-Y388 HydrophobicContact CE1-CG 4.3Å; F382-Y388 AromaticContact CE1-CZ 3.38Å; F382-Y388 HydrophobicContact CZ-CD1 4.47Å; F382-Y388 AromaticContact CZ-CE1 3.66Å; F382-Y388 HydrophobicContact CZ-CE1 3.66Å; F382-Y388 HydrophobicContact CZ-CE2 4.28Å; F382-Y388 AromaticContact CZ-CZ 3.55Å; F382-Y388 WeakPolarHBondContact CZ-OH 3.47Å; G384-Y388 VanDerWaalsContact CA-OH 3.28Å; G384-Y388 WeakPolarHBondContact CA-OH 3.4Å; C386-Y388 HydrophobicContact CB-CD2 4.43Å; C386-Y388 HydrophobicContact CB-CE2 3.67Å; C386-Y388 WeakPolarHBondContact O-CD2 3.44Å; C386-Y388 WeakPolarHBondContact O-CE2 3.37Å; Y388-L390 PolarHBondContact O-N 3.11Å; Y388-L404 WeakPolarHBondContact O-CA 3.42Å; Y388-V405 PolarHBondContact N-O 3.37Å; Y388-V405 PolarHBondContact O-N 2.91Å; Y388-L496 HydrophobicContact CG-CD1 4.3Å; Y388-A523 WeakPolarHBondContact CD1-O 3.2Å; Y388-E524 PolarHBondContact OH-OE2 3.06Å; Y388-E524 VanDerWaalsContact OH-OE2 3.08Å; Y388-W526 WeakPolarHBondContact CA-O 3.2Å; Y388-R527 HydrophobicContact CD1-CB 3.96Å; Y388-R527 HydrophobicContact CE1-CB 3.78Å; Y388-R527 HydrophobicContact CE1-CG 4.15Å
389	V	96.6	Very high	88.2	Confident	9 Å²	9	36 Å²	36	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	105.5	171.8	-178.4	0	0	0	0	109.1	K392 L404 L496 W526 V528	V389-K392 HydrophobicContact CG1-CB 4.1Å; V389-K392 HydrophobicContact CG1-CD 3.96Å; V389-K392 HydrophobicContact CG1-CG 3.97Å; V389-L404 HydrophobicContact CB-CD2 4.38Å; V389-L404 HydrophobicContact CG2-CD2 3.97Å; V389-L496 WeakPolarHBondContact O-CG 3.39Å; V389-L496 PolarHBondContact O-N 3.23Å; V389-W526 HydrophobicContact CB-CB 4.47Å; V389-W526 HydrophobicContact CB-CE3 3.97Å; V389-W526 HydrophobicContact CG1-CE3 4.28Å; V389-W526 HydrophobicContact CG2-CE3 4.37Å; V389-W526 PolarHBondContact N-O 3.12Å; V389-V528 HydrophobicContact CG2-CG2 3.58Å
390	L	97.6	Very high	88	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-51.5	175.2	-175	59.7	0	0	0	110.1	V366 Y372 Y388 V403 V405 V481 V483 L496 C497	V366-L390 HydrophobicContact CG2-CD1 3.63Å; V366-L390 HydrophobicContact CG2-CD2 4.26Å; Y372-L390 HydrophobicContact CD1-CD1 4.13Å; Y372-L390 HydrophobicContact CE1-CD1 4.06Å; Y388-L390 PolarHBondContact O-N 3.11Å; L390-V403 HydrophobicContact CB-CG1 4.34Å; L390-V403 WeakPolarHBondContact CB-O 3.47Å; L390-V403 HydrophobicContact CD2-CG1 4.15Å; L390-V403 PolarHBondContact N-O 2.92Å; L390-V405 HydrophobicContact CB-CB 4.17Å; L390-V405 HydrophobicContact CB-CG1 4.1Å; L390-V405 HydrophobicContact CD1-CG1 4.39Å; L390-V405 HydrophobicContact CD2-CB 4.42Å; L390-V481 HydrophobicContact CD2-CG1 4.06Å; L390-V483 HydrophobicContact CD2-CG2 3.81Å; L390-L496 HydrophobicContact CD1-CB 4.29Å; L390-L496 PolarHBondContact O-N 2.82Å; L390-L496 VanDerWaalsContact O-N 3.15Å; L390-C497 WeakPolarHBondContact CD1-SG 3.01Å; L390-C497 VanDerWaalsContact CG-SG 3.55Å; L390-C497 WeakPolarHBondContact O-CB 3.31Å; L390-C497 PolarHBondContact O-N 2.86Å; L390-C497 PolarHBondContact O-SG 3.33Å
391	T	98	Very high	88.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.3	171.2	-177.1	0	0	0	0	110.6	F375 Q402 V403 V483 C494	F375-T391 HydrophobicContact CZ-CG2 4.22Å; T391-Q402 CarbonylContact O-C 3.59Å; T391-V403 HydrophobicContact CG2-CB 3.86Å; T391-V403 HydrophobicContact CG2-CG2 3.85Å; T391-V403 PolarHBondContact N-O 3.04Å; T391-V403 PolarHBondContact O-N 2.02Å; T391-V483 HydrophobicContact CG2-CG1 4.03Å; T391-C494 CarbonylContact C-O 3.52Å; T391-C494 WeakPolarHBondContact CA-O 3.44Å
392	K	95.8	Very high	88.4	Confident	60 Å²	60	36.5 Å²	36.5	26%	0.261	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162.6	170.4	72.8	-178.3	179.9	179.7	0	110.2	V389 C394 F401 Q402 L493 C494	V389-K392 HydrophobicContact CG1-CB 4.1Å; V389-K392 HydrophobicContact CG1-CD 3.96Å; V389-K392 HydrophobicContact CG1-CG 3.97Å; K392-C394 WeakPolarHBondContact CG-SG 3.37Å; K392-C394 PolarHBondContact O-SG 3.02Å; K392-C394 VanDerWaalsContact O-SG 3.34Å; K392-F401 WeakPolarHBondContact CA-O 3.41Å; K392-Q402 HydrophobicContact CB-CB 3.51Å; K392-L493 CarbonylContact O-C 3.48Å; K392-L493 VanDerWaalsContact O-CA 3.3Å; K392-L493 WeakPolarHBondContact O-CA 3Å; K392-C494 PolarHBondContact N-O 2.97Å; K392-C494 PolarHBondContact O-N 3.18Å
393	D	94.4	Very high	88.9	Confident	12 Å²	12	36.1 Å²	36.1	6%	0.064	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.9	170.7	-175.3	-20.6	0	0	0	109.9	S395 S399 P400 F401	D393-S395 VanDerWaalsContact OD1-CB 3.25Å; D393-S395 WeakPolarHBondContact OD1-CB 3.14Å; D393-S395 PolarHBondContact OD1-N 2.81Å; D393-S395 PolarHBondContact OD1-OG 3.33Å; D393-S395 PolarHBondContact OD2-OG 3.15Å; D393-S399 PolarHBondContact N-OG 3.24Å; D393-S399 WeakPolarHBondContact O-CA 3.23Å; D393-S399 VanDerWaalsContact O-CB 3.27Å; D393-S399 WeakPolarHBondContact O-CB 3.44Å; D393-S399 PolarHBondContact O-OG 2.88Å; D393-P400 HydrophobicContact CB-CG 3.74Å; D393-P400 VanDerWaalsContact OD2-CG 3.23Å; D393-P400 WeakPolarHBondContact OD2-CG 3.31Å; D393-F401 HydrophobicContact CB-CD1 4.29Å; D393-F401 HydrophobicContact CB-CE1 3.84Å; D393-F401 HydrophobicContact CB-CE2 4.25Å; D393-F401 HydrophobicContact CB-CZ 3.82Å; D393-F401 PolarHBondContact N-O 3.39Å
394	C	92.3	Very high	89.6	Confident	54 Å²	54	34.5 Å²	34.5	37%	0.365	22%	0.222	S	C	.	.			trans	-112.4	8.7	-175	-49.9	0	0	0	0	112.2	K392 S396 K492 C494	K392-C394 WeakPolarHBondContact CG-SG 3.37Å; K392-C394 PolarHBondContact O-SG 3.02Å; K392-C394 VanDerWaalsContact O-SG 3.34Å; C394-S396 VanDerWaalsContact C-N 3.3Å; C394-K492 PolarHBondContact N-O 3.17Å; C394-C494 HydrophobicContact CB-CB 3.92Å; C394-C494 WeakPolarHBondContact CB-SG 3.44Å; C394-C494 WeakPolarHBondContact SG-CB 3.02Å; C394-C494 PolarHBondContact SG-N 2.86Å; C394-C494 VanDerWaalsContact SG-N 3.37Å; C394-C494 CovalentContact SG-SG 2Å; C394-C494 PolarHBondContact SG-SG 3.09Å
395	S	88	Confident	90.2	Very high	78 Å²	78	34.1 Å²	34.1	55%	0.545	22%	0.218	S	C	.	.	S	Bend	trans	-74.4	-19	175.7	68.4	0	0	0	0	113.5	D393	D393-S395 VanDerWaalsContact OD1-CB 3.25Å; D393-S395 WeakPolarHBondContact OD1-CB 3.14Å; D393-S395 PolarHBondContact OD1-N 2.81Å; D393-S395 PolarHBondContact OD1-OG 3.33Å; D393-S395 PolarHBondContact OD2-OG 3.15Å
396	S	79.3	Confident	90.6	Very high	55 Å²	55	35.6 Å²	35.6	39%	0.385	22%	0.222	S	C	.	.	S	Bend	trans	-140.3	143.3	176.9	174.8	0	0	0	0	110.7	C394 A398 S399	C394-S396 VanDerWaalsContact C-N 3.3Å; S396-A398 PolarHBondContact O-N 3.14Å; S396-A398 VanDerWaalsContact O-N 3.13Å; S396-A398 PolarHBondContact OG-N 3.24Å; S396-S399 PolarHBondContact O-N 3.19Å
397	P	74.7	Confident	90.6	Very high	143 Å²	143	35.7 Å²	35.7	93%	0.929	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.4	175.8	-24.3	33	0	0	0	113.8	S399	P397-S399 PolarHBondContact O-N 3.26Å
398	A	73.6	Confident	90.1	Very high	87 Å²	87	36.2 Å²	36.2	72%	0.719	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.7	-178.6	0	0	0	0	0	114.1	S396	S396-A398 PolarHBondContact O-N 3.14Å; S396-A398 VanDerWaalsContact O-N 3.13Å; S396-A398 PolarHBondContact OG-N 3.24Å
399	S	74.4	Confident	89	Confident	27 Å²	27	37.4 Å²	37.4	19%	0.189	24%	0.236	C	C	.	.			trans	29	89.3	-179.8	-161.2	0	0	0	0	113.9	D393 S396 P397 F401	D393-S399 PolarHBondContact N-OG 3.24Å; D393-S399 WeakPolarHBondContact O-CA 3.23Å; D393-S399 VanDerWaalsContact O-CB 3.27Å; D393-S399 WeakPolarHBondContact O-CB 3.44Å; D393-S399 PolarHBondContact O-OG 2.88Å; S396-S399 PolarHBondContact O-N 3.19Å; P397-S399 PolarHBondContact O-N 3.26Å; S399-F401 PolarHBondContact O-N 2.92Å; S399-F401 PolarHBondContact OG-O 3.32Å; S399-F401 VanDerWaalsContact OG-O 3.14Å
400	P	87	Confident	87.7	Confident	68 Å²	68	41.3 Å²	41.3	44%	0.442	25%	0.25	S	C	.	.	S	Bend	trans	-54.5	-24.6	-173.2	20.9	-35.7	0	0	0	114.3	D393	D393-P400 HydrophobicContact CB-CG 3.74Å; D393-P400 VanDerWaalsContact OD2-CG 3.23Å; D393-P400 WeakPolarHBondContact OD2-CG 3.31Å
401	F	94.2	Very high	85.9	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.013	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.6	172	62.2	-95.2	0	0	0	111.5	K392 D393 S399 V424 L425 A469 L471 L489 L493	K392-F401 WeakPolarHBondContact CA-O 3.41Å; D393-F401 HydrophobicContact CB-CD1 4.29Å; D393-F401 HydrophobicContact CB-CE1 3.84Å; D393-F401 HydrophobicContact CB-CE2 4.25Å; D393-F401 HydrophobicContact CB-CZ 3.82Å; D393-F401 PolarHBondContact N-O 3.39Å; S399-F401 PolarHBondContact O-N 2.92Å; S399-F401 PolarHBondContact OG-O 3.32Å; S399-F401 VanDerWaalsContact OG-O 3.14Å; F401-V424 VanDerWaalsContact CA-O 3.23Å; F401-V424 WeakPolarHBondContact CA-O 3.38Å; F401-L425 HydrophobicContact CB-CD2 3.51Å; F401-L425 HydrophobicContact CB-CG 4.41Å; F401-A469 HydrophobicContact CD1-CB 3.63Å; F401-A469 HydrophobicContact CE1-CB 3.96Å; F401-A469 HydrophobicContact CG-CB 4.45Å; F401-L471 HydrophobicContact CD2-CD1 3.28Å; F401-L471 HydrophobicContact CD2-CG 4.13Å; F401-L471 HydrophobicContact CE2-CD1 3.34Å; F401-L471 HydrophobicContact CE2-CD2 4.13Å; F401-L471 HydrophobicContact CE2-CG 3.83Å; F401-L471 HydrophobicContact CG-CD1 4.06Å; F401-L471 HydrophobicContact CZ-CD1 4.13Å; F401-L471 HydrophobicContact CZ-CD2 4.37Å; F401-L471 HydrophobicContact CZ-CG 4.13Å; F401-L489 HydrophobicContact CE1-CD1 4.42Å; F401-L489 HydrophobicContact CE1-CD2 3.91Å; F401-L489 HydrophobicContact CZ-CD1 3.93Å; F401-L489 HydrophobicContact CZ-CD2 3.89Å; F401-L493 HydrophobicContact CE2-CD2 3.82Å; F401-L493 HydrophobicContact CZ-CD2 3.61Å
402	Q	95.3	Very high	84.1	Confident	55 Å²	55	55.8 Å²	55.8	26%	0.257	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.4	166	58	179	-8.6	0	0	110.4	T391 K392 L404 V424	T391-Q402 CarbonylContact O-C 3.59Å; K392-Q402 HydrophobicContact CB-CB 3.51Å; Q402-L404 HydrophobicContact CG-CD2 4.46Å; Q402-V424 HydrophobicContact CG-CB 3.61Å; Q402-V424 HydrophobicContact CG-CG1 4.4Å; Q402-V424 HydrophobicContact CG-CG2 3.9Å; Q402-V424 PolarHBondContact N-O 2.88Å; Q402-V424 PolarHBondContact O-N 2.79Å
403	V	97.6	Very high	82.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.7	174.1	-174.6	0	0	0	0	107.4	L390 T391 V421 E422 L423 L471 I473 V483	L390-V403 HydrophobicContact CB-CG1 4.34Å; L390-V403 WeakPolarHBondContact CB-O 3.47Å; L390-V403 HydrophobicContact CD2-CG1 4.15Å; L390-V403 PolarHBondContact N-O 2.92Å; T391-V403 HydrophobicContact CG2-CB 3.86Å; T391-V403 HydrophobicContact CG2-CG2 3.85Å; T391-V403 PolarHBondContact N-O 3.04Å; T391-V403 PolarHBondContact O-N 2.02Å; V403-V421 HydrophobicContact CG1-CG1 3.66Å; V403-E422 CarbonylContact C-O 3.11Å; V403-E422 WeakPolarHBondContact CA-O 3.49Å; V403-L423 HydrophobicContact CG2-CD1 4.03Å; V403-L471 HydrophobicContact CG2-CD1 3.75Å; V403-I473 HydrophobicContact CG1-CD1 4.08Å; V403-I473 HydrophobicContact CG2-CD1 3.73Å; V403-V483 HydrophobicContact CG1-CG2 4.43Å
404	L	96.8	Very high	80.3	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.037	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.6	-179	-51	178.8	0	0	0	108.9	Q387 Y388 V389 Q402 V421 E422 V424 V528	Q387-L404 HydrophobicContact CG-CB 4.09Å; Y388-L404 WeakPolarHBondContact O-CA 3.42Å; V389-L404 HydrophobicContact CB-CD2 4.38Å; V389-L404 HydrophobicContact CG2-CD2 3.97Å; Q402-L404 HydrophobicContact CG-CD2 4.46Å; L404-V421 CarbonylContact O-C 3.58Å; L404-V421 WeakPolarHBondContact O-CA 3.37Å; L404-E422 HydrophobicContact CB-CB 4.3Å; L404-E422 PolarHBondContact N-O 3.48Å; L404-E422 PolarHBondContact O-N 3.32Å; L404-V424 HydrophobicContact CD1-CG2 4.34Å; L404-V528 HydrophobicContact CD2-CG2 3.99Å
405	V	95.8	Very high	78.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.4	174.9	66.5	0	0	0	0	108.5	Q387 Y388 L390 T418 L496	Q387-V405 CarbonylContact C-O 3.43Å; Q387-V405 WeakPolarHBondContact CA-O 3.34Å; Y388-V405 PolarHBondContact N-O 3.37Å; Y388-V405 PolarHBondContact O-N 2.91Å; L390-V405 HydrophobicContact CB-CB 4.17Å; L390-V405 HydrophobicContact CB-CG1 4.1Å; L390-V405 HydrophobicContact CD1-CG1 4.39Å; L390-V405 HydrophobicContact CD2-CB 4.42Å; V405-T418 HydrophobicContact CG2-CG2 3.58Å; V405-L496 HydrophobicContact CG1-CD1 4.25Å
406	K	93.1	Very high	78.1	Confident	64 Å²	64	59.8 Å²	59.8	28%	0.278	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.8	174.3	-173.6	166.1	-170.9	134.4	0	109.3	K419 S420 E529	K406-K419 WeakPolarHBondContact O-CB 3.23Å; K406-K419 PolarHBondContact O-N 2.9Å; K406-S420 PolarHBondContact N-O 2.92Å; K406-S420 PolarHBondContact O-N 3.19Å; K406-E529 IonicContact NZ-OE1 3.2Å; K406-E529 PolarHBondContact NZ-OE1 2.81Å; K406-E529 IonicContact NZ-OE2 3.37Å
407	N	89.8	Confident	77.8	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	143.7	177.3	-60.8	-23.5	0	0	0	109.4	Y372 G384 T385 C386 W417	Y372-N407 PolarHBondContact OH-ND2 2.94Å; G384-N407 WeakPolarHBondContact O-CB 2.98Å; T385-N407 CarbonylContact C-O 3.57Å; T385-N407 WeakPolarHBondContact CA-O 3.33Å; T385-N407 VanDerWaalsContact O-O 3.13Å; C386-N407 PolarHBondContact N-O 2.93Å; C386-N407 PolarHBondContact O-N 2.91Å; N407-W417 CarbonylContact C-O 3.55Å; N407-W417 VanDerWaalsContact CA-O 3.27Å; N407-W417 WeakPolarHBondContact CA-O 3.19Å
408	D	83	Confident	78.3	Confident	36 Å²	36	52.3 Å²	52.3	19%	0.193	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.3	168.8	76.7	16.5	0	0	0	111.5	R410 S416 W417 K419	D408-R410 PolarHBondContact O-N 3.5Å; D408-R410 WeakPolarHBondContact OD1-CG 3.4Å; D408-R410 PolarHBondContact OD1-N 3.1Å; D408-S416 CarbonylContact O-C 3.55Å; D408-S416 WeakPolarHBondContact O-CA 3.27Å; D408-W417 PolarHBondContact N-O 3.12Å; D408-W417 PolarHBondContact O-N 3.28Å; D408-K419 HydrophobicContact CB-CD 4.43Å; D408-K419 VanDerWaalsContact OD2-CD 3.23Å; D408-K419 WeakPolarHBondContact OD2-CD 3.5Å; D408-K419 WeakPolarHBondContact OD2-CE 3.41Å; D408-K419 IonicContact OD2-NZ 2.72Å; D408-K419 PolarHBondContact OD2-NZ 2.87Å
409	A	71.1	Confident	78.9	Confident	27 Å²	27	52 Å²	52	22%	0.223	24%	0.235	C	C	.	.			trans	-75.7	-1.2	-177.5	0	0	0	0	0	113.9	T385 R411 T412 F415	T385-A409 HydrophobicContact CG2-CB 4.03Å; A409-R411 PolarHBondContact O-N 2.71Å; A409-R411 VanDerWaalsContact O-N 3.14Å; A409-T412 WeakPolarHBondContact CB-O 3.39Å; A409-T412 PolarHBondContact O-N 2.95Å; A409-T412 PolarHBondContact O-OG1 2.97Å; A409-F415 VanDerWaalsContact CA-O 3.25Å; A409-F415 WeakPolarHBondContact CA-O 3.31Å; A409-F415 WeakPolarHBondContact CB-O 3.48Å
410	R	69.9	Low	79.8	Confident	90 Å²	90	51.7 Å²	51.7	34%	0.34	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.6	-115.8	-166	-60.6	-176.7	179.7	-168.6	0.1	111.4	D408 W417 T418 D478	D408-R410 PolarHBondContact O-N 3.5Å; D408-R410 WeakPolarHBondContact OD1-CG 3.4Å; D408-R410 PolarHBondContact OD1-N 3.1Å; R410-W417 HydrophobicContact CG-CB 4.01Å; R410-W417 HydrophobicContact CG-CG 4.17Å; R410-T418 PolarHBondContact NH2-O 3.39Å; R410-T418 VanDerWaalsContact NH2-O 3.14Å; R410-D478 IonicContact CZ-OD1 3.95Å; R410-D478 IonicContact NH1-OD1 2.74Å; R410-D478 PolarHBondContact NH1-OD1 2.99Å; R410-D478 IonicContact NH1-OD2 3.82Å; R410-D478 PolarHBondContact NH2-O 3.39Å; R410-D478 IonicContact NH2-OD1 2.67Å; R410-D478 PolarHBondContact NH2-OD1 3.12Å
411	R	60.3	Low	80.2	Confident	254 Å²	254	48.4 Å²	48.4	96%	0.958	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.3	19	175.8	-61.3	-175.9	-178.6	-178.3	0.3	112.6	A409	A409-R411 PolarHBondContact O-N 2.71Å; A409-R411 VanDerWaalsContact O-N 3.14Å
412	T	59.3	Low	80.3	Confident	50 Å²	50	50.3 Å²	50.3	31%	0.307	22%	0.22	S	C	.	.			trans	-111.7	146.3	-172.9	76	0	0	0	0	111.4	A409 F415	A409-T412 WeakPolarHBondContact CB-O 3.39Å; A409-T412 PolarHBondContact O-N 2.95Å; A409-T412 PolarHBondContact O-OG1 2.97Å; T412-F415 WeakPolarHBondContact OG1-CB 3.33Å; T412-F415 PolarHBondContact OG1-N 2.81Å; T412-F415 PolarHBondContact OG1-O 3.36Å; T412-F415 VanDerWaalsContact OG1-O 3.12Å
413	R	55.4	Low	80.4	Confident	236 Å²	236	47.8 Å²	47.8	89%	0.891	21%	0.208	S	C	*	.	S	Bend	trans	-87.3	-20.8	175	-72.3	-174	177.5	-178.2	-0.7	113.3	R536	R413-R536 PolarHBondContact O-NH2 3.11Å
414	S	55.9	Low	80.3	Confident	23 Å²	23	48.5 Å²	48.5	16%	0.161	21%	0.212	C	C	.	.	S	Bend	trans	-102.1	-29	-173.2	-66.2	0	0	0	0	114.8	R539 E590	S414-R539 VanDerWaalsContact CA-NH2 3.27Å; S414-R539 VanDerWaalsContact CB-NH2 3.34Å; S414-R539 PolarHBondContact O-NH1 2.63Å; S414-R539 PolarHBondContact OG-NH2 2.69Å; S414-E590 WeakPolarHBondContact CB-OE2 3.19Å; S414-E590 PolarHBondContact OG-OE2 2.87Å; S414-E590 VanDerWaalsContact OG-OE2 3.07Å
415	F	63.5	Low	80.1	Confident	29 Å²	29	49.3 Å²	49.3	13%	0.127	22%	0.217	C	C	.	.			trans	-114.4	160	-166.4	-58.2	-66.8	0	0	0	111.3	D369 A409 T412 R536 E590	D369-F415 HydrophobicContact CB-CB 4.28Å; D369-F415 HydrophobicContact CB-CD1 3.7Å; D369-F415 HydrophobicContact CB-CE1 4.33Å; D369-F415 HydrophobicContact CB-CG 4.18Å; D369-F415 WeakPolarHBondContact OD2-CD1 3.5Å; D369-F415 WeakPolarHBondContact OD2-CE1 3.43Å; A409-F415 VanDerWaalsContact CA-O 3.25Å; A409-F415 WeakPolarHBondContact CA-O 3.31Å; A409-F415 WeakPolarHBondContact CB-O 3.48Å; T412-F415 WeakPolarHBondContact OG1-CB 3.33Å; T412-F415 PolarHBondContact OG1-N 2.81Å; T412-F415 PolarHBondContact OG1-O 3.36Å; T412-F415 VanDerWaalsContact OG1-O 3.12Å; F415-R536 PolarHBondContact O-NH1 2.88Å; F415-R536 PolarHBondContact O-NH2 2.79Å; F415-R536 VanDerWaalsContact O-NH2 3.14Å; F415-E590 HydrophobicContact CE2-CB 3.43Å; F415-E590 VanDerWaalsContact CE2-CB 3.43Å; F415-E590 VanDerWaalsContact CE2-CD 3.5Å; F415-E590 HydrophobicContact CE2-CG 3.96Å; F415-E590 WeakPolarHBondContact CE2-OE2 3.08Å; F415-E590 HydrophobicContact CZ-CB 3.34Å; F415-E590 HydrophobicContact CZ-CG 3.47Å; F415-E590 VanDerWaalsContact CZ-CG 3.47Å; F415-E590 WeakPolarHBondContact CZ-OE2 3.37Å
416	S	69.8	Low	79.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.248	C	C	.	.			trans	-115.3	162	160.3	67.7	0	0	0	0	108.2	P370 Q383 G384 D408	P370-S416 VanDerWaalsContact CD-O 3.25Å; P370-S416 WeakPolarHBondContact CD-O 3.28Å; P370-S416 WeakPolarHBondContact CD-OG 3.4Å; P370-S416 WeakPolarHBondContact CG-OG 3.49Å; Q383-S416 WeakPolarHBondContact CA-OG 3.34Å; Q383-S416 PolarHBondContact OE1-OG 2.99Å; G384-S416 VanDerWaalsContact O-CB 3.22Å; G384-S416 WeakPolarHBondContact O-CB 3.24Å; G384-S416 PolarHBondContact O-OG 2.89Å; D408-S416 CarbonylContact O-C 3.55Å; D408-S416 WeakPolarHBondContact O-CA 3.27Å
417	W	74.2	Confident	79.4	Confident	42 Å²	42	58.2 Å²	58.2	16%	0.159	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	146	174.7	-71.1	74.9	0	0	0	107.6	N407 D408 R410 K419 E600	N407-W417 CarbonylContact C-O 3.55Å; N407-W417 VanDerWaalsContact CA-O 3.27Å; N407-W417 WeakPolarHBondContact CA-O 3.19Å; D408-W417 PolarHBondContact N-O 3.12Å; D408-W417 PolarHBondContact O-N 3.28Å; R410-W417 HydrophobicContact CG-CB 4.01Å; R410-W417 HydrophobicContact CG-CG 4.17Å; W417-K419 PolarHBondContact O-N 3.07Å; W417-E600 HydrophobicContact CH2-CG 4.25Å; W417-E600 HydrophobicContact CZ3-CG 4.12Å
418	T	83.7	Confident	79.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	130.8	170.5	-46.2	0	0	0	0	109.2	V405 R410 V421 W475 S479 V481	V405-T418 HydrophobicContact CG2-CG2 3.58Å; R410-T418 PolarHBondContact NH2-O 3.39Å; R410-T418 VanDerWaalsContact NH2-O 3.14Å; T418-V421 HydrophobicContact CG2-CG2 4.43Å; T418-W475 HydrophobicContact CG2-CH2 3.59Å; T418-W475 HydrophobicContact CG2-CZ3 3.49Å; T418-W475 VanDerWaalsContact CG2-CZ3 3.49Å; T418-S479 WeakPolarHBondContact CB-O 3.39Å; T418-S479 PolarHBondContact OG1-O 3.37Å; T418-V481 HydrophobicContact CG2-CG2 3.79Å
419	K	87.4	Confident	80	Confident	81 Å²	81	64.5 Å²	64.5	35%	0.352	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-40	178.6	-173.7	-165.4	-166.6	128.8	0	111.1	K406 D408 W417 Q434	K406-K419 WeakPolarHBondContact O-CB 3.23Å; K406-K419 PolarHBondContact O-N 2.9Å; D408-K419 HydrophobicContact CB-CD 4.43Å; D408-K419 VanDerWaalsContact OD2-CD 3.23Å; D408-K419 WeakPolarHBondContact OD2-CD 3.5Å; D408-K419 WeakPolarHBondContact OD2-CE 3.41Å; D408-K419 IonicContact OD2-NZ 2.72Å; D408-K419 PolarHBondContact OD2-NZ 2.87Å; W417-K419 PolarHBondContact O-N 3.07Å; K419-Q434 WeakPolarHBondContact O-CG 3.36Å
420	S	92.5	Very high	81.2	Confident	19 Å²	19	63.3 Å²	63.3	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	154.1	-179.5	56.9	0	0	0	0	111.5	K406 L432	K406-S420 PolarHBondContact N-O 2.92Å; K406-S420 PolarHBondContact O-N 3.19Å; S420-L432 CarbonylContact C-O 3.5Å; S420-L432 WeakPolarHBondContact CA-O 3.4Å; S420-L432 VanDerWaalsContact CB-O 3.23Å; S420-L432 WeakPolarHBondContact CB-O 3.4Å
421	V	96.3	Very high	82.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.2	172.4	-175.5	0	0	0	0	108.4	V403 L404 T418 L432 I473 W475 V481	V403-V421 HydrophobicContact CG1-CG1 3.66Å; L404-V421 CarbonylContact O-C 3.58Å; L404-V421 WeakPolarHBondContact O-CA 3.37Å; T418-V421 HydrophobicContact CG2-CG2 4.43Å; V421-L432 HydrophobicContact CB-CB 4.32Å; V421-L432 HydrophobicContact CB-CD1 4.38Å; V421-L432 PolarHBondContact N-O 3.48Å; V421-L432 PolarHBondContact O-N 3.16Å; V421-I473 HydrophobicContact CG1-CG2 4.21Å; V421-W475 HydrophobicContact CG2-CD2 4.34Å; V421-W475 HydrophobicContact CG2-CE3 3.95Å; V421-W475 HydrophobicContact CG2-CZ3 4.31Å; V421-V481 HydrophobicContact CG1-CG1 4.48Å; V421-V481 HydrophobicContact CG2-CB 4.3Å; V421-V481 HydrophobicContact CG2-CG1 3.81Å; V421-V481 HydrophobicContact CG2-CG2 3.45Å; V421-V481 VanDerWaalsContact CG2-CG2 3.45Å
422	E	96.8	Very high	84.1	Confident	42 Å²	42	48.1 Å²	48.1	20%	0.196	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.4	177.8	-172.8	-177.8	-179.4	0	0	110.1	Q387 V403 L404 V424 R429 V430	Q387-E422 PolarHBondContact NE2-OE2 2.72Å; Q387-E422 VanDerWaalsContact NE2-OE2 3.11Å; V403-E422 CarbonylContact C-O 3.11Å; V403-E422 WeakPolarHBondContact CA-O 3.49Å; L404-E422 HydrophobicContact CB-CB 4.3Å; L404-E422 PolarHBondContact N-O 3.48Å; L404-E422 PolarHBondContact O-N 3.32Å; E422-V424 HydrophobicContact CG-CG2 4.37Å; E422-R429 WeakPolarHBondContact OE1-CD 2.97Å; E422-R429 IonicContact OE1-NE 3.54Å; E422-V430 CarbonylContact C-O 3.52Å; E422-V430 WeakPolarHBondContact CA-O 3.36Å
423	L	97	Very high	85.3	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.3	172	170.4	66.5	0	0	0	109	V403 L425 R429 V430 V465 T467 I473	V403-L423 HydrophobicContact CG2-CD1 4.03Å; L423-L425 HydrophobicContact CD1-CD1 4.24Å; L423-L425 HydrophobicContact CD1-CD2 4.42Å; L423-L425 HydrophobicContact CD1-CG 3.88Å; L423-L425 HydrophobicContact CD2-CD1 3.58Å; L423-L425 HydrophobicContact CD2-CG 4.13Å; L423-L425 HydrophobicContact CG-CD1 3.92Å; L423-L425 HydrophobicContact CG-CG 3.9Å; L423-R429 WeakPolarHBondContact O-CA 3.33Å; L423-V430 HydrophobicContact CB-CB 4.32Å; L423-V430 PolarHBondContact N-O 2.96Å; L423-V430 PolarHBondContact O-N 2.86Å; L423-V465 HydrophobicContact CD2-CG1 3.63Å; L423-T467 HydrophobicContact CD2-CG2 3.65Å; L423-I473 HydrophobicContact CB-CD1 4.07Å; L423-I473 HydrophobicContact CD1-CD1 4.1Å; L423-I473 HydrophobicContact CD2-CD1 4.16Å; L423-I473 HydrophobicContact CG-CD1 4.34Å
424	V	95.3	Very high	86.5	Confident	14 Å²	14	39.5 Å²	39.5	9%	0.085	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.9	172.3	-171.1	0	0	0	0	108.1	F401 Q402 L404 E422 S428 R429	F401-V424 VanDerWaalsContact CA-O 3.23Å; F401-V424 WeakPolarHBondContact CA-O 3.38Å; Q402-V424 HydrophobicContact CG-CB 3.61Å; Q402-V424 HydrophobicContact CG-CG1 4.4Å; Q402-V424 HydrophobicContact CG-CG2 3.9Å; Q402-V424 PolarHBondContact N-O 2.88Å; Q402-V424 PolarHBondContact O-N 2.79Å; L404-V424 HydrophobicContact CD1-CG2 4.34Å; E422-V424 HydrophobicContact CG-CG2 4.37Å; V424-S428 WeakPolarHBondContact CA-O 3.27Å; V424-R429 HydrophobicContact CG1-CG 4.32Å; V424-R429 HydrophobicContact CG2-CG 4.32Å
425	L	92.1	Very high	87.5	Confident	24 Å²	24	46.2 Å²	46.2	13%	0.126	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	95.6	179.4	-79.5	167.9	0	0	0	108.8	F401 L423 E427 S428 F454 T467 A469	F401-L425 HydrophobicContact CB-CD2 3.51Å; F401-L425 HydrophobicContact CB-CG 4.41Å; L423-L425 HydrophobicContact CD1-CD1 4.24Å; L423-L425 HydrophobicContact CD1-CD2 4.42Å; L423-L425 HydrophobicContact CD1-CG 3.88Å; L423-L425 HydrophobicContact CD2-CD1 3.58Å; L423-L425 HydrophobicContact CD2-CG 4.13Å; L423-L425 HydrophobicContact CG-CD1 3.92Å; L423-L425 HydrophobicContact CG-CG 3.9Å; L425-E427 PolarHBondContact O-N 3.43Å; L425-S428 PolarHBondContact N-O 2.64Å; L425-S428 WeakPolarHBondContact O-CB 3.4Å; L425-S428 PolarHBondContact O-N 2.8Å; L425-F454 HydrophobicContact CD1-CB 4.04Å; L425-F454 HydrophobicContact CD1-CD1 3.93Å; L425-F454 HydrophobicContact CD1-CG 4.34Å; L425-T467 HydrophobicContact CD1-CG2 3.87Å; L425-A469 HydrophobicContact CD2-CB 4.45Å
426	G	86.8	Confident	88.1	Confident	63 Å²	63	46.9 Å²	46.9	65%	0.649	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	-119.5	-169.2	0	0	0	0	0	111
427	E	86.6	Confident	88.7	Confident	189 Å²	189	47.9 Å²	47.9	88%	0.883	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-12.2	177.6	-60.4	-175.6	165.9	0	0	113.9	L425	L425-E427 PolarHBondContact O-N 3.43Å
428	S	91.8	Very high	89.4	Confident	27 Å²	27	46 Å²	46	19%	0.189	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130.5	-179	-69.5	0	0	0	0	111.6	V424 L425	V424-S428 WeakPolarHBondContact CA-O 3.27Å; L425-S428 PolarHBondContact N-O 2.64Å; L425-S428 WeakPolarHBondContact O-CB 3.4Å; L425-S428 PolarHBondContact O-N 2.8Å
429	R	95.2	Very high	89.9	Confident	142 Å²	142	51.1 Å²	51.1	54%	0.536	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.8	173.4	-70.3	-176.9	160.2	111.2	-2.7	110.8	E422 L423 V424 W440 N441	E422-R429 WeakPolarHBondContact OE1-CD 2.97Å; E422-R429 IonicContact OE1-NE 3.54Å; L423-R429 WeakPolarHBondContact O-CA 3.33Å; V424-R429 HydrophobicContact CG1-CG 4.32Å; V424-R429 HydrophobicContact CG2-CG 4.32Å; R429-W440 CarbonylContact O-C 3.45Å; R429-W440 WeakPolarHBondContact O-CA 3.45Å; R429-N441 PolarHBondContact N-OD1 2.88Å; R429-N441 PolarHBondContact O-N 3.35Å
430	V	96.3	Very high	90.2	Very high	2 Å²	2	51 Å²	51	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.5	175.6	178.1	0	0	0	0	108.6	E422 L423 L432 V438 R439 F454 I456	E422-V430 CarbonylContact C-O 3.52Å; E422-V430 WeakPolarHBondContact CA-O 3.36Å; L423-V430 HydrophobicContact CB-CB 4.32Å; L423-V430 PolarHBondContact N-O 2.96Å; L423-V430 PolarHBondContact O-N 2.86Å; V430-L432 HydrophobicContact CG1-CD2 4.07Å; V430-V438 HydrophobicContact CG1-CG1 4.12Å; V430-R439 CarbonylContact C-O 3.53Å; V430-R439 WeakPolarHBondContact CA-O 3.26Å; V430-F454 HydrophobicContact CG2-CD1 4.47Å; V430-F454 HydrophobicContact CG2-CD2 4.21Å; V430-F454 HydrophobicContact CG2-CE1 3.99Å; V430-F454 HydrophobicContact CG2-CE2 3.7Å; V430-F454 HydrophobicContact CG2-CZ 3.57Å; V430-I456 HydrophobicContact CG1-CD1 3.5Å; V430-I456 HydrophobicContact CG2-CD1 4.31Å
431	S	96.1	Very high	90.2	Very high	23 Å²	23	54.6 Å²	54.6	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.8	177.7	-179.7	0	0	0	0	110.1	Q433 V438 R439	S431-Q433 PolarHBondContact OG-NE2 2.91Å; S431-V438 WeakPolarHBondContact O-CA 2.74Å; S431-R439 PolarHBondContact N-O 2.92Å; S431-R439 PolarHBondContact O-N 3.1Å
432	L	93.1	Very high	89.9	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.8	172.2	-48.9	-179.5	0	0	0	107.9	S420 V421 V430 V438 V465 I473 W475	S420-L432 CarbonylContact C-O 3.5Å; S420-L432 WeakPolarHBondContact CA-O 3.4Å; S420-L432 VanDerWaalsContact CB-O 3.23Å; S420-L432 WeakPolarHBondContact CB-O 3.4Å; V421-L432 HydrophobicContact CB-CB 4.32Å; V421-L432 HydrophobicContact CB-CD1 4.38Å; V421-L432 PolarHBondContact N-O 3.48Å; V421-L432 PolarHBondContact O-N 3.16Å; V430-L432 HydrophobicContact CG1-CD2 4.07Å; L432-V438 HydrophobicContact CD2-CG1 4.04Å; L432-V438 HydrophobicContact CD2-CG2 3.98Å; L432-V465 HydrophobicContact CD1-CG2 3.83Å; L432-V465 HydrophobicContact CD2-CG2 3.77Å; L432-V465 HydrophobicContact CG-CG2 4.32Å; L432-I473 HydrophobicContact CD1-CG2 4.1Å; L432-W475 HydrophobicContact CB-CB 4.44Å; L432-W475 HydrophobicContact CB-CG 4.16Å; L432-W475 HydrophobicContact CD1-CB 3.91Å; L432-W475 HydrophobicContact CD1-CG 4.49Å
433	Q	86.3	Confident	89.7	Confident	50 Å²	50	59 Å²	59	23%	0.234	32%	0.315	C	S	.	.			trans	-106.5	172.9	-175.2	-55.9	-175.3	-22.9	0	0	110.5	S431 T437 W475	S431-Q433 PolarHBondContact OG-NE2 2.91Å; Q433-T437 WeakPolarHBondContact CB-O 3.34Å; Q433-T437 PolarHBondContact N-O 2.97Å; Q433-W475 PolarHBondContact O-NE1 3.47Å
434	Q	80.4	Confident	89.4	Confident	54 Å²	54	67.8 Å²	67.8	25%	0.252	35%	0.348	S	S	.	.	S	Bend	trans	-58.7	159	173.1	-67.1	177.1	-55.2	0	0	111.9	K419 L436 T437 G477	K419-Q434 WeakPolarHBondContact O-CG 3.36Å; Q434-L436 PolarHBondContact O-N 3.37Å; Q434-T437 PolarHBondContact O-N 3.15Å; Q434-G477 CarbonylContact C-O 3.55Å; Q434-G477 WeakPolarHBondContact CA-O 3.19Å
435	H	75.6	Confident	89.1	Confident	164 Å²	164	69 Å²	69	76%	0.759	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	36.6	-178.2	-47.8	-64.9	0	0	0	113	T437 G477	H435-T437 PolarHBondContact O-N 2.84Å; H435-G477 PolarHBondContact N-O 3.37Å
436	L	76.7	Confident	88.7	Confident	43 Å²	43	71.8 Å²	71.8	23%	0.225	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	28.8	177.9	-49.8	173.5	0	0	0	113.8	Q434 L458 L463	Q434-L436 PolarHBondContact O-N 3.37Å; L436-L458 HydrophobicContact CD1-CD2 4.26Å; L436-L463 VanDerWaalsContact CA-CD1 3.49Å; L436-L463 HydrophobicContact CB-CD1 3.91Å; L436-L463 HydrophobicContact CB-CG 4.14Å; L436-L463 HydrophobicContact CD2-CD1 4.01Å; L436-L463 HydrophobicContact CD2-CG 3.83Å
437	T	82.1	Confident	88.4	Confident	21 Å²	21	71.3 Å²	71.3	13%	0.129	36%	0.362	C	S	.	.			trans	-83.5	121.6	178.7	-67.4	0	0	0	0	110.2	Q433 Q434 H435 R444	Q433-T437 WeakPolarHBondContact CB-O 3.34Å; Q433-T437 PolarHBondContact N-O 2.97Å; Q434-T437 PolarHBondContact O-N 3.15Å; H435-T437 PolarHBondContact O-N 2.84Å; T437-R444 HydrophobicContact CG2-CG 4.25Å; T437-R444 PolarHBondContact OG1-NH2 3.38Å
438	V	89.2	Confident	88.5	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.8	177.2	-173.7	0	0	0	0	110.2	V430 S431 L432 R444 I445 L447 I456 L463	V430-V438 HydrophobicContact CG1-CG1 4.12Å; S431-V438 WeakPolarHBondContact O-CA 2.74Å; L432-V438 HydrophobicContact CD2-CG1 4.04Å; L432-V438 HydrophobicContact CD2-CG2 3.98Å; V438-R444 WeakPolarHBondContact O-CA 3.06Å; V438-I445 HydrophobicContact CB-CD1 4.3Å; V438-I445 HydrophobicContact CB-CG1 3.92Å; V438-I445 HydrophobicContact CG1-CD1 3.65Å; V438-I445 HydrophobicContact CG1-CG1 3.76Å; V438-I445 PolarHBondContact O-N 3.38Å; V438-L447 HydrophobicContact CG2-CD1 4.24Å; V438-L447 HydrophobicContact CG2-CD2 4.3Å; V438-I456 HydrophobicContact CG1-CD1 3.91Å; V438-I456 HydrophobicContact CG2-CG2 4.47Å; V438-L463 HydrophobicContact CG2-CD1 3.64Å; V438-L463 HydrophobicContact CG2-CD2 3.76Å; V438-L463 HydrophobicContact CG2-CG 4.34Å
439	R	93.4	Very high	88.3	Confident	108 Å²	108	66.2 Å²	66.2	41%	0.408	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.5	170.2	-57.8	-175	-176	-152.7	-1.4	110.6	V430 S431 S443	V430-R439 CarbonylContact C-O 3.53Å; V430-R439 WeakPolarHBondContact CA-O 3.26Å; S431-R439 PolarHBondContact N-O 2.92Å; S431-R439 PolarHBondContact O-N 3.1Å; R439-S443 CarbonylContact C-O 3.44Å; R439-S443 WeakPolarHBondContact CA-O 3.42Å
440	W	94.2	Very high	88.1	Confident	80 Å²	80	69.8 Å²	69.8	30%	0.303	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.2	170.3	177.1	24.5	0	0	0	108.6	R429 G442 S443 I445 A451 F454	R429-W440 CarbonylContact O-C 3.45Å; R429-W440 WeakPolarHBondContact O-CA 3.45Å; W440-G442 PolarHBondContact O-N 3.24Å; W440-S443 PolarHBondContact N-O 3.06Å; W440-S443 PolarHBondContact O-N 2.72Å; W440-I445 HydrophobicContact CB-CD1 4.27Å; W440-I445 HydrophobicContact CB-CG2 3.88Å; W440-I445 HydrophobicContact CE3-CG2 4.47Å; W440-A451 HydrophobicContact CH2-CB 4.27Å; W440-A451 HydrophobicContact CZ2-CB 4.46Å; W440-F454 AromaticContact CD2-CZ 3.99Å; W440-F454 HydrophobicContact CD2-CZ 3.99Å; W440-F454 AromaticContact CE2-CZ 3.78Å; W440-F454 HydrophobicContact CG-CZ 4.18Å; W440-F454 HydrophobicContact CZ2-CZ 4.23Å; W440-F454 AromaticContact NE1-CZ 3.8Å
441	N	93.1	Very high	87.9	Confident	94 Å²	94	70.4 Å²	70.4	50%	0.503	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	43	-175.8	-65.9	-9.4	0	0	0	112.6	R429 S443	R429-N441 PolarHBondContact N-OD1 2.88Å; R429-N441 PolarHBondContact O-N 3.35Å; N441-S443 VanDerWaalsContact C-N 3.25Å; N441-S443 PolarHBondContact O-N 3.06Å
442	G	90.3	Very high	87.6	Confident	54 Å²	54	73.4 Å²	73.4	56%	0.557	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-18.4	-180	0	0	0	0	0	115.4	W440	W440-G442 PolarHBondContact O-N 3.24Å
443	S	91.2	Very high	87.5	Confident	80 Å²	80	78.9 Å²	78.9	56%	0.559	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	133.8	-178.7	-63.5	0	0	0	0	111.7	R439 W440 N441	R439-S443 CarbonylContact C-O 3.44Å; R439-S443 WeakPolarHBondContact CA-O 3.42Å; W440-S443 PolarHBondContact N-O 3.06Å; W440-S443 PolarHBondContact O-N 2.72Å; N441-S443 VanDerWaalsContact C-N 3.25Å; N441-S443 PolarHBondContact O-N 3.06Å
444	R	90.7	Very high	87.8	Confident	187 Å²	187	77 Å²	77	71%	0.706	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	134.4	175.5	-170.6	178.5	-173.9	176.7	5.3	109.9	T437 V438	T437-R444 HydrophobicContact CG2-CG 4.25Å; T437-R444 PolarHBondContact OG1-NH2 3.38Å; V438-R444 WeakPolarHBondContact O-CA 3.06Å
445	I	88.9	Confident	88.5	Confident	39 Å²	39	77 Å²	77	20%	0.2	40%	0.399	C	S	.	.			trans	-116	156.3	-179.4	62.4	170.2	0	0	0	111.7	V438 W440 C449 I456	V438-I445 HydrophobicContact CB-CD1 4.3Å; V438-I445 HydrophobicContact CB-CG1 3.92Å; V438-I445 HydrophobicContact CG1-CD1 3.65Å; V438-I445 HydrophobicContact CG1-CG1 3.76Å; V438-I445 PolarHBondContact O-N 3.38Å; W440-I445 HydrophobicContact CB-CD1 4.27Å; W440-I445 HydrophobicContact CB-CG2 3.88Å; W440-I445 HydrophobicContact CE3-CG2 4.47Å; I445-C449 HydrophobicContact CD1-CB 3.74Å; I445-I456 HydrophobicContact CD1-CD1 4.02Å
446	A	84.4	Confident	89.3	Confident	84 Å²	84	69.2 Å²	69.2	69%	0.694	36%	0.363	S	S	*	.			trans	-87.5	160.1	167.6	0	0	0	0	0	110.7
447	L	81.5	Confident	89.8	Confident	53 Å²	53	70 Å²	70	28%	0.277	37%	0.368	S	S	.	.	S	Bend	trans	-116	147.5	179.6	-60.2	173	0	0	0	110.1	V438 C449 I456 L458 L463	V438-L447 HydrophobicContact CG2-CD1 4.24Å; V438-L447 HydrophobicContact CG2-CD2 4.3Å; L447-C449 HydrophobicContact CD2-CB 4.49Å; L447-I456 HydrophobicContact CD2-CB 3.91Å; L447-I456 HydrophobicContact CD2-CG2 3.52Å; L447-L458 HydrophobicContact CD1-CD1 4.39Å; L447-L458 HydrophobicContact CD1-CD2 4.46Å; L447-L458 HydrophobicContact CD1-CG 4.07Å; L447-L463 HydrophobicContact CD1-CD2 3.16Å; L447-L463 HydrophobicContact CG-CD2 4.5Å
448	P	87.6	Confident	89.5	Confident	91 Å²	91	72.6 Å²	72.6	59%	0.591	38%	0.38	S	S	*	.	S	Bend	cis	-71	152.8	-4.1	29.7	-35.2	0	0	0	112.6	I456 D457	P448-I456 CarbonylContact C-O 3.6Å; P448-I456 WeakPolarHBondContact CA-O 3.29Å; P448-D457 HydrophobicContact CB-CB 4.45Å
449	C	87.6	Confident	88.5	Confident	18 Å²	18	76.9 Å²	76.9	12%	0.122	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	124.2	176.4	175.2	0	0	0	0	110.5	I445 L447 H455 I456	I445-C449 HydrophobicContact CD1-CB 3.74Å; L447-C449 HydrophobicContact CD2-CB 4.49Å; C449-H455 CarbonylContact O-C 3.59Å; C449-H455 WeakPolarHBondContact O-CA 3.32Å; C449-I456 HydrophobicContact CB-CB 4.37Å; C449-I456 PolarHBondContact N-O 3.09Å; C449-I456 PolarHBondContact O-N 3.5Å
450	R	92.3	Very high	87.2	Confident	216 Å²	216	75 Å²	75	82%	0.815	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	113.1	178.3	-167.2	179.9	-72.9	179	-1.8	110.1
451	A	90.8	Very high	86	Confident	15 Å²	15	75.2 Å²	75.2	12%	0.124	42%	0.419	C	S	.	.			trans	-110	167.9	175.9	0	0	0	0	0	110.9	W440 H453 F454	W440-A451 HydrophobicContact CH2-CB 4.27Å; W440-A451 HydrophobicContact CZ2-CB 4.46Å; A451-H453 VanDerWaalsContact C-N 3.27Å; A451-H453 PolarHBondContact O-N 3.2Å; A451-F454 CarbonylContact C-O 3.42Å; A451-F454 WeakPolarHBondContact CA-O 3.43Å; A451-F454 HydrophobicContact CB-CD1 3.95Å; A451-F454 HydrophobicContact CB-CD2 3.93Å; A451-F454 HydrophobicContact CB-CE1 3.63Å; A451-F454 HydrophobicContact CB-CE2 3.6Å; A451-F454 HydrophobicContact CB-CG 4.09Å; A451-F454 HydrophobicContact CB-CZ 3.44Å; A451-F454 VanDerWaalsContact CB-CZ 3.44Å; A451-F454 WeakPolarHBondContact CB-O 3.03Å; A451-F454 PolarHBondContact N-O 3.26Å; A451-F454 VanDerWaalsContact O-O 3.04Å
452	P	89.3	Confident	84.9	Confident	87 Å²	87	72 Å²	72	57%	0.565	40%	0.401	S	S	*	.	S	Bend	trans	-59.1	-32.2	-179.1	-27.6	36	0	0	0	114.7	K468	P452-K468 VanDerWaalsContact O-CD 3.32Å; P452-K468 WeakPolarHBondContact O-CD 3.09Å; P452-K468 WeakPolarHBondContact O-CE 3.39Å; P452-K468 PolarHBondContact O-NZ 3.26Å
453	H	91.2	Very high	84.7	Confident	117 Å²	117	69.4 Å²	69.4	54%	0.542	38%	0.375	S	S	.	.	S	Bend	trans	-114.6	-10.9	-174.5	-60.3	-69.8	0	0	0	114.6	A451 K468	A451-H453 VanDerWaalsContact C-N 3.27Å; A451-H453 PolarHBondContact O-N 3.2Å; H453-K468 PolarHBondContact O-N 3.08Å
454	F	94.1	Very high	84.6	Confident	9 Å²	9	67.7 Å²	67.7	4%	0.039	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	158.4	-178.7	63.9	-93.8	0	0	0	112	L425 V430 W440 A451 I456 V465 T466 T467	L425-F454 HydrophobicContact CD1-CB 4.04Å; L425-F454 HydrophobicContact CD1-CD1 3.93Å; L425-F454 HydrophobicContact CD1-CG 4.34Å; V430-F454 HydrophobicContact CG2-CD1 4.47Å; V430-F454 HydrophobicContact CG2-CD2 4.21Å; V430-F454 HydrophobicContact CG2-CE1 3.99Å; V430-F454 HydrophobicContact CG2-CE2 3.7Å; V430-F454 HydrophobicContact CG2-CZ 3.57Å; W440-F454 AromaticContact CD2-CZ 3.99Å; W440-F454 HydrophobicContact CD2-CZ 3.99Å; W440-F454 AromaticContact CE2-CZ 3.78Å; W440-F454 HydrophobicContact CG-CZ 4.18Å; W440-F454 HydrophobicContact CZ2-CZ 4.23Å; W440-F454 AromaticContact NE1-CZ 3.8Å; A451-F454 CarbonylContact C-O 3.42Å; A451-F454 WeakPolarHBondContact CA-O 3.43Å; A451-F454 HydrophobicContact CB-CD1 3.95Å; A451-F454 HydrophobicContact CB-CD2 3.93Å; A451-F454 HydrophobicContact CB-CE1 3.63Å; A451-F454 HydrophobicContact CB-CE2 3.6Å; A451-F454 HydrophobicContact CB-CG 4.09Å; A451-F454 HydrophobicContact CB-CZ 3.44Å; A451-F454 VanDerWaalsContact CB-CZ 3.44Å; A451-F454 WeakPolarHBondContact CB-O 3.03Å; A451-F454 PolarHBondContact N-O 3.26Å; A451-F454 VanDerWaalsContact O-O 3.04Å; F454-I456 HydrophobicContact CD2-CD1 3.92Å; F454-I456 HydrophobicContact CD2-CG1 3.76Å; F454-I456 HydrophobicContact CE2-CD1 3.73Å; F454-I456 HydrophobicContact CE2-CG1 4.02Å; F454-V465 HydrophobicContact CB-CG1 4.46Å; F454-T466 CarbonylContact C-O 3.59Å; F454-T466 VanDerWaalsContact CA-O 3.22Å; F454-T466 WeakPolarHBondContact CA-O 3.19Å; F454-T467 HydrophobicContact CB-CG2 4.3Å
455	H	94.8	Very high	84.8	Confident	55 Å²	55	58.8 Å²	58.8	26%	0.255	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	136.6	175.5	177.3	-100.3	0	0	0	108.7	C449 D457 V465 T466	C449-H455 CarbonylContact O-C 3.59Å; C449-H455 WeakPolarHBondContact O-CA 3.32Å; H455-D457 IonicContact CE1-OD2 3.67Å; H455-V465 CarbonylContact O-C 3.42Å; H455-V465 WeakPolarHBondContact O-CA 3.35Å; H455-T466 PolarHBondContact N-O 2.93Å; H455-T466 PolarHBondContact O-N 2.64Å
456	I	92.8	Very high	85.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.7	180	-44.8	-178.8	0	0	0	108.7	V430 V438 I445 L447 P448 C449 F454 K464 V465	V430-I456 HydrophobicContact CG1-CD1 3.5Å; V430-I456 HydrophobicContact CG2-CD1 4.31Å; V438-I456 HydrophobicContact CG1-CD1 3.91Å; V438-I456 HydrophobicContact CG2-CG2 4.47Å; I445-I456 HydrophobicContact CD1-CD1 4.02Å; L447-I456 HydrophobicContact CD2-CB 3.91Å; L447-I456 HydrophobicContact CD2-CG2 3.52Å; P448-I456 CarbonylContact C-O 3.6Å; P448-I456 WeakPolarHBondContact CA-O 3.29Å; C449-I456 HydrophobicContact CB-CB 4.37Å; C449-I456 PolarHBondContact N-O 3.09Å; C449-I456 PolarHBondContact O-N 3.5Å; F454-I456 HydrophobicContact CD2-CD1 3.92Å; F454-I456 HydrophobicContact CD2-CG1 3.76Å; F454-I456 HydrophobicContact CE2-CD1 3.73Å; F454-I456 HydrophobicContact CE2-CG1 4.02Å; I456-K464 VanDerWaalsContact CA-O 3.31Å; I456-K464 WeakPolarHBondContact CA-O 2.94Å; I456-V465 HydrophobicContact CD1-CG2 4.35Å; I456-V465 HydrophobicContact CG1-CG1 4.23Å; I456-V465 HydrophobicContact CG1-CG2 4.1Å; I456-V465 HydrophobicContact CG2-CG2 4.01Å
457	D	87.1	Confident	85.7	Confident	61 Å²	61	56 Å²	56	33%	0.326	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	174.9	179.9	-152.4	-7.5	0	0	0	111.2	P448 H455 K464	P448-D457 HydrophobicContact CB-CB 4.45Å; H455-D457 IonicContact CE1-OD2 3.67Å; D457-K464 PolarHBondContact N-O 2.71Å; D457-K464 PolarHBondContact O-N 3.01Å
458	L	75.4	Confident	86.2	Confident	74 Å²	74	61.4 Å²	61.4	39%	0.387	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.2	169.1	-73.3	167.6	0	0	0	110	L436 L447 L462 L463	L436-L458 HydrophobicContact CD1-CD2 4.26Å; L447-L458 HydrophobicContact CD1-CD1 4.39Å; L447-L458 HydrophobicContact CD1-CD2 4.46Å; L447-L458 HydrophobicContact CD1-CG 4.07Å; L458-L462 WeakPolarHBondContact CA-O 3.45Å; L458-L463 HydrophobicContact CD2-CD2 3.58Å; L458-L463 HydrophobicContact CD2-CG 4.01Å; L458-L463 HydrophobicContact CG-CD2 4.25Å
459	D	68.6	Low	86.3	Confident	93 Å²	93	58.5 Å²	58.5	50%	0.497	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	90.2	170.8	-166.2	-2.3	0	0	0	107.9	Y461 L462 K464	D459-Y461 PolarHBondContact O-N 3.14Å; D459-Y461 VanDerWaalsContact O-N 3.16Å; D459-L462 PolarHBondContact N-O 2.86Å; D459-L462 PolarHBondContact O-N 3.49Å; D459-L462 VanDerWaalsContact O-N 3.1Å; D459-K464 HydrophobicContact CB-CB 4.26Å; D459-K464 HydrophobicContact CB-CD 3.85Å; D459-K464 IonicContact OD2-NZ 3.44Å; D459-K464 PolarHBondContact OD2-NZ 2.01Å
460	G	66.1	Low	86.6	Confident	69 Å²	69	58.5 Å²	58.5	71%	0.711	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	-110.7	-166.5	0	0	0	0	0	111.4
461	Y	68.2	Low	86.8	Confident	84 Å²	84	48.3 Å²	48.3	33%	0.329	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	0.4	177.2	64.8	-91.4	0	0	0	113	D459 D476 R607	D459-Y461 PolarHBondContact O-N 3.14Å; D459-Y461 VanDerWaalsContact O-N 3.16Å; Y461-D476 HydrophobicContact CD2-CB 4.49Å; Y461-D476 HydrophobicContact CE2-CB 4.34Å; Y461-R607 VanDerWaalsContact OH-CZ 3.26Å; Y461-R607 PolarHBondContact OH-NE 3.07Å; Y461-R607 PolarHBondContact OH-NH2 3.44Å
462	L	70.6	Confident	87	Confident	25 Å²	25	50 Å²	50	13%	0.131	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.2	179.8	-63.1	175.8	0	0	0	110	L458 D459 K464 W475 D476	L458-L462 WeakPolarHBondContact CA-O 3.45Å; D459-L462 PolarHBondContact N-O 2.86Å; D459-L462 PolarHBondContact O-N 3.49Å; D459-L462 VanDerWaalsContact O-N 3.1Å; L462-K464 PolarHBondContact O-N 3.07Å; L462-W475 CarbonylContact C-O 3.53Å; L462-W475 WeakPolarHBondContact CA-O 3.42Å; L462-D476 HydrophobicContact CD2-CB 3.67Å
463	L	84.7	Confident	87.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	123.2	162.7	-79.1	172.9	0	0	0	109.2	L436 V438 L447 L458 S474 W475	L436-L463 VanDerWaalsContact CA-CD1 3.49Å; L436-L463 HydrophobicContact CB-CD1 3.91Å; L436-L463 HydrophobicContact CB-CG 4.14Å; L436-L463 HydrophobicContact CD2-CD1 4.01Å; L436-L463 HydrophobicContact CD2-CG 3.83Å; V438-L463 HydrophobicContact CG2-CD1 3.64Å; V438-L463 HydrophobicContact CG2-CD2 3.76Å; V438-L463 HydrophobicContact CG2-CG 4.34Å; L447-L463 HydrophobicContact CD1-CD2 3.16Å; L447-L463 HydrophobicContact CG-CD2 4.5Å; L458-L463 HydrophobicContact CD2-CD2 3.58Å; L458-L463 HydrophobicContact CD2-CG 4.01Å; L458-L463 HydrophobicContact CG-CD2 4.25Å; L463-S474 CarbonylContact O-C 3.52Å; L463-S474 VanDerWaalsContact O-CA 3.27Å; L463-S474 WeakPolarHBondContact O-CA 3.23Å; L463-W475 HydrophobicContact CB-CB 4.33Å; L463-W475 PolarHBondContact N-O 2.04Å; L463-W475 PolarHBondContact O-N 2.89Å
464	K	89.4	Confident	87.4	Confident	45 Å²	45	40.5 Å²	40.5	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.4	-175.5	-171.5	172	-171.1	158	0	110.6	I456 D457 D459 L462 E472 I473	I456-K464 VanDerWaalsContact CA-O 3.31Å; I456-K464 WeakPolarHBondContact CA-O 2.94Å; D457-K464 PolarHBondContact N-O 2.71Å; D457-K464 PolarHBondContact O-N 3.01Å; D459-K464 HydrophobicContact CB-CB 4.26Å; D459-K464 HydrophobicContact CB-CD 3.85Å; D459-K464 IonicContact OD2-NZ 3.44Å; D459-K464 PolarHBondContact OD2-NZ 2.01Å; L462-K464 PolarHBondContact O-N 3.07Å; K464-E472 WeakPolarHBondContact CE-OE1 3.36Å; K464-E472 VanDerWaalsContact CE-OE2 3.31Å; K464-E472 WeakPolarHBondContact CE-OE2 3.34Å; K464-E472 HydrophobicContact CG-CG 4.2Å; K464-E472 IonicContact NZ-OE1 3.69Å; K464-E472 PolarHBondContact NZ-OE1 3.11Å; K464-E472 IonicContact NZ-OE2 3.48Å; K464-I473 CarbonylContact C-O 3.57Å; K464-I473 WeakPolarHBondContact CA-O 3.38Å
465	V	96.3	Very high	87.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112	174.5	-175.9	0	0	0	0	109.2	L423 L432 F454 H455 I456 T467 E472 I473	L423-V465 HydrophobicContact CD2-CG1 3.63Å; L432-V465 HydrophobicContact CD1-CG2 3.83Å; L432-V465 HydrophobicContact CD2-CG2 3.77Å; L432-V465 HydrophobicContact CG-CG2 4.32Å; F454-V465 HydrophobicContact CB-CG1 4.46Å; H455-V465 CarbonylContact O-C 3.42Å; H455-V465 WeakPolarHBondContact O-CA 3.35Å; I456-V465 HydrophobicContact CD1-CG2 4.35Å; I456-V465 HydrophobicContact CG1-CG1 4.23Å; I456-V465 HydrophobicContact CG1-CG2 4.1Å; I456-V465 HydrophobicContact CG2-CG2 4.01Å; V465-T467 HydrophobicContact CG1-CG2 4.28Å; V465-E472 CarbonylContact O-C 3.55Å; V465-E472 VanDerWaalsContact O-CA 3.27Å; V465-E472 WeakPolarHBondContact O-CA 3.38Å; V465-I473 HydrophobicContact CB-CB 4.26Å; V465-I473 PolarHBondContact N-O 3.49Å; V465-I473 PolarHBondContact O-N 3.18Å
466	T	95.4	Very high	86.5	Confident	54 Å²	54	38.8 Å²	38.8	33%	0.331	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.6	175.3	-53.2	0	0	0	0	109.9	F454 H455	F454-T466 CarbonylContact C-O 3.59Å; F454-T466 VanDerWaalsContact CA-O 3.22Å; F454-T466 WeakPolarHBondContact CA-O 3.19Å; H455-T466 PolarHBondContact N-O 2.93Å; H455-T466 PolarHBondContact O-N 2.64Å
467	T	95	Very high	85.9	Confident	11 Å²	11	39.1 Å²	39.1	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	150.2	-176.4	71.6	0	0	0	0	111.9	L423 L425 F454 V465 A469 G470 L471	L423-T467 HydrophobicContact CD2-CG2 3.65Å; L425-T467 HydrophobicContact CD1-CG2 3.87Å; F454-T467 HydrophobicContact CB-CG2 4.3Å; V465-T467 HydrophobicContact CG1-CG2 4.28Å; T467-A469 PolarHBondContact O-N 3.33Å; T467-G470 PolarHBondContact O-N 3.45Å; T467-G470 PolarHBondContact OG1-N 3.14Å; T467-L471 HydrophobicContact CG2-CB 4.35Å; T467-L471 PolarHBondContact N-O 3.13Å; T467-L471 WeakPolarHBondContact OG1-CA 3.27Å; T467-L471 WeakPolarHBondContact OG1-CB 3.19Å; T467-L471 PolarHBondContact OG1-N 3.08Å; T467-L471 PolarHBondContact OG1-O 3.4Å
468	K	92.1	Very high	85.4	Confident	166 Å²	166	39.1 Å²	39.1	72%	0.722	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.9	171.1	-72.2	-172.3	176.6	169.6	0	113.1	P452 H453 G470	P452-K468 VanDerWaalsContact O-CD 3.32Å; P452-K468 WeakPolarHBondContact O-CD 3.09Å; P452-K468 WeakPolarHBondContact O-CE 3.39Å; P452-K468 PolarHBondContact O-NZ 3.26Å; H453-K468 PolarHBondContact O-N 3.08Å; K468-G470 PolarHBondContact O-N 3.23Å
469	A	91.5	Very high	85.7	Confident	30 Å²	30	35.6 Å²	35.6	25%	0.248	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-15.2	175.7	0	0	0	0	0	113.1	F401 L425 T467 H488	F401-A469 HydrophobicContact CD1-CB 3.63Å; F401-A469 HydrophobicContact CE1-CB 3.96Å; F401-A469 HydrophobicContact CG-CB 4.45Å; L425-A469 HydrophobicContact CD2-CB 4.45Å; T467-A469 PolarHBondContact O-N 3.33Å; A469-H488 PolarHBondContact O-NE2 2.6Å
470	G	93.1	Very high	86.6	Confident	17 Å²	17	31.2 Å²	31.2	18%	0.175	18%	0.179	C	C	.	.	S	Bend	trans	98.3	16.4	-179.2	0	0	0	0	0	114.5	T467 K468 A486	T467-G470 PolarHBondContact O-N 3.45Å; T467-G470 PolarHBondContact OG1-N 3.14Å; K468-G470 PolarHBondContact O-N 3.23Å; G470-A486 VanDerWaalsContact O-CB 3.28Å; G470-A486 WeakPolarHBondContact O-CB 3.3Å; G470-A486 PolarHBondContact O-N 3.36Å
471	L	96.1	Very high	87.9	Confident	3 Å²	3	28 Å²	28	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.3	167.4	-64.6	-175.3	0	0	0	111.7	F401 V403 T467 V483 M484 A485 L489	F401-L471 HydrophobicContact CD2-CD1 3.28Å; F401-L471 HydrophobicContact CD2-CG 4.13Å; F401-L471 HydrophobicContact CE2-CD1 3.34Å; F401-L471 HydrophobicContact CE2-CD2 4.13Å; F401-L471 HydrophobicContact CE2-CG 3.83Å; F401-L471 HydrophobicContact CG-CD1 4.06Å; F401-L471 HydrophobicContact CZ-CD1 4.13Å; F401-L471 HydrophobicContact CZ-CD2 4.37Å; F401-L471 HydrophobicContact CZ-CG 4.13Å; V403-L471 HydrophobicContact CG2-CD1 3.75Å; T467-L471 HydrophobicContact CG2-CB 4.35Å; T467-L471 PolarHBondContact N-O 3.13Å; T467-L471 WeakPolarHBondContact OG1-CA 3.27Å; T467-L471 WeakPolarHBondContact OG1-CB 3.19Å; T467-L471 PolarHBondContact OG1-N 3.08Å; T467-L471 PolarHBondContact OG1-O 3.4Å; L471-V483 HydrophobicContact CD2-CG1 4.18Å; L471-M484 WeakPolarHBondContact CA-O 3.04Å; L471-A485 HydrophobicContact CD2-CB 3.99Å; L471-L489 HydrophobicContact CD2-CD1 3.72Å; L471-L489 HydrophobicContact CG-CD1 4.24Å
472	E	95.4	Very high	89.2	Confident	49 Å²	49	24.8 Å²	24.8	23%	0.229	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.7	166.9	179.2	169.1	122.1	0	0	108.8	K464 V465 V483 M484	K464-E472 WeakPolarHBondContact CE-OE1 3.36Å; K464-E472 VanDerWaalsContact CE-OE2 3.31Å; K464-E472 WeakPolarHBondContact CE-OE2 3.34Å; K464-E472 HydrophobicContact CG-CG 4.2Å; K464-E472 IonicContact NZ-OE1 3.69Å; K464-E472 PolarHBondContact NZ-OE1 3.11Å; K464-E472 IonicContact NZ-OE2 3.48Å; V465-E472 CarbonylContact O-C 3.55Å; V465-E472 VanDerWaalsContact O-CA 3.27Å; V465-E472 WeakPolarHBondContact O-CA 3.38Å; E472-V483 CarbonylContact O-C 3.59Å; E472-V483 WeakPolarHBondContact O-CA 3.3Å; E472-M484 HydrophobicContact CB-CB 4.24Å; E472-M484 PolarHBondContact N-O 3.39Å; E472-M484 PolarHBondContact O-N 2.56Å
473	I	97.1	Very high	90.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.7	-176.4	-53.6	170.4	0	0	0	108.4	V403 V421 L423 L432 K464 V465 V481 E482 V483	V403-I473 HydrophobicContact CG1-CD1 4.08Å; V403-I473 HydrophobicContact CG2-CD1 3.73Å; V421-I473 HydrophobicContact CG1-CG2 4.21Å; L423-I473 HydrophobicContact CB-CD1 4.07Å; L423-I473 HydrophobicContact CD1-CD1 4.1Å; L423-I473 HydrophobicContact CD2-CD1 4.16Å; L423-I473 HydrophobicContact CG-CD1 4.34Å; L432-I473 HydrophobicContact CD1-CG2 4.1Å; K464-I473 CarbonylContact C-O 3.57Å; K464-I473 WeakPolarHBondContact CA-O 3.38Å; V465-I473 HydrophobicContact CB-CB 4.26Å; V465-I473 PolarHBondContact N-O 3.49Å; V465-I473 PolarHBondContact O-N 3.18Å; I473-V481 HydrophobicContact CG2-CG1 4.41Å; I473-E482 CarbonylContact C-O 3.6Å; I473-E482 WeakPolarHBondContact CA-O 3.27Å; I473-V483 HydrophobicContact CG1-CG1 4.42Å; I473-V483 HydrophobicContact CG1-CG2 4.39Å; I473-V483 HydrophobicContact CG2-CG2 4.43Å
474	S	91.9	Very high	91	Very high	6 Å²	6	25.1 Å²	25.1	4%	0.042	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.6	175.3	-60.1	0	0	0	0	109.9	L463 V481 E482	L463-S474 CarbonylContact O-C 3.52Å; L463-S474 VanDerWaalsContact O-CA 3.27Å; L463-S474 WeakPolarHBondContact O-CA 3.23Å; S474-V481 CarbonylContact O-C 3.56Å; S474-V481 WeakPolarHBondContact O-CA 3.27Å; S474-E482 PolarHBondContact N-O 2.9Å; S474-E482 PolarHBondContact O-N 2.79Å
475	W	88.9	Confident	91.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130	-178.4	171.7	-118.1	0	0	0	110.3	T418 V421 L432 Q433 L462 L463 G477 D478 S479 F480 V481	T418-W475 HydrophobicContact CG2-CH2 3.59Å; T418-W475 HydrophobicContact CG2-CZ3 3.49Å; T418-W475 VanDerWaalsContact CG2-CZ3 3.49Å; V421-W475 HydrophobicContact CG2-CD2 4.34Å; V421-W475 HydrophobicContact CG2-CE3 3.95Å; V421-W475 HydrophobicContact CG2-CZ3 4.31Å; L432-W475 HydrophobicContact CB-CB 4.44Å; L432-W475 HydrophobicContact CB-CG 4.16Å; L432-W475 HydrophobicContact CD1-CB 3.91Å; L432-W475 HydrophobicContact CD1-CG 4.49Å; Q433-W475 PolarHBondContact O-NE1 3.47Å; L462-W475 CarbonylContact C-O 3.53Å; L462-W475 WeakPolarHBondContact CA-O 3.42Å; L463-W475 HydrophobicContact CB-CB 4.33Å; L463-W475 PolarHBondContact N-O 2.04Å; L463-W475 PolarHBondContact O-N 2.89Å; W475-G477 VanDerWaalsContact C-N 3.32Å; W475-G477 VanDerWaalsContact NE1-CA 3.26Å; W475-G477 PolarHBondContact O-N 2.03Å; W475-D478 WeakPolarHBondContact CH2-O 3.31Å; W475-S479 VanDerWaalsContact CZ3-C 3.48Å; W475-F480 WeakPolarHBondContact CA-O 3.4Å; W475-V481 HydrophobicContact CE3-CB 4.42Å; W475-V481 HydrophobicContact CE3-CG2 3.56Å; W475-V481 HydrophobicContact CZ3-CG2 3.52Å
476	D	80.7	Confident	91.3	Very high	27 Å²	27	24 Å²	24	14%	0.144	13%	0.134	C	C	.	.			trans	-84.6	-2.2	-177.6	72.7	-10.7	0	0	0	114.8	Y461 L462 D478 S479 F480	Y461-D476 HydrophobicContact CD2-CB 4.49Å; Y461-D476 HydrophobicContact CE2-CB 4.34Å; L462-D476 HydrophobicContact CD2-CB 3.67Å; D476-D478 VanDerWaalsContact C-N 3.32Å; D476-D478 WeakPolarHBondContact OD1-CA 3.37Å; D476-D478 PolarHBondContact OD1-N 2.92Å; D476-S479 PolarHBondContact OD1-N 2.69Å; D476-F480 HydrophobicContact CB-CB 4.15Å; D476-F480 PolarHBondContact N-O 2.75Å; D476-F480 PolarHBondContact OD1-N 3.48Å; D476-F480 VanDerWaalsContact OD2-CB 3.23Å; D476-F480 WeakPolarHBondContact OD2-CB 3.38Å; D476-F480 PolarHBondContact OD2-N 3.13Å
477	G	80.2	Confident	91.2	Very high	7 Å²	7	23.7 Å²	23.7	7%	0.072	13%	0.132	C	C	.	.	S	Bend	trans	83.2	4.4	-176.2	0	0	0	0	0	114.4	Q434 H435 W475	Q434-G477 CarbonylContact C-O 3.55Å; Q434-G477 WeakPolarHBondContact CA-O 3.19Å; H435-G477 PolarHBondContact N-O 3.37Å; W475-G477 VanDerWaalsContact C-N 3.32Å; W475-G477 VanDerWaalsContact NE1-CA 3.26Å; W475-G477 PolarHBondContact O-N 2.03Å
478	D	77.1	Confident	91	Very high	62 Å²	62	28.2 Å²	28.2	33%	0.332	15%	0.153	S	C	.	.	S	Bend	trans	-134.8	-68.1	179.3	-171.1	3.4	0	0	0	112.8	R410 W475 D476	R410-D478 IonicContact CZ-OD1 3.95Å; R410-D478 IonicContact NH1-OD1 2.74Å; R410-D478 PolarHBondContact NH1-OD1 2.99Å; R410-D478 IonicContact NH1-OD2 3.82Å; R410-D478 PolarHBondContact NH2-O 3.39Å; R410-D478 IonicContact NH2-OD1 2.67Å; R410-D478 PolarHBondContact NH2-OD1 3.12Å; W475-D478 WeakPolarHBondContact CH2-O 3.31Å; D476-D478 VanDerWaalsContact C-N 3.32Å; D476-D478 WeakPolarHBondContact OD1-CA 3.37Å; D476-D478 PolarHBondContact OD1-N 2.92Å
479	S	81.3	Confident	91.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-144.5	-26.4	-172	83.8	0	0	0	0	115.4	T418 W475 D476 E600	T418-S479 WeakPolarHBondContact CB-O 3.39Å; T418-S479 PolarHBondContact OG1-O 3.37Å; W475-S479 VanDerWaalsContact CZ3-C 3.48Å; D476-S479 PolarHBondContact OD1-N 2.69Å; S479-E600 PolarHBondContact OG-OE2 2.89Å
480	F	87.6	Confident	91.2	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	13%	0.127	C	C	.	.			trans	-83.2	123.4	-176.3	178.3	-91.1	0	0	0	111.8	T365 V366 F367 W475 D476 E482 A604 R607	T365-F480 HydrophobicContact CG2-CZ 4.45Å; V366-F480 CarbonylContact O-C 3.01Å; V366-F480 WeakPolarHBondContact O-CA 3.31Å; F367-F480 HydrophobicContact CB-CD2 3.79Å; F367-F480 HydrophobicContact CB-CE2 4.42Å; W475-F480 WeakPolarHBondContact CA-O 3.4Å; D476-F480 HydrophobicContact CB-CB 4.15Å; D476-F480 PolarHBondContact N-O 2.75Å; D476-F480 PolarHBondContact OD1-N 3.48Å; D476-F480 VanDerWaalsContact OD2-CB 3.23Å; D476-F480 WeakPolarHBondContact OD2-CB 3.38Å; D476-F480 PolarHBondContact OD2-N 3.13Å; F480-E482 HydrophobicContact CE1-CB 3.68Å; F480-E482 HydrophobicContact CZ-CB 3.85Å; F480-A604 HydrophobicContact CD2-CB 4.21Å; F480-A604 HydrophobicContact CE2-CB 3.93Å; F480-R607 VanDerWaalsContact CE1-CD 3.46Å; F480-R607 HydrophobicContact CZ-CB 4.36Å; F480-R607 VanDerWaalsContact CZ-CD 3.46Å
481	V	94.4	Very high	91.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.7	170.5	-166.9	0	0	0	0	109	T365 V366 L390 T418 V421 I473 S474 W475 V483	T365-V481 CarbonylContact C-O 3.49Å; T365-V481 VanDerWaalsContact CA-O 3.29Å; T365-V481 WeakPolarHBondContact CA-O 3.35Å; V366-V481 HydrophobicContact CB-CB 4.07Å; V366-V481 HydrophobicContact CB-CG2 4.21Å; V366-V481 HydrophobicContact CG2-CB 4.33Å; V366-V481 PolarHBondContact N-O 2.95Å; V366-V481 PolarHBondContact O-N 3.38Å; L390-V481 HydrophobicContact CD2-CG1 4.06Å; T418-V481 HydrophobicContact CG2-CG2 3.79Å; V421-V481 HydrophobicContact CG1-CG1 4.48Å; V421-V481 HydrophobicContact CG2-CB 4.3Å; V421-V481 HydrophobicContact CG2-CG1 3.81Å; V421-V481 HydrophobicContact CG2-CG2 3.45Å; V421-V481 VanDerWaalsContact CG2-CG2 3.45Å; I473-V481 HydrophobicContact CG2-CG1 4.41Å; S474-V481 CarbonylContact O-C 3.56Å; S474-V481 WeakPolarHBondContact O-CA 3.27Å; W475-V481 HydrophobicContact CE3-CB 4.42Å; W475-V481 HydrophobicContact CE3-CG2 3.56Å; W475-V481 HydrophobicContact CZ3-CG2 3.52Å; V481-V483 HydrophobicContact CG1-CG2 4.16Å
482	E	94.9	Very high	91.3	Very high	17 Å²	17	29.2 Å²	29.2	8%	0.079	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.7	163.8	179.3	175.6	85.7	0	0	109.1	V363 C364 T365 I473 S474 F480 M484 R611	V363-E482 HydrophobicContact CG1-CG 3.55Å; C364-E482 CarbonylContact O-C 3.54Å; C364-E482 WeakPolarHBondContact O-CA 3.37Å; T365-E482 HydrophobicContact CG2-CB 4.25Å; T365-E482 HydrophobicContact CG2-CG 4.02Å; I473-E482 CarbonylContact C-O 3.6Å; I473-E482 WeakPolarHBondContact CA-O 3.27Å; S474-E482 PolarHBondContact N-O 2.9Å; S474-E482 PolarHBondContact O-N 2.79Å; F480-E482 HydrophobicContact CE1-CB 3.68Å; F480-E482 HydrophobicContact CZ-CB 3.85Å; E482-M484 HydrophobicContact CG-CG 4.26Å; E482-R611 IonicContact OE2-NE 3.94Å
483	V	97.7	Very high	91.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	115.7	173.6	-176	0	0	0	0	107.9	C364 F375 L390 T391 V403 L471 E472 I473 V481	C364-V483 HydrophobicContact CB-CB 4.48Å; C364-V483 PolarHBondContact N-O 2.93Å; C364-V483 PolarHBondContact O-N 2.86Å; F375-V483 HydrophobicContact CE1-CG1 4.45Å; F375-V483 WeakPolarHBondContact CE1-O 3.41Å; F375-V483 HydrophobicContact CZ-CG1 4.27Å; L390-V483 HydrophobicContact CD2-CG2 3.81Å; T391-V483 HydrophobicContact CG2-CG1 4.03Å; V403-V483 HydrophobicContact CG1-CG2 4.43Å; L471-V483 HydrophobicContact CD2-CG1 4.18Å; E472-V483 CarbonylContact O-C 3.59Å; E472-V483 WeakPolarHBondContact O-CA 3.3Å; I473-V483 HydrophobicContact CG1-CG1 4.42Å; I473-V483 HydrophobicContact CG1-CG2 4.39Å; I473-V483 HydrophobicContact CG2-CG2 4.43Å; V481-V483 HydrophobicContact CG1-CG2 4.16Å
484	M	96	Very high	91.3	Very high	32 Å²	32	28.3 Å²	28.3	16%	0.158	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.4	172.3	-56.2	-178.7	65	0	0	109.6	P361 G362 V363 L471 E472 E482	P361-M484 HydrophobicContact CB-CE 4.31Å; P361-M484 HydrophobicContact CG-CE 3.58Å; G362-M484 CarbonylContact O-C 3.47Å; G362-M484 WeakPolarHBondContact O-CA 3.48Å; V363-M484 HydrophobicContact CG1-CG 4.31Å; V363-M484 HydrophobicContact CG2-CE 4.23Å; V363-M484 HydrophobicContact CG2-CG 4.01Å; L471-M484 WeakPolarHBondContact CA-O 3.04Å; E472-M484 HydrophobicContact CB-CB 4.24Å; E472-M484 PolarHBondContact N-O 3.39Å; E472-M484 PolarHBondContact O-N 2.56Å; E482-M484 HydrophobicContact CG-CG 4.26Å
485	A	96.9	Very high	91.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.8	178.3	0	0	0	0	0	110.9	P361 G362 F375 L471 L489 L493 Y500	P361-A485 CarbonylContact C-O 3.48Å; P361-A485 WeakPolarHBondContact CA-O 3.38Å; P361-A485 WeakPolarHBondContact CB-O 3.4Å; G362-A485 PolarHBondContact N-O 3.4Å; G362-A485 PolarHBondContact O-N 2.9Å; F375-A485 HydrophobicContact CD1-CB 4.31Å; F375-A485 HydrophobicContact CE1-CB 3.79Å; F375-A485 HydrophobicContact CZ-CB 4.13Å; L471-A485 HydrophobicContact CD2-CB 3.99Å; A485-L489 HydrophobicContact CB-CD1 4.22Å; A485-L493 HydrophobicContact CB-CD1 3.74Å; A485-Y500 HydrophobicContact CB-CD1 4.03Å; A485-Y500 HydrophobicContact CB-CE1 3.9Å
486	A	94.3	Very high	92	Very high	22 Å²	22	28.1 Å²	28.1	18%	0.182	16%	0.158	C	C	.	.			trans	-65.1	151	177.2	0	0	0	0	0	112	G470 H488 L489	G470-A486 VanDerWaalsContact O-CB 3.28Å; G470-A486 WeakPolarHBondContact O-CB 3.3Å; G470-A486 PolarHBondContact O-N 3.36Å; A486-H488 WeakPolarHBondContact CB-CE1 3.29Å; A486-H488 WeakPolarHBondContact CB-ND1 3.45Å; A486-H488 PolarHBondContact O-N 3.48Å; A486-L489 WeakPolarHBondContact O-CB 3.26Å; A486-L489 PolarHBondContact O-N 2.98Å
487	P	92.2	Very high	92.8	Very high	46 Å²	46	26.8 Å²	26.8	30%	0.299	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-56.1	-26.3	-174.9	-29.4	35.7	0	0	0	116.2	E359 L489 K490	E359-P487 HydrophobicContact CB-CB 3.93Å; E359-P487 HydrophobicContact CB-CG 3.84Å; E359-P487 VanDerWaalsContact O-CG 3.26Å; E359-P487 WeakPolarHBondContact O-CG 3.29Å; P487-L489 PolarHBondContact O-N 2.79Å; P487-K490 WeakPolarHBondContact O-CB 3.14Å; P487-K490 PolarHBondContact O-N 3.27Å
488	H	91.3	Very high	93.6	Very high	107 Å²	107	26.7 Å²	26.7	50%	0.495	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-71.9	-8.8	178	65.8	-90.2	0	0	0	114.2	A469 A486 K492	A469-H488 PolarHBondContact O-NE2 2.6Å; A486-H488 WeakPolarHBondContact CB-CE1 3.29Å; A486-H488 WeakPolarHBondContact CB-ND1 3.45Å; A486-H488 PolarHBondContact O-N 3.48Å; H488-K492 WeakPolarHBondContact O-CE 3.23Å; H488-K492 PolarHBondContact O-NZ 3Å
489	L	94.7	Very high	94.5	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.026	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-92.1	-5.7	173.8	-61.8	176.1	0	0	0	113	F401 L471 A485 A486 P487 G491 K492 L493	F401-L489 HydrophobicContact CE1-CD1 4.42Å; F401-L489 HydrophobicContact CE1-CD2 3.91Å; F401-L489 HydrophobicContact CZ-CD1 3.93Å; F401-L489 HydrophobicContact CZ-CD2 3.89Å; L471-L489 HydrophobicContact CD2-CD1 3.72Å; L471-L489 HydrophobicContact CG-CD1 4.24Å; A485-L489 HydrophobicContact CB-CD1 4.22Å; A486-L489 WeakPolarHBondContact O-CB 3.26Å; A486-L489 PolarHBondContact O-N 2.98Å; P487-L489 PolarHBondContact O-N 2.79Å; L489-G491 PolarHBondContact O-N 3.3Å; L489-K492 WeakPolarHBondContact O-CB 3.49Å; L489-K492 PolarHBondContact O-N 3.18Å; L489-L493 HydrophobicContact CB-CD1 4.3Å; L489-L493 HydrophobicContact CB-CD2 4.22Å; L489-L493 HydrophobicContact CB-CG 4.25Å
490	K	94.3	Very high	95.3	Very high	92 Å²	92	25.6 Å²	25.6	40%	0.4	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	127.2	179.5	-163.2	-179.8	-167.3	173.7	0	111.2	E359 P487 K492 Y500	E359-K490 IonicContact OE2-NZ 3.56Å; E359-K490 PolarHBondContact OE2-NZ 3.14Å; P487-K490 WeakPolarHBondContact O-CB 3.14Å; P487-K490 PolarHBondContact O-N 3.27Å; K490-K492 VanDerWaalsContact C-N 3.26Å; K490-K492 PolarHBondContact O-N 2.82Å; K490-Y500 CarbonylContact C-O 3.55Å; K490-Y500 VanDerWaalsContact CA-O 3.3Å; K490-Y500 WeakPolarHBondContact CA-O 3.02Å; K490-Y500 HydrophobicContact CB-CD1 4.21Å; K490-Y500 HydrophobicContact CB-CE1 3.97Å; K490-Y500 HydrophobicContact CG-CD2 4.46Å; K490-Y500 HydrophobicContact CG-CE1 4.44Å; K490-Y500 HydrophobicContact CG-CE2 4.34Å; K490-Y500 WeakPolarHBondContact CG-O 3.25Å
491	G	94.5	Very high	95.6	Very high	51 Å²	51	27.9 Å²	27.9	53%	0.526	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	7.3	-177.5	0	0	0	0	0	115.4	L489 N499 Y500	L489-G491 PolarHBondContact O-N 3.3Å; G491-N499 WeakPolarHBondContact CA-O 3.15Å; G491-Y500 PolarHBondContact N-O 2.89Å
492	K	95.1	Very high	95.5	Very high	88 Å²	88	30.1 Å²	30.1	38%	0.383	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-12.4	178.7	-60.6	-179.4	-177.2	163.6	0	113.6	C394 H488 L489 K490	C394-K492 PolarHBondContact N-O 3.17Å; H488-K492 WeakPolarHBondContact O-CE 3.23Å; H488-K492 PolarHBondContact O-NZ 3Å; L489-K492 WeakPolarHBondContact O-CB 3.49Å; L489-K492 PolarHBondContact O-N 3.18Å; K490-K492 VanDerWaalsContact C-N 3.26Å; K490-K492 PolarHBondContact O-N 2.82Å
493	L	96.9	Very high	95.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	159.1	-175.5	-56.9	-176.8	0	0	0	111	F375 K392 F401 A485 L489 N499 Y500	F375-L493 HydrophobicContact CD2-CD1 4.07Å; F375-L493 HydrophobicContact CE2-CB 4.42Å; F375-L493 HydrophobicContact CE2-CD1 3.48Å; F375-L493 VanDerWaalsContact CE2-CD1 3.48Å; F375-L493 HydrophobicContact CZ-CD1 3.77Å; K392-L493 CarbonylContact O-C 3.48Å; K392-L493 VanDerWaalsContact O-CA 3.3Å; K392-L493 WeakPolarHBondContact O-CA 3Å; F401-L493 HydrophobicContact CE2-CD2 3.82Å; F401-L493 HydrophobicContact CZ-CD2 3.61Å; A485-L493 HydrophobicContact CB-CD1 3.74Å; L489-L493 HydrophobicContact CB-CD1 4.3Å; L489-L493 HydrophobicContact CB-CD2 4.22Å; L489-L493 HydrophobicContact CB-CG 4.25Å; L493-N499 WeakPolarHBondContact O-CA 3.35Å; L493-Y500 HydrophobicContact CD1-CD1 3.94Å; L493-Y500 HydrophobicContact CD1-CG 4.46Å
494	C	96.8	Very high	95.3	Very high	25 Å²	25	41 Å²	41	17%	0.169	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	163	163	74.6	0	0	0	0	110.5	T391 K392 C394 G498 W526	T391-C494 CarbonylContact C-O 3.52Å; T391-C494 WeakPolarHBondContact CA-O 3.44Å; K392-C494 PolarHBondContact N-O 2.97Å; K392-C494 PolarHBondContact O-N 3.18Å; C394-C494 HydrophobicContact CB-CB 3.92Å; C394-C494 WeakPolarHBondContact CB-SG 3.44Å; C394-C494 WeakPolarHBondContact SG-CB 3.02Å; C394-C494 PolarHBondContact SG-N 2.86Å; C394-C494 VanDerWaalsContact SG-N 3.37Å; C394-C494 CovalentContact SG-SG 2Å; C394-C494 PolarHBondContact SG-SG 3.09Å; C494-G498 WeakPolarHBondContact CA-O 3.33Å; C494-W526 HydrophobicContact CB-CH2 3.76Å; C494-W526 HydrophobicContact CB-CZ2 4.2Å; C494-W526 WeakPolarHBondContact SG-CH2 3.46Å
495	G	97.2	Very high	95.2	Very high	2 Å²	2	49.7 Å²	49.7	2%	0.021	26%	0.259	C	S	.	.	S	Bend	trans	136.2	-167	-174.6	0	0	0	0	0	111.5	C497 G498	G495-C497 PolarHBondContact O-N 3.14Å; G495-C497 VanDerWaalsContact O-N 3.17Å; G495-G498 PolarHBondContact O-N 2.83Å
496	L	97.7	Very high	95.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.6	175.1	-65.7	179.6	0	0	0	113.4	Y372 F380 Y388 V389 L390 V405 G498 F522 A523 W526	Y372-L496 HydrophobicContact CD1-CB 4.23Å; Y372-L496 HydrophobicContact CD1-CD1 4.34Å; Y372-L496 HydrophobicContact CE1-CB 4.32Å; Y372-L496 HydrophobicContact CE1-CD1 3.65Å; F380-L496 WeakPolarHBondContact CE1-O 3.31Å; F380-L496 HydrophobicContact CZ-CB 4.3Å; F380-L496 HydrophobicContact CZ-CD2 4.44Å; F380-L496 WeakPolarHBondContact CZ-O 3.43Å; Y388-L496 HydrophobicContact CG-CD1 4.3Å; V389-L496 WeakPolarHBondContact O-CG 3.39Å; V389-L496 PolarHBondContact O-N 3.23Å; L390-L496 HydrophobicContact CD1-CB 4.29Å; L390-L496 PolarHBondContact O-N 2.82Å; L390-L496 VanDerWaalsContact O-N 3.15Å; V405-L496 HydrophobicContact CG1-CD1 4.25Å; L496-G498 PolarHBondContact O-N 2.87Å; L496-F522 HydrophobicContact CD2-CE1 3.89Å; L496-F522 HydrophobicContact CD2-CZ 4.25Å; L496-A523 HydrophobicContact CD2-CB 3.62Å; L496-W526 HydrophobicContact CD2-CB 4.1Å; L496-W526 HydrophobicContact CD2-CG 4.3Å; L496-W526 HydrophobicContact CG-CB 4.3Å
497	C	98.2	Very high	95.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	5.4	175.9	-67	0	0	0	0	114.7	C364 T374 F375 L390 G495	C364-C497 HydrophobicContact CB-CB 3.58Å; C364-C497 WeakPolarHBondContact CB-SG 3.31Å; C364-C497 WeakPolarHBondContact SG-CB 3.46Å; C364-C497 CovalentContact SG-SG 2.02Å; C364-C497 PolarHBondContact SG-SG 3.02Å; T374-C497 WeakPolarHBondContact CA-O 3.36Å; T374-C497 VanDerWaalsContact CB-O 3.23Å; T374-C497 WeakPolarHBondContact CB-O 3.33Å; F375-C497 HydrophobicContact CD2-CB 3.64Å; F375-C497 WeakPolarHBondContact CD2-O 3.04Å; F375-C497 HydrophobicContact CE2-CB 3.31Å; F375-C497 HydrophobicContact CG-CB 4.45Å; F375-C497 HydrophobicContact CZ-CB 3.91Å; F375-C497 PolarHBondContact N-O 3.21Å; L390-C497 WeakPolarHBondContact CD1-SG 3.01Å; L390-C497 VanDerWaalsContact CG-SG 3.55Å; L390-C497 WeakPolarHBondContact O-CB 3.31Å; L390-C497 PolarHBondContact O-N 2.86Å; L390-C497 PolarHBondContact O-SG 3.33Å; G495-C497 PolarHBondContact O-N 3.14Å; G495-C497 VanDerWaalsContact O-N 3.17Å
498	G	97.2	Very high	95.4	Very high	4 Å²	4	48.7 Å²	48.7	4%	0.041	25%	0.248	C	C	.	.			trans	78.6	-167.6	-178.9	0	0	0	0	0	113.5	C494 G495 L496 D507	C494-G498 WeakPolarHBondContact CA-O 3.33Å; G495-G498 PolarHBondContact O-N 2.83Å; L496-G498 PolarHBondContact O-N 2.87Å; G498-D507 WeakPolarHBondContact CA-OD1 3.4Å
499	N	96.3	Very high	95.6	Very high	29 Å²	29	46.5 Å²	46.5	16%	0.155	24%	0.239	C	C	.	.			trans	-98.8	-4.3	-172.2	65.8	21.4	0	0	0	114.6	G491 L493 N501 D506	G491-N499 WeakPolarHBondContact CA-O 3.15Å; L493-N499 WeakPolarHBondContact O-CA 3.35Å; N499-N501 PolarHBondContact ND2-ND2 2.91Å; N499-N501 VanDerWaalsContact ND2-ND2 3.14Å; N499-N501 WeakPolarHBondContact OD1-CB 3.5Å; N499-N501 PolarHBondContact OD1-N 3.05Å; N499-N501 PolarHBondContact OD1-ND2 3.27Å; N499-N501 PolarHBondContact OD1-OD1 2.84Å; N499-D506 PolarHBondContact ND2-OD1 2.86Å; N499-D506 PolarHBondContact ND2-OD2 3.39Å
500	Y	97.1	Very high	95.5	Very high	11 Å²	11	46.3 Å²	46.3	4%	0.043	24%	0.239	C	C	.	.			trans	53.5	51.7	-179.3	-174.7	-148.7	0	0	0	113.1	G362 F375 A485 K490 G491 L493	G362-Y500 VanDerWaalsContact CA-CE2 3.4Å; G362-Y500 PolarHBondContact N-OH 3.15Å; F375-Y500 HydrophobicContact CB-CD2 3.59Å; F375-Y500 HydrophobicContact CB-CE2 4.48Å; F375-Y500 HydrophobicContact CB-CG 3.84Å; F375-Y500 HydrophobicContact CD2-CG 4.33Å; F375-Y500 HydrophobicContact CG-CD2 4.25Å; F375-Y500 HydrophobicContact CG-CG 4.07Å; A485-Y500 HydrophobicContact CB-CD1 4.03Å; A485-Y500 HydrophobicContact CB-CE1 3.9Å; K490-Y500 CarbonylContact C-O 3.55Å; K490-Y500 VanDerWaalsContact CA-O 3.3Å; K490-Y500 WeakPolarHBondContact CA-O 3.02Å; K490-Y500 HydrophobicContact CB-CD1 4.21Å; K490-Y500 HydrophobicContact CB-CE1 3.97Å; K490-Y500 HydrophobicContact CG-CD2 4.46Å; K490-Y500 HydrophobicContact CG-CE1 4.44Å; K490-Y500 HydrophobicContact CG-CE2 4.34Å; K490-Y500 WeakPolarHBondContact CG-O 3.25Å; G491-Y500 PolarHBondContact N-O 2.89Å; L493-Y500 HydrophobicContact CD1-CD1 3.94Å; L493-Y500 HydrophobicContact CD1-CG 4.46Å
501	N	94.6	Very high	95.4	Very high	48 Å²	48	43.9 Å²	43.9	26%	0.257	24%	0.24	S	C	.	.	S	Bend	trans	-109.2	-4.1	-179.9	74.2	9.3	0	0	0	113.4	D376 N499 H503 D506	D376-N501 PolarHBondContact OD2-N 3.05Å; D376-N501 PolarHBondContact OD2-OD1 3.39Å; N499-N501 PolarHBondContact ND2-ND2 2.91Å; N499-N501 VanDerWaalsContact ND2-ND2 3.14Å; N499-N501 WeakPolarHBondContact OD1-CB 3.5Å; N499-N501 PolarHBondContact OD1-N 3.05Å; N499-N501 PolarHBondContact OD1-ND2 3.27Å; N499-N501 PolarHBondContact OD1-OD1 2.84Å; N501-H503 WeakPolarHBondContact OD1-CA 3.37Å; N501-H503 WeakPolarHBondContact OD1-CB 3.22Å; N501-H503 PolarHBondContact OD1-N 3.37Å; N501-D506 PolarHBondContact ND2-OD2 3.5Å
502	G	92.3	Very high	95.2	Very high	48 Å²	48	45.4 Å²	45.4	50%	0.495	24%	0.236	S	C	.	.	S	Bend	trans	92.9	8.2	-175.5	0	0	0	0	0	114.5	D376	D376-G502 VanDerWaalsContact OD1-CA 3.31Å; D376-G502 WeakPolarHBondContact OD1-CA 3.18Å; D376-G502 PolarHBondContact OD1-N 3.39Å; D376-G502 PolarHBondContact OD2-N 2.94Å
503	H	93.9	Very high	95.1	Very high	123 Å²	123	43.7 Å²	43.7	57%	0.569	24%	0.243	S	C	*	.			trans	-126.6	85.5	-173.6	-59.7	-54.6	0	0	0	113.5	D376 N501 R505 D506	D376-H503 PolarHBondContact OD2-N 2.03Å; D376-H503 VanDerWaalsContact OD2-N 3.12Å; N501-H503 WeakPolarHBondContact OD1-CA 3.37Å; N501-H503 WeakPolarHBondContact OD1-CB 3.22Å; N501-H503 PolarHBondContact OD1-N 3.37Å; H503-R505 PolarHBondContact O-N 2.97Å; H503-D506 PolarHBondContact O-N 3.28Å; H503-D506 VanDerWaalsContact O-N 3.12Å
504	K	94.1	Very high	94.9	Very high	124 Å²	124	48 Å²	48	54%	0.539	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-13	177.2	73.5	-179.9	-177.8	-177.8	0	118.7	D376 R378 D507	D376-K504 HydrophobicContact CB-CB 4.4Å; R378-K504 HydrophobicContact CB-CB 4.09Å; R378-K504 PolarHBondContact NH1-O 3.3Å; K504-D507 WeakPolarHBondContact CA-OD2 3.45Å
505	R	93.4	Very high	94.8	Very high	213 Å²	213	50.6 Å²	50.6	80%	0.804	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-24.9	-178.5	-67.9	-172.3	-174.3	-167	1.9	112.7	H503 F515	H503-R505 PolarHBondContact O-N 2.97Å; R505-F515 WeakPolarHBondContact O-CE2 3.19Å
506	D	94.9	Very high	94.6	Very high	44 Å²	44	52.9 Å²	52.9	24%	0.235	28%	0.284	C	S	.	.	S	Bend	trans	-103.9	1.7	-178.3	67.7	13	0	0	0	113.6	N499 N501 H503 L508 I509	N499-D506 PolarHBondContact ND2-OD1 2.86Å; N499-D506 PolarHBondContact ND2-OD2 3.39Å; N501-D506 PolarHBondContact ND2-OD2 3.5Å; H503-D506 PolarHBondContact O-N 3.28Å; H503-D506 VanDerWaalsContact O-N 3.12Å; D506-L508 PolarHBondContact O-N 2.94Å; D506-I509 HydrophobicContact CB-CD1 4.04Å; D506-I509 WeakPolarHBondContact O-CD1 3.36Å; D506-I509 WeakPolarHBondContact O-CG1 3.44Å; D506-I509 PolarHBondContact O-N 3.08Å; D506-I509 VanDerWaalsContact O-N 3.11Å
507	D	96.5	Very high	94.2	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.011	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.1	178.1	-82.5	-25.2	0	0	0	115.4	T374 R378 G498 K504 I509 F522	T374-D507 VanDerWaalsContact CB-OD2 3.31Å; T374-D507 WeakPolarHBondContact CB-OD2 3.48Å; T374-D507 HydrophobicContact CG2-CB 4.04Å; T374-D507 PolarHBondContact OG1-OD2 2.96Å; R378-D507 HydrophobicContact CB-CB 4.15Å; R378-D507 VanDerWaalsContact CB-OD2 3.31Å; R378-D507 WeakPolarHBondContact CB-OD2 3.15Å; G498-D507 WeakPolarHBondContact CA-OD1 3.4Å; K504-D507 WeakPolarHBondContact CA-OD2 3.45Å; D507-I509 VanDerWaalsContact C-N 3.31Å; D507-F522 VanDerWaalsContact O-CE2 3.27Å; D507-F522 WeakPolarHBondContact O-CE2 3.5Å; D507-F522 WeakPolarHBondContact O-CZ 3.45Å
508	L	96	Very high	93.8	Very high	1 Å²	1	62 Å²	62	1%	0.005	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	26.8	174.4	-58.9	-169.6	0	0	0	113.6	R378 D506 G510 F515 K516 V519 F522	R378-L508 VanDerWaalsContact CZ-CD1 3.5Å; R378-L508 VanDerWaalsContact CZ-CG 3.45Å; D506-L508 PolarHBondContact O-N 2.94Å; L508-G510 PolarHBondContact O-N 3.35Å; L508-F515 HydrophobicContact CB-CD2 4.36Å; L508-F515 HydrophobicContact CB-CE2 3.87Å; L508-F515 HydrophobicContact CB-CZ 4.25Å; L508-K516 WeakPolarHBondContact CB-O 3.31Å; L508-K516 WeakPolarHBondContact CD1-O 3.46Å; L508-K516 PolarHBondContact O-N 2.99Å; L508-V519 HydrophobicContact CD1-CG2 4.33Å; L508-F522 HydrophobicContact CB-CB 4.46Å; L508-F522 HydrophobicContact CB-CD2 4.14Å; L508-F522 HydrophobicContact CB-CG 4.26Å; L508-F522 HydrophobicContact CD2-CB 4.27Å; L508-F522 HydrophobicContact CD2-CD1 3.54Å; L508-F522 HydrophobicContact CD2-CD2 4.16Å; L508-F522 HydrophobicContact CD2-CE1 3.8Å; L508-F522 HydrophobicContact CD2-CE2 4.37Å; L508-F522 HydrophobicContact CD2-CG 3.71Å; L508-F522 HydrophobicContact CD2-CZ 4.19Å
509	I	96.1	Very high	93.5	Very high	61 Å²	61	63.5 Å²	63.5	31%	0.313	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-71.7	117.4	166.6	-69.5	161.3	0	0	0	108.3	D506 D507 F515 F522 W526	D506-I509 HydrophobicContact CB-CD1 4.04Å; D506-I509 WeakPolarHBondContact O-CD1 3.36Å; D506-I509 WeakPolarHBondContact O-CG1 3.44Å; D506-I509 PolarHBondContact O-N 3.08Å; D506-I509 VanDerWaalsContact O-N 3.11Å; D507-I509 VanDerWaalsContact C-N 3.31Å; I509-F515 HydrophobicContact CG1-CD2 4.49Å; I509-F522 WeakPolarHBondContact O-CE2 3.44Å; I509-W526 WeakPolarHBondContact O-CZ2 3.24Å; I509-W526 PolarHBondContact O-NE1 3.43Å
510	G	93.2	Very high	93.2	Very high	2 Å²	2	65.3 Å²	65.3	2%	0.021	35%	0.345	C	S	.	.			trans	-73.4	174.8	-179.5	0	0	0	0	0	113.8	L508 D512 G513 N514 S525 W526	L508-G510 PolarHBondContact O-N 3.35Å; G510-D512 PolarHBondContact O-N 3.11Å; G510-D512 VanDerWaalsContact O-N 3.15Å; G510-G513 PolarHBondContact O-N 2.88Å; G510-N514 PolarHBondContact N-O 3.5Å; G510-S525 WeakPolarHBondContact CA-OG 3.25Å; G510-W526 VanDerWaalsContact C-CZ2 3.48Å
511	G	91.5	Very high	92.9	Very high	41 Å²	41	68.8 Å²	68.8	42%	0.423	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.9	176.1	0	0	0	0	0	114.4	G513 S525	G511-G513 VanDerWaalsContact C-N 3.33Å; G511-S525 PolarHBondContact N-OG 2.82Å
512	D	91.4	Very high	92.9	Very high	82 Å²	82	66.5 Å²	66.5	44%	0.439	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-1	173.4	67.5	-19.9	0	0	0	113.7	G510 N514 K516	G510-D512 PolarHBondContact O-N 3.11Å; G510-D512 VanDerWaalsContact O-N 3.15Å; D512-N514 VanDerWaalsContact C-N 3.28Å; D512-N514 PolarHBondContact O-N 2.82Å; D512-N514 PolarHBondContact OD1-N 3.27Å; D512-N514 VanDerWaalsContact OD1-N 3.14Å; D512-N514 PolarHBondContact OD2-ND2 3.45Å; D512-K516 VanDerWaalsContact OD1-CE 3.27Å; D512-K516 WeakPolarHBondContact OD1-CE 3.28Å; D512-K516 IonicContact OD1-NZ 3.2Å; D512-K516 WeakPolarHBondContact OD2-CE 3.45Å; D512-K516 IonicContact OD2-NZ 2.84Å; D512-K516 PolarHBondContact OD2-NZ 2.87Å
513	G	91.8	Very high	93	Very high	53 Å²	53	64.2 Å²	64.2	55%	0.546	33%	0.328	S	S	.	.	S	Bend	trans	81	0.3	-178	0	0	0	0	0	114.6	G510 G511	G510-G513 PolarHBondContact O-N 2.88Å; G511-G513 VanDerWaalsContact C-N 3.33Å
514	N	93.6	Very high	92.8	Very high	96 Å²	96	61.3 Å²	61.3	51%	0.513	32%	0.315	S	S	.	.			trans	-95.6	143.8	179.9	-63.8	-52.5	0	0	0	111.3	G510 D512 K516	G510-N514 PolarHBondContact N-O 3.5Å; D512-N514 VanDerWaalsContact C-N 3.28Å; D512-N514 PolarHBondContact O-N 2.82Å; D512-N514 PolarHBondContact OD1-N 3.27Å; D512-N514 VanDerWaalsContact OD1-N 3.14Å; D512-N514 PolarHBondContact OD2-ND2 3.45Å; N514-K516 PolarHBondContact O-N 2.04Å
515	F	94.3	Very high	92.8	Very high	79 Å²	79	57.3 Å²	57.3	35%	0.346	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-68	131.4	170.3	-175.6	-93.7	0	0	0	110.7	R505 L508 I509 F517	R505-F515 WeakPolarHBondContact O-CE2 3.19Å; L508-F515 HydrophobicContact CB-CD2 4.36Å; L508-F515 HydrophobicContact CB-CE2 3.87Å; L508-F515 HydrophobicContact CB-CZ 4.25Å; I509-F515 HydrophobicContact CG1-CD2 4.49Å; F515-F517 HydrophobicContact CD1-CD1 4.46Å; F515-F517 HydrophobicContact CD1-CE1 4.32Å; F515-F517 HydrophobicContact CD1-CE2 4.49Å; F515-F517 HydrophobicContact CD1-CZ 4.33Å; F515-F517 AromaticContact CE1-CD1 3.9Å; F515-F517 HydrophobicContact CE1-CD1 3.9Å; F515-F517 AromaticContact CE1-CE1 3.97Å; F515-F517 HydrophobicContact CE1-CE1 3.97Å; F515-F517 HydrophobicContact CE1-CG 4.32Å; F515-F517 HydrophobicContact CE1-CZ 4.44Å
516	K	91.9	Very high	92.9	Very high	50 Å²	50	47.8 Å²	47.8	22%	0.217	27%	0.267	C	S	.	.			trans	-109.3	134.8	177.3	-54.4	-65.4	-178.4	177.2	0	110	L508 D512 N514 F522	L508-K516 WeakPolarHBondContact CB-O 3.31Å; L508-K516 WeakPolarHBondContact CD1-O 3.46Å; L508-K516 PolarHBondContact O-N 2.99Å; D512-K516 VanDerWaalsContact OD1-CE 3.27Å; D512-K516 WeakPolarHBondContact OD1-CE 3.28Å; D512-K516 IonicContact OD1-NZ 3.2Å; D512-K516 WeakPolarHBondContact OD2-CE 3.45Å; D512-K516 IonicContact OD2-NZ 2.84Å; D512-K516 PolarHBondContact OD2-NZ 2.87Å; N514-K516 PolarHBondContact O-N 2.04Å; K516-F522 HydrophobicContact CB-CB 3.87Å; K516-F522 HydrophobicContact CG-CB 4.23Å
517	F	89.9	Confident	92.8	Very high	139 Å²	139	50 Å²	50	61%	0.61	27%	0.272	S	S	*	.	S	Bend	trans	-83	-34	177	-66.5	-83.5	0	0	0	112.2	W3 F515	W3-F517 HydrophobicContact CZ2-CZ 4.23Å; W3-F517 AromaticContact NE1-CZ 3.95Å; F515-F517 HydrophobicContact CD1-CD1 4.46Å; F515-F517 HydrophobicContact CD1-CE1 4.32Å; F515-F517 HydrophobicContact CD1-CE2 4.49Å; F515-F517 HydrophobicContact CD1-CZ 4.33Å; F515-F517 AromaticContact CE1-CD1 3.9Å; F515-F517 HydrophobicContact CE1-CD1 3.9Å; F515-F517 AromaticContact CE1-CE1 3.97Å; F515-F517 HydrophobicContact CE1-CE1 3.97Å; F515-F517 HydrophobicContact CE1-CG 4.32Å; F515-F517 HydrophobicContact CE1-CZ 4.44Å
518	D	89.7	Confident	92.5	Very high	53 Å²	53	53.4 Å²	53.4	28%	0.283	29%	0.292	S	S	.	.	S	Bend	trans	-90.4	138.5	176.8	-173.2	-85.4	0	0	0	110.7	D520 D521 F522	D518-D520 WeakPolarHBondContact OD1-CA 3.22Å; D518-D520 WeakPolarHBondContact OD1-CB 3.38Å; D518-D520 PolarHBondContact OD1-N 3.08Å; D518-D521 HydrophobicContact CB-CB 4.13Å; D518-D521 PolarHBondContact OD1-N 3.45Å; D518-D521 VanDerWaalsContact OD1-N 3.07Å; D518-F522 WeakPolarHBondContact O-CB 3.44Å; D518-F522 PolarHBondContact O-N 3.05Å; D518-F522 VanDerWaalsContact O-N 3.12Å
519	V	90.9	Very high	91.6	Very high	35 Å²	35	55.8 Å²	55.8	21%	0.212	30%	0.303	C	S	.	.	H	α-helix	trans	-75.5	-35.3	-175.9	170.6	0	0	0	0	111.6	F380 N381 L508 F522 A523	F380-V519 HydrophobicContact CB-CG1 3.85Å; F380-V519 HydrophobicContact CB-CG2 4.16Å; F380-V519 HydrophobicContact CD2-CG1 3.47Å; F380-V519 VanDerWaalsContact CD2-CG1 3.47Å; F380-V519 HydrophobicContact CE2-CG1 4.37Å; F380-V519 HydrophobicContact CG-CG1 3.96Å; N381-V519 WeakPolarHBondContact O-CG1 3.09Å; L508-V519 HydrophobicContact CD1-CG2 4.33Å; V519-F522 WeakPolarHBondContact O-CB 3.36Å; V519-F522 PolarHBondContact O-N 3.17Å; V519-A523 WeakPolarHBondContact O-CB 3.2Å; V519-A523 PolarHBondContact O-N 3.21Å
520	D	89.3	Confident	90.1	Very high	66 Å²	66	58.1 Å²	58.1	35%	0.353	33%	0.325	S	S	.	.	H	α-helix	trans	-69	-43.6	178.4	-65.7	-62.3	0	0	0	109.5	F382 D518 F522 A523 E524	F382-D520 WeakPolarHBondContact CD2-OD1 3.31Å; D518-D520 WeakPolarHBondContact OD1-CA 3.22Å; D518-D520 WeakPolarHBondContact OD1-CB 3.38Å; D518-D520 PolarHBondContact OD1-N 3.08Å; D520-F522 VanDerWaalsContact C-N 3.33Å; D520-F522 PolarHBondContact O-N 3.38Å; D520-A523 PolarHBondContact O-N 3.32Å; D520-E524 WeakPolarHBondContact O-CB 3.15Å; D520-E524 PolarHBondContact O-N 2.96Å
521	D	91.7	Very high	88.7	Confident	84 Å²	84	62.3 Å²	62.3	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-60.9	-40.8	173.8	-73.8	-18.7	0	0	0	112.5	D518 S525	D518-D521 HydrophobicContact CB-CB 4.13Å; D518-D521 PolarHBondContact OD1-N 3.45Å; D518-D521 VanDerWaalsContact OD1-N 3.07Å; D521-S525 PolarHBondContact O-N 3.08Å
522	F	95	Very high	87.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58	-56.7	172.6	159.6	-108.1	0	0	0	111.5	F380 L496 D507 L508 I509 K516 D518 V519 D520 E524 S525 W526	F380-F522 AromaticContact CE1-CE1 3.88Å; F380-F522 HydrophobicContact CE1-CE1 3.88Å; F380-F522 HydrophobicContact CE2-CD1 4.42Å; F380-F522 AromaticContact CE2-CE1 3.98Å; F380-F522 HydrophobicContact CE2-CE1 3.98Å; F380-F522 HydrophobicContact CZ-CD1 4.41Å; F380-F522 AromaticContact CZ-CE1 3.56Å; F380-F522 HydrophobicContact CZ-CE1 3.56Å; F380-F522 HydrophobicContact CZ-CZ 4.44Å; L496-F522 HydrophobicContact CD2-CE1 3.89Å; L496-F522 HydrophobicContact CD2-CZ 4.25Å; D507-F522 VanDerWaalsContact O-CE2 3.27Å; D507-F522 WeakPolarHBondContact O-CE2 3.5Å; D507-F522 WeakPolarHBondContact O-CZ 3.45Å; L508-F522 HydrophobicContact CB-CB 4.46Å; L508-F522 HydrophobicContact CB-CD2 4.14Å; L508-F522 HydrophobicContact CB-CG 4.26Å; L508-F522 HydrophobicContact CD2-CB 4.27Å; L508-F522 HydrophobicContact CD2-CD1 3.54Å; L508-F522 HydrophobicContact CD2-CD2 4.16Å; L508-F522 HydrophobicContact CD2-CE1 3.8Å; L508-F522 HydrophobicContact CD2-CE2 4.37Å; L508-F522 HydrophobicContact CD2-CG 3.71Å; L508-F522 HydrophobicContact CD2-CZ 4.19Å; I509-F522 WeakPolarHBondContact O-CE2 3.44Å; K516-F522 HydrophobicContact CB-CB 3.87Å; K516-F522 HydrophobicContact CG-CB 4.23Å; D518-F522 WeakPolarHBondContact O-CB 3.44Å; D518-F522 PolarHBondContact O-N 3.05Å; D518-F522 VanDerWaalsContact O-N 3.12Å; V519-F522 WeakPolarHBondContact O-CB 3.36Å; V519-F522 PolarHBondContact O-N 3.17Å; D520-F522 VanDerWaalsContact C-N 3.33Å; D520-F522 PolarHBondContact O-N 3.38Å; F522-E524 VanDerWaalsContact C-N 3.33Å; F522-E524 PolarHBondContact O-N 3.07Å; F522-S525 WeakPolarHBondContact O-CB 3.49Å; F522-S525 PolarHBondContact O-N 2.86Å; F522-S525 PolarHBondContact O-OG 2.9Å; F522-W526 AromaticContact CD2-NE1 3.85Å; F522-W526 AromaticContact CE2-CD1 3.71Å; F522-W526 AromaticContact CE2-NE1 3.29Å; F522-W526 VanDerWaalsContact CE2-NE1 3.29Å; F522-W526 AromaticContact CZ-NE1 3.92Å
523	A	93.2	Very high	85.9	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-71	-33.9	-171.2	0	0	0	0	0	111.8	F382 Y388 L496 V519 D520 S525 W526	F382-A523 HydrophobicContact CB-CB 4.08Å; F382-A523 HydrophobicContact CD1-CB 3.44Å; F382-A523 VanDerWaalsContact CD1-CB 3.44Å; F382-A523 HydrophobicContact CD2-CB 3.42Å; F382-A523 VanDerWaalsContact CD2-CB 3.42Å; F382-A523 HydrophobicContact CE1-CB 3.54Å; F382-A523 HydrophobicContact CE2-CB 3.55Å; F382-A523 HydrophobicContact CG-CB 3.34Å; F382-A523 HydrophobicContact CZ-CB 3.59Å; Y388-A523 WeakPolarHBondContact CD1-O 3.2Å; L496-A523 HydrophobicContact CD2-CB 3.62Å; V519-A523 WeakPolarHBondContact O-CB 3.2Å; V519-A523 PolarHBondContact O-N 3.21Å; D520-A523 PolarHBondContact O-N 3.32Å; A523-S525 VanDerWaalsContact C-N 3.28Å; A523-S525 PolarHBondContact O-N 3.3Å; A523-W526 PolarHBondContact O-N 3.07Å; A523-W526 VanDerWaalsContact O-N 3.08Å
524	E	91.4	Very high	84.9	Confident	63 Å²	63	71.8 Å²	71.8	29%	0.294	36%	0.361	S	S	.	.	H	α-helix	trans	-67.2	-29.8	176.4	-163.3	61	-164.3	0	0	112.4	Y388 D520 F522 W526 R527	Y388-E524 PolarHBondContact OH-OE2 3.06Å; Y388-E524 VanDerWaalsContact OH-OE2 3.08Å; D520-E524 WeakPolarHBondContact O-CB 3.15Å; D520-E524 PolarHBondContact O-N 2.96Å; F522-E524 VanDerWaalsContact C-N 3.33Å; F522-E524 PolarHBondContact O-N 3.07Å; E524-W526 PolarHBondContact O-N 3.42Å; E524-W526 VanDerWaalsContact O-N 3.14Å; E524-R527 VanDerWaalsContact O-CB 3.26Å; E524-R527 WeakPolarHBondContact O-CB 3.32Å; E524-R527 PolarHBondContact O-N 2.84Å; E524-R527 VanDerWaalsContact O-N 3.13Å; E524-R527 WeakPolarHBondContact OE1-CD 3.27Å; E524-R527 IonicContact OE1-CZ 3.72Å; E524-R527 IonicContact OE1-NE 3.78Å; E524-R527 PolarHBondContact OE1-NE 2.88Å; E524-R527 IonicContact OE1-NH1 3.81Å; E524-R527 PolarHBondContact OE1-NH1 3.2Å; E524-R527 IonicContact OE1-NH2 2.86Å
525	S	94.1	Very high	83.4	Confident	39 Å²	39	72.6 Å²	72.6	27%	0.273	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.1	172.8	79.5	0	0	0	0	114	G510 G511 D521 F522 A523	G510-S525 WeakPolarHBondContact CA-OG 3.25Å; G511-S525 PolarHBondContact N-OG 2.82Å; D521-S525 PolarHBondContact O-N 3.08Å; F522-S525 WeakPolarHBondContact O-CB 3.49Å; F522-S525 PolarHBondContact O-N 2.86Å; F522-S525 PolarHBondContact O-OG 2.9Å; A523-S525 VanDerWaalsContact C-N 3.28Å; A523-S525 PolarHBondContact O-N 3.3Å
526	W	94.9	Very high	81.7	Confident	14 Å²	14	72.5 Å²	72.5	5%	0.053	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	9.6	177.1	-69.4	110.8	0	0	0	113.8	Y388 V389 C494 L496 I509 G510 F522 A523 E524	Y388-W526 WeakPolarHBondContact CA-O 3.2Å; V389-W526 HydrophobicContact CB-CB 4.47Å; V389-W526 HydrophobicContact CB-CE3 3.97Å; V389-W526 HydrophobicContact CG1-CE3 4.28Å; V389-W526 HydrophobicContact CG2-CE3 4.37Å; V389-W526 PolarHBondContact N-O 3.12Å; C494-W526 HydrophobicContact CB-CH2 3.76Å; C494-W526 HydrophobicContact CB-CZ2 4.2Å; C494-W526 WeakPolarHBondContact SG-CH2 3.46Å; L496-W526 HydrophobicContact CD2-CB 4.1Å; L496-W526 HydrophobicContact CD2-CG 4.3Å; L496-W526 HydrophobicContact CG-CB 4.3Å; I509-W526 WeakPolarHBondContact O-CZ2 3.24Å; I509-W526 PolarHBondContact O-NE1 3.43Å; G510-W526 VanDerWaalsContact C-CZ2 3.48Å; F522-W526 AromaticContact CD2-NE1 3.85Å; F522-W526 AromaticContact CE2-CD1 3.71Å; F522-W526 AromaticContact CE2-NE1 3.29Å; F522-W526 VanDerWaalsContact CE2-NE1 3.29Å; F522-W526 AromaticContact CZ-NE1 3.92Å; A523-W526 PolarHBondContact O-N 3.07Å; A523-W526 VanDerWaalsContact O-N 3.08Å; E524-W526 PolarHBondContact O-N 3.42Å; E524-W526 VanDerWaalsContact O-N 3.14Å
527	R	92.9	Very high	80	Confident	91 Å²	91	75.5 Å²	75.5	34%	0.343	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-66.5	136.9	177.2	-174.4	174.2	63.6	-179.7	7.5	111.7	C386 Y388 E524 E529	C386-R527 HydrophobicContact CB-CG 4.35Å; Y388-R527 HydrophobicContact CD1-CB 3.96Å; Y388-R527 HydrophobicContact CE1-CB 3.78Å; Y388-R527 HydrophobicContact CE1-CG 4.15Å; E524-R527 VanDerWaalsContact O-CB 3.26Å; E524-R527 WeakPolarHBondContact O-CB 3.32Å; E524-R527 PolarHBondContact O-N 2.84Å; E524-R527 VanDerWaalsContact O-N 3.13Å; E524-R527 WeakPolarHBondContact OE1-CD 3.27Å; E524-R527 IonicContact OE1-CZ 3.72Å; E524-R527 IonicContact OE1-NE 3.78Å; E524-R527 PolarHBondContact OE1-NE 2.88Å; E524-R527 IonicContact OE1-NH1 3.81Å; E524-R527 PolarHBondContact OE1-NH1 3.2Å; E524-R527 IonicContact OE1-NH2 2.86Å; R527-E529 WeakPolarHBondContact CD-O 3.38Å; R527-E529 WeakPolarHBondContact CG-O 3.33Å; R527-E529 PolarHBondContact NE-O 3.31Å
528	V	89.7	Confident	78.2	Confident	73 Å²	73	77.2 Å²	77.2	44%	0.442	40%	0.398	S	S	.	.			trans	-100	-39.7	178.6	-178	0	0	0	0	112.4	Q387 V389 L404	Q387-V528 PolarHBondContact O-N 3.46Å; V389-V528 HydrophobicContact CG2-CG2 3.58Å; L404-V528 HydrophobicContact CD2-CG2 3.99Å
529	E	77.1	Confident	76.6	Confident	50 Å²	50	81 Å²	81	23%	0.234	41%	0.408	C	S	.	.			trans	-80.5	128.6	-178.8	-73.7	175.8	-173.4	0	0	111	Q387 K406 R527	Q387-E529 HydrophobicContact CB-CG 3.95Å; Q387-E529 PolarHBondContact OE1-OE1 3.03Å; K406-E529 IonicContact NZ-OE1 3.2Å; K406-E529 PolarHBondContact NZ-OE1 2.81Å; K406-E529 IonicContact NZ-OE2 3.37Å; R527-E529 WeakPolarHBondContact CD-O 3.38Å; R527-E529 WeakPolarHBondContact CG-O 3.33Å; R527-E529 PolarHBondContact NE-O 3.31Å
530	S	65.7	Low	74.7	Confident	110 Å²	110	88.3 Å²	88.3	77%	0.769	44%	0.437	S	S	*	.			trans	-91.4	-2.9	177.1	53.7	0	0	0	0	114.2
531	N	62.2	Low	72.9	Confident	91 Å²	91	89.8 Å²	89.8	49%	0.487	45%	0.45	S	S	.	.			trans	-67.7	140.1	-170.4	-70.3	-15.7	0	0	0	112.6	F533 C534	N531-F533 HydrophobicContact CB-CD2 4.09Å; N531-F533 PolarHBondContact O-N 2.97Å; N531-C534 WeakPolarHBondContact O-CB 3.21Å; N531-C534 PolarHBondContact O-N 2.96Å
532	E	59.4	Low	70.9	Confident	168 Å²	168	89 Å²	89	79%	0.785	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-56.9	-21.5	177.4	-68.1	-175.4	156.8	0	0	114.2	C534 N535	E532-C534 PolarHBondContact O-N 3.02Å; E532-C534 VanDerWaalsContact O-N 3.07Å; E532-N535 PolarHBondContact O-N 3.21Å; E532-N535 PolarHBondContact O-ND2 2.79Å
533	F	65	Low	68.9	Low	197 Å²	197	95.3 Å²	95.3	86%	0.864	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-62.6	-13.4	176.4	-59.4	-67.7	0	0	0	113.9	N531	N531-F533 HydrophobicContact CB-CD2 4.09Å; N531-F533 PolarHBondContact O-N 2.97Å
534	C	71.9	Confident	67.3	Low	9 Å²	9	100.4 Å²	100.4	6%	0.061	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-85.9	-3.5	179.3	-95.2	0	0	0	0	115	C386 N531 E532 R536	C386-C534 HydrophobicContact CB-CB 4.19Å; C386-C534 WeakPolarHBondContact CB-SG 3.32Å; C386-C534 WeakPolarHBondContact SG-CA 3.44Å; C386-C534 WeakPolarHBondContact SG-CB 3.37Å; C386-C534 CovalentContact SG-SG 2.01Å; C386-C534 PolarHBondContact SG-SG 3.45Å; N531-C534 WeakPolarHBondContact O-CB 3.21Å; N531-C534 PolarHBondContact O-N 2.96Å; E532-C534 PolarHBondContact O-N 3.02Å; E532-C534 VanDerWaalsContact O-N 3.07Å; C534-R536 PolarHBondContact O-N 3.33Å
535	N	60.5	Low	65.9	Low	113 Å²	113	101.8 Å²	101.8	60%	0.604	52%	0.522	S	S	*	.			trans	-82	90.9	-174.6	-68	-30.4	0	0	0	111.6	E532	E532-N535 PolarHBondContact O-N 3.21Å; E532-N535 PolarHBondContact O-ND2 2.79Å
536	R	58.5	Low	64.9	Low	77 Å²	77	100.5 Å²	100.5	29%	0.291	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-83.1	135.3	160.9	-142.9	179	-166.1	169.7	10.6	108.2	Q383 R413 F415 C534 Q538	Q383-R536 PolarHBondContact O-NH1 2.98Å; R413-R536 PolarHBondContact O-NH2 3.11Å; F415-R536 PolarHBondContact O-NH1 2.88Å; F415-R536 PolarHBondContact O-NH2 2.79Å; F415-R536 VanDerWaalsContact O-NH2 3.14Å; C534-R536 PolarHBondContact O-N 3.33Å; R536-Q538 PolarHBondContact O-N 2.85Å
537	P	56.1	Low	63.9	Low	113 Å²	113	106.9 Å²	106.9	73%	0.734	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-55.6	129.3	173	-21.5	30.6	0	0	0	109.9	R539	P537-R539 PolarHBondContact O-N 3.43Å; P537-R539 VanDerWaalsContact O-N 3.1Å
538	Q	54	Low	62.8	Low	175 Å²	175	103.5 Å²	103.5	82%	0.818	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-52.9	118.8	176.3	-75	-172.5	-27.7	0	0	109.3	R536	R536-Q538 PolarHBondContact O-N 2.85Å
539	R	55.1	Low	62.5	Low	133 Å²	133	104.5 Å²	104.5	50%	0.502	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-74.1	134.5	169.9	-81.9	-177.2	168.3	-167.1	-9.8	107.7	S414 P537	S414-R539 VanDerWaalsContact CA-NH2 3.27Å; S414-R539 VanDerWaalsContact CB-NH2 3.34Å; S414-R539 PolarHBondContact O-NH1 2.63Å; S414-R539 PolarHBondContact OG-NH2 2.69Å; P537-R539 PolarHBondContact O-N 3.43Å; P537-R539 VanDerWaalsContact O-N 3.1Å
540	K	50.5	Low	62.9	Low	188 Å²	188	107.2 Å²	107.2	82%	0.817	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.4	168.9	-74.1	-176.6	176.8	-178.6	0	108.3	V542	K540-V542 PolarHBondContact O-N 2.82Å; K540-V542 VanDerWaalsContact O-N 3.12Å
541	P	51.2	Low	63.8	Low	98 Å²	98	110.3 Å²	110.3	64%	0.636	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-54.6	122.7	177	1.9	-6.8	0	0	0	109
542	V	50.7	Low	64.9	Low	68 Å²	68	108 Å²	108	41%	0.412	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-91.6	121.3	178.8	175.2	0	0	0	0	107.9	K540 E544 Q547	K540-V542 PolarHBondContact O-N 2.82Å; K540-V542 VanDerWaalsContact O-N 3.12Å; V542-E544 HydrophobicContact CG1-CB 4.43Å; V542-E544 WeakPolarHBondContact CG1-O 3.48Å; V542-E544 PolarHBondContact O-N 3.23Å; V542-Q547 VanDerWaalsContact CG1-CD 3.44Å; V542-Q547 HydrophobicContact CG1-CG 3.54Å
543	P	52.7	Low	66.2	Low	131 Å²	131	103.1 Å²	103.1	85%	0.851	53%	0.528	S	S	*	.	S	Bend	trans	-64	-25.7	-179.3	-22.1	32.3	0	0	0	114
544	E	59.4	Low	67.3	Low	107 Å²	107	99.2 Å²	99.2	50%	0.5	52%	0.515	S	S	.	.	S	Bend	trans	-96.6	129.3	-176.3	-64.7	-168.6	177.9	0	0	111.5	V542 C546 K553	V542-E544 HydrophobicContact CG1-CB 4.43Å; V542-E544 WeakPolarHBondContact CG1-O 3.48Å; V542-E544 PolarHBondContact O-N 3.23Å; E544-C546 PolarHBondContact O-N 2.95Å; E544-K553 IonicContact OE2-NZ 3.56Å; E544-K553 PolarHBondContact OE2-NZ 3.06Å
545	L	62.8	Low	68.2	Low	93 Å²	93	101.2 Å²	101.2	49%	0.487	52%	0.522	S	S	.	.	S	Bend	trans	-54.4	-19.1	170.4	-91.2	81.7	0	0	0	113.3	R582	L545-R582 HydrophobicContact CD2-CB 3.88Å; L545-R582 HydrophobicContact CD2-CG 4.17Å
546	C	72.2	Confident	69.6	Low	12 Å²	12	95.9 Å²	95.9	8%	0.081	49%	0.493	C	S	.	.			trans	-150.5	107.5	-172.9	-175.5	0	0	0	0	110.5	E544 G548 K553 C589	E544-C546 PolarHBondContact O-N 2.95Å; C546-G548 PolarHBondContact O-N 3.33Å; C546-K553 HydrophobicContact CB-CG 4.22Å; C546-K553 WeakPolarHBondContact O-CE 3.46Å; C546-K553 PolarHBondContact O-NZ 2.92Å; C546-K553 WeakPolarHBondContact SG-CG 3.26Å; C546-C589 HydrophobicContact CB-CB 3.66Å; C546-C589 WeakPolarHBondContact CB-SG 3.33Å; C546-C589 WeakPolarHBondContact SG-CB 3.42Å; C546-C589 CovalentContact SG-SG 1.99Å; C546-C589 PolarHBondContact SG-SG 2.95Å
547	Q	73.5	Confident	71.2	Confident	147 Å²	147	95.7 Å²	95.7	69%	0.687	50%	0.495	S	S	*	.			trans	-84.9	6.2	172.2	-66	-172.5	-33.5	0	0	113.3	V542	V542-Q547 VanDerWaalsContact CG1-CD 3.44Å; V542-Q547 HydrophobicContact CG1-CG 3.54Å
548	G	71.1	Confident	72.9	Confident	21 Å²	21	98.9 Å²	98.9	22%	0.216	49%	0.493	C	S	.	.	S	Bend	trans	-64.3	160.1	-178.6	0	0	0	0	0	113.3	C546 K553	C546-G548 PolarHBondContact O-N 3.33Å; G548-K553 WeakPolarHBondContact O-CE 3.46Å
549	T	83.1	Confident	74.8	Confident	93 Å²	93	92 Å²	92	57%	0.571	46%	0.461	S	S	*	.			trans	-56	161.1	170.4	65.6	0	0	0	0	111.2	K551 V552 K553	T549-K551 PolarHBondContact O-N 3.5Å; T549-K551 VanDerWaalsContact O-N 3.09Å; T549-V552 WeakPolarHBondContact O-CA 3.33Å; T549-V552 WeakPolarHBondContact O-CB 3.29Å; T549-V552 PolarHBondContact O-N 2.85Å; T549-V552 WeakPolarHBondContact OG1-CG2 2.95Å; T549-V552 PolarHBondContact OG1-N 2.88Å; T549-K553 PolarHBondContact O-N 3.5Å
550	V	84.4	Confident	76.6	Confident	107 Å²	107	85.7 Å²	85.7	65%	0.648	44%	0.437	S	S	*	.	H	α-helix	trans	-51	-38.7	176.2	179.2	0	0	0	0	111.8	V552 K553 L554	V550-V552 VanDerWaalsContact C-N 3.35Å; V550-V552 PolarHBondContact O-N 3.45Å; V550-K553 PolarHBondContact O-N 2.78Å; V550-L554 HydrophobicContact CG1-CD1 3.91Å; V550-L554 HydrophobicContact CG1-CG 4.24Å; V550-L554 WeakPolarHBondContact O-CB 3Å; V550-L554 VanDerWaalsContact O-CG 3.25Å; V550-L554 WeakPolarHBondContact O-CG 3.04Å; V550-L554 PolarHBondContact O-N 3.5Å
551	K	85.7	Confident	78.7	Confident	176 Å²	176	81.7 Å²	81.7	77%	0.765	42%	0.421	S	S	*	.	H	α-helix	trans	-61.2	-41.1	175.8	-67.6	-175.4	179.8	-179.8	0	112.6	T549 R555	T549-K551 PolarHBondContact O-N 3.5Å; T549-K551 VanDerWaalsContact O-N 3.09Å; K551-R555 WeakPolarHBondContact O-CB 2.96Å; K551-R555 PolarHBondContact O-N 3.18Å
552	V	86.1	Confident	80.6	Confident	43 Å²	43	80.7 Å²	80.7	26%	0.261	41%	0.407	S	S	.	.	H	α-helix	trans	-69.8	-46.1	178	172	0	0	0	0	110.7	T549 V550 L554 R555 A556 C589	T549-V552 WeakPolarHBondContact O-CA 3.33Å; T549-V552 WeakPolarHBondContact O-CB 3.29Å; T549-V552 PolarHBondContact O-N 2.85Å; T549-V552 WeakPolarHBondContact OG1-CG2 2.95Å; T549-V552 PolarHBondContact OG1-N 2.88Å; V550-V552 VanDerWaalsContact C-N 3.35Å; V550-V552 PolarHBondContact O-N 3.45Å; V552-L554 VanDerWaalsContact C-N 3.35Å; V552-L554 PolarHBondContact O-N 2.89Å; V552-R555 PolarHBondContact O-N 3Å; V552-A556 WeakPolarHBondContact O-CB 3.43Å; V552-A556 PolarHBondContact O-N 3.22Å; V552-C589 HydrophobicContact CG1-CB 4.46Å; V552-C589 WeakPolarHBondContact CG1-O 3.42Å
553	K	85.5	Confident	82.7	Confident	65 Å²	65	77.4 Å²	77.4	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-56.3	-47.2	174.2	-73.7	177.5	174.8	-174	0	111.6	E544 C546 G548 T549 V550 A556 H557	E544-K553 IonicContact OE2-NZ 3.56Å; E544-K553 PolarHBondContact OE2-NZ 3.06Å; C546-K553 HydrophobicContact CB-CG 4.22Å; C546-K553 WeakPolarHBondContact O-CE 3.46Å; C546-K553 PolarHBondContact O-NZ 2.92Å; C546-K553 WeakPolarHBondContact SG-CG 3.26Å; G548-K553 WeakPolarHBondContact O-CE 3.46Å; T549-K553 PolarHBondContact O-N 3.5Å; V550-K553 PolarHBondContact O-N 2.78Å; K553-A556 PolarHBondContact O-N 2.91Å; K553-H557 WeakPolarHBondContact O-CB 3.08Å; K553-H557 PolarHBondContact O-CD2 2.96Å; K553-H557 VanDerWaalsContact O-CD2 3.25Å; K553-H557 PolarHBondContact O-N 3.13Å
554	L	88.1	Confident	84.6	Confident	114 Å²	114	76 Å²	76	60%	0.597	37%	0.367	S	S	*	.	H	α-helix	trans	-62.7	-43.1	177	-74.4	172.5	0	0	0	112.2	V550 V552 R558	V550-L554 HydrophobicContact CG1-CD1 3.91Å; V550-L554 HydrophobicContact CG1-CG 4.24Å; V550-L554 WeakPolarHBondContact O-CB 3Å; V550-L554 VanDerWaalsContact O-CG 3.25Å; V550-L554 WeakPolarHBondContact O-CG 3.04Å; V550-L554 PolarHBondContact O-N 3.5Å; V552-L554 VanDerWaalsContact C-N 3.35Å; V552-L554 PolarHBondContact O-N 2.89Å; L554-R558 WeakPolarHBondContact O-CB 3.46Å; L554-R558 PolarHBondContact O-N 3.32Å
555	R	90.5	Very high	86.1	Confident	52 Å²	52	72.1 Å²	72.1	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-61.7	-47.9	174.8	178.3	-179.7	171.8	-132.3	-0.1	111.3	K551 V552 R558 E559 M588 C591 P592 V593 K595	K551-R555 WeakPolarHBondContact O-CB 2.96Å; K551-R555 PolarHBondContact O-N 3.18Å; V552-R555 PolarHBondContact O-N 3Å; R555-R558 PolarHBondContact O-N 2.01Å; R555-E559 HydrophobicContact CG-CG 4.43Å; R555-E559 WeakPolarHBondContact O-CG 3.34Å; R555-E559 PolarHBondContact O-N 3.48Å; R555-M588 HydrophobicContact CG-CE 4.36Å; R555-C591 PolarHBondContact NH1-O 3.42Å; R555-P592 PolarHBondContact NH1-O 3.08Å; R555-P592 PolarHBondContact NH2-O 3.27Å; R555-V593 PolarHBondContact NH2-O 3.37Å; R555-V593 VanDerWaalsContact NH2-O 3.07Å; R555-K595 PolarHBondContact NH2-O 3.25Å
556	A	90.5	Very high	87.6	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-49.5	180	0	0	0	0	0	111.4	V552 K553 E559 C560 V585 M588 C589	V552-A556 WeakPolarHBondContact O-CB 3.43Å; V552-A556 PolarHBondContact O-N 3.22Å; K553-A556 PolarHBondContact O-N 2.91Å; A556-E559 PolarHBondContact O-N 3.04Å; A556-C560 VanDerWaalsContact O-CB 3.28Å; A556-C560 WeakPolarHBondContact O-CB 3.43Å; A556-C560 PolarHBondContact O-N 2.87Å; A556-C560 PolarHBondContact O-SG 2.83Å; A556-V585 HydrophobicContact CB-CG1 4.43Å; A556-M588 HydrophobicContact CB-CB 3.56Å; A556-C589 VanDerWaalsContact CB-SG 3.57Å
557	H	91.8	Very high	88.6	Confident	73 Å²	73	77.3 Å²	77.3	34%	0.338	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-46.2	175.1	-79.4	-56.8	0	0	0	112.5	K553 E559 C560 Q561 Y581	K553-H557 WeakPolarHBondContact O-CB 3.08Å; K553-H557 PolarHBondContact O-CD2 2.96Å; K553-H557 VanDerWaalsContact O-CD2 3.25Å; K553-H557 PolarHBondContact O-N 3.13Å; H557-E559 PolarHBondContact O-N 3.43Å; H557-C560 PolarHBondContact O-N 3.01Å; H557-Q561 WeakPolarHBondContact O-CB 3.38Å; H557-Q561 VanDerWaalsContact O-CD 3.26Å; H557-Q561 WeakPolarHBondContact O-CG 3.33Å; H557-Q561 PolarHBondContact O-N 2.88Å; H557-Y581 AromaticContact ND1-CZ 3.82Å; H557-Y581 PolarHBondContact ND1-OH 2.03Å
558	R	92.9	Very high	89.5	Confident	180 Å²	180	70.3 Å²	70.3	68%	0.679	33%	0.333	S	S	*	.	H	α-helix	trans	-57	-46.2	178.8	176.1	-177.8	168.5	178.8	-1.9	112.5	L554 R555	L554-R558 WeakPolarHBondContact O-CB 3.46Å; L554-R558 PolarHBondContact O-N 3.32Å; R555-R558 PolarHBondContact O-N 2.01Å
559	E	92.1	Very high	90.5	Very high	31 Å²	31	75.4 Å²	75.4	15%	0.145	35%	0.351	C	S	.	.	H	α-helix	trans	-70.9	-44.1	180	-63.7	-52.8	137	0	0	111.5	R555 A556 H557 Q561 K562 M588 Y598	R555-E559 HydrophobicContact CG-CG 4.43Å; R555-E559 WeakPolarHBondContact O-CG 3.34Å; R555-E559 PolarHBondContact O-N 3.48Å; A556-E559 PolarHBondContact O-N 3.04Å; H557-E559 PolarHBondContact O-N 3.43Å; E559-Q561 PolarHBondContact O-N 2.9Å; E559-K562 WeakPolarHBondContact O-CB 3.05Å; E559-K562 WeakPolarHBondContact O-CG 3.22Å; E559-K562 PolarHBondContact O-N 3.46Å; E559-K562 WeakPolarHBondContact OE2-CE 3.48Å; E559-K562 IonicContact OE2-NZ 2.71Å; E559-K562 PolarHBondContact OE2-NZ 2.84Å; E559-M588 HydrophobicContact CB-CE 4Å; E559-M588 HydrophobicContact CG-CE 3.79Å; E559-Y598 HydrophobicContact CB-CD1 3.82Å; E559-Y598 HydrophobicContact CB-CE1 4.31Å; E559-Y598 HydrophobicContact CB-CG 4.37Å; E559-Y598 HydrophobicContact CG-CD1 4.24Å; E559-Y598 HydrophobicContact CG-CE1 4.38Å
560	C	93.5	Very high	91	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-73.5	-24	-178	-63.2	0	0	0	0	114.2	A556 H557 K562 L563 Y581 C584 V585	A556-C560 VanDerWaalsContact O-CB 3.28Å; A556-C560 WeakPolarHBondContact O-CB 3.43Å; A556-C560 PolarHBondContact O-N 2.87Å; A556-C560 PolarHBondContact O-SG 2.83Å; H557-C560 PolarHBondContact O-N 3.01Å; C560-K562 PolarHBondContact O-N 2.05Å; C560-L563 VanDerWaalsContact O-CB 3.29Å; C560-L563 WeakPolarHBondContact O-CB 3.47Å; C560-L563 PolarHBondContact O-N 2.81Å; C560-L563 VanDerWaalsContact O-N 3.08Å; C560-Y581 HydrophobicContact CB-CD2 4.05Å; C560-Y581 HydrophobicContact CB-CE2 3.91Å; C560-Y581 WeakPolarHBondContact O-CD2 3.27Å; C560-C584 WeakPolarHBondContact CA-SG 3.32Å; C560-C584 HydrophobicContact CB-CB 3.82Å; C560-C584 WeakPolarHBondContact CB-SG 3.23Å; C560-C584 WeakPolarHBondContact SG-CB 3.08Å; C560-C584 PolarHBondContact SG-O 3.39Å; C560-C584 CovalentContact SG-SG 2.04Å; C560-C584 PolarHBondContact SG-SG 2.99Å; C560-V585 HydrophobicContact CB-CG2 3.93Å; C560-V585 PolarHBondContact SG-N 3.12Å; C560-V585 VanDerWaalsContact SG-N 3.37Å
561	Q	94	Very high	91.5	Very high	104 Å²	104	69.1 Å²	69.1	49%	0.486	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22.5	174.6	-80.4	165.6	20.4	0	0	112.7	H557 E559 L563 K564 Y581	H557-Q561 WeakPolarHBondContact O-CB 3.38Å; H557-Q561 VanDerWaalsContact O-CD 3.26Å; H557-Q561 WeakPolarHBondContact O-CG 3.33Å; H557-Q561 PolarHBondContact O-N 2.88Å; E559-Q561 PolarHBondContact O-N 2.9Å; Q561-L563 PolarHBondContact O-N 2.76Å; Q561-L563 VanDerWaalsContact O-N 3.14Å; Q561-K564 WeakPolarHBondContact O-CB 3.49Å; Q561-K564 PolarHBondContact O-N 3.14Å; Q561-Y581 HydrophobicContact CG-CE2 4.16Å
562	K	92.7	Very high	91.9	Very high	77 Å²	77	63.1 Å²	63.1	34%	0.335	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-59.5	-21.6	173.1	-61.1	170.9	178.2	170.7	0	112.7	E559 C560 K564 S565 F602	E559-K562 WeakPolarHBondContact O-CB 3.05Å; E559-K562 WeakPolarHBondContact O-CG 3.22Å; E559-K562 PolarHBondContact O-N 3.46Å; E559-K562 WeakPolarHBondContact OE2-CE 3.48Å; E559-K562 IonicContact OE2-NZ 2.71Å; E559-K562 PolarHBondContact OE2-NZ 2.84Å; C560-K562 PolarHBondContact O-N 2.05Å; K562-K564 PolarHBondContact O-N 3.08Å; K562-S565 WeakPolarHBondContact O-CB 3.41Å; K562-S565 PolarHBondContact O-N 2.85Å; K562-S565 PolarHBondContact O-OG 3.26Å; K562-F602 HydrophobicContact CB-CE1 3.74Å; K562-F602 HydrophobicContact CB-CZ 3.73Å
563	L	93.3	Very high	92.2	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-64.2	-20.8	173.7	-161.6	68.9	0	0	0	112.5	C560 Q561 F568 H572 F580 F602 Y605	C560-L563 VanDerWaalsContact O-CB 3.29Å; C560-L563 WeakPolarHBondContact O-CB 3.47Å; C560-L563 PolarHBondContact O-N 2.81Å; C560-L563 VanDerWaalsContact O-N 3.08Å; Q561-L563 PolarHBondContact O-N 2.76Å; Q561-L563 VanDerWaalsContact O-N 3.14Å; L563-F568 HydrophobicContact CD1-CD2 4.4Å; L563-F568 HydrophobicContact CD1-CE1 4.42Å; L563-F568 HydrophobicContact CD1-CE2 4.24Å; L563-F568 HydrophobicContact CD1-CZ 4.24Å; L563-F568 WeakPolarHBondContact O-CB 3.42Å; L563-H572 PolarHBondContact O-NE2 2.76Å; L563-F580 HydrophobicContact CD2-CB 3.82Å; L563-F602 HydrophobicContact CB-CE1 4.44Å; L563-F602 HydrophobicContact CB-CE2 3.92Å; L563-F602 HydrophobicContact CB-CZ 3.81Å; L563-F602 HydrophobicContact CD1-CD1 4.28Å; L563-F602 HydrophobicContact CD1-CD2 3.96Å; L563-F602 HydrophobicContact CD1-CE1 4.38Å; L563-F602 HydrophobicContact CD1-CE2 4.06Å; L563-F602 HydrophobicContact CD1-CG 4.08Å; L563-F602 HydrophobicContact CD1-CZ 4.28Å; L563-Y605 HydrophobicContact CD1-CD1 3.52Å; L563-Y605 HydrophobicContact CD1-CE1 4.34Å; L563-Y605 HydrophobicContact CD1-CG 3.87Å; L563-Y605 HydrophobicContact CG-CD1 4.15Å; L563-Y605 HydrophobicContact CG-CG 4.48Å
564	K	92.8	Very high	92.3	Very high	101 Å²	101	66.6 Å²	66.6	44%	0.439	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-92.1	3.8	176.2	-57.5	178.2	174.7	-179.4	0	112.9	Q561 K562 Y577	Q561-K564 WeakPolarHBondContact O-CB 3.49Å; Q561-K564 PolarHBondContact O-N 3.14Å; K562-K564 PolarHBondContact O-N 3.08Å; K564-Y577 HydrophobicContact CD-CE2 4.25Å; K564-Y577 HydrophobicContact CG-CD2 4.33Å; K564-Y577 HydrophobicContact CG-CE2 3.84Å
565	S	92.5	Very high	92.5	Very high	26 Å²	26	62 Å²	62	18%	0.182	30%	0.296	C	S	.	.	S	Bend	trans	-69.7	169.8	-178.9	75.9	0	0	0	0	112	K562 E567 F568 Q569	K562-S565 WeakPolarHBondContact O-CB 3.41Å; K562-S565 PolarHBondContact O-N 2.85Å; K562-S565 PolarHBondContact O-OG 3.26Å; S565-E567 VanDerWaalsContact CB-OE2 3.28Å; S565-E567 WeakPolarHBondContact CB-OE2 3.46Å; S565-E567 PolarHBondContact O-N 3.37Å; S565-E567 WeakPolarHBondContact OG-CB 3.45Å; S565-E567 PolarHBondContact OG-N 3.2Å; S565-E567 PolarHBondContact OG-OE2 3.42Å; S565-F568 PolarHBondContact O-N 3.26Å; S565-Q569 PolarHBondContact O-N 3.14Å
566	W	93.2	Very high	92.5	Very high	167 Å²	167	64.2 Å²	64.2	63%	0.633	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-58.2	-25.3	173.6	74.1	-90.7	0	0	0	112.6	F568 Q569 H617	W566-F568 PolarHBondContact O-N 3.42Å; W566-Q569 WeakPolarHBondContact O-CB 3.25Å; W566-Q569 PolarHBondContact O-N 2.86Å; W566-H617 HydrophobicContact CH2-CB 4.22Å; W566-H617 HydrophobicContact CZ3-CB 3.99Å; W566-H617 AromaticContact CZ3-CD2 3.81Å; W566-H617 AromaticContact CZ3-CG 3.88Å
567	E	92.5	Very high	92.7	Very high	47 Å²	47	67.5 Å²	67.5	22%	0.22	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-64.7	-23.7	-177.2	-59.1	151.3	112	0	0	112.5	S565 H617 W618	S565-E567 VanDerWaalsContact CB-OE2 3.28Å; S565-E567 WeakPolarHBondContact CB-OE2 3.46Å; S565-E567 PolarHBondContact O-N 3.37Å; S565-E567 WeakPolarHBondContact OG-CB 3.45Å; S565-E567 PolarHBondContact OG-N 3.2Å; S565-E567 PolarHBondContact OG-OE2 3.42Å; E567-H617 HydrophobicContact CB-CB 4.37Å; E567-H617 PolarHBondContact O-N 3.18Å; E567-W618 HydrophobicContact CB-CB 4.03Å
568	F	93.9	Very high	92.7	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-111.7	-4.8	179.7	-68.8	-72.8	0	0	0	113.8	L563 S565 W566 T570 C571 H572 F602 Y605 V616 W618	L563-F568 HydrophobicContact CD1-CD2 4.4Å; L563-F568 HydrophobicContact CD1-CE1 4.42Å; L563-F568 HydrophobicContact CD1-CE2 4.24Å; L563-F568 HydrophobicContact CD1-CZ 4.24Å; L563-F568 WeakPolarHBondContact O-CB 3.42Å; S565-F568 PolarHBondContact O-N 3.26Å; W566-F568 PolarHBondContact O-N 3.42Å; F568-T570 PolarHBondContact O-N 2.94Å; F568-T570 VanDerWaalsContact O-N 3.13Å; F568-C571 WeakPolarHBondContact O-CB 3.29Å; F568-C571 PolarHBondContact O-N 3.12Å; F568-H572 PolarHBondContact O-CD2 2.69Å; F568-H572 PolarHBondContact O-N 2.83Å; F568-F602 AromaticContact CE2-CD1 3.78Å; F568-F602 HydrophobicContact CE2-CD1 3.78Å; F568-F602 AromaticContact CE2-CE1 3.85Å; F568-F602 HydrophobicContact CE2-CE1 3.85Å; F568-F602 AromaticContact CZ-CD1 3.75Å; F568-F602 HydrophobicContact CZ-CD1 3.75Å; F568-F602 HydrophobicContact CZ-CE1 4.3Å; F568-F602 HydrophobicContact CZ-CG 4.48Å; F568-Y605 HydrophobicContact CB-CE1 4.09Å; F568-Y605 AromaticContact CD1-CD1 3.64Å; F568-Y605 HydrophobicContact CD1-CD1 3.64Å; F568-Y605 AromaticContact CD1-CE1 3.8Å; F568-Y605 HydrophobicContact CD1-CE1 3.8Å; F568-Y605 HydrophobicContact CE1-CD1 4.01Å; F568-Y605 HydrophobicContact CG-CD1 4.28Å; F568-Y605 HydrophobicContact CG-CE1 4.19Å; F568-V616 HydrophobicContact CD1-CB 4.32Å; F568-V616 HydrophobicContact CD1-CG1 4.07Å; F568-W618 HydrophobicContact CD2-CB 4.49Å; F568-W618 HydrophobicContact CE1-CB 3.84Å; F568-W618 HydrophobicContact CE1-CD2 4.41Å; F568-W618 HydrophobicContact CE1-CE3 4.46Å; F568-W618 HydrophobicContact CE1-CG 4.17Å; F568-W618 HydrophobicContact CE2-CB 3.74Å; F568-W618 AromaticContact CE2-CD1 3.77Å; F568-W618 HydrophobicContact CE2-CD2 4.28Å; F568-W618 AromaticContact CE2-CG 3.65Å; F568-W618 HydrophobicContact CE2-CG 3.65Å; F568-W618 HydrophobicContact CZ-CB 3.38Å; F568-W618 AromaticContact CZ-CD1 3.85Å; F568-W618 AromaticContact CZ-CD2 3.57Å; F568-W618 HydrophobicContact CZ-CD2 3.57Å; F568-W618 AromaticContact CZ-CE3 3.98Å; F568-W618 HydrophobicContact CZ-CE3 3.98Å; F568-W618 AromaticContact CZ-CG 3.29Å; F568-W618 HydrophobicContact CZ-CG 3.29Å
569	Q	92.3	Very high	92.6	Very high	128 Å²	128	57.7 Å²	57.7	60%	0.598	29%	0.292	S	S	*	.	H	α-helix	trans	-58.2	-32.8	-170.5	-177.2	177.7	2.6	0	0	113.4	S565 W566 C571 H572	S565-Q569 PolarHBondContact O-N 3.14Å; W566-Q569 WeakPolarHBondContact O-CB 3.25Å; W566-Q569 PolarHBondContact O-N 2.86Å; Q569-C571 PolarHBondContact O-N 3.26Å; Q569-H572 PolarHBondContact O-N 3.27Å
570	T	92.9	Very high	92.6	Very high	67 Å²	67	56.8 Å²	56.8	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-23.2	176.8	54.9	0	0	0	0	113.2	F568 K615	F568-T570 PolarHBondContact O-N 2.94Å; F568-T570 VanDerWaalsContact O-N 3.13Å; T570-K615 PolarHBondContact OG1-O 3.22Å
571	C	94.5	Very high	92.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-98.8	-21.8	-177	-174.1	0	0	0	0	113.7	F568 Q569 S573 T574 V575 Y605 C609 I614 V616	F568-C571 WeakPolarHBondContact O-CB 3.29Å; F568-C571 PolarHBondContact O-N 3.12Å; Q569-C571 PolarHBondContact O-N 3.26Å; C571-S573 PolarHBondContact O-N 3.27Å; C571-S573 VanDerWaalsContact O-N 3.08Å; C571-T574 PolarHBondContact O-N 2.98Å; C571-V575 PolarHBondContact O-N 3.48Å; C571-Y605 HydrophobicContact CB-CE1 4.37Å; C571-C609 HydrophobicContact CB-CB 3.78Å; C571-C609 WeakPolarHBondContact CB-SG 3.35Å; C571-C609 WeakPolarHBondContact SG-CA 3.07Å; C571-C609 WeakPolarHBondContact SG-CB 3.49Å; C571-C609 CovalentContact SG-SG 2.01Å; C571-C609 PolarHBondContact SG-SG 3.14Å; C571-I614 HydrophobicContact CB-CG2 4.18Å; C571-V616 HydrophobicContact CB-CG1 4.35Å
572	H	94.7	Very high	92.5	Very high	50 Å²	50	60 Å²	60	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-57.5	-28.8	-175.9	-66.1	165.8	0	0	0	113.7	L563 F568 Q569 T574 Y577 Y605	L563-H572 PolarHBondContact O-NE2 2.76Å; F568-H572 PolarHBondContact O-CD2 2.69Å; F568-H572 PolarHBondContact O-N 2.83Å; Q569-H572 PolarHBondContact O-N 3.27Å; H572-T574 VanDerWaalsContact C-N 3.29Å; H572-T574 PolarHBondContact O-N 3.36Å; H572-Y577 HydrophobicContact CB-CD1 4.35Å; H572-Y577 AromaticContact CD2-CD1 3.74Å; H572-Y605 PolarHBondContact CD2-OH 2.85Å
573	S	91.1	Very high	92.4	Very high	107 Å²	107	56.4 Å²	56.4	75%	0.748	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.7	177.1	61.2	0	0	0	0	114	C571	C571-S573 PolarHBondContact O-N 3.27Å; C571-S573 VanDerWaalsContact O-N 3.08Å
574	T	89	Confident	92.3	Very high	75 Å²	75	56.4 Å²	56.4	46%	0.46	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-38.5	-171	-53.7	0	0	0	0	112.5	C571 H572 E612 I614	C571-T574 PolarHBondContact O-N 2.98Å; H572-T574 VanDerWaalsContact C-N 3.29Å; H572-T574 PolarHBondContact O-N 3.36Å; T574-E612 HydrophobicContact CG2-CB 3.86Å; T574-E612 HydrophobicContact CG2-CG 3.88Å; T574-I614 VanDerWaalsContact CB-CD1 3.5Å; T574-I614 HydrophobicContact CG2-CD1 3.86Å; T574-I614 VanDerWaalsContact OG1-CD1 3.31Å; T574-I614 WeakPolarHBondContact OG1-CD1 3.42Å
575	V	91.6	Very high	92.3	Very high	18 Å²	18	51.9 Å²	51.9	11%	0.109	26%	0.261	C	S	.	.	S	Bend	trans	-119.5	122.7	179.9	-174.2	0	0	0	0	109.8	C571 Y577 F580 Y605 A608 E612	C571-V575 PolarHBondContact O-N 3.48Å; V575-Y577 PolarHBondContact O-N 3.01Å; V575-F580 HydrophobicContact CG1-CE2 4.13Å; V575-Y605 HydrophobicContact CB-CE2 3.86Å; V575-Y605 HydrophobicContact CG1-CD2 4.07Å; V575-Y605 HydrophobicContact CG1-CE2 3.6Å; V575-Y605 PolarHBondContact O-OH 2.8Å; V575-A608 HydrophobicContact CG1-CB 3.79Å; V575-A608 HydrophobicContact CG2-CB 4.43Å; V575-E612 HydrophobicContact CG2-CG 3.96Å
576	D	91.2	Very high	92	Very high	98 Å²	98	51.6 Å²	51.6	52%	0.524	26%	0.258	S	S	.	.			trans	-63.9	106.6	176.2	-179.7	12.5	0	0	0	110.8	A578 T579 F580	D576-A578 VanDerWaalsContact C-N 3.27Å; D576-A578 PolarHBondContact O-N 3.43Å; D576-A578 WeakPolarHBondContact OD1-CB 3.48Å; D576-A578 PolarHBondContact OD1-N 3.06Å; D576-T579 PolarHBondContact O-OG1 3.06Å; D576-F580 WeakPolarHBondContact O-CD2 3.43Å
577	Y	93.8	Very high	91.7	Very high	68 Å²	68	44 Å²	44	27%	0.267	23%	0.23	S	C	.	.	H	α-helix	trans	-75.7	-14.7	178.9	72	-96.9	0	0	0	112.7	K564 H572 V575 T579 F580 Y581	K564-Y577 HydrophobicContact CD-CE2 4.25Å; K564-Y577 HydrophobicContact CG-CD2 4.33Å; K564-Y577 HydrophobicContact CG-CE2 3.84Å; H572-Y577 HydrophobicContact CB-CD1 4.35Å; H572-Y577 AromaticContact CD2-CD1 3.74Å; V575-Y577 PolarHBondContact O-N 3.01Å; Y577-T579 VanDerWaalsContact C-N 3.27Å; Y577-T579 PolarHBondContact O-N 3.03Å; Y577-F580 PolarHBondContact O-N 3.49Å; Y577-Y581 WeakPolarHBondContact O-CB 3.48Å; Y577-Y581 PolarHBondContact O-N 2.86Å
578	A	92.5	Very high	91.5	Very high	24 Å²	24	41.8 Å²	41.8	20%	0.198	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-32.3	-170.8	0	0	0	0	0	112.5	D576 R582	D576-A578 VanDerWaalsContact C-N 3.27Å; D576-A578 PolarHBondContact O-N 3.43Å; D576-A578 WeakPolarHBondContact OD1-CB 3.48Å; D576-A578 PolarHBondContact OD1-N 3.06Å; A578-R582 WeakPolarHBondContact O-CG 2.91Å; A578-R582 PolarHBondContact O-N 3.48Å; A578-R582 VanDerWaalsContact O-N 3.16Å
579	T	89.8	Confident	91	Very high	24 Å²	24	42.4 Å²	42.4	15%	0.147	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-47.1	175.9	53.9	0	0	0	0	111.4	T379 D576 Y577 Y581 R582 S583	T379-T579 WeakPolarHBondContact OG1-CB 3.4Å; T379-T579 WeakPolarHBondContact OG1-CG2 3.45Å; D576-T579 PolarHBondContact O-OG1 3.06Å; Y577-T579 VanDerWaalsContact C-N 3.27Å; Y577-T579 PolarHBondContact O-N 3.03Å; T579-Y581 PolarHBondContact O-N 3.36Å; T579-R582 PolarHBondContact O-N 3.2Å; T579-S583 WeakPolarHBondContact O-CB 3.37Å; T579-S583 PolarHBondContact O-N 3.34Å; T579-S583 PolarHBondContact O-OG 3.46Å
580	F	93.3	Very high	90.3	Very high	11 Å²	11	41 Å²	41	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-36.9	175.8	-61.5	-88.6	0	0	0	112.4	F367 L563 V575 D576 Y577 S583 C584 A604 Y605 A608	F367-F580 HydrophobicContact CE1-CD1 4.4Å; F367-F580 HydrophobicContact CE1-CE1 4.2Å; F367-F580 HydrophobicContact CE2-CD1 4.17Å; F367-F580 AromaticContact CZ-CD1 3.83Å; F367-F580 HydrophobicContact CZ-CD1 3.83Å; F367-F580 HydrophobicContact CZ-CE1 4.09Å; L563-F580 HydrophobicContact CD2-CB 3.82Å; V575-F580 HydrophobicContact CG1-CE2 4.13Å; D576-F580 WeakPolarHBondContact O-CD2 3.43Å; Y577-F580 PolarHBondContact O-N 3.49Å; F580-S583 WeakPolarHBondContact O-CB 3.2Å; F580-S583 PolarHBondContact O-N 3.28Å; F580-C584 VanDerWaalsContact O-CB 3.28Å; F580-C584 WeakPolarHBondContact O-CB 3.28Å; F580-C584 PolarHBondContact O-N 2.85Å; F580-A604 HydrophobicContact CD1-CB 4Å; F580-A604 HydrophobicContact CE1-CB 3.77Å; F580-Y605 HydrophobicContact CB-CD2 4.31Å; F580-Y605 HydrophobicContact CD1-CD2 4.48Å; F580-Y605 AromaticContact CD2-CD2 3.45Å; F580-Y605 HydrophobicContact CD2-CD2 3.45Å; F580-Y605 VanDerWaalsContact CD2-CD2 3.45Å; F580-Y605 HydrophobicContact CD2-CE2 4.18Å; F580-Y605 HydrophobicContact CD2-CG 4.35Å; F580-Y605 AromaticContact CE2-CD2 3.77Å; F580-Y605 HydrophobicContact CE2-CD2 3.77Å; F580-Y605 HydrophobicContact CE2-CE2 4.44Å; F580-Y605 AromaticContact CG-CD2 3.83Å; F580-Y605 HydrophobicContact CG-CD2 3.83Å; F580-Y605 HydrophobicContact CG-CG 4.31Å; F580-Y605 HydrophobicContact CZ-CD2 4.41Å; F580-A608 HydrophobicContact CZ-CB 4.06Å
581	Y	94	Very high	89.7	Confident	34 Å²	34	38.3 Å²	38.3	13%	0.133	20%	0.201	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.3	177.9	-93.5	0	0	0	112.1	H557 C560 Q561 Y577 T579 C584 V585	H557-Y581 AromaticContact ND1-CZ 3.82Å; H557-Y581 PolarHBondContact ND1-OH 2.03Å; C560-Y581 HydrophobicContact CB-CD2 4.05Å; C560-Y581 HydrophobicContact CB-CE2 3.91Å; C560-Y581 WeakPolarHBondContact O-CD2 3.27Å; Q561-Y581 HydrophobicContact CG-CE2 4.16Å; Y577-Y581 WeakPolarHBondContact O-CB 3.48Å; Y577-Y581 PolarHBondContact O-N 2.86Å; T579-Y581 PolarHBondContact O-N 3.36Å; Y581-C584 WeakPolarHBondContact O-CB 3.45Å; Y581-C584 PolarHBondContact O-N 2.89Å; Y581-V585 HydrophobicContact CD1-CG2 4.37Å; Y581-V585 HydrophobicContact CE1-CG2 3.98Å; Y581-V585 HydrophobicContact CE2-CG2 4.49Å; Y581-V585 WeakPolarHBondContact O-CG2 3.15Å; Y581-V585 PolarHBondContact O-N 3.22Å
582	R	90.9	Very high	89.1	Confident	138 Å²	138	40.9 Å²	40.9	52%	0.521	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-42.2	176.7	-74.6	-178.2	-166.4	108.7	-2.6	111.8	L545 A578 T579 V585 T586	L545-R582 HydrophobicContact CD2-CB 3.88Å; L545-R582 HydrophobicContact CD2-CG 4.17Å; A578-R582 WeakPolarHBondContact O-CG 2.91Å; A578-R582 PolarHBondContact O-N 3.48Å; A578-R582 VanDerWaalsContact O-N 3.16Å; T579-R582 PolarHBondContact O-N 3.2Å; R582-V585 PolarHBondContact O-N 3.25Å; R582-T586 PolarHBondContact O-N 3.06Å; R582-T586 VanDerWaalsContact O-N 3.14Å; R582-T586 PolarHBondContact O-OG1 2.84Å
583	S	90.7	Very high	88.3	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-58.1	-52.7	174.4	-57.1	0	0	0	0	110.6	H371 T579 F580 V585 T586 D587	H371-S583 VanDerWaalsContact CD2-CB 3.42Å; H371-S583 WeakPolarHBondContact CD2-CB 3.11Å; H371-S583 WeakPolarHBondContact NE2-CB 3.4Å; H371-S583 PolarHBondContact NE2-O 3.43Å; T579-S583 WeakPolarHBondContact O-CB 3.37Å; T579-S583 PolarHBondContact O-N 3.34Å; T579-S583 PolarHBondContact O-OG 3.46Å; F580-S583 WeakPolarHBondContact O-CB 3.2Å; F580-S583 PolarHBondContact O-N 3.28Å; S583-V585 VanDerWaalsContact C-N 3.32Å; S583-V585 PolarHBondContact O-N 3.16Å; S583-T586 WeakPolarHBondContact O-CA 3.25Å; S583-T586 VanDerWaalsContact O-CB 3.26Å; S583-T586 WeakPolarHBondContact O-CB 3.49Å; S583-T586 PolarHBondContact O-N 3.45Å; S583-D587 PolarHBondContact O-N 3.37Å
584	C	92.1	Very high	87.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54	-44.4	176.6	-179.9	0	0	0	0	113.3	C560 F580 Y581 T586 D587 M588 Y598 S601	C560-C584 WeakPolarHBondContact CA-SG 3.32Å; C560-C584 HydrophobicContact CB-CB 3.82Å; C560-C584 WeakPolarHBondContact CB-SG 3.23Å; C560-C584 WeakPolarHBondContact SG-CB 3.08Å; C560-C584 PolarHBondContact SG-O 3.39Å; C560-C584 CovalentContact SG-SG 2.04Å; C560-C584 PolarHBondContact SG-SG 2.99Å; F580-C584 VanDerWaalsContact O-CB 3.28Å; F580-C584 WeakPolarHBondContact O-CB 3.28Å; F580-C584 PolarHBondContact O-N 2.85Å; Y581-C584 WeakPolarHBondContact O-CB 3.45Å; Y581-C584 PolarHBondContact O-N 2.89Å; C584-T586 VanDerWaalsContact C-N 3.27Å; C584-T586 PolarHBondContact O-N 3.31Å; C584-D587 PolarHBondContact O-N 2.63Å; C584-M588 VanDerWaalsContact O-CB 3.3Å; C584-M588 WeakPolarHBondContact O-CB 2.9Å; C584-M588 WeakPolarHBondContact O-CG 3.43Å; C584-M588 PolarHBondContact O-N 3.14Å; C584-Y598 WeakPolarHBondContact SG-CB 2.93Å; C584-S601 VanDerWaalsContact CA-OG 3.29Å; C584-S601 WeakPolarHBondContact CA-OG 3.26Å; C584-S601 PolarHBondContact N-OG 2.86Å
585	V	91	Very high	86.8	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-38.8	179.4	170.4	0	0	0	0	110.4	A556 C560 Y581 R582 S583 C589	A556-V585 HydrophobicContact CB-CG1 4.43Å; C560-V585 HydrophobicContact CB-CG2 3.93Å; C560-V585 PolarHBondContact SG-N 3.12Å; C560-V585 VanDerWaalsContact SG-N 3.37Å; Y581-V585 HydrophobicContact CD1-CG2 4.37Å; Y581-V585 HydrophobicContact CE1-CG2 3.98Å; Y581-V585 HydrophobicContact CE2-CG2 4.49Å; Y581-V585 WeakPolarHBondContact O-CG2 3.15Å; Y581-V585 PolarHBondContact O-N 3.22Å; R582-V585 PolarHBondContact O-N 3.25Å; S583-V585 VanDerWaalsContact C-N 3.32Å; S583-V585 PolarHBondContact O-N 3.16Å; V585-C589 WeakPolarHBondContact O-CB 3.43Å; V585-C589 PolarHBondContact O-N 3.23Å; V585-C589 VanDerWaalsContact O-N 3.14Å; V585-C589 PolarHBondContact O-SG 3.38Å
586	T	86.4	Confident	86.3	Confident	20 Å²	20	51.6 Å²	51.6	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-53.8	176.4	-49.9	0	0	0	0	110.4	R582 S583 C584 M588 C589	R582-T586 PolarHBondContact O-N 3.06Å; R582-T586 VanDerWaalsContact O-N 3.14Å; R582-T586 PolarHBondContact O-OG1 2.84Å; S583-T586 WeakPolarHBondContact O-CA 3.25Å; S583-T586 VanDerWaalsContact O-CB 3.26Å; S583-T586 WeakPolarHBondContact O-CB 3.49Å; S583-T586 PolarHBondContact O-N 3.45Å; C584-T586 VanDerWaalsContact C-N 3.27Å; C584-T586 PolarHBondContact O-N 3.31Å; T586-M588 VanDerWaalsContact C-N 3.33Å; T586-M588 PolarHBondContact O-N 3.4Å; T586-C589 WeakPolarHBondContact O-CB 3.3Å; T586-C589 PolarHBondContact O-N 3.01Å; T586-C589 VanDerWaalsContact O-N 3.14Å
587	D	86.6	Confident	86	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.043	24%	0.242	C	C	.	.	H	α-helix	trans	-52.2	-48.8	175.8	-79.9	-45.6	0	0	0	112	D369 H371 S583 C584 C589 C591 C597 S601	D369-D587 PolarHBondContact N-OD1 2.8Å; H371-D587 IonicContact CD2-OD2 2.64Å; H371-D587 IonicContact NE2-OD1 2.64Å; H371-D587 IonicContact NE2-OD2 2.97Å; H371-D587 PolarHBondContact NE2-OD2 2.83Å; S583-D587 PolarHBondContact O-N 3.37Å; C584-D587 PolarHBondContact O-N 2.63Å; D587-C589 VanDerWaalsContact C-N 3.25Å; D587-C589 PolarHBondContact O-N 2.03Å; D587-C591 WeakPolarHBondContact O-CB 3.32Å; D587-C591 PolarHBondContact O-N 2.74Å; D587-C597 HydrophobicContact CB-CB 4.2Å; D587-S601 PolarHBondContact OD2-OG 2.92Å
588	M	88.4	Confident	85.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71	-20.6	-175.2	-77.6	-60.3	-60.9	0	0	113.8	R555 A556 E559 C584 T586 C591 C597 Y598	R555-M588 HydrophobicContact CG-CE 4.36Å; A556-M588 HydrophobicContact CB-CB 3.56Å; E559-M588 HydrophobicContact CB-CE 4Å; E559-M588 HydrophobicContact CG-CE 3.79Å; C584-M588 VanDerWaalsContact O-CB 3.3Å; C584-M588 WeakPolarHBondContact O-CB 2.9Å; C584-M588 WeakPolarHBondContact O-CG 3.43Å; C584-M588 PolarHBondContact O-N 3.14Å; T586-M588 VanDerWaalsContact C-N 3.33Å; T586-M588 PolarHBondContact O-N 3.4Å; M588-C591 HydrophobicContact CE-CB 4.39Å; M588-C591 WeakPolarHBondContact O-CB 3.15Å; M588-C591 PolarHBondContact O-N 3.13Å; M588-C591 HydrophobicContact SD-CB 4Å; M588-C597 HydrophobicContact SD-CB 4.03Å; M588-Y598 HydrophobicContact CE-CD1 4.23Å; M588-Y598 HydrophobicContact SD-CD1 3.75Å; M588-Y598 HydrophobicContact SD-CG 4.26Å; M588-Y598 PolarHBondContact SD-N 3.18Å
589	C	85	Confident	85.5	Confident	12 Å²	12	44.4 Å²	44.4	8%	0.081	22%	0.223	C	C	.	.	H	α-helix	trans	-75.2	-25	-176.9	-85.8	0	0	0	0	114.6	C546 V552 A556 V585 T586 D587	C546-C589 HydrophobicContact CB-CB 3.66Å; C546-C589 WeakPolarHBondContact CB-SG 3.33Å; C546-C589 WeakPolarHBondContact SG-CB 3.42Å; C546-C589 CovalentContact SG-SG 1.99Å; C546-C589 PolarHBondContact SG-SG 2.95Å; V552-C589 HydrophobicContact CG1-CB 4.46Å; V552-C589 WeakPolarHBondContact CG1-O 3.42Å; A556-C589 VanDerWaalsContact CB-SG 3.57Å; V585-C589 WeakPolarHBondContact O-CB 3.43Å; V585-C589 PolarHBondContact O-N 3.23Å; V585-C589 VanDerWaalsContact O-N 3.14Å; V585-C589 PolarHBondContact O-SG 3.38Å; T586-C589 WeakPolarHBondContact O-CB 3.3Å; T586-C589 PolarHBondContact O-N 3.01Å; T586-C589 VanDerWaalsContact O-N 3.14Å; D587-C589 VanDerWaalsContact C-N 3.25Å; D587-C589 PolarHBondContact O-N 2.03Å
590	E	77.6	Confident	85.3	Confident	99 Å²	99	44.7 Å²	44.7	46%	0.463	22%	0.222	S	C	.	.	S	Bend	trans	-109.7	8.3	168.6	-58.4	-168.1	-156	0	0	111.8	S414 F415 P592	S414-E590 WeakPolarHBondContact CB-OE2 3.19Å; S414-E590 PolarHBondContact OG-OE2 2.87Å; S414-E590 VanDerWaalsContact OG-OE2 3.07Å; F415-E590 HydrophobicContact CE2-CB 3.43Å; F415-E590 VanDerWaalsContact CE2-CB 3.43Å; F415-E590 VanDerWaalsContact CE2-CD 3.5Å; F415-E590 HydrophobicContact CE2-CG 3.96Å; F415-E590 WeakPolarHBondContact CE2-OE2 3.08Å; F415-E590 HydrophobicContact CZ-CB 3.34Å; F415-E590 HydrophobicContact CZ-CG 3.47Å; F415-E590 VanDerWaalsContact CZ-CG 3.47Å; F415-E590 WeakPolarHBondContact CZ-OE2 3.37Å; E590-P592 WeakPolarHBondContact O-CD 3.32Å
591	C	79.4	Confident	85.3	Confident	10 Å²	10	44.2 Å²	44.2	7%	0.068	22%	0.22	C	C	.	.			trans	-70.8	125.6	-178.5	-167.4	0	0	0	0	112.2	R555 D587 M588 K595 C597	R555-C591 PolarHBondContact NH1-O 3.42Å; D587-C591 WeakPolarHBondContact O-CB 3.32Å; D587-C591 PolarHBondContact O-N 2.74Å; M588-C591 HydrophobicContact CE-CB 4.39Å; M588-C591 WeakPolarHBondContact O-CB 3.15Å; M588-C591 PolarHBondContact O-N 3.13Å; M588-C591 HydrophobicContact SD-CB 4Å; C591-K595 PolarHBondContact SG-O 3.41Å; C591-C597 VanDerWaalsContact CA-SG 3.56Å; C591-C597 HydrophobicContact CB-CB 3.58Å; C591-C597 WeakPolarHBondContact CB-SG 2.93Å; C591-C597 WeakPolarHBondContact SG-CB 3.2Å; C591-C597 PolarHBondContact SG-N 3.4Å; C591-C597 CovalentContact SG-SG 2.04Å; C591-C597 PolarHBondContact SG-SG 3.4Å
592	P	81.5	Confident	85.2	Confident	55 Å²	55	42.6 Å²	42.6	36%	0.357	21%	0.214	S	C	.	.			trans	-54.2	148.6	173.2	-26	34.7	0	0	0	112.6	R555 E590 H594 K595	R555-P592 PolarHBondContact NH1-O 3.08Å; R555-P592 PolarHBondContact NH2-O 3.27Å; E590-P592 WeakPolarHBondContact O-CD 3.32Å; P592-H594 VanDerWaalsContact CB-CE1 3.5Å; P592-H594 WeakPolarHBondContact CB-CE1 3.42Å; P592-H594 PolarHBondContact O-N 3.45Å; P592-H594 VanDerWaalsContact O-N 3.1Å; P592-K595 HydrophobicContact CB-CB 4.43Å; P592-K595 HydrophobicContact CB-CD 4.45Å; P592-K595 HydrophobicContact CB-CG 4.23Å; P592-K595 HydrophobicContact CG-CD 4.1Å; P592-K595 HydrophobicContact CG-CG 4.42Å; P592-K595 PolarHBondContact O-N 3.31Å
593	V	78.3	Confident	85.1	Confident	127 Å²	127	37.5 Å²	37.5	77%	0.77	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.3	-175.4	-177.6	0	0	0	0	113.1	R555	R555-V593 PolarHBondContact NH2-O 3.37Å; R555-V593 VanDerWaalsContact NH2-O 3.07Å
594	H	72.8	Confident	85.1	Confident	158 Å²	158	37.5 Å²	37.5	73%	0.731	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	9.3	-178.5	58.8	-90.4	0	0	0	113.9	P592	P592-H594 VanDerWaalsContact CB-CE1 3.5Å; P592-H594 WeakPolarHBondContact CB-CE1 3.42Å; P592-H594 PolarHBondContact O-N 3.45Å; P592-H594 VanDerWaalsContact O-N 3.1Å
595	K	76	Confident	85.2	Confident	113 Å²	113	37.5 Å²	37.5	49%	0.491	20%	0.197	S	C	.	.			trans	-119.6	153.3	177.9	-67.8	-165.6	179	-172	0	111.2	R555 C591 P592	R555-K595 PolarHBondContact NH2-O 3.25Å; C591-K595 PolarHBondContact SG-O 3.41Å; P592-K595 HydrophobicContact CB-CB 4.43Å; P592-K595 HydrophobicContact CB-CD 4.45Å; P592-K595 HydrophobicContact CB-CG 4.23Å; P592-K595 HydrophobicContact CG-CD 4.1Å; P592-K595 HydrophobicContact CG-CG 4.42Å; P592-K595 PolarHBondContact O-N 3.31Å
596	N	81	Confident	85.1	Confident	77 Å²	77	37.7 Å²	37.7	41%	0.412	20%	0.198	S	C	.	.			trans	-112	70.6	178.3	-68.1	-8.2	0	0	0	109.8	Y598 C599 N623	N596-Y598 HydrophobicContact CB-CD1 4Å; N596-Y598 HydrophobicContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CB-CE1 3.47Å; N596-Y598 PolarHBondContact ND2-OH 3.18Å; N596-Y598 PolarHBondContact O-N 3.27Å; N596-C599 VanDerWaalsContact O-CB 3.27Å; N596-C599 WeakPolarHBondContact O-CB 2.99Å; N596-C599 PolarHBondContact O-N 3.25Å; N596-C599 PolarHBondContact O-SG 3.11Å; N596-N623 PolarHBondContact ND2-O 3.26Å; N596-N623 VanDerWaalsContact ND2-O 3.12Å
597	C	84.6	Confident	85.2	Confident	25 Å²	25	37.5 Å²	37.5	17%	0.169	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.6	-175.6	-49	0	0	0	0	112.9	D587 M588 C591 C599 E600	D587-C597 HydrophobicContact CB-CB 4.2Å; M588-C597 HydrophobicContact SD-CB 4.03Å; C591-C597 VanDerWaalsContact CA-SG 3.56Å; C591-C597 HydrophobicContact CB-CB 3.58Å; C591-C597 WeakPolarHBondContact CB-SG 2.93Å; C591-C597 WeakPolarHBondContact SG-CB 3.2Å; C591-C597 PolarHBondContact SG-N 3.4Å; C591-C597 CovalentContact SG-SG 2.04Å; C591-C597 PolarHBondContact SG-SG 3.4Å; C597-C599 PolarHBondContact O-N 3.48Å; C597-E600 PolarHBondContact O-N 3.21Å
598	Y	89.1	Confident	85.4	Confident	8 Å²	8	37.5 Å²	37.5	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-56.3	-21.4	172.4	66.1	-101.2	0	0	0	113.3	E559 C584 M588 N596 E600 S601 F602 N623	E559-Y598 HydrophobicContact CB-CD1 3.82Å; E559-Y598 HydrophobicContact CB-CE1 4.31Å; E559-Y598 HydrophobicContact CB-CG 4.37Å; E559-Y598 HydrophobicContact CG-CD1 4.24Å; E559-Y598 HydrophobicContact CG-CE1 4.38Å; C584-Y598 WeakPolarHBondContact SG-CB 2.93Å; M588-Y598 HydrophobicContact CE-CD1 4.23Å; M588-Y598 HydrophobicContact SD-CD1 3.75Å; M588-Y598 HydrophobicContact SD-CG 4.26Å; M588-Y598 PolarHBondContact SD-N 3.18Å; N596-Y598 HydrophobicContact CB-CD1 4Å; N596-Y598 HydrophobicContact CB-CE1 3.47Å; N596-Y598 VanDerWaalsContact CB-CE1 3.47Å; N596-Y598 PolarHBondContact ND2-OH 3.18Å; N596-Y598 PolarHBondContact O-N 3.27Å; Y598-E600 VanDerWaalsContact C-N 3.34Å; Y598-E600 PolarHBondContact O-N 3.45Å; Y598-S601 PolarHBondContact O-N 2.86Å; Y598-F602 HydrophobicContact CD2-CD1 4.47Å; Y598-F602 HydrophobicContact CD2-CD2 4.12Å; Y598-F602 HydrophobicContact CD2-CE2 4.24Å; Y598-F602 HydrophobicContact CD2-CG 4.24Å; Y598-F602 HydrophobicContact CD2-CZ 4.45Å; Y598-F602 WeakPolarHBondContact O-CD2 3.34Å; Y598-F602 PolarHBondContact O-N 3.37Å; Y598-N623 PolarHBondContact OH-O 3.19Å
599	C	87.3	Confident	85.6	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-38.9	-175.4	-74.9	0	0	0	0	114	N596 C597 S601 F602 L603 C624	N596-C599 VanDerWaalsContact O-CB 3.27Å; N596-C599 WeakPolarHBondContact O-CB 2.99Å; N596-C599 PolarHBondContact O-N 3.25Å; N596-C599 PolarHBondContact O-SG 3.11Å; C597-C599 PolarHBondContact O-N 3.48Å; C599-S601 VanDerWaalsContact C-N 3.33Å; C599-S601 PolarHBondContact O-N 2.88Å; C599-F602 PolarHBondContact O-N 3.39Å; C599-L603 WeakPolarHBondContact O-CB 2.96Å; C599-L603 VanDerWaalsContact O-CG 3.26Å; C599-L603 WeakPolarHBondContact O-CG 3.01Å; C599-L603 PolarHBondContact O-N 3.44Å; C599-C624 WeakPolarHBondContact CA-SG 2.88Å; C599-C624 HydrophobicContact CB-CB 3.61Å; C599-C624 WeakPolarHBondContact CB-SG 3.48Å; C599-C624 WeakPolarHBondContact SG-CA 3.42Å; C599-C624 WeakPolarHBondContact SG-CB 3.29Å; C599-C624 CovalentContact SG-SG 2.03Å; C599-C624 PolarHBondContact SG-SG 3.34Å
600	E	86.3	Confident	85.7	Confident	30 Å²	30	42.2 Å²	42.2	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-46	179.4	-59.9	-52.4	133	0	0	110.8	W417 S479 C597 Y598 F602 A604	W417-E600 HydrophobicContact CH2-CG 4.25Å; W417-E600 HydrophobicContact CZ3-CG 4.12Å; S479-E600 PolarHBondContact OG-OE2 2.89Å; C597-E600 PolarHBondContact O-N 3.21Å; Y598-E600 VanDerWaalsContact C-N 3.34Å; Y598-E600 PolarHBondContact O-N 3.45Å; E600-F602 PolarHBondContact O-N 3.36Å; E600-A604 VanDerWaalsContact O-CB 3.32Å; E600-A604 WeakPolarHBondContact O-CB 3.42Å; E600-A604 PolarHBondContact O-N 3.12Å
601	S	92.1	Very high	86.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-38	176.4	-74.9	0	0	0	0	113	C584 D587 Y598 C599 Y605	C584-S601 VanDerWaalsContact CA-OG 3.29Å; C584-S601 WeakPolarHBondContact CA-OG 3.26Å; C584-S601 PolarHBondContact N-OG 2.86Å; D587-S601 PolarHBondContact OD2-OG 2.92Å; Y598-S601 PolarHBondContact O-N 2.86Å; C599-S601 VanDerWaalsContact C-N 3.33Å; C599-S601 PolarHBondContact O-N 2.88Å; S601-Y605 PolarHBondContact O-N 2.04Å
602	F	92.3	Very high	86.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.1	-40.1	179	-83.3	-131.8	0	0	0	112.1	K562 L563 F568 Y598 C599 E600 Y605 T606 W618	K562-F602 HydrophobicContact CB-CE1 3.74Å; K562-F602 HydrophobicContact CB-CZ 3.73Å; L563-F602 HydrophobicContact CB-CE1 4.44Å; L563-F602 HydrophobicContact CB-CE2 3.92Å; L563-F602 HydrophobicContact CB-CZ 3.81Å; L563-F602 HydrophobicContact CD1-CD1 4.28Å; L563-F602 HydrophobicContact CD1-CD2 3.96Å; L563-F602 HydrophobicContact CD1-CE1 4.38Å; L563-F602 HydrophobicContact CD1-CE2 4.06Å; L563-F602 HydrophobicContact CD1-CG 4.08Å; L563-F602 HydrophobicContact CD1-CZ 4.28Å; F568-F602 AromaticContact CE2-CD1 3.78Å; F568-F602 HydrophobicContact CE2-CD1 3.78Å; F568-F602 AromaticContact CE2-CE1 3.85Å; F568-F602 HydrophobicContact CE2-CE1 3.85Å; F568-F602 AromaticContact CZ-CD1 3.75Å; F568-F602 HydrophobicContact CZ-CD1 3.75Å; F568-F602 HydrophobicContact CZ-CE1 4.3Å; F568-F602 HydrophobicContact CZ-CG 4.48Å; Y598-F602 HydrophobicContact CD2-CD1 4.47Å; Y598-F602 HydrophobicContact CD2-CD2 4.12Å; Y598-F602 HydrophobicContact CD2-CE2 4.24Å; Y598-F602 HydrophobicContact CD2-CG 4.24Å; Y598-F602 HydrophobicContact CD2-CZ 4.45Å; Y598-F602 WeakPolarHBondContact O-CD2 3.34Å; Y598-F602 PolarHBondContact O-N 3.37Å; C599-F602 PolarHBondContact O-N 3.39Å; E600-F602 PolarHBondContact O-N 3.36Å; F602-Y605 PolarHBondContact O-N 2.87Å; F602-T606 VanDerWaalsContact O-CB 3.29Å; F602-T606 WeakPolarHBondContact O-CB 3.41Å; F602-T606 PolarHBondContact O-N 3.37Å; F602-T606 PolarHBondContact O-OG1 3.2Å; F602-W618 HydrophobicContact CB-CH2 3.72Å; F602-W618 HydrophobicContact CB-CZ2 3.84Å; F602-W618 HydrophobicContact CB-CZ3 4.2Å; F602-W618 HydrophobicContact CD1-CD2 4.37Å; F602-W618 AromaticContact CD1-CE2 3.74Å; F602-W618 AromaticContact CD1-CZ2 3.84Å; F602-W618 HydrophobicContact CD1-CZ2 3.84Å; F602-W618 AromaticContact CD1-NE1 3.82Å; F602-W618 HydrophobicContact CG-CZ2 4.27Å
603	L	88.1	Confident	86.5	Confident	31 Å²	31	44.8 Å²	44.8	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-44.5	173.4	-74.3	168.2	0	0	0	110.9	C599 Y605 T606 R607 W618 P620	C599-L603 WeakPolarHBondContact O-CB 2.96Å; C599-L603 VanDerWaalsContact O-CG 3.26Å; C599-L603 WeakPolarHBondContact O-CG 3.01Å; C599-L603 PolarHBondContact O-N 3.44Å; L603-Y605 PolarHBondContact O-N 3.44Å; L603-T606 PolarHBondContact O-N 3.1Å; L603-R607 WeakPolarHBondContact O-CG 3.36Å; L603-R607 PolarHBondContact O-N 2.99Å; L603-W618 HydrophobicContact CD2-CH2 4.42Å; L603-W618 HydrophobicContact CD2-CZ3 4.17Å; L603-W618 HydrophobicContact CG-CH2 4.44Å; L603-P620 HydrophobicContact CD2-CB 3.77Å; L603-P620 HydrophobicContact CD2-CG 4.26Å
604	A	90.7	Very high	86.9	Confident	3 Å²	3	40.3 Å²	40.3	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-43.9	176.4	0	0	0	0	0	112	F367 F480 F580 E600 R607 A608	F367-A604 HydrophobicContact CB-CB 3.97Å; F367-A604 HydrophobicContact CD1-CB 4.03Å; F367-A604 HydrophobicContact CD2-CB 3.69Å; F367-A604 HydrophobicContact CE1-CB 4.49Å; F367-A604 HydrophobicContact CE2-CB 4.17Å; F367-A604 HydrophobicContact CG-CB 3.61Å; F480-A604 HydrophobicContact CD2-CB 4.21Å; F480-A604 HydrophobicContact CE2-CB 3.93Å; F580-A604 HydrophobicContact CD1-CB 4Å; F580-A604 HydrophobicContact CE1-CB 3.77Å; E600-A604 VanDerWaalsContact O-CB 3.32Å; E600-A604 WeakPolarHBondContact O-CB 3.42Å; E600-A604 PolarHBondContact O-N 3.12Å; A604-R607 PolarHBondContact O-N 2.84Å; A604-A608 PolarHBondContact O-N 2.96Å
605	Y	93.9	Very high	87.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-43.9	175.6	-172.4	-114.5	0	0	0	112.2	L563 F568 C571 H572 V575 F580 S601 F602 L603 R607 A608 C609	L563-Y605 HydrophobicContact CD1-CD1 3.52Å; L563-Y605 HydrophobicContact CD1-CE1 4.34Å; L563-Y605 HydrophobicContact CD1-CG 3.87Å; L563-Y605 HydrophobicContact CG-CD1 4.15Å; L563-Y605 HydrophobicContact CG-CG 4.48Å; F568-Y605 HydrophobicContact CB-CE1 4.09Å; F568-Y605 AromaticContact CD1-CD1 3.64Å; F568-Y605 HydrophobicContact CD1-CD1 3.64Å; F568-Y605 AromaticContact CD1-CE1 3.8Å; F568-Y605 HydrophobicContact CD1-CE1 3.8Å; F568-Y605 HydrophobicContact CE1-CD1 4.01Å; F568-Y605 HydrophobicContact CG-CD1 4.28Å; F568-Y605 HydrophobicContact CG-CE1 4.19Å; C571-Y605 HydrophobicContact CB-CE1 4.37Å; H572-Y605 PolarHBondContact CD2-OH 2.85Å; V575-Y605 HydrophobicContact CB-CE2 3.86Å; V575-Y605 HydrophobicContact CG1-CD2 4.07Å; V575-Y605 HydrophobicContact CG1-CE2 3.6Å; V575-Y605 PolarHBondContact O-OH 2.8Å; F580-Y605 HydrophobicContact CB-CD2 4.31Å; F580-Y605 HydrophobicContact CD1-CD2 4.48Å; F580-Y605 AromaticContact CD2-CD2 3.45Å; F580-Y605 HydrophobicContact CD2-CD2 3.45Å; F580-Y605 VanDerWaalsContact CD2-CD2 3.45Å; F580-Y605 HydrophobicContact CD2-CE2 4.18Å; F580-Y605 HydrophobicContact CD2-CG 4.35Å; F580-Y605 AromaticContact CE2-CD2 3.77Å; F580-Y605 HydrophobicContact CE2-CD2 3.77Å; F580-Y605 HydrophobicContact CE2-CE2 4.44Å; F580-Y605 AromaticContact CG-CD2 3.83Å; F580-Y605 HydrophobicContact CG-CD2 3.83Å; F580-Y605 HydrophobicContact CG-CG 4.31Å; F580-Y605 HydrophobicContact CZ-CD2 4.41Å; S601-Y605 PolarHBondContact O-N 2.04Å; F602-Y605 PolarHBondContact O-N 2.87Å; L603-Y605 PolarHBondContact O-N 3.44Å; Y605-R607 VanDerWaalsContact C-N 3.3Å; Y605-R607 PolarHBondContact O-N 3.42Å; Y605-A608 WeakPolarHBondContact O-CB 3.3Å; Y605-A608 PolarHBondContact O-N 2.89Å; Y605-A608 VanDerWaalsContact O-N 3.15Å; Y605-C609 PolarHBondContact O-N 3.44Å; Y605-C609 PolarHBondContact O-SG 3.47Å
606	T	90.8	Very high	88	Confident	10 Å²	10	36.5 Å²	36.5	6%	0.061	19%	0.192	C	C	.	.	H	α-helix	trans	-57.2	-43.6	176.3	-64	0	0	0	0	111.6	F602 L603 C609 Q610 V616	F602-T606 VanDerWaalsContact O-CB 3.29Å; F602-T606 WeakPolarHBondContact O-CB 3.41Å; F602-T606 PolarHBondContact O-N 3.37Å; F602-T606 PolarHBondContact O-OG1 3.2Å; L603-T606 PolarHBondContact O-N 3.1Å; T606-C609 WeakPolarHBondContact O-CB 3.41Å; T606-C609 PolarHBondContact O-N 2.95Å; T606-Q610 HydrophobicContact CG2-CG 4.46Å; T606-Q610 VanDerWaalsContact O-CG 3.31Å; T606-Q610 WeakPolarHBondContact O-CG 3.42Å; T606-Q610 PolarHBondContact O-N 3.07Å; T606-V616 HydrophobicContact CG2-CG2 3.52Å
607	R	88	Confident	88.4	Confident	16 Å²	16	38 Å²	38	6%	0.06	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-42	176.2	-72.7	176.5	-171.6	127.3	6.2	112	Y461 F480 L603 A604 Y605 C609 Q610 R611	Y461-R607 VanDerWaalsContact OH-CZ 3.26Å; Y461-R607 PolarHBondContact OH-NE 3.07Å; Y461-R607 PolarHBondContact OH-NH2 3.44Å; F480-R607 VanDerWaalsContact CE1-CD 3.46Å; F480-R607 HydrophobicContact CZ-CB 4.36Å; F480-R607 VanDerWaalsContact CZ-CD 3.46Å; L603-R607 WeakPolarHBondContact O-CG 3.36Å; L603-R607 PolarHBondContact O-N 2.99Å; A604-R607 PolarHBondContact O-N 2.84Å; Y605-R607 VanDerWaalsContact C-N 3.3Å; Y605-R607 PolarHBondContact O-N 3.42Å; R607-C609 VanDerWaalsContact C-N 3.29Å; R607-C609 PolarHBondContact O-N 3.21Å; R607-Q610 PolarHBondContact O-N 2.87Å; R607-R611 WeakPolarHBondContact O-CB 3.01Å; R607-R611 PolarHBondContact O-N 3.02Å
608	A	91.5	Very high	88.5	Confident	7 Å²	7	37.3 Å²	37.3	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-40.5	174.7	0	0	0	0	0	111.9	V575 F580 A604 Y605 R611 E612	V575-A608 HydrophobicContact CG1-CB 3.79Å; V575-A608 HydrophobicContact CG2-CB 4.43Å; F580-A608 HydrophobicContact CZ-CB 4.06Å; A604-A608 PolarHBondContact O-N 2.96Å; Y605-A608 WeakPolarHBondContact O-CB 3.3Å; Y605-A608 PolarHBondContact O-N 2.89Å; Y605-A608 VanDerWaalsContact O-N 3.15Å; A608-R611 PolarHBondContact O-N 3.32Å; A608-E612 PolarHBondContact O-N 3.14Å
609	C	91.7	Very high	88	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-47.2	174.3	-59.7	0	0	0	0	112.8	C571 Y605 T606 R607 R611 E612 G613 I614 V616	C571-C609 HydrophobicContact CB-CB 3.78Å; C571-C609 WeakPolarHBondContact CB-SG 3.35Å; C571-C609 WeakPolarHBondContact SG-CA 3.07Å; C571-C609 WeakPolarHBondContact SG-CB 3.49Å; C571-C609 CovalentContact SG-SG 2.01Å; C571-C609 PolarHBondContact SG-SG 3.14Å; Y605-C609 PolarHBondContact O-N 3.44Å; Y605-C609 PolarHBondContact O-SG 3.47Å; T606-C609 WeakPolarHBondContact O-CB 3.41Å; T606-C609 PolarHBondContact O-N 2.95Å; R607-C609 VanDerWaalsContact C-N 3.29Å; R607-C609 PolarHBondContact O-N 3.21Å; C609-R611 VanDerWaalsContact C-N 3.26Å; C609-R611 PolarHBondContact O-N 2.04Å; C609-E612 CarbonylContact O-C 3.59Å; C609-E612 PolarHBondContact O-N 3.2Å; C609-E612 VanDerWaalsContact O-N 3.08Å; C609-G613 PolarHBondContact O-N 3.32Å; C609-I614 CarbonylContact C-O 3.41Å; C609-I614 HydrophobicContact CB-CB 4.5Å; C609-I614 PolarHBondContact O-N 3.21Å; C609-V616 HydrophobicContact CB-CG1 3.68Å
610	Q	87.7	Confident	87.3	Confident	112 Å²	112	43.3 Å²	43.3	52%	0.523	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-36.8	178.8	-73.6	172.7	-19.6	0	0	111.9	T606 R607 E612 G613	T606-Q610 HydrophobicContact CG2-CG 4.46Å; T606-Q610 VanDerWaalsContact O-CG 3.31Å; T606-Q610 WeakPolarHBondContact O-CG 3.42Å; T606-Q610 PolarHBondContact O-N 3.07Å; R607-Q610 PolarHBondContact O-N 2.87Å; Q610-E612 VanDerWaalsContact C-N 3.26Å; Q610-E612 PolarHBondContact O-N 3.37Å; Q610-G613 WeakPolarHBondContact O-CA 3.46Å; Q610-G613 PolarHBondContact O-N 3.32Å
611	R	86	Confident	86.4	Confident	91 Å²	91	48.6 Å²	48.6	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-30	175.5	-174.8	168	57.1	66.7	-2	113.1	E482 R607 A608 C609 G613	E482-R611 IonicContact OE2-NE 3.94Å; R607-R611 WeakPolarHBondContact O-CB 3.01Å; R607-R611 PolarHBondContact O-N 3.02Å; A608-R611 PolarHBondContact O-N 3.32Å; C609-R611 VanDerWaalsContact C-N 3.26Å; C609-R611 PolarHBondContact O-N 2.04Å; R611-G613 PolarHBondContact O-N 2.9Å
612	E	85.7	Confident	85.2	Confident	56 Å²	56	55.5 Å²	55.5	26%	0.262	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	5.8	172.2	-59.9	-60.5	141.9	0	0	112.6	K360 T574 V575 A608 C609 Q610 I614	K360-E612 IonicContact NZ-OE2 3.01Å; K360-E612 PolarHBondContact NZ-OE2 3.32Å; T574-E612 HydrophobicContact CG2-CB 3.86Å; T574-E612 HydrophobicContact CG2-CG 3.88Å; V575-E612 HydrophobicContact CG2-CG 3.96Å; A608-E612 PolarHBondContact O-N 3.14Å; C609-E612 CarbonylContact O-C 3.59Å; C609-E612 PolarHBondContact O-N 3.2Å; C609-E612 VanDerWaalsContact O-N 3.08Å; Q610-E612 VanDerWaalsContact C-N 3.26Å; Q610-E612 PolarHBondContact O-N 3.37Å; E612-I614 VanDerWaalsContact C-N 3.32Å; E612-I614 HydrophobicContact CB-CD1 4.36Å; E612-I614 HydrophobicContact CB-CG1 4.42Å
613	G	83.6	Confident	84.1	Confident	71 Å²	71	57.6 Å²	57.6	73%	0.732	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	12.7	-179.9	0	0	0	0	0	114.1	C609 Q610 R611	C609-G613 PolarHBondContact O-N 3.32Å; Q610-G613 WeakPolarHBondContact O-CA 3.46Å; Q610-G613 PolarHBondContact O-N 3.32Å; R611-G613 PolarHBondContact O-N 2.9Å
614	I	87	Confident	83.3	Confident	33 Å²	33	56.9 Å²	56.9	17%	0.169	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-96.6	120.2	-176.5	-56.6	174.6	0	0	0	109.3	C571 T574 C609 E612	C571-I614 HydrophobicContact CB-CG2 4.18Å; T574-I614 VanDerWaalsContact CB-CD1 3.5Å; T574-I614 HydrophobicContact CG2-CD1 3.86Å; T574-I614 VanDerWaalsContact OG1-CD1 3.31Å; T574-I614 WeakPolarHBondContact OG1-CD1 3.42Å; C609-I614 CarbonylContact C-O 3.41Å; C609-I614 HydrophobicContact CB-CB 4.5Å; C609-I614 PolarHBondContact O-N 3.21Å; E612-I614 VanDerWaalsContact C-N 3.32Å; E612-I614 HydrophobicContact CB-CD1 4.36Å; E612-I614 HydrophobicContact CB-CG1 4.42Å
615	K	84.2	Confident	81.6	Confident	177 Å²	177	60.1 Å²	60.1	77%	0.77	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-78.6	126.3	171.9	-170.5	176.4	179.9	-178.5	0	109.6	T570	T570-K615 PolarHBondContact OG1-O 3.22Å
616	V	87.4	Confident	79.3	Confident	13 Å²	13	64 Å²	64	8%	0.079	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-95	151.6	171.4	-61.9	0	0	0	0	110.1	F568 C571 T606 C609	F568-V616 HydrophobicContact CD1-CB 4.32Å; F568-V616 HydrophobicContact CD1-CG1 4.07Å; C571-V616 HydrophobicContact CB-CG1 4.35Å; T606-V616 HydrophobicContact CG2-CG2 3.52Å; C609-V616 HydrophobicContact CB-CG1 3.68Å
617	H	88.2	Confident	77.1	Confident	109 Å²	109	68.6 Å²	68.6	51%	0.505	38%	0.375	S	S	.	.			trans	-86.6	-14.4	179.2	-66.7	-69.7	0	0	0	113.2	W566 E567 E619	W566-H617 HydrophobicContact CH2-CB 4.22Å; W566-H617 HydrophobicContact CZ3-CB 3.99Å; W566-H617 AromaticContact CZ3-CD2 3.81Å; W566-H617 AromaticContact CZ3-CG 3.88Å; E567-H617 HydrophobicContact CB-CB 4.37Å; E567-H617 PolarHBondContact O-N 3.18Å; H617-E619 PolarHBondContact O-N 3.37Å
618	W	86.9	Confident	75.3	Confident	10 Å²	10	76.1 Å²	76.1	4%	0.038	41%	0.41	C	S	.	.			trans	-70.7	126.3	-179.2	-178	83.8	0	0	0	111.8	E567 F568 F602 L603 P620 N623 C624	E567-W618 HydrophobicContact CB-CB 4.03Å; F568-W618 HydrophobicContact CD2-CB 4.49Å; F568-W618 HydrophobicContact CE1-CB 3.84Å; F568-W618 HydrophobicContact CE1-CD2 4.41Å; F568-W618 HydrophobicContact CE1-CE3 4.46Å; F568-W618 HydrophobicContact CE1-CG 4.17Å; F568-W618 HydrophobicContact CE2-CB 3.74Å; F568-W618 AromaticContact CE2-CD1 3.77Å; F568-W618 HydrophobicContact CE2-CD2 4.28Å; F568-W618 AromaticContact CE2-CG 3.65Å; F568-W618 HydrophobicContact CE2-CG 3.65Å; F568-W618 HydrophobicContact CZ-CB 3.38Å; F568-W618 AromaticContact CZ-CD1 3.85Å; F568-W618 AromaticContact CZ-CD2 3.57Å; F568-W618 HydrophobicContact CZ-CD2 3.57Å; F568-W618 AromaticContact CZ-CE3 3.98Å; F568-W618 HydrophobicContact CZ-CE3 3.98Å; F568-W618 AromaticContact CZ-CG 3.29Å; F568-W618 HydrophobicContact CZ-CG 3.29Å; F602-W618 HydrophobicContact CB-CH2 3.72Å; F602-W618 HydrophobicContact CB-CZ2 3.84Å; F602-W618 HydrophobicContact CB-CZ3 4.2Å; F602-W618 HydrophobicContact CD1-CD2 4.37Å; F602-W618 AromaticContact CD1-CE2 3.74Å; F602-W618 AromaticContact CD1-CZ2 3.84Å; F602-W618 HydrophobicContact CD1-CZ2 3.84Å; F602-W618 AromaticContact CD1-NE1 3.82Å; F602-W618 HydrophobicContact CG-CZ2 4.27Å; L603-W618 HydrophobicContact CD2-CH2 4.42Å; L603-W618 HydrophobicContact CD2-CZ3 4.17Å; L603-W618 HydrophobicContact CG-CH2 4.44Å; W618-P620 HydrophobicContact CH2-CB 3.83Å; W618-P620 HydrophobicContact CZ3-CB 3.75Å; W618-P620 HydrophobicContact CZ3-CG 4.39Å; W618-N623 HydrophobicContact CZ2-CB 3.82Å; W618-N623 PolarHBondContact NE1-ND2 2.04Å; W618-N623 VanDerWaalsContact NE1-ND2 3.14Å; W618-C624 HydrophobicContact CH2-CB 4.27Å; W618-C624 VanDerWaalsContact CH2-SG 3.51Å; W618-C624 HydrophobicContact CZ2-CB 4.49Å; W618-C624 WeakPolarHBondContact CZ2-SG 3.17Å
619	E	78.3	Confident	73.6	Confident	99 Å²	99	76.9 Å²	76.9	46%	0.463	42%	0.415	S	S	.	.			trans	-104.4	125.5	178	-69.6	-174.8	174.1	0	0	111.7	H617 Q621 Q622 N623	H617-E619 PolarHBondContact O-N 3.37Å; E619-Q621 PolarHBondContact O-N 3.42Å; E619-Q622 HydrophobicContact CB-CG 4.38Å; E619-Q622 PolarHBondContact OE2-NE2 3.02Å; E619-N623 PolarHBondContact O-ND2 3.25Å; E619-N623 VanDerWaalsContact O-ND2 3.11Å
620	P	74	Confident	72	Confident	42 Å²	42	84.3 Å²	84.3	27%	0.273	45%	0.447	S	S	.	.	H	α-helix	trans	-70.3	-29.2	-179.9	25.8	-32.1	0	0	0	112.9	L603 W618 Q622 N623 C624	L603-P620 HydrophobicContact CD2-CB 3.77Å; L603-P620 HydrophobicContact CD2-CG 4.26Å; W618-P620 HydrophobicContact CH2-CB 3.83Å; W618-P620 HydrophobicContact CZ3-CB 3.75Å; W618-P620 HydrophobicContact CZ3-CG 4.39Å; P620-Q622 PolarHBondContact O-N 2.91Å; P620-N623 PolarHBondContact O-N 2.99Å; P620-C624 HydrophobicContact CB-CB 4.33Å; P620-C624 CarbonylContact O-C 3.59Å; P620-C624 VanDerWaalsContact O-CA 3.25Å; P620-C624 WeakPolarHBondContact O-CA 3.4Å; P620-C624 WeakPolarHBondContact O-CB 3.28Å; P620-C624 PolarHBondContact O-N 3.45Å
621	Q	66.5	Low	71.3	Confident	140 Å²	140	83.9 Å²	83.9	65%	0.654	45%	0.445	S	S	*	.	H	α-helix	trans	-61.7	-33.4	-178.2	-65	88.5	-9.4	0	0	112.4	E619	E619-Q621 PolarHBondContact O-N 3.42Å
622	Q	66.4	Low	70.3	Confident	146 Å²	146	81.9 Å²	81.9	68%	0.682	45%	0.453	S	S	*	.	H	α-helix	trans	-81.7	-32.7	-177.4	-55.9	-172.3	15.5	0	0	112.1	E619 P620	E619-Q622 HydrophobicContact CB-CG 4.38Å; E619-Q622 PolarHBondContact OE2-NE2 3.02Å; P620-Q622 PolarHBondContact O-N 2.91Å
623	N	69	Low	69.8	Low	43 Å²	43	80.1 Å²	80.1	23%	0.23	45%	0.448	C	S	.	.	H	α-helix	trans	-107.6	-29.7	-168.7	-65.3	-58	0	0	0	113.4	N596 Y598 W618 E619 P620	N596-N623 PolarHBondContact ND2-O 3.26Å; N596-N623 VanDerWaalsContact ND2-O 3.12Å; Y598-N623 PolarHBondContact OH-O 3.19Å; W618-N623 HydrophobicContact CZ2-CB 3.82Å; W618-N623 PolarHBondContact NE1-ND2 2.04Å; W618-N623 VanDerWaalsContact NE1-ND2 3.14Å; E619-N623 PolarHBondContact O-ND2 3.25Å; E619-N623 VanDerWaalsContact O-ND2 3.11Å; P620-N623 PolarHBondContact O-N 2.99Å
624	C	72.4	Confident	69.2	Low	17 Å²	17	81 Å²	81	12%	0.115	44%	0.438	C	S	.	.			trans	-124	26.4	-168.8	-70.8	0	0	0	0	113.5	C599 W618 P620 A626	C599-C624 WeakPolarHBondContact CA-SG 2.88Å; C599-C624 HydrophobicContact CB-CB 3.61Å; C599-C624 WeakPolarHBondContact CB-SG 3.48Å; C599-C624 WeakPolarHBondContact SG-CA 3.42Å; C599-C624 WeakPolarHBondContact SG-CB 3.29Å; C599-C624 CovalentContact SG-SG 2.03Å; C599-C624 PolarHBondContact SG-SG 3.34Å; W618-C624 HydrophobicContact CH2-CB 4.27Å; W618-C624 VanDerWaalsContact CH2-SG 3.51Å; W618-C624 HydrophobicContact CZ2-CB 4.49Å; W618-C624 WeakPolarHBondContact CZ2-SG 3.17Å; P620-C624 HydrophobicContact CB-CB 4.33Å; P620-C624 CarbonylContact O-C 3.59Å; P620-C624 VanDerWaalsContact O-CA 3.25Å; P620-C624 WeakPolarHBondContact O-CA 3.4Å; P620-C624 WeakPolarHBondContact O-CB 3.28Å; P620-C624 PolarHBondContact O-N 3.45Å; C624-A626 PolarHBondContact O-N 3.08Å
625	A	54.4	Low	68	Low	70 Å²	70	85.4 Å²	85.4	58%	0.579	45%	0.454	S	S	*	.			trans	-61.3	72.6	167.3	0	0	0	0	0	111	T627	A625-T627 PolarHBondContact O-N 3.21Å
626	A	44.8	Very low	66.9	Low	81 Å²	81	80.1 Å²	80.1	67%	0.669	43%	0.434	S	S	*	.			trans	-68.9	116.1	164.4	0	0	0	0	0	106.3	C624	C624-A626 PolarHBondContact O-N 3.08Å
627	T	45.8	Very low	65	Low	108 Å²	108	83 Å²	83	66%	0.663	45%	0.452	S	S	*	.	S	Bend	trans	76.5	92	-173.1	67.2	0	0	0	0	114.7	A625 C629	A625-T627 PolarHBondContact O-N 3.21Å; T627-C629 VanDerWaalsContact C-N 3.34Å; T627-C629 PolarHBondContact O-N 2.95Å
628	Q	49.6	Very low	63.6	Low	174 Å²	174	81.2 Å²	81.2	81%	0.813	45%	0.451	S	S	*	.			trans	-47.2	100.6	156.1	-74.3	172.9	-16.9	0	0	108.6	K630	Q628-K630 PolarHBondContact O-N 3.12Å
629	C	57.3	Low	62.7	Low	22 Å²	22	80.8 Å²	80.8	15%	0.149	45%	0.45	C	S	.	.			trans	-53.3	115.7	161.5	-68.4	0	0	0	0	106.8	T627 A633 Y635 C663	T627-C629 VanDerWaalsContact C-N 3.34Å; T627-C629 PolarHBondContact O-N 2.95Å; C629-A633 VanDerWaalsContact CB-C 3.49Å; C629-A633 HydrophobicContact CB-CB 3.85Å; C629-A633 WeakPolarHBondContact CB-O 3.35Å; C629-Y635 PolarHBondContact SG-N 2.95Å; C629-C663 WeakPolarHBondContact CA-SG 3.45Å; C629-C663 HydrophobicContact CB-CB 3.66Å; C629-C663 WeakPolarHBondContact CB-SG 3.5Å; C629-C663 VanDerWaalsContact SG-CA 3.54Å; C629-C663 WeakPolarHBondContact SG-CB 2.93Å; C629-C663 CovalentContact SG-SG 2.03Å; C629-C663 PolarHBondContact SG-SG 2.91Å
630	K	57.4	Low	62.4	Low	157 Å²	157	79.6 Å²	79.6	68%	0.683	45%	0.45	S	S	*	.	S	Bend	trans	-73.5	152.7	-172.4	-64.7	-175.4	179.2	-179.7	0	109.7	Q628 G632 A633	Q628-K630 PolarHBondContact O-N 3.12Å; K630-G632 PolarHBondContact O-N 3.46Å; K630-A633 PolarHBondContact O-N 3.14Å
631	H	72.8	Confident	62.6	Low	102 Å²	102	78.3 Å²	78.3	47%	0.472	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	43	165.7	-50.7	-59.9	0	0	0	115.9	A633 G674 R675 C676	H631-A633 VanDerWaalsContact C-N 3.35Å; H631-G674 VanDerWaalsContact CB-O 3.3Å; H631-G674 WeakPolarHBondContact CB-O 2.8Å; H631-G674 PolarHBondContact CD2-O 2.74Å; H631-G674 VanDerWaalsContact CD2-O 3.27Å; H631-R675 HydrophobicContact CB-CB 3.84Å; H631-R675 HydrophobicContact CB-CG 3.64Å; H631-C676 PolarHBondContact O-N 3.45Å
632	G	65.7	Low	63.4	Low	49 Å²	49	73.7 Å²	73.7	51%	0.505	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	5.5	171.7	0	0	0	0	0	115	K630 P666	K630-G632 PolarHBondContact O-N 3.46Å; G632-P666 VanDerWaalsContact O-CD 3.22Å; G632-P666 WeakPolarHBondContact O-CD 2.98Å
633	A	75.1	Confident	64.2	Low	19 Å²	19	71 Å²	71	16%	0.157	42%	0.417	C	S	.	.			trans	-74.5	153.6	168.1	0	0	0	0	0	110.9	C629 K630 H631 C663 H664	C629-A633 VanDerWaalsContact CB-C 3.49Å; C629-A633 HydrophobicContact CB-CB 3.85Å; C629-A633 WeakPolarHBondContact CB-O 3.35Å; K630-A633 PolarHBondContact O-N 3.14Å; H631-A633 VanDerWaalsContact C-N 3.35Å; A633-C663 HydrophobicContact CB-CB 4.08Å; A633-H664 CarbonylContact C-O 3.57Å; A633-H664 WeakPolarHBondContact CA-O 3.42Å
634	V	70.3	Confident	65	Low	89 Å²	89	75.1 Å²	75.1	54%	0.539	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.7	178.2	178	0	0	0	0	107.7	D636 H664 P666	V634-D636 PolarHBondContact O-N 3.01Å; V634-H664 PolarHBondContact N-O 3.07Å; V634-H664 PolarHBondContact O-N 3.1Å; V634-P666 HydrophobicContact CG2-CG 3.86Å
635	Y	61.4	Low	65.8	Low	127 Å²	127	76 Å²	76	50%	0.498	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	119.2	176.3	-170	-92.6	0	0	0	109	C629 T637 G662	C629-Y635 PolarHBondContact SG-N 2.95Å; Y635-T637 HydrophobicContact CD1-CG2 4.33Å; Y635-T637 HydrophobicContact CE1-CG2 3.82Å; Y635-G662 CarbonylContact C-O 3.53Å; Y635-G662 WeakPolarHBondContact CA-O 3.34Å
636	D	62.2	Low	67.5	Low	65 Å²	65	73.6 Å²	73.6	35%	0.348	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.8	174.8	-167.8	-19.3	0	0	0	108.2	V634 C638 G639 A661 G662 H664	V634-D636 PolarHBondContact O-N 3.01Å; D636-C638 PolarHBondContact O-N 3.18Å; D636-C638 VanDerWaalsContact OD1-C 3.28Å; D636-C638 PolarHBondContact OD1-N 2.94Å; D636-G639 VanDerWaalsContact CG-CA 3.49Å; D636-G639 PolarHBondContact OD1-N 2.55Å; D636-G639 WeakPolarHBondContact OD2-CA 3.28Å; D636-A661 WeakPolarHBondContact O-CA 3.44Å; D636-G662 PolarHBondContact N-O 2.84Å; D636-G662 PolarHBondContact O-N 3.37Å; D636-H664 HydrophobicContact CB-CB 4.44Å
637	T	46.3	Very low	69.5	Low	74 Å²	74	74.8 Å²	74.8	45%	0.454	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-19.4	177.9	47.3	0	0	0	0	112.2	Y635 A661	Y635-T637 HydrophobicContact CD1-CG2 4.33Å; Y635-T637 HydrophobicContact CE1-CG2 3.82Å; T637-A661 WeakPolarHBondContact O-CA 3.04Å; T637-A661 WeakPolarHBondContact O-CB 2.84Å
638	C	59.2	Low	71.4	Confident	72 Å²	72	72 Å²	72	49%	0.486	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	58.8	176	-179.6	0	0	0	0	109.3	D636 C659	D636-C638 PolarHBondContact O-N 3.18Å; D636-C638 VanDerWaalsContact OD1-C 3.28Å; D636-C638 PolarHBondContact OD1-N 2.94Å; C638-C659 VanDerWaalsContact CA-SG 3.56Å; C638-C659 HydrophobicContact CB-CB 3.97Å; C638-C659 WeakPolarHBondContact CB-SG 3.43Å; C638-C659 WeakPolarHBondContact SG-CB 3.24Å; C638-C659 CovalentContact SG-SG 2.04Å; C638-C659 PolarHBondContact SG-SG 2.81Å
639	G	68.5	Low	72.9	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	166.2	177.2	0	0	0	0	0	113.1	D636 G641 C659 V660	D636-G639 VanDerWaalsContact CG-CA 3.49Å; D636-G639 PolarHBondContact OD1-N 2.55Å; D636-G639 WeakPolarHBondContact OD2-CA 3.28Å; G639-G641 PolarHBondContact O-N 3.37Å; G639-C659 CarbonylContact O-C 3.59Å; G639-C659 WeakPolarHBondContact O-CA 3.05Å; G639-C659 WeakPolarHBondContact O-CB 3.33Å; G639-V660 PolarHBondContact N-O 3.3Å; G639-V660 VanDerWaalsContact N-O 3.15Å; G639-V660 PolarHBondContact O-N 3.33Å
640	P	72.4	Confident	73.8	Confident	73 Å²	73	72.3 Å²	72.3	47%	0.474	39%	0.391	S	S	.	.			trans	-57.5	128.6	-174.3	21.6	-31.6	0	0	0	111.9	C642	P640-C642 PolarHBondContact O-N 3.25Å
641	G	77.1	Confident	74.4	Confident	15 Å²	15	71.8 Å²	71.8	16%	0.155	39%	0.391	C	S	.	.	S	Bend	trans	-62.6	-21.6	177.9	0	0	0	0	0	113.8	G639 K657 P658	G639-G641 PolarHBondContact O-N 3.37Å; G641-K657 VanDerWaalsContact O-CD 3.31Å; G641-K657 WeakPolarHBondContact O-CD 3Å; G641-P658 WeakPolarHBondContact CA-O 2.94Å
642	C	82.5	Confident	73.6	Confident	44 Å²	44	75.5 Å²	75.5	30%	0.297	41%	0.412	S	S	.	.	S	Bend	trans	-112.4	108.9	172.7	-54.1	0	0	0	0	109.5	P640 K644 C655	P640-C642 PolarHBondContact O-N 3.25Å; C642-K644 PolarHBondContact O-N 3.08Å; C642-C655 HydrophobicContact CB-CB 3.78Å; C642-C655 WeakPolarHBondContact CB-SG 3.49Å; C642-C655 PolarHBondContact N-SG 3.21Å; C642-C655 WeakPolarHBondContact SG-CB 3.23Å; C642-C655 CovalentContact SG-SG 2.03Å; C642-C655 PolarHBondContact SG-SG 3.05Å
643	I	84.6	Confident	73.3	Confident	88 Å²	88	75.8 Å²	75.8	45%	0.451	42%	0.415	S	S	.	.			trans	-68.2	131.5	178.9	-60.4	169.6	0	0	0	109.4	T645 N648 L671	I643-T645 HydrophobicContact CG2-CG2 4.03Å; I643-N648 PolarHBondContact O-ND2 2.78Å; I643-L671 HydrophobicContact CG2-CB 4.16Å; I643-L671 HydrophobicContact CG2-CD2 3.99Å
644	K	86	Confident	72.6	Confident	130 Å²	130	80.5 Å²	80.5	57%	0.565	44%	0.444	S	S	*	.			trans	-83.5	123.9	169.5	-65.9	-168	176	-168.2	0	110.3	C642 V670 L671	C642-K644 PolarHBondContact O-N 3.08Å; K644-V670 HydrophobicContact CB-CG1 4.24Å; K644-L671 PolarHBondContact O-N 3.4Å
645	T	88.6	Confident	72.6	Confident	37 Å²	37	79.2 Å²	79.2	23%	0.227	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-125.9	170.6	179.8	68.5	0	0	0	0	109.3	I643 D647 N648 W649 L671	I643-T645 HydrophobicContact CG2-CG2 4.03Å; T645-D647 PolarHBondContact O-N 3.36Å; T645-D647 VanDerWaalsContact O-N 3.09Å; T645-D647 PolarHBondContact OG1-N 2.65Å; T645-N648 WeakPolarHBondContact CA-OD1 3.49Å; T645-N648 PolarHBondContact N-OD1 3.37Å; T645-N648 PolarHBondContact O-N 3.25Å; T645-N648 PolarHBondContact O-OD1 2.9Å; T645-N648 PolarHBondContact OG1-OD1 2.01Å; T645-W649 WeakPolarHBondContact O-CB 3.43Å; T645-W649 PolarHBondContact O-N 3.31Å; T645-W649 VanDerWaalsContact O-N 3.08Å; T645-L671 WeakPolarHBondContact CA-O 3.48Å; T645-L671 HydrophobicContact CG2-CB 4.48Å
646	C	89.5	Confident	73.3	Confident	19 Å²	19	80.4 Å²	80.4	13%	0.128	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.8	175.3	-76.2	0	0	0	0	114.4	C682	C646-C682 WeakPolarHBondContact CA-SG 3.48Å; C646-C682 HydrophobicContact CB-CB 3.66Å; C646-C682 WeakPolarHBondContact CB-SG 3.25Å; C646-C682 WeakPolarHBondContact SG-CA 3.37Å; C646-C682 WeakPolarHBondContact SG-CB 3.41Å; C646-C682 CovalentContact SG-SG 2.04Å; C646-C682 PolarHBondContact SG-SG 3.25Å
647	D	86.4	Confident	73.8	Confident	105 Å²	105	84 Å²	84	56%	0.561	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-23.8	-178.7	-70	-59	0	0	0	114	T645 R685	T645-D647 PolarHBondContact O-N 3.36Å; T645-D647 VanDerWaalsContact O-N 3.09Å; T645-D647 PolarHBondContact OG1-N 2.65Å; D647-R685 IonicContact OD1-NH2 3.64Å; D647-R685 PolarHBondContact OD1-NH2 3.49Å
648	N	86.1	Confident	74.3	Confident	50 Å²	50	85.5 Å²	85.5	27%	0.267	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.5	6.8	-169.4	71.4	-14.1	0	0	0	114.7	I643 T645 N650 E651	I643-N648 PolarHBondContact O-ND2 2.78Å; T645-N648 WeakPolarHBondContact CA-OD1 3.49Å; T645-N648 PolarHBondContact N-OD1 3.37Å; T645-N648 PolarHBondContact O-N 3.25Å; T645-N648 PolarHBondContact O-OD1 2.9Å; T645-N648 PolarHBondContact OG1-OD1 2.01Å; N648-N650 PolarHBondContact O-N 2.84Å; N648-E651 HydrophobicContact CB-CG 4.3Å; N648-E651 PolarHBondContact O-N 3.26Å; N648-E651 VanDerWaalsContact O-N 3.16Å
649	W	80.9	Confident	74.8	Confident	101 Å²	101	85 Å²	85	38%	0.383	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.5	-174.8	73.9	-88.9	0	0	0	114	T645 V670 P679	T645-W649 WeakPolarHBondContact O-CB 3.43Å; T645-W649 PolarHBondContact O-N 3.31Å; T645-W649 VanDerWaalsContact O-N 3.08Å; W649-V670 HydrophobicContact CB-CB 4.47Å; W649-V670 HydrophobicContact CB-CG1 3.4Å; W649-V670 VanDerWaalsContact CB-CG1 3.4Å; W649-V670 HydrophobicContact CG-CG1 3.96Å; W649-P679 HydrophobicContact CD2-CB 3.7Å; W649-P679 HydrophobicContact CD2-CG 4.16Å; W649-P679 HydrophobicContact CE3-CB 3.86Å; W649-P679 HydrophobicContact CE3-CG 4.02Å; W649-P679 HydrophobicContact CG-CB 4.36Å; W649-P679 HydrophobicContact CH2-CB 3.89Å; W649-P679 HydrophobicContact CZ2-CB 3.74Å; W649-P679 HydrophobicContact CZ3-CB 3.94Å; W649-P679 HydrophobicContact CZ3-CG 4.31Å
650	N	76.8	Confident	74.5	Confident	101 Å²	101	88.1 Å²	88.1	54%	0.54	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	2.6	-179.8	25	-12.2	0	0	0	112.8	N648 I652	N648-N650 PolarHBondContact O-N 2.84Å; N650-I652 PolarHBondContact O-N 2.97Å
651	E	70.2	Confident	73.8	Confident	146 Å²	146	87 Å²	87	68%	0.682	49%	0.489	S	S	*	.			trans	-75.3	115.3	169.2	-69.2	-177.7	174.9	0	0	110	N648 G653	N648-E651 HydrophobicContact CB-CG 4.3Å; N648-E651 PolarHBondContact O-N 3.26Å; N648-E651 VanDerWaalsContact O-N 3.16Å; E651-G653 PolarHBondContact O-N 3.09Å
652	I	55.5	Low	73.2	Confident	180 Å²	180	87 Å²	87	92%	0.923	49%	0.49	S	S	*	.			trans	-90.1	79.6	175.4	-51.7	173.6	0	0	0	107.5	N650	N650-I652 PolarHBondContact O-N 2.97Å
653	G	59.3	Low	72.7	Confident	55 Å²	55	88 Å²	88	57%	0.567	50%	0.496	S	S	*	.			trans	-130.4	141	174.3	0	0	0	0	0	111.4	E651 C655	E651-G653 PolarHBondContact O-N 3.09Å; G653-C655 PolarHBondContact O-N 3.14Å
654	P	60.4	Low	72.5	Confident	119 Å²	119	84.8 Å²	84.8	77%	0.773	48%	0.479	S	S	*	.			trans	-63.4	127.1	173.8	24.9	-30.9	0	0	0	110.4	N656	P654-N656 PolarHBondContact O-N 1.99Å
655	C	70.8	Confident	72.4	Confident	62 Å²	62	80.1 Å²	80.1	42%	0.419	46%	0.463	S	S	.	.			trans	-82.9	112.1	174.5	175.9	0	0	0	0	110.1	C642 G653 K657	C642-C655 HydrophobicContact CB-CB 3.78Å; C642-C655 WeakPolarHBondContact CB-SG 3.49Å; C642-C655 PolarHBondContact N-SG 3.21Å; C642-C655 WeakPolarHBondContact SG-CB 3.23Å; C642-C655 CovalentContact SG-SG 2.03Å; C642-C655 PolarHBondContact SG-SG 3.05Å; G653-C655 PolarHBondContact O-N 3.14Å; C655-K657 VanDerWaalsContact C-N 3.33Å
656	N	76.8	Confident	72.2	Confident	152 Å²	152	80.8 Å²	80.8	81%	0.813	47%	0.468	S	S	*	.			trans	-91	11.7	178.2	-64.8	-19.2	0	0	0	113.5	P654	P654-N656 PolarHBondContact O-N 1.99Å
657	K	72.1	Confident	71.7	Confident	141 Å²	141	84.2 Å²	84.2	61%	0.613	50%	0.497	S	S	*	.	S	Bend	trans	-89.1	136.7	179.3	-69	-176.2	179.1	177.7	0	110.5	G641 C655	G641-K657 VanDerWaalsContact O-CD 3.31Å; G641-K657 WeakPolarHBondContact O-CD 3Å; C655-K657 VanDerWaalsContact C-N 3.33Å
658	P	56.3	Low	71.4	Confident	105 Å²	105	86.2 Å²	86.2	68%	0.682	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-60.8	154.3	173.5	27.2	-33.9	0	0	0	110.5	G641	G641-P658 WeakPolarHBondContact CA-O 2.94Å
659	C	69.4	Low	71.5	Confident	60 Å²	60	86 Å²	86	41%	0.405	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-62.8	149.8	175.8	73	0	0	0	0	111	C638 G639	C638-C659 VanDerWaalsContact CA-SG 3.56Å; C638-C659 HydrophobicContact CB-CB 3.97Å; C638-C659 WeakPolarHBondContact CB-SG 3.43Å; C638-C659 WeakPolarHBondContact SG-CB 3.24Å; C638-C659 CovalentContact SG-SG 2.04Å; C638-C659 PolarHBondContact SG-SG 2.81Å; G639-C659 CarbonylContact O-C 3.59Å; G639-C659 WeakPolarHBondContact O-CA 3.05Å; G639-C659 WeakPolarHBondContact O-CB 3.33Å
660	V	64	Low	71.9	Confident	68 Å²	68	81.4 Å²	81.4	41%	0.412	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.7	-177.5	-64.3	0	0	0	0	110.2	G639 H664	G639-V660 PolarHBondContact N-O 3.3Å; G639-V660 VanDerWaalsContact N-O 3.15Å; G639-V660 PolarHBondContact O-N 3.33Å; V660-H664 PolarHBondContact O-NE2 2.95Å
661	A	57.3	Low	72.5	Confident	48 Å²	48	79.5 Å²	79.5	40%	0.397	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133	172.7	0	0	0	0	0	110.2	D636 T637	D636-A661 WeakPolarHBondContact O-CA 3.44Å; T637-A661 WeakPolarHBondContact O-CA 3.04Å; T637-A661 WeakPolarHBondContact O-CB 2.84Å
662	G	63.2	Low	73.4	Confident	17 Å²	17	74.8 Å²	74.8	18%	0.175	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.9	-172.2	178.4	0	0	0	0	0	113.9	Y635 D636 H664	Y635-G662 CarbonylContact C-O 3.53Å; Y635-G662 WeakPolarHBondContact CA-O 3.34Å; D636-G662 PolarHBondContact N-O 2.84Å; D636-G662 PolarHBondContact O-N 3.37Å; G662-H664 PolarHBondContact O-CD2 2.9Å
663	C	72.4	Confident	74.7	Confident	64 Å²	64	75 Å²	75	43%	0.432	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.9	172.2	-66.8	0	0	0	0	110.7	C629 A633	C629-C663 WeakPolarHBondContact CA-SG 3.45Å; C629-C663 HydrophobicContact CB-CB 3.66Å; C629-C663 WeakPolarHBondContact CB-SG 3.5Å; C629-C663 VanDerWaalsContact SG-CA 3.54Å; C629-C663 WeakPolarHBondContact SG-CB 2.93Å; C629-C663 CovalentContact SG-SG 2.03Å; C629-C663 PolarHBondContact SG-SG 2.91Å; A633-C663 HydrophobicContact CB-CB 4.08Å
664	H	81.7	Confident	75.7	Confident	20 Å²	20	74.5 Å²	74.5	9%	0.093	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.4	-177.4	-64.4	-84.8	0	0	0	111.6	A633 V634 D636 V660 G662	A633-H664 CarbonylContact C-O 3.57Å; A633-H664 WeakPolarHBondContact CA-O 3.42Å; V634-H664 PolarHBondContact N-O 3.07Å; V634-H664 PolarHBondContact O-N 3.1Å; D636-H664 HydrophobicContact CB-CB 4.44Å; V660-H664 PolarHBondContact O-NE2 2.95Å; G662-H664 PolarHBondContact O-CD2 2.9Å
665	C	84	Confident	76.9	Confident	33 Å²	33	75.8 Å²	75.8	22%	0.223	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-74.7	136	173.9	-70.1	0	0	0	0	110.9	L669 C676	C665-L669 HydrophobicContact CB-CB 4.09Å; C665-C676 WeakPolarHBondContact CA-SG 3.48Å; C665-C676 HydrophobicContact CB-CB 3.8Å; C665-C676 WeakPolarHBondContact CB-SG 3.43Å; C665-C676 WeakPolarHBondContact SG-CA 3.35Å; C665-C676 WeakPolarHBondContact SG-CB 3.4Å; C665-C676 CovalentContact SG-SG 2.05Å; C665-C676 PolarHBondContact SG-SG 3.09Å
666	P	82.7	Confident	77.7	Confident	51 Å²	51	73.8 Å²	73.8	33%	0.331	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-51.9	159.7	172.5	-26.8	32.1	0	0	0	113.1	G632 V634 N668 L669	G632-P666 VanDerWaalsContact O-CD 3.22Å; G632-P666 WeakPolarHBondContact O-CD 2.98Å; V634-P666 HydrophobicContact CG2-CG 3.86Å; P666-N668 PolarHBondContact O-N 2.97Å; P666-L669 HydrophobicContact CB-CD1 4.26Å; P666-L669 HydrophobicContact CG-CD1 4.18Å; P666-L669 PolarHBondContact O-N 3.37Å; P666-L669 VanDerWaalsContact O-N 3.08Å
667	A	79.6	Confident	78.4	Confident	91 Å²	91	68.1 Å²	68.1	75%	0.752	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	139.9	174.4	0	0	0	0	0	111.5	L669	A667-L669 VanDerWaalsContact C-N 3.27Å; A667-L669 PolarHBondContact O-N 3.47Å
668	N	80.3	Confident	79.3	Confident	147 Å²	147	67.7 Å²	67.7	79%	0.786	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	4.8	-175.7	-50.2	-39.4	0	0	0	116.7	P666 P679	P666-N668 PolarHBondContact O-N 2.97Å; N668-P679 WeakPolarHBondContact O-CD 3.43Å
669	L	88.4	Confident	80.8	Confident	46 Å²	46	64.1 Å²	64.1	24%	0.241	37%	0.366	C	S	.	.			trans	-110	156.5	171.2	-59	179.3	0	0	0	111.2	C665 P666 A667 C676 I677 K678	C665-L669 HydrophobicContact CB-CB 4.09Å; P666-L669 HydrophobicContact CB-CD1 4.26Å; P666-L669 HydrophobicContact CG-CD1 4.18Å; P666-L669 PolarHBondContact O-N 3.37Å; P666-L669 VanDerWaalsContact O-N 3.08Å; A667-L669 VanDerWaalsContact C-N 3.27Å; A667-L669 PolarHBondContact O-N 3.47Å; L669-C676 HydrophobicContact CB-CB 4.1Å; L669-C676 HydrophobicContact CD1-CB 3.89Å; L669-I677 WeakPolarHBondContact CA-O 3.21Å; L669-K678 HydrophobicContact CD2-CB 4.46Å; L669-K678 HydrophobicContact CD2-CG 3.78Å
670	V	89.9	Confident	81.8	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147	178.3	-59.8	0	0	0	0	109.7	K644 W649 H672 I677 P679 C682	K644-V670 HydrophobicContact CB-CG1 4.24Å; W649-V670 HydrophobicContact CB-CB 4.47Å; W649-V670 HydrophobicContact CB-CG1 3.4Å; W649-V670 VanDerWaalsContact CB-CG1 3.4Å; W649-V670 HydrophobicContact CG-CG1 3.96Å; V670-H672 PolarHBondContact O-N 3.29Å; V670-I677 HydrophobicContact CG2-CG1 4.06Å; V670-I677 PolarHBondContact N-O 2.96Å; V670-I677 PolarHBondContact O-N 2.92Å; V670-P679 HydrophobicContact CG1-CG 3.97Å; V670-C682 VanDerWaalsContact CG2-SG 3.57Å
671	L	87.8	Confident	83.2	Confident	61 Å²	61	69.7 Å²	69.7	32%	0.319	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.8	178.1	-175.4	67.7	0	0	0	109.9	I643 K644 T645	I643-L671 HydrophobicContact CG2-CB 4.16Å; I643-L671 HydrophobicContact CG2-CD2 3.99Å; K644-L671 PolarHBondContact O-N 3.4Å; T645-L671 WeakPolarHBondContact CA-O 3.48Å; T645-L671 HydrophobicContact CG2-CB 4.48Å
672	H	88.8	Confident	84.7	Confident	47 Å²	47	68.2 Å²	68.2	22%	0.218	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	123	173.5	-172	69	0	0	0	110.6	V670 G674 R675 I677	V670-H672 PolarHBondContact O-N 3.29Å; H672-G674 PolarHBondContact O-N 3.28Å; H672-G674 VanDerWaalsContact O-N 3.13Å; H672-R675 PolarHBondContact N-O 2.85Å; H672-R675 PolarHBondContact O-N 2.87Å; H672-R675 VanDerWaalsContact O-O 3.12Å; H672-I677 HydrophobicContact CB-CD1 3.47Å; H672-I677 VanDerWaalsContact CB-CD1 3.47Å; H672-I677 HydrophobicContact CB-CG1 3.8Å
673	K	84.5	Confident	85.7	Confident	185 Å²	185	71.5 Å²	71.5	80%	0.804	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	42.3	-179.1	-63.4	-178.1	179.6	179.2	0	113.5	R675	K673-R675 VanDerWaalsContact C-N 3.3Å; K673-R675 PolarHBondContact O-N 2.67Å
674	G	80.5	Confident	85.5	Confident	45 Å²	45	77.5 Å²	77.5	46%	0.464	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	10.6	179.5	0	0	0	0	0	115.3	H631 H672	H631-G674 VanDerWaalsContact CB-O 3.3Å; H631-G674 WeakPolarHBondContact CB-O 2.8Å; H631-G674 PolarHBondContact CD2-O 2.74Å; H631-G674 VanDerWaalsContact CD2-O 3.27Å; H672-G674 PolarHBondContact O-N 3.28Å; H672-G674 VanDerWaalsContact O-N 3.13Å
675	R	84.8	Confident	84.2	Confident	146 Å²	146	89.6 Å²	89.6	55%	0.551	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	146.1	176.9	-48.9	-164.1	170.7	163.2	-1.7	111.2	H631 H672 K673 I677	H631-R675 HydrophobicContact CB-CB 3.84Å; H631-R675 HydrophobicContact CB-CG 3.64Å; H672-R675 PolarHBondContact N-O 2.85Å; H672-R675 PolarHBondContact O-N 2.87Å; H672-R675 VanDerWaalsContact O-O 3.12Å; K673-R675 VanDerWaalsContact C-N 3.3Å; K673-R675 PolarHBondContact O-N 2.67Å; R675-I677 HydrophobicContact CB-CG2 4.39Å
676	C	86.8	Confident	84.2	Confident	20 Å²	20	92.5 Å²	92.5	14%	0.135	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.4	172	-61.1	0	0	0	0	109.6	H631 C665 L669	H631-C676 PolarHBondContact O-N 3.45Å; C665-C676 WeakPolarHBondContact CA-SG 3.48Å; C665-C676 HydrophobicContact CB-CB 3.8Å; C665-C676 WeakPolarHBondContact CB-SG 3.43Å; C665-C676 WeakPolarHBondContact SG-CA 3.35Å; C665-C676 WeakPolarHBondContact SG-CB 3.4Å; C665-C676 CovalentContact SG-SG 2.05Å; C665-C676 PolarHBondContact SG-SG 3.09Å; L669-C676 HydrophobicContact CB-CB 4.1Å; L669-C676 HydrophobicContact CD1-CB 3.89Å
677	I	91.7	Very high	84.3	Confident	33 Å²	33	94.6 Å²	94.6	17%	0.169	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	159.5	-179.5	65.2	170.9	0	0	0	110.7	L669 V670 H672 R675 L681	L669-I677 WeakPolarHBondContact CA-O 3.21Å; V670-I677 HydrophobicContact CG2-CG1 4.06Å; V670-I677 PolarHBondContact N-O 2.96Å; V670-I677 PolarHBondContact O-N 2.92Å; H672-I677 HydrophobicContact CB-CD1 3.47Å; H672-I677 VanDerWaalsContact CB-CD1 3.47Å; H672-I677 HydrophobicContact CB-CG1 3.8Å; R675-I677 HydrophobicContact CB-CG2 4.39Å; I677-L681 HydrophobicContact CB-CB 4.46Å; I677-L681 HydrophobicContact CD1-CB 4.19Å
678	K	91.1	Very high	84.6	Confident	132 Å²	132	94.8 Å²	94.8	57%	0.574	47%	0.47	S	S	*	.			trans	-68.7	143.2	171.8	-68.2	-176.2	177.2	178.9	0	109.4	L669 V680 L681	L669-K678 HydrophobicContact CD2-CB 4.46Å; L669-K678 HydrophobicContact CD2-CG 3.78Å; K678-V680 HydrophobicContact CB-CG2 3.88Å; K678-V680 PolarHBondContact O-N 3.43Å; K678-V680 VanDerWaalsContact O-N 3.08Å; K678-L681 HydrophobicContact CB-CD1 4.47Å; K678-L681 HydrophobicContact CB-CG 4.49Å; K678-L681 WeakPolarHBondContact O-CB 3.35Å; K678-L681 PolarHBondContact O-N 2.87Å
679	P	89	Confident	84.8	Confident	30 Å²	30	91.8 Å²	91.8	20%	0.195	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-49.8	-35.6	176.3	-29.6	33.1	0	0	0	114.6	W649 N668 V670 L681 C682	W649-P679 HydrophobicContact CD2-CB 3.7Å; W649-P679 HydrophobicContact CD2-CG 4.16Å; W649-P679 HydrophobicContact CE3-CB 3.86Å; W649-P679 HydrophobicContact CE3-CG 4.02Å; W649-P679 HydrophobicContact CG-CB 4.36Å; W649-P679 HydrophobicContact CH2-CB 3.89Å; W649-P679 HydrophobicContact CZ2-CB 3.74Å; W649-P679 HydrophobicContact CZ3-CB 3.94Å; W649-P679 HydrophobicContact CZ3-CG 4.31Å; N668-P679 WeakPolarHBondContact O-CD 3.43Å; V670-P679 HydrophobicContact CG1-CG 3.97Å; P679-L681 PolarHBondContact O-N 2.87Å; P679-C682 VanDerWaalsContact O-CB 3.25Å; P679-C682 WeakPolarHBondContact O-CB 3.18Å; P679-C682 PolarHBondContact O-N 3.44Å; P679-C682 PolarHBondContact O-SG 3.4Å
680	V	90.2	Very high	84.6	Confident	128 Å²	128	94.6 Å²	94.6	78%	0.776	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-64.2	-16.5	177.5	-59.3	0	0	0	0	114.5	K678	K678-V680 HydrophobicContact CB-CG2 3.88Å; K678-V680 PolarHBondContact O-N 3.43Å; K678-V680 VanDerWaalsContact O-N 3.08Å
681	L	91.6	Very high	84.3	Confident	116 Å²	116	100.7 Å²	100.7	61%	0.607	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-97.3	1.4	177.1	-61.2	175.8	0	0	0	112.4	I677 K678 P679	I677-L681 HydrophobicContact CB-CB 4.46Å; I677-L681 HydrophobicContact CD1-CB 4.19Å; K678-L681 HydrophobicContact CB-CD1 4.47Å; K678-L681 HydrophobicContact CB-CG 4.49Å; K678-L681 WeakPolarHBondContact O-CB 3.35Å; K678-L681 PolarHBondContact O-N 2.87Å; P679-L681 PolarHBondContact O-N 2.87Å
682	C	89.6	Confident	84	Confident	18 Å²	18	103.6 Å²	103.6	12%	0.122	51%	0.507	C	S	.	.	S	Bend	trans	-63.4	136	171.6	-72.5	0	0	0	0	109.4	C646 V670 P679 Q684	C646-C682 WeakPolarHBondContact CA-SG 3.48Å; C646-C682 HydrophobicContact CB-CB 3.66Å; C646-C682 WeakPolarHBondContact CB-SG 3.25Å; C646-C682 WeakPolarHBondContact SG-CA 3.37Å; C646-C682 WeakPolarHBondContact SG-CB 3.41Å; C646-C682 CovalentContact SG-SG 2.04Å; C646-C682 PolarHBondContact SG-SG 3.25Å; V670-C682 VanDerWaalsContact CG2-SG 3.57Å; P679-C682 VanDerWaalsContact O-CB 3.25Å; P679-C682 WeakPolarHBondContact O-CB 3.18Å; P679-C682 PolarHBondContact O-N 3.44Å; P679-C682 PolarHBondContact O-SG 3.4Å; C682-Q684 PolarHBondContact O-N 2.99Å; C682-Q684 VanDerWaalsContact O-N 3.12Å
683	P	85.3	Confident	83.6	Confident	85 Å²	85	107.9 Å²	107.9	55%	0.552	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-56.5	122.6	173.5	21.7	-29.4	0	0	0	108.7	R685	P683-R685 PolarHBondContact O-N 3.22Å
684	Q	67.6	Low	83.6	Confident	191 Å²	191	101.5 Å²	101.5	89%	0.893	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-60.4	136.7	172.4	-69.5	-168.4	-19.7	0	0	108.3	C682	C682-Q684 PolarHBondContact O-N 2.99Å; C682-Q684 VanDerWaalsContact O-N 3.12Å
685	R	54.7	Low	83.8	Confident	274 Å²	274	106.6 Å²	106.6	100%	1.034	51%	0.51	S	S	*	.			trans	-67.6	0	174.3	-81.5	-172.7	179.3	-180	3.2	111.4	D647 P683	D647-R685 IonicContact OD1-NH2 3.64Å; D647-R685 PolarHBondContact OD1-NH2 3.49Å; P683-R685 PolarHBondContact O-N 3.22Å

Retrieved 685 of 685 residues in 457.3 ms (Link to these results)

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