A0A096MYS3_PAPAN Loading...

Scavenger receptor cysteine rich family member with 4 domains

AlphaFold DB , UniProt , Accession A0A096MYS3, Species PAPAN (Papio anubis, Olive baboon), Gene SSC4D, Length 575 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.2	Very low	35.5	Very low	252 Å²	252	159.5 Å²	159.5	100%	1.241	90%	0.901	S	S	*	*				0	103.7	0	-79.4	150.5	90.7	0	0	106.6
2	G	34.9	Very low	35.6	Very low	76 Å²	76	160.7 Å²	160.7	78%	0.784	89%	0.894	S	S	*	*			trans	-92.6	172.6	-179.1	0	0	0	0	0	112.8
3	K	36.2	Very low	36.2	Very low	214 Å²	214	157.8 Å²	157.8	93%	0.93	89%	0.886	S	S	*	*			trans	-161	118.8	133.8	-103.7	-176.2	-179.3	-171.2	0	108.9
4	E	35.9	Very low	36.2	Very low	197 Å²	197	156.8 Å²	156.8	92%	0.921	88%	0.878	S	S	*	*			trans	-76.9	158.2	163.6	-74.1	162.9	124.9	0	0	110.6
5	A	39.4	Very low	36.1	Very low	107 Å²	107	158.2 Å²	158.2	88%	0.884	88%	0.875	S	S	*	*			trans	-142.7	118.2	153.9	0	0	0	0	0	109.5
6	E	33.9	Very low	35.9	Very low	189 Å²	189	160.6 Å²	160.6	88%	0.883	87%	0.874	S	S	*	*			trans	-68.8	151.6	175.1	-113.8	169.7	116.5	0	0	112.9
7	M	31.3	Very low	35.5	Very low	188 Å²	188	155.5 Å²	155.5	93%	0.926	87%	0.867	S	S	*	*			trans	-115	122.2	166.6	-168.7	152.3	87.3	0	0	109.3
8	Q	33.4	Very low	35.3	Very low	182 Å²	182	159.2 Å²	159.2	85%	0.85	87%	0.866	S	S	*	*			trans	-86.2	135.5	-175	-82.3	168.1	-25.8	0	0	113
9	T	36.8	Very low	34.9	Very low	145 Å²	145	154.3 Å²	154.3	89%	0.89	86%	0.856	S	S	*	*			trans	-89.2	141.7	164.7	47.8	0	0	0	0	111.3
10	G	31.1	Very low	34.7	Very low	72 Å²	72	158.5 Å²	158.5	74%	0.742	86%	0.858	S	S	*	*			trans	-131.3	161.1	170.7	0	0	0	0	0	112.4
11	P	41.8	Very low	34.5	Very low	133 Å²	133	161.6 Å²	161.6	86%	0.864	86%	0.858	S	S	*	*			trans	-116.1	168.3	-136.5	38.3	-27.8	0	0	0	117.7
12	Q	36.8	Very low	34.3	Very low	173 Å²	173	157.3 Å²	157.3	81%	0.808	84%	0.839	S	S	*	*			trans	-52.4	160.2	169.3	-83.3	173.8	-85.2	0	0	115.5
13	P	43.4	Very low	34	Very low	123 Å²	123	157 Å²	157	80%	0.799	84%	0.836	S	S	*	*			trans	-114.5	139.6	153	35.3	-22.2	0	0	0	113.2
14	D	36.1	Very low	33.8	Very low	144 Å²	144	155 Å²	155	77%	0.77	84%	0.836	S	S	*	*			trans	-126	147	165.5	-109.9	-25.2	0	0	0	111
15	E	34.7	Very low	33.5	Very low	178 Å²	178	149.4 Å²	149.4	83%	0.832	83%	0.83	S	S	*	*			trans	46.4	126.4	156.1	-61.6	-155.8	131.2	0	0	122.8
16	K	32.6	Very low	33.2	Very low	197 Å²	197	150.1 Å²	150.1	86%	0.857	83%	0.829	S	S	*	*			trans	-151.2	117	130.4	-81.5	-163.5	-179.7	166.6	0	112.1
17	G	28.4	Very low	33	Very low	74 Å²	74	146 Å²	146	76%	0.763	83%	0.827	S	S	*	*			trans	-82.7	149.4	169.7	0	0	0	0	0	113.8
18	W	32.3	Very low	33.2	Very low	222 Å²	222	141.3 Å²	141.3	84%	0.841	82%	0.818	S	S	*	*			trans	-134.7	116.2	167.1	-82	55.3	0	0	0	108.6
19	G	28.4	Very low	34.3	Very low	66 Å²	66	138.2 Å²	138.2	68%	0.68	81%	0.814	S	S	*	*			trans	-100.1	149	169.2	0	0	0	0	0	111.4
20	W	29.6	Very low	35.3	Very low	237 Å²	237	135.4 Å²	135.4	90%	0.898	80%	0.798	S	S	*	*			trans	-143.7	137.9	158.8	-73.3	106.3	0	0	0	110.1
21	R	31	Very low	35.3	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.849	80%	0.803	S	S	*	*			trans	-94.6	151.7	179.6	-74.2	-172.7	-169.8	-142.6	4.3	112.4
22	L	31.9	Very low	34.9	Very low	161 Å²	161	142.4 Å²	142.4	84%	0.843	80%	0.802	S	S	*	*			trans	45.1	130.6	138.9	-75.2	154.6	0	0	0	121.5
23	G	29.8	Very low	35.7	Very low	71 Å²	71	139 Å²	139	73%	0.732	80%	0.795	S	S	*	*			trans	171.2	94.6	156	0	0	0	0	0	114.9
24	D	30.8	Very low	35.5	Very low	172 Å²	172	142 Å²	142	92%	0.92	80%	0.798	S	S	*	*			trans	13.8	144.6	150.3	-65.6	-33.5	0	0	0	123.2
25	G	30.1	Very low	35.5	Very low	78 Å²	78	139.2 Å²	139.2	80%	0.804	80%	0.795	S	S	*	*			trans	171.7	69.8	159.7	0	0	0	0	0	116.6
26	S	32.9	Very low	35.5	Very low	123 Å²	123	138.7 Å²	138.7	86%	0.86	80%	0.797	S	S	*	*			trans	-59.6	141.8	170.5	-47.1	0	0	0	0	114
27	A	31.1	Very low	35.7	Very low	102 Å²	102	134.3 Å²	134.3	84%	0.843	79%	0.791	S	S	*	*			trans	174.9	116.4	133.2	0	0	0	0	0	113.3
28	A	35.4	Very low	36.2	Very low	90 Å²	90	140.8 Å²	140.8	74%	0.744	80%	0.799	S	S	*	*			trans	-97.2	-172.6	142	0	0	0	0	0	107.5
29	P	54.7	Low	36.8	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	80%	0.798	S	S	*	*			cis	-134.7	-133.8	-8.7	27.9	0.6	0	0	0	108.8
30	P	58.2	Low	37.3	Very low	87 Å²	87	143 Å²	143	57%	0.565	81%	0.81	S	S	*	*			cis	-138.2	-175.5	-23.8	15.3	13.5	0	0	0	114.9
31	F	31	Very low	38.2	Very low	193 Å²	193	139.4 Å²	139.4	85%	0.846	81%	0.807	S	S	*	*			trans	110.4	105	147	-61.7	-66.6	0	0	0	120.5
32	L	33.6	Very low	39.1	Very low	159 Å²	159	136.2 Å²	136.2	83%	0.832	81%	0.806	S	S	*	*			trans	-77	177.1	140.9	-79.7	157.6	0	0	0	109.6
33	P	54.1	Low	39.6	Very low	102 Å²	102	134.7 Å²	134.7	66%	0.662	81%	0.806	S	S	*	*			cis	-151.1	-173	20.1	34.5	-8.1	0	0	0	118.2
34	Q	39.6	Very low	40.1	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	81%	0.809	S	S	*	*			trans	77.5	143.7	155.7	-54.4	-164.6	-8.3	0	0	119.4
35	A	35.7	Very low	40.9	Very low	84 Å²	84	135.2 Å²	135.2	69%	0.694	81%	0.805	S	S	*	*			cis	-173.9	171.3	-12.2	0	0	0	0	0	108.3
36	L	34.5	Very low	41.4	Very low	167 Å²	167	136.9 Å²	136.9	87%	0.874	81%	0.805	S	S	*	*			trans	98	98.3	157.8	-61	166.8	0	0	0	120
37	S	37.5	Very low	41.8	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	80%	0.795	S	S	*	*			trans	3	129.7	136.5	-65.7	0	0	0	0	119.6
38	F	38.6	Very low	42.3	Very low	210 Å²	210	138.6 Å²	138.6	92%	0.921	80%	0.8	S	S	*	*				-150	128.8	124.7	-112	-82.5	0	0	0	110.9
39	L	43.6	Very low	42.7	Very low	157 Å²	157	142.5 Å²	142.5	82%	0.822	80%	0.803	S	S	*	*			trans	-61	127.6	175.9	-77.2	125	0	0	0	111.8
40	L	40	Very low	42.1	Very low	178 Å²	178	142.5 Å²	142.5	93%	0.932	80%	0.803	S	S	*	*			trans	-141.4	118.9	145.2	-92.4	168.4	0	0	0	108.9
41	L	48	Very low	41.3	Very low	160 Å²	160	143.9 Å²	143.9	84%	0.838	81%	0.81	S	S	*	*			trans	-57.4	129.2	176.7	-71.7	139.8	0	0	0	110.9
42	L	49.6	Very low	42	Very low	159 Å²	159	140.4 Å²	140.4	83%	0.832	81%	0.807	S	S	*	*			trans	173.2	111.2	141.4	-91.7	165.9	0	0	0	107.7
43	P	41.8	Very low	42.7	Very low	128 Å²	128	138.7 Å²	138.7	83%	0.831	80%	0.798	S	S	*	*			trans	-94.4	110.4	160	27.7	-14.9	0	0	0	109
44	L	42.3	Very low	43	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	80%	0.802	S	S	*	*			trans	-49.8	134.6	146.8	-82.9	88.8	0	0	0	108.5	S46	L44-S46 PolarHBondContact O-N 3.33Å; L44-S46 VanDerWaalsContact O-N 3.14Å
45	A	45.9	Very low	43.9	Very low	102 Å²	102	134 Å²	134	84%	0.843	78%	0.775	S	S	*	*			trans	-52.3	116.6	166.1	0	0	0	0	0	109.8
46	S	41.5	Very low	45.5	Very low	113 Å²	113	131.4 Å²	131.4	79%	0.79	75%	0.751	S	S	*	*			trans	-150.6	120	160.1	-101.3	0	0	0	0	109.5	L44	L44-S46 PolarHBondContact O-N 3.33Å; L44-S46 VanDerWaalsContact O-N 3.14Å
47	A	41	Very low	47.9	Very low	81 Å²	81	128.5 Å²	128.5	67%	0.669	73%	0.732	S	S	*	*			trans	62.9	81.6	147.4	0	0	0	0	0	117.4	Q49	A47-Q49 HydrophobicContact CB-CG 4.39Å; A47-Q49 PolarHBondContact O-N 3.31Å; A47-Q49 VanDerWaalsContact O-N 3.09Å
48	L	41.3	Very low	50.6	Low	179 Å²	179	124.1 Å²	124.1	94%	0.937	70%	0.701	S	S	*	*				-59.5	96.4	127.4	-80.5	149.5	0	0	0	106.2	P50	L48-P50 VanDerWaalsContact O-CD 3.25Å; L48-P50 WeakPolarHBondContact O-CD 3.42Å
49	Q	43.8	Very low	53.2	Low	173 Å²	173	118.6 Å²	118.6	81%	0.808	67%	0.674	S	S	*	*			trans	-66.4	117.7	160.4	-80.6	176.1	-56.4	0	0	106.1	A47 T51	A47-Q49 HydrophobicContact CB-CG 4.39Å; A47-Q49 PolarHBondContact O-N 3.31Å; A47-Q49 VanDerWaalsContact O-N 3.09Å; Q49-T51 PolarHBondContact O-N 3.27Å
50	P	42.5	Very low	55.5	Low	115 Å²	115	112 Å²	112	75%	0.747	64%	0.639	S	S	*	*			trans	-59	129.5	166.7	25.2	-30.8	0	0	0	107	L48	L48-P50 VanDerWaalsContact O-CD 3.25Å; L48-P50 WeakPolarHBondContact O-CD 3.42Å
51	T	40.9	Very low	58	Low	117 Å²	117	105.4 Å²	105.4	72%	0.718	61%	0.606	S	S	*	*			trans	-45.4	130	163.2	41	0	0	0	0	107.9	Q49 L53	Q49-T51 PolarHBondContact O-N 3.27Å; T51-L53 PolarHBondContact O-N 3.4Å
52	P	45.5	Very low	59.7	Low	119 Å²	119	100.6 Å²	100.6	77%	0.773	60%	0.596	S	S	*	*			trans	-57.1	119.2	177.7	23	-30.2	0	0	0	107.2	T54	P52-T54 PolarHBondContact O-N 3.21Å
53	L	48.5	Very low	61.2	Low	123 Å²	123	94.2 Å²	94.2	64%	0.644	57%	0.568	S	S	*	*			trans	-55	126.1	169.6	-64.8	172.8	0	0	0	105.6	T51 F55 E57	T51-L53 PolarHBondContact O-N 3.4Å; L53-F55 PolarHBondContact O-N 3.26Å; L53-E57 HydrophobicContact CD1-CG 4.35Å
54	T	60	Low	63.1	Low	123 Å²	123	93.4 Å²	93.4	76%	0.755	56%	0.563	S	S	*	*	S	Bend	trans	-66.3	1	-176.1	40.1	0	0	0	0	113.2	P52	P52-T54 PolarHBondContact O-N 3.21Å
55	F	59.6	Low	65.1	Low	67 Å²	67	88.1 Å²	88.1	29%	0.294	54%	0.539	S	S	.	.	S	Bend	trans	-142.7	152.8	-175.3	-56.1	-67.2	0	0	0	110.1	L53 A132 A133 E136	L53-F55 PolarHBondContact O-N 3.26Å; F55-A132 HydrophobicContact CZ-CB 4.47Å; F55-A133 HydrophobicContact CB-CB 3.69Å; F55-A133 HydrophobicContact CD1-CB 3.51Å; F55-A133 HydrophobicContact CD2-CB 3.91Å; F55-A133 HydrophobicContact CE1-CB 4.11Å; F55-A133 HydrophobicContact CE2-CB 4.44Å; F55-A133 HydrophobicContact CG-CB 3.4Å; F55-E136 HydrophobicContact CE1-CG 4.09Å; F55-E136 WeakPolarHBondContact CE1-OE1 3.48Å; F55-E136 WeakPolarHBondContact CZ-OE1 3.43Å
56	P	69.4	Low	67.1	Low	30 Å²	30	91.8 Å²	91.8	20%	0.195	53%	0.531	C	S	.	.			trans	-56.7	140.5	173.7	22.6	-30.1	0	0	0	110.9	V73 M74 Q98 S135 W142	P56-V73 HydrophobicContact CB-CG2 3.98Å; P56-V73 HydrophobicContact CG-CG2 4.25Å; P56-M74 WeakPolarHBondContact CB-O 3.36Å; P56-Q98 PolarHBondContact O-NE2 2.83Å; P56-S135 VanDerWaalsContact CD-OG 3.31Å; P56-S135 WeakPolarHBondContact CD-OG 3.37Å; P56-S135 VanDerWaalsContact CG-CB 3.47Å; P56-W142 HydrophobicContact CG-CH2 4.15Å
57	E	84.6	Confident	69.4	Low	105 Å²	105	86.4 Å²	86.4	49%	0.491	49%	0.493	S	S	.	.			trans	-70.4	134.7	-178.5	-161.4	179	170.5	0	0	109.9	L53 M74 W79	L53-E57 HydrophobicContact CD1-CG 4.35Å; E57-M74 HydrophobicContact CB-CB 3.98Å; E57-M74 WeakPolarHBondContact O-CB 3.49Å; E57-M74 PolarHBondContact O-N 3.08Å; E57-W79 HydrophobicContact CB-CH2 3.96Å; E57-W79 HydrophobicContact CG-CH2 3.92Å; E57-W79 HydrophobicContact CG-CZ2 4.45Å; E57-W79 VanDerWaalsContact O-CZ3 3.24Å; E57-W79 WeakPolarHBondContact O-CZ3 3.47Å
58	L	94.1	Very high	71.7	Confident	14 Å²	14	86.8 Å²	86.8	7%	0.073	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	148.7	176.1	-62	-172.8	0	0	0	110.5	L71 V73 V95 Q98 L99 L134	L58-L71 HydrophobicContact CD1-CD1 4.48Å; L58-L71 HydrophobicContact CD2-CD1 4.41Å; L58-V73 HydrophobicContact CD2-CB 3.81Å; L58-V73 HydrophobicContact CD2-CG2 3.74Å; L58-V95 HydrophobicContact CD1-CB 4.45Å; L58-V95 HydrophobicContact CD1-CG1 4.16Å; L58-V95 HydrophobicContact CD1-CG2 4.2Å; L58-Q98 HydrophobicContact CD1-CB 4.31Å; L58-Q98 VanDerWaalsContact CD1-CD 3.44Å; L58-Q98 HydrophobicContact CD1-CG 4.18Å; L58-L99 HydrophobicContact CB-CD2 3.9Å; L58-L99 HydrophobicContact CB-CG 4.48Å; L58-L134 HydrophobicContact CD1-CB 4.09Å; L58-L134 HydrophobicContact CD1-CD2 4.41Å; L58-L134 HydrophobicContact CD2-CB 4.49Å; L58-L134 HydrophobicContact CD2-CD2 4.05Å
59	R	92.9	Very high	74	Confident	95 Å²	95	78.3 Å²	78.3	36%	0.358	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.9	168.1	70.6	-177.3	-174.2	-172	0.1	111.8	V61 E72 W79	R59-V61 HydrophobicContact CG-CG2 3.75Å; R59-E72 HydrophobicContact CG-CB 3.96Å; R59-E72 IonicContact CZ-OE2 3.94Å; R59-E72 PolarHBondContact N-O 3.35Å; R59-E72 IonicContact NE-OE2 3.84Å; R59-E72 PolarHBondContact NE-OE2 2.88Å; R59-E72 IonicContact NH2-OE2 2.66Å; R59-E72 PolarHBondContact NH2-OE2 2.81Å; R59-E72 PolarHBondContact O-N 3.09Å; R59-W79 HydrophobicContact CB-CH2 4Å; R59-W79 HydrophobicContact CB-CZ3 4.04Å; R59-W79 HydrophobicContact CG-CD2 4.42Å; R59-W79 HydrophobicContact CG-CE3 3.83Å; R59-W79 HydrophobicContact CG-CH2 3.81Å; R59-W79 HydrophobicContact CG-CZ2 4.39Å; R59-W79 HydrophobicContact CG-CZ3 3.5Å; R59-W79 VanDerWaalsContact CG-CZ3 3.5Å
60	L	92.8	Very high	76.3	Confident	17 Å²	17	71 Å²	71	9%	0.089	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.8	170.2	-58.1	-178.4	0	0	0	109.5	R70 L71 V95 L99 V155	L60-R70 CarbonylContact C-O 3.56Å; L60-R70 VanDerWaalsContact CA-O 3.32Å; L60-R70 WeakPolarHBondContact CA-O 3.02Å; L60-L71 HydrophobicContact CD2-CB 4.12Å; L60-L71 HydrophobicContact CD2-CD1 3.8Å; L60-V95 HydrophobicContact CD2-CG1 4.4Å; L60-L99 HydrophobicContact CD1-CD1 3.76Å; L60-L99 HydrophobicContact CD2-CD1 4.3Å; L60-L99 HydrophobicContact CG-CD1 3.69Å; L60-V155 HydrophobicContact CD1-CB 4.22Å; L60-V155 HydrophobicContact CD1-CG1 4.25Å; L60-V155 HydrophobicContact CD2-CB 3.84Å; L60-V155 HydrophobicContact CD2-CG1 4.5Å; L60-V155 HydrophobicContact CD2-CG2 4.38Å
61	V	91.4	Very high	78.7	Confident	41 Å²	41	65.5 Å²	65.5	25%	0.248	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.8	-172.1	-173.4	0	0	0	0	111.1	R59 G63 G69 R70 E72	R59-V61 HydrophobicContact CG-CG2 3.75Å; V61-G63 PolarHBondContact O-N 3.48Å; V61-G69 CarbonylContact O-C 3.46Å; V61-G69 WeakPolarHBondContact O-CA 3.27Å; V61-R70 PolarHBondContact N-O 3.08Å; V61-R70 PolarHBondContact O-N 3.32Å; V61-E72 HydrophobicContact CG2-CG 4.23Å
62	G	84	Confident	81.3	Confident	59 Å²	59	60.6 Å²	60.6	61%	0.608	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	79.9	-2.9	171.3	0	0	0	0	0	115.2
63	G	81.7	Confident	83.6	Confident	25 Å²	25	55 Å²	55	26%	0.258	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	173.7	174.4	0	0	0	0	0	114.4	V61 S65 R68	V61-G63 PolarHBondContact O-N 3.48Å; G63-S65 PolarHBondContact O-N 3.23Å; G63-R68 WeakPolarHBondContact CA-O 3.49Å
64	P	80.8	Confident	85.6	Confident	110 Å²	110	51.5 Å²	51.5	71%	0.714	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	-5.1	-171.4	30.6	-37.2	0	0	0	114.3	R68	P64-R68 HydrophobicContact CG-CB 4.39Å
65	S	84.8	Confident	87	Confident	43 Å²	43	48.9 Å²	48.9	30%	0.301	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	169.4	-177.1	71.9	0	0	0	0	110.7	G63 C67 R68	G63-S65 PolarHBondContact O-N 3.23Å; S65-C67 PolarHBondContact O-N 3.14Å; S65-C67 PolarHBondContact OG-N 3.23Å; S65-R68 PolarHBondContact O-N 3.23Å; S65-R68 PolarHBondContact OG-N 3.03Å
66	R	88.8	Confident	88.2	Confident	179 Å²	179	49.5 Å²	49.5	68%	0.675	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-14.3	174.1	71.5	-177.7	-176.6	124.6	6.1	114.3
67	C	90	Very high	88.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	10.4	-177.4	-65.8	0	0	0	0	112.5	S65 C101 C157 E159	S65-C67 PolarHBondContact O-N 3.14Å; S65-C67 PolarHBondContact OG-N 3.23Å; C67-C101 WeakPolarHBondContact CA-SG 3.27Å; C67-C101 HydrophobicContact CB-CB 3.56Å; C67-C101 WeakPolarHBondContact CB-SG 2.96Å; C67-C101 WeakPolarHBondContact SG-CB 3.24Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 2.89Å; C67-C157 HydrophobicContact CB-CB 4.15Å; C67-C157 WeakPolarHBondContact O-CB 3.42Å; C67-C157 PolarHBondContact O-N 2.83Å; C67-E159 HydrophobicContact CB-CG 3.92Å; C67-E159 WeakPolarHBondContact CB-OE1 3.46Å; C67-E159 PolarHBondContact SG-OE1 3.37Å
68	R	89.2	Confident	89.2	Confident	89 Å²	89	49.1 Å²	49.1	34%	0.336	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	127.9	179.1	-61.8	-178.1	177.3	-171.1	-2.7	110.4	G63 P64 S65 V155 L156	G63-R68 WeakPolarHBondContact CA-O 3.49Å; P64-R68 HydrophobicContact CG-CB 4.39Å; S65-R68 PolarHBondContact O-N 3.23Å; S65-R68 PolarHBondContact OG-N 3.03Å; R68-V155 WeakPolarHBondContact CA-O 3.49Å; R68-L156 HydrophobicContact CG-CG 4.38Å
69	G	89.4	Confident	89.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.7	-176.4	176.9	0	0	0	0	0	113.5	V61 V155	V61-G69 CarbonylContact O-C 3.46Å; V61-G69 WeakPolarHBondContact O-CA 3.27Å; G69-V155 PolarHBondContact N-O 3.09Å; G69-V155 PolarHBondContact O-N 2.83Å
70	R	91.4	Very high	89.2	Confident	20 Å²	20	46.8 Å²	46.8	8%	0.075	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	133.9	168.1	179.1	-177.4	60.1	-95.4	-3.7	109.6	L60 V61 E72 F113 G114 D152 V153	L60-R70 CarbonylContact C-O 3.56Å; L60-R70 VanDerWaalsContact CA-O 3.32Å; L60-R70 WeakPolarHBondContact CA-O 3.02Å; V61-R70 PolarHBondContact N-O 3.08Å; V61-R70 PolarHBondContact O-N 3.32Å; R70-E72 IonicContact CZ-OE1 3.17Å; R70-E72 IonicContact NE-OE1 2.87Å; R70-E72 PolarHBondContact NE-OE1 2.59Å; R70-E72 IonicContact NH2-OE1 3.75Å; R70-E72 PolarHBondContact NH2-OE1 3.35Å; R70-F113 HydrophobicContact CB-CB 4.22Å; R70-F113 PolarHBondContact NH1-O 2.88Å; R70-G114 VanDerWaalsContact NH1-C 3.27Å; R70-G114 PolarHBondContact NH1-O 2.82Å; R70-D152 WeakPolarHBondContact CD-OD2 3.26Å; R70-D152 HydrophobicContact CG-CB 4.03Å; R70-V153 WeakPolarHBondContact CA-O 3.03Å
71	L	94	Very high	89.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131	178	-177.9	58.9	0	0	0	111.6	L58 L60 V82 W87 V95 L134 V153 V155	L58-L71 HydrophobicContact CD1-CD1 4.48Å; L58-L71 HydrophobicContact CD2-CD1 4.41Å; L60-L71 HydrophobicContact CD2-CB 4.12Å; L60-L71 HydrophobicContact CD2-CD1 3.8Å; L71-V82 HydrophobicContact CD2-CB 4.14Å; L71-V82 HydrophobicContact CD2-CG1 4.45Å; L71-V82 HydrophobicContact CD2-CG2 3.89Å; L71-V82 HydrophobicContact CG-CB 4.45Å; L71-V82 HydrophobicContact CG-CG2 3.99Å; L71-W87 HydrophobicContact CD2-CH2 3.26Å; L71-W87 HydrophobicContact CD2-CZ2 3.85Å; L71-W87 HydrophobicContact CD2-CZ3 3.9Å; L71-V95 HydrophobicContact CD1-CG1 3.76Å; L71-V95 HydrophobicContact CD1-CG2 4.26Å; L71-V95 HydrophobicContact CD2-CG2 3.74Å; L71-L134 HydrophobicContact CD2-CD2 3.86Å; L71-V153 HydrophobicContact CB-CG2 3.5Å; L71-V153 HydrophobicContact CD2-CG2 3.8Å; L71-V153 HydrophobicContact CG-CG2 4.26Å; L71-V153 PolarHBondContact N-O 3.01Å; L71-V155 HydrophobicContact CB-CG2 4.19Å; L71-V155 HydrophobicContact CD2-CG2 4.31Å
72	E	94.4	Very high	89.4	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.2	168.7	-64.7	178.5	-171.2	0	0	110.1	R59 V61 R70 W79 G80	R59-E72 HydrophobicContact CG-CB 3.96Å; R59-E72 IonicContact CZ-OE2 3.94Å; R59-E72 PolarHBondContact N-O 3.35Å; R59-E72 IonicContact NE-OE2 3.84Å; R59-E72 PolarHBondContact NE-OE2 2.88Å; R59-E72 IonicContact NH2-OE2 2.66Å; R59-E72 PolarHBondContact NH2-OE2 2.81Å; R59-E72 PolarHBondContact O-N 3.09Å; V61-E72 HydrophobicContact CG2-CG 4.23Å; R70-E72 IonicContact CZ-OE1 3.17Å; R70-E72 IonicContact NE-OE1 2.87Å; R70-E72 PolarHBondContact NE-OE1 2.59Å; R70-E72 IonicContact NH2-OE1 3.75Å; R70-E72 PolarHBondContact NH2-OE1 3.35Å; E72-W79 HydrophobicContact CB-CE3 4.01Å; E72-W79 WeakPolarHBondContact O-CZ3 2.97Å; E72-G80 CarbonylContact C-O 3.53Å; E72-G80 WeakPolarHBondContact CA-O 3.25Å
73	V	93.9	Very high	89.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.4	-179.9	60.3	0	0	0	0	110.3	P56 L58 G80 V82 L121 L122 W142	P56-V73 HydrophobicContact CB-CG2 3.98Å; P56-V73 HydrophobicContact CG-CG2 4.25Å; L58-V73 HydrophobicContact CD2-CB 3.81Å; L58-V73 HydrophobicContact CD2-CG2 3.74Å; V73-G80 PolarHBondContact N-O 3.21Å; V73-G80 PolarHBondContact O-N 2.98Å; V73-V82 HydrophobicContact CG1-CG2 4.03Å; V73-L121 HydrophobicContact CG1-CB 3.88Å; V73-L121 HydrophobicContact CG1-CD1 3.95Å; V73-L121 WeakPolarHBondContact O-CD1 3.5Å; V73-L122 HydrophobicContact CG1-CD1 4.08Å; V73-L122 HydrophobicContact CG1-CG 4.3Å; V73-W142 HydrophobicContact CG1-CZ3 4.14Å; V73-W142 HydrophobicContact CG2-CH2 4.1Å; V73-W142 HydrophobicContact CG2-CZ3 4.03Å
74	M	91	Very high	89.8	Confident	49 Å²	49	40.8 Å²	40.8	24%	0.241	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115.3	174.7	178	66.3	84.2	0	0	110.4	P56 E57 G77 S78 W79	P56-M74 WeakPolarHBondContact CB-O 3.36Å; E57-M74 HydrophobicContact CB-CB 3.98Å; E57-M74 WeakPolarHBondContact O-CB 3.49Å; E57-M74 PolarHBondContact O-N 3.08Å; M74-G77 VanDerWaalsContact SD-C 3.51Å; M74-S78 PolarHBondContact SD-N 3.33Å; M74-W79 HydrophobicContact CB-CD2 4.25Å; M74-W79 HydrophobicContact CB-CE3 4.04Å; M74-W79 HydrophobicContact CB-CH2 4.04Å; M74-W79 HydrophobicContact CB-CZ2 4.26Å; M74-W79 HydrophobicContact CB-CZ3 3.92Å; M74-W79 HydrophobicContact CE-CD2 3.95Å; M74-W79 HydrophobicContact CE-CG 4.07Å; M74-W79 HydrophobicContact CE-CZ2 3.81Å; M74-W79 HydrophobicContact SD-CG 4.5Å
75	H	89.3	Confident	89.9	Confident	69 Å²	69	37.5 Å²	37.5	32%	0.319	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.7	173.3	-170.8	81.1	0	0	0	111	G77 S78 L121 W142	H75-G77 PolarHBondContact O-N 3.18Å; H75-G77 VanDerWaalsContact O-N 3.07Å; H75-S78 PolarHBondContact N-O 3.47Å; H75-S78 PolarHBondContact O-N 2.77Å; H75-S78 PolarHBondContact O-OG 2.05Å; H75-L121 HydrophobicContact CB-CD1 3.98Å; H75-W142 HydrophobicContact CB-CD2 4.35Å; H75-W142 HydrophobicContact CB-CE3 3.71Å; H75-W142 HydrophobicContact CB-CH2 4.34Å; H75-W142 HydrophobicContact CB-CZ3 3.7Å; H75-W142 AromaticContact CD2-CD2 3.91Å; H75-W142 AromaticContact CD2-CG 3.96Å; H75-W142 AromaticContact CE1-CD1 3.55Å; H75-W142 AromaticContact CE1-CD2 3.45Å; H75-W142 VanDerWaalsContact CE1-CD2 3.45Å; H75-W142 AromaticContact CE1-CE2 3.4Å; H75-W142 AromaticContact CE1-CG 3.56Å; H75-W142 AromaticContact CE1-NE1 3.46Å; H75-W142 PolarHBondContact CE1-NE1 2.95Å; H75-W142 AromaticContact CG-CD2 3.62Å; H75-W142 AromaticContact CG-CE3 3.49Å; H75-W142 VanDerWaalsContact CG-CE3 3.49Å; H75-W142 AromaticContact CG-CZ3 3.83Å; H75-W142 AromaticContact ND1-CD2 3.32Å; H75-W142 VanDerWaalsContact ND1-CD2 3.32Å; H75-W142 AromaticContact ND1-CE2 3.3Å; H75-W142 VanDerWaalsContact ND1-CE2 3.3Å; H75-W142 AromaticContact ND1-CE3 3.56Å; H75-W142 AromaticContact ND1-CG 3.92Å; H75-W142 AromaticContact ND1-CH2 3.75Å; H75-W142 AromaticContact ND1-CZ2 3.53Å; H75-W142 AromaticContact ND1-CZ3 3.76Å; H75-W142 AromaticContact ND1-NE1 3.86Å; H75-W142 AromaticContact NE2-CD1 3.86Å; H75-W142 AromaticContact NE2-CD2 3.85Å; H75-W142 AromaticContact NE2-CG 3.61Å
76	G	83.7	Confident	89.7	Confident	79 Å²	79	40.9 Å²	40.9	81%	0.814	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	20.8	176.7	0	0	0	0	0	115.3
77	G	85.7	Confident	89.4	Confident	71 Å²	71	33.9 Å²	33.9	73%	0.732	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.1	5.1	-176.9	0	0	0	0	0	115.1	M74 H75	M74-G77 VanDerWaalsContact SD-C 3.51Å; H75-G77 PolarHBondContact O-N 3.18Å; H75-G77 VanDerWaalsContact O-N 3.07Å
78	S	89.3	Confident	88.7	Confident	57 Å²	57	36.4 Å²	36.4	40%	0.399	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145	174.6	53.3	0	0	0	0	112.4	M74 H75	M74-S78 PolarHBondContact SD-N 3.33Å; H75-S78 PolarHBondContact N-O 3.47Å; H75-S78 PolarHBondContact O-N 2.77Å; H75-S78 PolarHBondContact O-OG 2.05Å
79	W	94.4	Very high	88.1	Confident	59 Å²	59	33 Å²	33	22%	0.223	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	141.6	168.8	-69.2	98.9	0	0	0	110.3	E57 R59 E72 M74	E57-W79 HydrophobicContact CB-CH2 3.96Å; E57-W79 HydrophobicContact CG-CH2 3.92Å; E57-W79 HydrophobicContact CG-CZ2 4.45Å; E57-W79 VanDerWaalsContact O-CZ3 3.24Å; E57-W79 WeakPolarHBondContact O-CZ3 3.47Å; R59-W79 HydrophobicContact CB-CH2 4Å; R59-W79 HydrophobicContact CB-CZ3 4.04Å; R59-W79 HydrophobicContact CG-CD2 4.42Å; R59-W79 HydrophobicContact CG-CE3 3.83Å; R59-W79 HydrophobicContact CG-CH2 3.81Å; R59-W79 HydrophobicContact CG-CZ2 4.39Å; R59-W79 HydrophobicContact CG-CZ3 3.5Å; R59-W79 VanDerWaalsContact CG-CZ3 3.5Å; E72-W79 HydrophobicContact CB-CE3 4.01Å; E72-W79 WeakPolarHBondContact O-CZ3 2.97Å; M74-W79 HydrophobicContact CB-CD2 4.25Å; M74-W79 HydrophobicContact CB-CE3 4.04Å; M74-W79 HydrophobicContact CB-CH2 4.04Å; M74-W79 HydrophobicContact CB-CZ2 4.26Å; M74-W79 HydrophobicContact CB-CZ3 3.92Å; M74-W79 HydrophobicContact CE-CD2 3.95Å; M74-W79 HydrophobicContact CE-CG 4.07Å; M74-W79 HydrophobicContact CE-CZ2 3.81Å; M74-W79 HydrophobicContact SD-CG 4.5Å
80	G	94	Very high	87.7	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	163.4	169	0	0	0	0	0	111.7	E72 V73 P119 L121	E72-G80 CarbonylContact C-O 3.53Å; E72-G80 WeakPolarHBondContact CA-O 3.25Å; V73-G80 PolarHBondContact N-O 3.21Å; V73-G80 PolarHBondContact O-N 2.98Å; G80-P119 CarbonylContact C-O 3.48Å; G80-P119 WeakPolarHBondContact CA-O 3.18Å; G80-L121 VanDerWaalsContact CA-CD1 3.5Å; G80-L121 VanDerWaalsContact N-CD1 3.35Å
81	S	93.7	Very high	87.5	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	173.6	-178.6	56.5	0	0	0	0	112.1	P119 I120 L121 H149 D152	S81-P119 PolarHBondContact N-O 2.94Å; S81-I120 WeakPolarHBondContact OG-CG1 3.03Å; S81-L121 PolarHBondContact O-N 2.71Å; S81-H149 PolarHBondContact OG-CE1 3.17Å; S81-H149 PolarHBondContact OG-ND1 2.02Å; S81-D152 WeakPolarHBondContact CB-OD1 3.36Å; S81-D152 WeakPolarHBondContact CB-OD2 3.42Å; S81-D152 VanDerWaalsContact OG-CG 3.25Å; S81-D152 PolarHBondContact OG-OD1 3.1Å; S81-D152 PolarHBondContact OG-OD2 3.31Å
82	V	93.8	Very high	87.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.7	179.1	178.2	0	0	0	0	107.7	L71 V73 W87 L122 V125 D152 V153	L71-V82 HydrophobicContact CD2-CB 4.14Å; L71-V82 HydrophobicContact CD2-CG1 4.45Å; L71-V82 HydrophobicContact CD2-CG2 3.89Å; L71-V82 HydrophobicContact CG-CB 4.45Å; L71-V82 HydrophobicContact CG-CG2 3.99Å; V73-V82 HydrophobicContact CG1-CG2 4.03Å; V82-W87 HydrophobicContact CG1-CE3 3.85Å; V82-W87 HydrophobicContact CG1-CZ3 3.65Å; V82-L122 HydrophobicContact CB-CB 4.42Å; V82-L122 HydrophobicContact CG1-CB 3.92Å; V82-L122 HydrophobicContact CG2-CB 4.12Å; V82-L122 HydrophobicContact CG2-CD1 4.19Å; V82-V125 HydrophobicContact CG1-CG2 3.83Å; V82-D152 WeakPolarHBondContact O-CA 3.43Å; V82-V153 HydrophobicContact CB-CG2 3.85Å; V82-V153 HydrophobicContact CG1-CG2 4.12Å; V82-V153 PolarHBondContact O-N 3.25Å
83	C	90	Very high	86.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-73.2	151.6	178.4	-176.7	0	0	0	0	111.6	D85 I120 L122 D123 C147 E151 V153	C83-D85 PolarHBondContact SG-N 2.96Å; C83-D85 VanDerWaalsContact SG-N 3.44Å; C83-I120 HydrophobicContact CB-CG2 4.06Å; C83-L122 PolarHBondContact N-O 3.04Å; C83-D123 HydrophobicContact CB-CB 4.17Å; C83-D123 WeakPolarHBondContact CB-OD1 3.48Å; C83-D123 PolarHBondContact SG-OD1 2.91Å; C83-D123 VanDerWaalsContact SG-OD1 3.4Å; C83-C147 HydrophobicContact CB-CB 3.63Å; C83-C147 WeakPolarHBondContact CB-SG 3.35Å; C83-C147 WeakPolarHBondContact SG-CB 3.19Å; C83-C147 CovalentContact SG-SG 2Å; C83-C147 PolarHBondContact SG-SG 2.97Å; C83-E151 CarbonylContact C-O 3.42Å; C83-E151 WeakPolarHBondContact CA-O 3.32Å; C83-V153 VanDerWaalsContact C-CG1 3.47Å; C83-V153 WeakPolarHBondContact O-CG1 3.31Å
84	D	83.5	Confident	86.5	Confident	12 Å²	12	32.4 Å²	32.4	6%	0.064	21%	0.206	C	C	.	.			trans	-96.2	-0.3	-174.1	79.2	12	0	0	0	114	D86 W87 R109 E151 V153	D84-D86 PolarHBondContact O-N 3.07Å; D84-W87 HydrophobicContact CB-CB 4.47Å; D84-W87 WeakPolarHBondContact O-CB 3.33Å; D84-W87 PolarHBondContact O-N 2.71Å; D84-W87 VanDerWaalsContact O-N 3.16Å; D84-R109 PolarHBondContact O-NH2 2.72Å; D84-R109 IonicContact OD1-CZ 3.85Å; D84-R109 IonicContact OD1-NH1 3.85Å; D84-R109 PolarHBondContact OD1-NH1 3.3Å; D84-R109 IonicContact OD1-NH2 3.1Å; D84-R109 IonicContact OD2-CZ 2.98Å; D84-R109 IonicContact OD2-NE 3.99Å; D84-R109 PolarHBondContact OD2-NE 3.49Å; D84-R109 IonicContact OD2-NH1 2.75Å; D84-R109 PolarHBondContact OD2-NH1 2.66Å; D84-R109 IonicContact OD2-NH2 2.64Å; D84-E151 WeakPolarHBondContact CB-O 3.41Å; D84-E151 PolarHBondContact N-O 2.72Å; D84-E151 WeakPolarHBondContact OD1-CB 3.31Å; D84-E151 WeakPolarHBondContact OD2-CA 3.48Å; D84-V153 HydrophobicContact CB-CB 4.34Å; D84-V153 HydrophobicContact CB-CG1 3.33Å
85	D	83.3	Confident	86.6	Confident	41 Å²	41	30.1 Å²	30.1	22%	0.219	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	126.4	164	-77.3	-0.3	0	0	0	109.5	C83 W87 D123 N124 N146	C83-D85 PolarHBondContact SG-N 2.96Å; C83-D85 VanDerWaalsContact SG-N 3.44Å; D85-W87 PolarHBondContact O-N 2.87Å; D85-D123 WeakPolarHBondContact CB-OD1 3.32Å; D85-N124 WeakPolarHBondContact O-CA 3.4Å; D85-N146 PolarHBondContact OD2-ND2 3.04Å; D85-N146 VanDerWaalsContact OD2-ND2 3.08Å
86	D	80.1	Confident	86.6	Confident	115 Å²	115	26.8 Å²	26.8	62%	0.615	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	6.5	-174.9	-58.1	-30.6	0	0	0	116.1	D84 D88 N124	D84-D86 PolarHBondContact O-N 3.07Å; D86-D88 PolarHBondContact O-N 2.03Å; D86-N124 HydrophobicContact CB-CB 4.47Å; D86-N124 PolarHBondContact OD2-ND2 3.04Å
87	W	84.1	Confident	86.7	Confident	31 Å²	31	26.9 Å²	26.9	12%	0.117	15%	0.154	C	C	.	.			trans	-71.6	120.6	-178.5	-176.8	-81.4	0	0	0	112.1	L71 V82 D84 D85 D91 A92 V95 V125 L134 V153 V155	L71-W87 HydrophobicContact CD2-CH2 3.26Å; L71-W87 HydrophobicContact CD2-CZ2 3.85Å; L71-W87 HydrophobicContact CD2-CZ3 3.9Å; V82-W87 HydrophobicContact CG1-CE3 3.85Å; V82-W87 HydrophobicContact CG1-CZ3 3.65Å; D84-W87 HydrophobicContact CB-CB 4.47Å; D84-W87 WeakPolarHBondContact O-CB 3.33Å; D84-W87 PolarHBondContact O-N 2.71Å; D84-W87 VanDerWaalsContact O-N 3.16Å; D85-W87 PolarHBondContact O-N 2.87Å; W87-D91 WeakPolarHBondContact CA-OD2 3.41Å; W87-D91 HydrophobicContact CD2-CB 3.96Å; W87-D91 HydrophobicContact CE3-CB 3.93Å; W87-D91 HydrophobicContact CH2-CB 3.87Å; W87-D91 HydrophobicContact CZ2-CB 3.92Å; W87-D91 HydrophobicContact CZ3-CB 3.89Å; W87-A92 HydrophobicContact CZ2-CB 4.25Å; W87-V95 HydrophobicContact CH2-CG2 3.69Å; W87-V95 HydrophobicContact CZ2-CG2 4.09Å; W87-V125 HydrophobicContact CE3-CB 3.97Å; W87-V125 HydrophobicContact CE3-CG1 4.45Å; W87-V125 HydrophobicContact CE3-CG2 4.24Å; W87-V125 HydrophobicContact CZ3-CB 3.97Å; W87-V125 HydrophobicContact CZ3-CG1 4.06Å; W87-V125 HydrophobicContact CZ3-CG2 4.07Å; W87-L134 HydrophobicContact CH2-CD1 3.92Å; W87-L134 HydrophobicContact CH2-CD2 4.5Å; W87-L134 HydrophobicContact CZ3-CD1 4.03Å; W87-V153 HydrophobicContact CB-CG1 3.66Å; W87-V153 HydrophobicContact CD2-CB 3.92Å; W87-V153 HydrophobicContact CD2-CG1 3.45Å; W87-V153 VanDerWaalsContact CD2-CG1 3.45Å; W87-V153 HydrophobicContact CD2-CG2 4.05Å; W87-V153 HydrophobicContact CE3-CB 4.44Å; W87-V153 HydrophobicContact CE3-CG1 3.85Å; W87-V153 HydrophobicContact CE3-CG2 4.2Å; W87-V153 HydrophobicContact CG-CB 4.02Å; W87-V153 HydrophobicContact CG-CG1 3.33Å; W87-V153 HydrophobicContact CH2-CG2 4.32Å; W87-V153 HydrophobicContact CZ2-CG2 4.13Å; W87-V153 HydrophobicContact CZ3-CG2 4.34Å; W87-V155 HydrophobicContact CZ2-CG2 3.69Å
88	D	74.3	Confident	87	Confident	54 Å²	54	26 Å²	26	29%	0.289	13%	0.131	S	C	.	.			trans	-122.2	-172.4	-179.3	76	13	0	0	0	113.8	D86 V90 D91 A92	D86-D88 PolarHBondContact O-N 2.03Å; D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V90 VanDerWaalsContact OD1-CA 3.24Å; D88-V90 WeakPolarHBondContact OD1-CA 3.4Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.79Å; D88-D91 PolarHBondContact N-OD2 3.36Å; D88-D91 PolarHBondContact OD1-N 3.46Å; D88-A92 PolarHBondContact O-N 2.87Å
89	V	77.1	Confident	87	Confident	16 Å²	16	25.1 Å²	25.1	10%	0.097	12%	0.122	C	C	.	.	H	α-helix	trans	-78.6	-18.3	178.4	69.6	0	0	0	0	112.5	N93 A104 H276	V89-N93 WeakPolarHBondContact O-CB 3.24Å; V89-N93 VanDerWaalsContact O-CG 3.3Å; V89-N93 PolarHBondContact O-N 3.44Å; V89-N93 PolarHBondContact O-ND2 3.1Å; V89-A104 HydrophobicContact CG2-CB 3.84Å; V89-H276 WeakPolarHBondContact CG1-CE1 3.23Å; V89-H276 WeakPolarHBondContact CG1-O 3.39Å
90	V	79.8	Confident	86.7	Confident	11 Å²	11	24.9 Å²	24.9	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-46.6	169.3	-174.1	0	0	0	0	109.9	D88 N93 V94 C127 V275 H276 N277	D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V90 VanDerWaalsContact OD1-CA 3.24Å; D88-V90 WeakPolarHBondContact OD1-CA 3.4Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.79Å; V90-N93 WeakPolarHBondContact O-CB 2.9Å; V90-N93 PolarHBondContact O-N 2.83Å; V90-V94 PolarHBondContact O-N 3.4Å; V90-C127 HydrophobicContact CG1-CB 4.33Å; V90-V275 HydrophobicContact CG1-CG1 4.35Å; V90-H276 VanDerWaalsContact CG2-C 3.48Å; V90-H276 WeakPolarHBondContact CG2-O 3.39Å; V90-N277 HydrophobicContact CG2-CB 4.05Å
91	D	88.4	Confident	86.3	Confident	1 Å²	1	25 Å²	25	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-47	175.8	-56.4	-45.5	0	0	0	111.4	W87 D88 N93 V94 V95 V125 C127	W87-D91 WeakPolarHBondContact CA-OD2 3.41Å; W87-D91 HydrophobicContact CD2-CB 3.96Å; W87-D91 HydrophobicContact CE3-CB 3.93Å; W87-D91 HydrophobicContact CH2-CB 3.87Å; W87-D91 HydrophobicContact CZ2-CB 3.92Å; W87-D91 HydrophobicContact CZ3-CB 3.89Å; D88-D91 PolarHBondContact N-OD2 3.36Å; D88-D91 PolarHBondContact OD1-N 3.46Å; D91-N93 PolarHBondContact O-N 3.35Å; D91-V94 WeakPolarHBondContact O-CB 3.36Å; D91-V94 PolarHBondContact O-N 3.23Å; D91-V94 VanDerWaalsContact O-N 3.1Å; D91-V95 PolarHBondContact O-N 3.03Å; D91-V95 VanDerWaalsContact O-N 3.13Å; D91-V125 HydrophobicContact CB-CG1 4.41Å; D91-C127 WeakPolarHBondContact OD1-CB 3.02Å; D91-C127 PolarHBondContact OD1-N 2.86Å; D91-C127 PolarHBondContact OD1-SG 3.41Å
92	A	87.6	Confident	85.8	Confident	6 Å²	6	25 Å²	25	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-60.4	-35.6	177.8	0	0	0	0	0	112	W87 D88 V95 C96 A104 V155	W87-A92 HydrophobicContact CZ2-CB 4.25Å; D88-A92 PolarHBondContact O-N 2.87Å; A92-V95 WeakPolarHBondContact O-CB 3.31Å; A92-V95 PolarHBondContact O-N 3.21Å; A92-C96 WeakPolarHBondContact O-CB 3.48Å; A92-C96 PolarHBondContact O-N 3.25Å; A92-C96 PolarHBondContact O-SG 3.24Å; A92-C96 VanDerWaalsContact O-SG 3.32Å; A92-A104 HydrophobicContact CB-CB 3.52Å; A92-V155 HydrophobicContact CB-CG1 4.32Å; A92-V155 HydrophobicContact CB-CG2 4.48Å
93	N	84.1	Confident	85.3	Confident	6 Å²	6	25.5 Å²	25.5	3%	0.032	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-37.4	175.7	-87.6	-53.8	0	0	0	112.5	V89 V90 D91 V95 C96 R97 A104 G274	V89-N93 WeakPolarHBondContact O-CB 3.24Å; V89-N93 VanDerWaalsContact O-CG 3.3Å; V89-N93 PolarHBondContact O-N 3.44Å; V89-N93 PolarHBondContact O-ND2 3.1Å; V90-N93 WeakPolarHBondContact O-CB 2.9Å; V90-N93 PolarHBondContact O-N 2.83Å; D91-N93 PolarHBondContact O-N 3.35Å; N93-V95 VanDerWaalsContact C-N 3.33Å; N93-C96 PolarHBondContact O-N 2.88Å; N93-R97 VanDerWaalsContact O-CB 3.22Å; N93-R97 WeakPolarHBondContact O-CB 3.31Å; N93-R97 PolarHBondContact O-N 2.68Å; N93-A104 HydrophobicContact CB-CB 4.46Å; N93-A104 PolarHBondContact OD1-N 3.36Å; N93-G274 PolarHBondContact ND2-O 3.32Å
94	V	90	Very high	84.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-44.5	172.9	175.3	0	0	0	0	110.1	V90 D91 R97 Q98 C127 E131	V90-V94 PolarHBondContact O-N 3.4Å; D91-V94 WeakPolarHBondContact O-CB 3.36Å; D91-V94 PolarHBondContact O-N 3.23Å; D91-V94 VanDerWaalsContact O-N 3.1Å; V94-R97 PolarHBondContact O-N 3.45Å; V94-Q98 VanDerWaalsContact O-CB 3.29Å; V94-Q98 WeakPolarHBondContact O-CB 3.24Å; V94-Q98 PolarHBondContact O-N 3.31Å; V94-C127 HydrophobicContact CG2-CB 3.84Å; V94-E131 HydrophobicContact CG1-CB 4.1Å; V94-E131 HydrophobicContact CG2-CB 4.21Å
95	V	92.5	Very high	84.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-51.1	175.5	173.9	0	0	0	0	111.8	L58 L60 L71 W87 D91 A92 N93 R97 Q98 L99 L134 V155	L58-V95 HydrophobicContact CD1-CB 4.45Å; L58-V95 HydrophobicContact CD1-CG1 4.16Å; L58-V95 HydrophobicContact CD1-CG2 4.2Å; L60-V95 HydrophobicContact CD2-CG1 4.4Å; L71-V95 HydrophobicContact CD1-CG1 3.76Å; L71-V95 HydrophobicContact CD1-CG2 4.26Å; L71-V95 HydrophobicContact CD2-CG2 3.74Å; W87-V95 HydrophobicContact CH2-CG2 3.69Å; W87-V95 HydrophobicContact CZ2-CG2 4.09Å; D91-V95 PolarHBondContact O-N 3.03Å; D91-V95 VanDerWaalsContact O-N 3.13Å; A92-V95 WeakPolarHBondContact O-CB 3.31Å; A92-V95 PolarHBondContact O-N 3.21Å; N93-V95 VanDerWaalsContact C-N 3.33Å; V95-R97 VanDerWaalsContact C-N 3.29Å; V95-R97 PolarHBondContact O-N 3.23Å; V95-Q98 PolarHBondContact O-N 3.16Å; V95-L99 HydrophobicContact CG1-CD1 3.76Å; V95-L99 HydrophobicContact CG1-CG 4.38Å; V95-L99 WeakPolarHBondContact O-CB 3.22Å; V95-L99 WeakPolarHBondContact O-CG 3.29Å; V95-L99 PolarHBondContact O-N 3.34Å; V95-L134 HydrophobicContact CG2-CD1 3.84Å; V95-L134 HydrophobicContact CG2-CD2 4.1Å; V95-L134 HydrophobicContact CG2-CG 4.4Å; V95-V155 HydrophobicContact CB-CG1 4.42Å; V95-V155 HydrophobicContact CG1-CG1 4.05Å; V95-V155 HydrophobicContact CG1-CG2 4.33Å
96	C	88.8	Confident	83.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-38.5	-178.7	-70.4	0	0	0	0	111.8	A92 N93 G100 C101 G102 V155 C157	A92-C96 WeakPolarHBondContact O-CB 3.48Å; A92-C96 PolarHBondContact O-N 3.25Å; A92-C96 PolarHBondContact O-SG 3.24Å; A92-C96 VanDerWaalsContact O-SG 3.32Å; N93-C96 PolarHBondContact O-N 2.88Å; C96-G100 PolarHBondContact O-N 2.82Å; C96-G100 VanDerWaalsContact O-N 3.14Å; C96-C101 PolarHBondContact O-N 2.94Å; C96-G102 CarbonylContact C-O 3.57Å; C96-G102 VanDerWaalsContact CB-O 3.26Å; C96-G102 WeakPolarHBondContact CB-O 3.33Å; C96-V155 VanDerWaalsContact SG-CG1 3.56Å; C96-C157 WeakPolarHBondContact CA-SG 3.36Å; C96-C157 HydrophobicContact CB-CB 3.74Å; C96-C157 WeakPolarHBondContact CB-SG 3.48Å; C96-C157 VanDerWaalsContact SG-CA 3.51Å; C96-C157 WeakPolarHBondContact SG-CB 3.28Å; C96-C157 CovalentContact SG-SG 2.03Å; C96-C157 PolarHBondContact SG-SG 3.28Å
97	R	86.6	Confident	82.5	Confident	80 Å²	80	24 Å²	24	30%	0.302	14%	0.138	S	C	.	.	H	α-helix	trans	-65.7	-46.5	173	-178.4	169	63.3	-149.7	-5	111.8	N93 V94 V95 L99 G100 G129 Q130 E131	N93-R97 VanDerWaalsContact O-CB 3.22Å; N93-R97 WeakPolarHBondContact O-CB 3.31Å; N93-R97 PolarHBondContact O-N 2.68Å; V94-R97 PolarHBondContact O-N 3.45Å; V95-R97 VanDerWaalsContact C-N 3.29Å; V95-R97 PolarHBondContact O-N 3.23Å; R97-L99 VanDerWaalsContact C-N 3.28Å; R97-L99 PolarHBondContact O-N 2.76Å; R97-G100 PolarHBondContact O-N 3.49Å; R97-G129 PolarHBondContact NH1-O 2.95Å; R97-G129 PolarHBondContact NH2-O 3.21Å; R97-Q130 VanDerWaalsContact NH2-C 3.26Å; R97-E131 PolarHBondContact NH2-O 2.78Å
98	Q	91.2	Very high	80.6	Confident	52 Å²	52	27.3 Å²	27.3	24%	0.243	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-36.7	179.3	-174.8	177.9	-11.7	0	0	111.9	P56 L58 V94 V95 G100 A133	P56-Q98 PolarHBondContact O-NE2 2.83Å; L58-Q98 HydrophobicContact CD1-CB 4.31Å; L58-Q98 VanDerWaalsContact CD1-CD 3.44Å; L58-Q98 HydrophobicContact CD1-CG 4.18Å; V94-Q98 VanDerWaalsContact O-CB 3.29Å; V94-Q98 WeakPolarHBondContact O-CB 3.24Å; V94-Q98 PolarHBondContact O-N 3.31Å; V95-Q98 PolarHBondContact O-N 3.16Å; Q98-G100 VanDerWaalsContact C-N 3.29Å; Q98-G100 PolarHBondContact O-N 3.4Å; Q98-A133 HydrophobicContact CG-CB 4.4Å
99	L	90.6	Very high	79.4	Confident	39 Å²	39	31.9 Å²	31.9	20%	0.204	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-10.6	175.4	-67.1	173.5	0	0	0	113.7	L58 L60 V95 R97 C101	L58-L99 HydrophobicContact CB-CD2 3.9Å; L58-L99 HydrophobicContact CB-CG 4.48Å; L60-L99 HydrophobicContact CD1-CD1 3.76Å; L60-L99 HydrophobicContact CD2-CD1 4.3Å; L60-L99 HydrophobicContact CG-CD1 3.69Å; V95-L99 HydrophobicContact CG1-CD1 3.76Å; V95-L99 HydrophobicContact CG1-CG 4.38Å; V95-L99 WeakPolarHBondContact O-CB 3.22Å; V95-L99 WeakPolarHBondContact O-CG 3.29Å; V95-L99 PolarHBondContact O-N 3.34Å; R97-L99 VanDerWaalsContact C-N 3.28Å; R97-L99 PolarHBondContact O-N 2.76Å; L99-C101 VanDerWaalsContact C-N 3.32Å; L99-C101 HydrophobicContact CB-CB 4.24Å
100	G	86.6	Confident	77.9	Confident	54 Å²	54	37 Å²	37	56%	0.557	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	33.8	-173.8	0	0	0	0	0	112.9	C96 R97 Q98	C96-G100 PolarHBondContact O-N 2.82Å; C96-G100 VanDerWaalsContact O-N 3.14Å; R97-G100 PolarHBondContact O-N 3.49Å; Q98-G100 VanDerWaalsContact C-N 3.29Å; Q98-G100 PolarHBondContact O-N 3.4Å
101	C	87.4	Confident	76.4	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.02	23%	0.23	C	C	.	.			trans	-105.2	9.1	-173.8	-73.1	0	0	0	0	113.9	C67 C96 L99 C157 D158	C67-C101 WeakPolarHBondContact CA-SG 3.27Å; C67-C101 HydrophobicContact CB-CB 3.56Å; C67-C101 WeakPolarHBondContact CB-SG 2.96Å; C67-C101 WeakPolarHBondContact SG-CB 3.24Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 2.89Å; C96-C101 PolarHBondContact O-N 2.94Å; L99-C101 VanDerWaalsContact C-N 3.32Å; L99-C101 HydrophobicContact CB-CB 4.24Å; C101-C157 HydrophobicContact CB-CB 3.47Å; C101-C157 VanDerWaalsContact CB-CB 3.47Å; C101-C157 VanDerWaalsContact O-CB 3.3Å; C101-C157 WeakPolarHBondContact O-CB 3.42Å; C101-D158 CarbonylContact O-C 3.58Å; C101-D158 VanDerWaalsContact O-C 3.25Å; C101-D158 VanDerWaalsContact O-O 3.06Å
102	G	82.8	Confident	74.9	Confident	4 Å²	4	45 Å²	45	4%	0.041	27%	0.265	C	S	.	.			trans	88.2	-142.2	178.9	0	0	0	0	0	113.4	C96 L161	C96-G102 CarbonylContact C-O 3.57Å; C96-G102 VanDerWaalsContact CB-O 3.26Å; C96-G102 WeakPolarHBondContact CB-O 3.33Å; G102-L161 WeakPolarHBondContact CA-O 3.49Å
103	L	82	Confident	73.9	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.052	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	151.6	178.9	-65.5	-179.4	0	0	0	111.4	C157 D158 L161 T163 L252 W273	L103-C157 CarbonylContact O-C 3.4Å; L103-C157 WeakPolarHBondContact O-CA 3.11Å; L103-D158 PolarHBondContact O-N 3.27Å; L103-L161 HydrophobicContact CD1-CD1 3.58Å; L103-L161 HydrophobicContact CG-CB 4.47Å; L103-L161 HydrophobicContact CG-CD1 4.15Å; L103-T163 HydrophobicContact CD2-CG2 4.14Å; L103-L252 HydrophobicContact CD1-CD2 4.25Å; L103-W273 WeakPolarHBondContact CD2-O 3.32Å
104	A	81.4	Confident	73.1	Confident	3 Å²	3	48.2 Å²	48.2	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	142.9	171.5	0	0	0	0	0	110.8	V89 A92 N93 L156	V89-A104 HydrophobicContact CG2-CB 3.84Å; A92-A104 HydrophobicContact CB-CB 3.52Å; N93-A104 HydrophobicContact CB-CB 4.46Å; N93-A104 PolarHBondContact OD1-N 3.36Å; A104-L156 WeakPolarHBondContact CA-O 3.42Å
105	L	73.5	Confident	72.6	Confident	38 Å²	38	54.1 Å²	54.1	20%	0.199	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.8	165.6	-73.1	167.5	0	0	0	108.4	V107 L156 D158 H250	L105-V107 WeakPolarHBondContact O-CG2 3.02Å; L105-V107 PolarHBondContact O-N 2.89Å; L105-L156 HydrophobicContact CB-CB 4.23Å; L105-L156 PolarHBondContact N-O 2.74Å; L105-D158 HydrophobicContact CD1-CB 4.3Å; L105-D158 HydrophobicContact CG-CB 4.26Å; L105-H250 WeakPolarHBondContact CD2-CE1 3.28Å
106	P	65.8	Low	72	Confident	55 Å²	55	54.4 Å²	54.4	36%	0.357	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-60	126.6	171.2	23.3	-30.2	0	0	0	109	P108	P106-P108 VanDerWaalsContact O-CD 3.26Å; P106-P108 WeakPolarHBondContact O-CD 3.22Å
107	V	58.8	Low	71.5	Confident	41 Å²	41	65.5 Å²	65.5	25%	0.248	36%	0.363	C	S	.	.			trans	-102.5	104.3	-178.7	-169.5	0	0	0	0	107.7	L105 R109 L111 L156	L105-V107 WeakPolarHBondContact O-CG2 3.02Å; L105-V107 PolarHBondContact O-N 2.89Å; V107-R109 PolarHBondContact O-N 2.9Å; V107-R109 VanDerWaalsContact O-N 3.11Å; V107-L111 HydrophobicContact CG1-CB 4.26Å; V107-L111 HydrophobicContact CG1-CD1 4.09Å; V107-L156 HydrophobicContact CB-CD1 4.47Å; V107-L156 HydrophobicContact CG1-CD1 3.95Å; V107-L156 HydrophobicContact CG2-CB 4.05Å; V107-L156 HydrophobicContact CG2-CD1 3.64Å; V107-L156 HydrophobicContact CG2-CG 4.33Å
108	P	44.6	Very low	71.5	Confident	101 Å²	101	64.1 Å²	64.1	66%	0.656	37%	0.374	S	S	*	.			trans	-63.2	116	165.6	23.7	-28.8	0	0	0	107.5	P106	P106-P108 VanDerWaalsContact O-CD 3.26Å; P106-P108 WeakPolarHBondContact O-CD 3.22Å
109	R	47.5	Very low	71.6	Confident	149 Å²	149	64.4 Å²	64.4	56%	0.562	38%	0.38	S	S	*	.	S	Bend	trans	-58.9	131.4	169.2	-64.2	-169.8	-165.3	158.7	13.5	107.1	D84 V107	D84-R109 PolarHBondContact O-NH2 2.72Å; D84-R109 IonicContact OD1-CZ 3.85Å; D84-R109 IonicContact OD1-NH1 3.85Å; D84-R109 PolarHBondContact OD1-NH1 3.3Å; D84-R109 IonicContact OD1-NH2 3.1Å; D84-R109 IonicContact OD2-CZ 2.98Å; D84-R109 IonicContact OD2-NE 3.99Å; D84-R109 PolarHBondContact OD2-NE 3.49Å; D84-R109 IonicContact OD2-NH1 2.75Å; D84-R109 PolarHBondContact OD2-NH1 2.66Å; D84-R109 IonicContact OD2-NH2 2.64Å; V107-R109 PolarHBondContact O-N 2.9Å; V107-R109 VanDerWaalsContact O-N 3.11Å
110	P	46.7	Very low	71.6	Confident	124 Å²	124	62.9 Å²	62.9	81%	0.805	37%	0.372	S	S	*	.			cis	-127.9	88.7	32.3	35.7	-15.7	0	0	0	112.3	A112	P110-A112 PolarHBondContact O-N 2.95Å
111	L	47.8	Very low	72	Confident	88 Å²	88	61 Å²	61	46%	0.461	35%	0.349	S	S	.	.			trans	-88.8	85.6	165	-89.5	155.2	0	0	0	108.9	V107 F113 L156	V107-L111 HydrophobicContact CG1-CB 4.26Å; V107-L111 HydrophobicContact CG1-CD1 4.09Å; L111-F113 HydrophobicContact CB-CE2 4.41Å; L111-F113 PolarHBondContact O-N 2.94Å; L111-L156 HydrophobicContact CD1-CD2 4.48Å
112	A	57.2	Low	72.3	Confident	92 Å²	92	61 Å²	61	76%	0.76	35%	0.349	S	S	*	.			trans	-71.8	99.7	180	0	0	0	0	0	111	P110 G114	P110-A112 PolarHBondContact O-N 2.95Å; A112-G114 PolarHBondContact O-N 2.79Å
113	F	66.9	Low	72.7	Confident	35 Å²	35	60.8 Å²	60.8	15%	0.154	35%	0.347	C	S	.	.	S	Bend	trans	-77.3	28.1	163.6	-63.6	-70.7	0	0	0	112.5	R70 L111 A154 L156	R70-F113 HydrophobicContact CB-CB 4.22Å; R70-F113 PolarHBondContact NH1-O 2.88Å; L111-F113 HydrophobicContact CB-CE2 4.41Å; L111-F113 PolarHBondContact O-N 2.94Å; F113-A154 HydrophobicContact CD2-CB 3.74Å; F113-A154 HydrophobicContact CE2-CB 3.98Å; F113-L156 HydrophobicContact CE2-CD1 3.53Å; F113-L156 HydrophobicContact CZ-CD1 3.82Å; F113-L156 HydrophobicContact CZ-CG 4.45Å
114	G	66.2	Low	73	Confident	44 Å²	44	62.1 Å²	62.1	45%	0.454	35%	0.354	S	S	.	.			trans	78.2	158.3	-168.3	0	0	0	0	0	112.8	R70 A112	R70-G114 VanDerWaalsContact NH1-C 3.27Å; R70-G114 PolarHBondContact NH1-O 2.82Å; A112-G114 PolarHBondContact O-N 2.79Å
115	Q	80.1	Confident	73.5	Confident	124 Å²	124	62 Å²	62	58%	0.579	35%	0.353	S	S	*	.			trans	-74.8	147.1	168.9	-67.9	-177.8	-1.8	0	0	110	H149	Q115-H149 HydrophobicContact CB-CB 3.93Å; Q115-H149 HydrophobicContact CG-CB 4.43Å; Q115-H149 WeakPolarHBondContact CG-O 3.48Å
116	G	79.3	Confident	74.1	Confident	7 Å²	7	67.4 Å²	67.4	7%	0.072	38%	0.378	C	S	.	.			trans	-61.6	168.6	171.9	0	0	0	0	0	112.5	D152	G116-D152 WeakPolarHBondContact CA-OD2 3.5Å; G116-D152 PolarHBondContact N-OD2 3.07Å
117	R	79.8	Confident	75.1	Confident	232 Å²	232	65.3 Å²	65.3	88%	0.875	36%	0.364	S	S	*	.			trans	-134.2	125.9	172.7	-64.3	-177.9	179.3	-176.1	-0.8	107.7
118	G	86.3	Confident	76.2	Confident	52 Å²	52	73.4 Å²	73.4	54%	0.536	39%	0.391	S	S	.	.	S	Bend	trans	112.8	-149.5	177.3	0	0	0	0	0	111.7	H149	G118-H149 PolarHBondContact O-CE1 2.75Å; G118-H149 VanDerWaalsContact O-CE1 3.25Å; G118-H149 PolarHBondContact O-NE2 3.14Å
119	P	92.1	Very high	77.6	Confident	57 Å²	57	68.7 Å²	68.7	37%	0.37	36%	0.36	S	S	.	.			trans	-75.2	147.8	179.7	30.8	-33	0	0	0	111.6	G80 S81 L121	G80-P119 CarbonylContact C-O 3.48Å; G80-P119 WeakPolarHBondContact CA-O 3.18Å; S81-P119 PolarHBondContact N-O 2.94Å; P119-L121 HydrophobicContact CB-CD2 4.04Å; P119-L121 HydrophobicContact CB-CG 4.34Å; P119-L121 HydrophobicContact CG-CD2 4.03Å; P119-L121 HydrophobicContact CG-CG 4.18Å
120	I	92.2	Very high	79	Confident	7 Å²	7	69 Å²	69	4%	0.036	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.1	158.7	-61.7	161.1	0	0	0	105.5	S81 C83 H145 C147	S81-I120 WeakPolarHBondContact OG-CG1 3.03Å; C83-I120 HydrophobicContact CB-CG2 4.06Å; I120-H145 HydrophobicContact CG2-CB 4.26Å; I120-H145 PolarHBondContact O-CD2 3.32Å; I120-C147 HydrophobicContact CD1-CB 4.21Å; I120-C147 VanDerWaalsContact CD1-O 3.31Å; I120-C147 WeakPolarHBondContact CD1-O 3.37Å
121	L	94.4	Very high	81.1	Confident	14 Å²	14	64.2 Å²	64.2	7%	0.073	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-26.9	-166.9	-73.6	175.9	0	0	0	113.9	V73 H75 G80 S81 P119 W142 G143	V73-L121 HydrophobicContact CG1-CB 3.88Å; V73-L121 HydrophobicContact CG1-CD1 3.95Å; V73-L121 WeakPolarHBondContact O-CD1 3.5Å; H75-L121 HydrophobicContact CB-CD1 3.98Å; G80-L121 VanDerWaalsContact CA-CD1 3.5Å; G80-L121 VanDerWaalsContact N-CD1 3.35Å; S81-L121 PolarHBondContact O-N 2.71Å; P119-L121 HydrophobicContact CB-CD2 4.04Å; P119-L121 HydrophobicContact CB-CG 4.34Å; P119-L121 HydrophobicContact CG-CD2 4.03Å; P119-L121 HydrophobicContact CG-CG 4.18Å; L121-W142 HydrophobicContact CB-CE3 4.28Å; L121-W142 WeakPolarHBondContact O-CA 3.26Å; L121-G143 PolarHBondContact O-N 3.3Å
122	L	94	Very high	82.8	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.8	-179.9	-66.2	174.9	0	0	0	109.3	V73 V82 C83 V125 L134 W142	V73-L122 HydrophobicContact CG1-CD1 4.08Å; V73-L122 HydrophobicContact CG1-CG 4.3Å; V82-L122 HydrophobicContact CB-CB 4.42Å; V82-L122 HydrophobicContact CG1-CB 3.92Å; V82-L122 HydrophobicContact CG2-CB 4.12Å; V82-L122 HydrophobicContact CG2-CD1 4.19Å; C83-L122 PolarHBondContact N-O 3.04Å; L122-V125 HydrophobicContact CB-CG2 3.87Å; L122-V125 HydrophobicContact CD1-CG2 4.46Å; L122-L134 HydrophobicContact CD1-CD2 3.97Å; L122-L134 HydrophobicContact CD1-CG 4.33Å; L122-W142 HydrophobicContact CD1-CH2 4.41Å; L122-W142 HydrophobicContact CD1-CZ3 4.15Å; L122-W142 HydrophobicContact CD2-CD2 4.24Å; L122-W142 HydrophobicContact CD2-CE3 3.76Å; L122-W142 HydrophobicContact CD2-CH2 4.13Å; L122-W142 HydrophobicContact CD2-CZ3 3.71Å; L122-W142 HydrophobicContact CG-CE3 4.22Å; L122-W142 HydrophobicContact CG-CZ3 3.88Å
123	D	91.3	Very high	84.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.			trans	-150	147.1	-177.9	-173.2	24.5	0	0	0	109.5	C83 D85 V125 R140 V144 H145 N146 C147	C83-D123 HydrophobicContact CB-CB 4.17Å; C83-D123 WeakPolarHBondContact CB-OD1 3.48Å; C83-D123 PolarHBondContact SG-OD1 2.91Å; C83-D123 VanDerWaalsContact SG-OD1 3.4Å; D85-D123 WeakPolarHBondContact CB-OD1 3.32Å; D123-V125 VanDerWaalsContact C-N 3.33Å; D123-V125 PolarHBondContact O-N 3.07Å; D123-R140 PolarHBondContact O-N 2.69Å; D123-R140 VanDerWaalsContact O-N 3.14Å; D123-R140 IonicContact OD2-NH1 3.83Å; D123-V144 WeakPolarHBondContact CB-O 3.39Å; D123-H145 HydrophobicContact CB-CB 3.59Å; D123-H145 WeakPolarHBondContact OD2-CA 3.49Å; D123-N146 PolarHBondContact OD2-N 3.49Å; D123-C147 PolarHBondContact OD1-SG 3.3Å
124	N	87.4	Confident	85.6	Confident	37 Å²	37	56.9 Å²	56.9	20%	0.198	29%	0.293	C	S	.	.	S	Bend	trans	43	59.3	-169.3	-55.4	67.5	0	0	0	110.8	D85 D86 E126 S139 R140	D85-N124 WeakPolarHBondContact O-CA 3.4Å; D86-N124 HydrophobicContact CB-CB 4.47Å; D86-N124 PolarHBondContact OD2-ND2 3.04Å; N124-E126 PolarHBondContact O-N 2.87Å; N124-S139 WeakPolarHBondContact O-CA 3.07Å; N124-R140 HydrophobicContact CB-CG 4.09Å; N124-R140 WeakPolarHBondContact OD1-CD 3.49Å; N124-R140 PolarHBondContact OD1-NH1 3.35Å
125	V	91	Very high	86.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	29%	0.286	C	S	.	.			trans	-69.5	128.3	176.1	179.8	0	0	0	0	107.7	V82 W87 D91 L122 D123 L134 C137 G138	V82-V125 HydrophobicContact CG1-CG2 3.83Å; W87-V125 HydrophobicContact CE3-CB 3.97Å; W87-V125 HydrophobicContact CE3-CG1 4.45Å; W87-V125 HydrophobicContact CE3-CG2 4.24Å; W87-V125 HydrophobicContact CZ3-CB 3.97Å; W87-V125 HydrophobicContact CZ3-CG1 4.06Å; W87-V125 HydrophobicContact CZ3-CG2 4.07Å; D91-V125 HydrophobicContact CB-CG1 4.41Å; L122-V125 HydrophobicContact CB-CG2 3.87Å; L122-V125 HydrophobicContact CD1-CG2 4.46Å; D123-V125 VanDerWaalsContact C-N 3.33Å; D123-V125 PolarHBondContact O-N 3.07Å; V125-L134 HydrophobicContact CG1-CD1 3.8Å; V125-C137 HydrophobicContact CG1-CB 4Å; V125-G138 WeakPolarHBondContact CA-O 3.43Å
126	E	87.3	Confident	87.2	Confident	151 Å²	151	55.7 Å²	55.7	71%	0.706	28%	0.28	S	S	*	.	B	Isolated β-bridge	trans	-132.5	94.1	-178.3	-168.5	-176.8	-167.8	0	0	109.1	N124 G138	N124-E126 PolarHBondContact O-N 2.87Å; E126-G138 PolarHBondContact N-O 2.96Å; E126-G138 PolarHBondContact O-N 3.48Å
127	C	87.3	Confident	87.7	Confident	12 Å²	12	55.9 Å²	55.9	8%	0.081	28%	0.28	C	S	.	.			trans	-90.5	153.1	174	-61.1	0	0	0	0	111.5	V90 D91 V94 C137	V90-C127 HydrophobicContact CG1-CB 4.33Å; D91-C127 WeakPolarHBondContact OD1-CB 3.02Å; D91-C127 PolarHBondContact OD1-N 2.86Å; D91-C127 PolarHBondContact OD1-SG 3.41Å; V94-C127 HydrophobicContact CG2-CB 3.84Å; C127-C137 HydrophobicContact CB-CB 3.96Å; C127-C137 WeakPolarHBondContact CB-SG 3.41Å; C127-C137 WeakPolarHBondContact SG-CB 3.01Å; C127-C137 CovalentContact SG-SG 2.03Å; C127-C137 PolarHBondContact SG-SG 3.03Å
128	R	80.2	Confident	88.3	Confident	211 Å²	211	46.6 Å²	46.6	80%	0.796	26%	0.256	S	S	*	.			trans	-94.6	-1.6	170.1	-57.4	179.4	179	-174.8	-1.5	112.8	Q130 E131	R128-Q130 VanDerWaalsContact C-N 3.32Å; R128-Q130 PolarHBondContact O-N 2.95Å; R128-E131 VanDerWaalsContact CB-OE1 3.31Å; R128-E131 WeakPolarHBondContact CB-OE1 3.45Å; R128-E131 VanDerWaalsContact N-CD 3.27Å; R128-E131 PolarHBondContact N-OE1 3.25Å; R128-E131 PolarHBondContact N-OE2 2.74Å; R128-E131 VanDerWaalsContact N-OE2 3.09Å
129	G	75.7	Confident	88.6	Confident	2 Å²	2	46.6 Å²	46.6	2%	0.021	25%	0.248	C	C	.	.	S	Bend	trans	84.2	-2.8	179.6	0	0	0	0	0	115	R97 E131	R97-G129 PolarHBondContact NH1-O 2.95Å; R97-G129 PolarHBondContact NH2-O 3.21Å; G129-E131 PolarHBondContact N-OE2 2.86Å
130	Q	77	Confident	88.4	Confident	155 Å²	155	50 Å²	50	72%	0.724	25%	0.254	S	S	*	.			trans	-105.5	-8.5	-178.8	-62.6	-175.4	13	0	0	113.5	R97 R128	R97-Q130 VanDerWaalsContact NH2-C 3.26Å; R128-Q130 VanDerWaalsContact C-N 3.32Å; R128-Q130 PolarHBondContact O-N 2.95Å
131	E	88.8	Confident	88.2	Confident	24 Å²	24	50.8 Å²	50.8	11%	0.112	26%	0.264	C	S	.	.			trans	-63.9	137.4	-176.7	-66.3	81	-176.9	0	0	112.3	V94 R97 R128 G129 A133 E136	V94-E131 HydrophobicContact CG1-CB 4.1Å; V94-E131 HydrophobicContact CG2-CB 4.21Å; R97-E131 PolarHBondContact NH2-O 2.78Å; R128-E131 VanDerWaalsContact CB-OE1 3.31Å; R128-E131 WeakPolarHBondContact CB-OE1 3.45Å; R128-E131 VanDerWaalsContact N-CD 3.27Å; R128-E131 PolarHBondContact N-OE1 3.25Å; R128-E131 PolarHBondContact N-OE2 2.74Å; R128-E131 VanDerWaalsContact N-OE2 3.09Å; G129-E131 PolarHBondContact N-OE2 2.86Å; E131-A133 VanDerWaalsContact C-N 3.26Å; E131-A133 PolarHBondContact O-N 3.23Å; E131-E136 HydrophobicContact CB-CB 4.14Å; E131-E136 HydrophobicContact CG-CB 4.07Å
132	A	85.3	Confident	88	Confident	56 Å²	56	54.6 Å²	54.6	46%	0.463	28%	0.278	S	S	.	.	S	Bend	trans	-73.7	-24.8	178.9	0	0	0	0	0	112	F55 E136	F55-A132 HydrophobicContact CZ-CB 4.47Å; A132-E136 PolarHBondContact N-OE2 3.39Å
133	A	89.9	Confident	87.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-148.7	152.9	-179.4	0	0	0	0	0	112.4	F55 Q98 E131 S135 E136	F55-A133 HydrophobicContact CB-CB 3.69Å; F55-A133 HydrophobicContact CD1-CB 3.51Å; F55-A133 HydrophobicContact CD2-CB 3.91Å; F55-A133 HydrophobicContact CE1-CB 4.11Å; F55-A133 HydrophobicContact CE2-CB 4.44Å; F55-A133 HydrophobicContact CG-CB 3.4Å; Q98-A133 HydrophobicContact CG-CB 4.4Å; E131-A133 VanDerWaalsContact C-N 3.26Å; E131-A133 PolarHBondContact O-N 3.23Å; A133-S135 PolarHBondContact O-N 2.93Å; A133-S135 VanDerWaalsContact O-N 3.14Å; A133-E136 WeakPolarHBondContact O-CB 3.08Å; A133-E136 PolarHBondContact O-N 3.06Å
134	L	92.5	Very high	87.8	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.026	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-56.6	-31.2	179.5	-169.7	68.5	0	0	0	113.1	L58 L71 W87 V95 L122 V125 E136 C137	L58-L134 HydrophobicContact CD1-CB 4.09Å; L58-L134 HydrophobicContact CD1-CD2 4.41Å; L58-L134 HydrophobicContact CD2-CB 4.49Å; L58-L134 HydrophobicContact CD2-CD2 4.05Å; L71-L134 HydrophobicContact CD2-CD2 3.86Å; W87-L134 HydrophobicContact CH2-CD1 3.92Å; W87-L134 HydrophobicContact CH2-CD2 4.5Å; W87-L134 HydrophobicContact CZ3-CD1 4.03Å; V95-L134 HydrophobicContact CG2-CD1 3.84Å; V95-L134 HydrophobicContact CG2-CD2 4.1Å; V95-L134 HydrophobicContact CG2-CG 4.4Å; L122-L134 HydrophobicContact CD1-CD2 3.97Å; L122-L134 HydrophobicContact CD1-CG 4.33Å; V125-L134 HydrophobicContact CG1-CD1 3.8Å; L134-E136 PolarHBondContact O-N 2.99Å; L134-C137 WeakPolarHBondContact O-CB 3.1Å; L134-C137 PolarHBondContact O-N 3.1Å; L134-C137 VanDerWaalsContact O-N 3.16Å
135	S	88.8	Confident	87.9	Confident	43 Å²	43	61.9 Å²	61.9	30%	0.301	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-69.3	-11.8	178.3	59.2	0	0	0	0	114.8	P56 A133	P56-S135 VanDerWaalsContact CD-OG 3.31Å; P56-S135 WeakPolarHBondContact CD-OG 3.37Å; P56-S135 VanDerWaalsContact CG-CB 3.47Å; A133-S135 PolarHBondContact O-N 2.93Å; A133-S135 VanDerWaalsContact O-N 3.14Å
136	E	90.1	Very high	87.6	Confident	99 Å²	99	66 Å²	66	46%	0.463	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-88.9	-13	175.3	-59.1	-179.6	160.2	0	0	112.1	F55 E131 A132 A133 L134	F55-E136 HydrophobicContact CE1-CG 4.09Å; F55-E136 WeakPolarHBondContact CE1-OE1 3.48Å; F55-E136 WeakPolarHBondContact CZ-OE1 3.43Å; E131-E136 HydrophobicContact CB-CB 4.14Å; E131-E136 HydrophobicContact CG-CB 4.07Å; A132-E136 PolarHBondContact N-OE2 3.39Å; A133-E136 WeakPolarHBondContact O-CB 3.08Å; A133-E136 PolarHBondContact O-N 3.06Å; L134-E136 PolarHBondContact O-N 2.99Å
137	C	91.3	Very high	87.4	Confident	12 Å²	12	59 Å²	59	8%	0.081	32%	0.316	C	S	.	.	S	Bend	trans	-74.2	158.5	177.8	-55.5	0	0	0	0	111.6	V125 C127 L134	V125-C137 HydrophobicContact CG1-CB 4Å; C127-C137 HydrophobicContact CB-CB 3.96Å; C127-C137 WeakPolarHBondContact CB-SG 3.41Å; C127-C137 WeakPolarHBondContact SG-CB 3.01Å; C127-C137 CovalentContact SG-SG 2.03Å; C127-C137 PolarHBondContact SG-SG 3.03Å; L134-C137 WeakPolarHBondContact O-CB 3.1Å; L134-C137 PolarHBondContact O-N 3.1Å; L134-C137 VanDerWaalsContact O-N 3.16Å
138	G	91.9	Very high	87.1	Confident	36 Å²	36	64.5 Å²	64.5	37%	0.371	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-60.2	145.4	169.8	0	0	0	0	0	110.7	V125 E126	V125-G138 WeakPolarHBondContact CA-O 3.43Å; E126-G138 PolarHBondContact N-O 2.96Å; E126-G138 PolarHBondContact O-N 3.48Å
139	S	92.5	Very high	87.3	Confident	52 Å²	52	56.6 Å²	56.6	36%	0.364	31%	0.31	S	S	.	.			trans	-160.2	168.7	168.9	61.3	0	0	0	0	109.8	N124 G141	N124-S139 WeakPolarHBondContact O-CA 3.07Å; S139-G141 PolarHBondContact O-N 2.93Å; S139-G141 VanDerWaalsContact O-N 3.16Å
140	R	87.6	Confident	87.3	Confident	128 Å²	128	63.6 Å²	63.6	48%	0.483	34%	0.338	S	S	.	.	S	Bend	trans	-71.4	-3.3	175.8	-66.4	175.9	80.9	168.6	5.2	114.3	D123 N124 V144 N146	D123-R140 PolarHBondContact O-N 2.69Å; D123-R140 VanDerWaalsContact O-N 3.14Å; D123-R140 IonicContact OD2-NH1 3.83Å; N124-R140 HydrophobicContact CB-CG 4.09Å; N124-R140 WeakPolarHBondContact OD1-CD 3.49Å; N124-R140 PolarHBondContact OD1-NH1 3.35Å; R140-V144 HydrophobicContact CB-CB 4.45Å; R140-V144 HydrophobicContact CB-CG1 4.27Å; R140-N146 PolarHBondContact NH1-OD1 3.24Å
141	G	87.2	Confident	87.5	Confident	25 Å²	25	57.8 Å²	57.8	26%	0.258	31%	0.31	S	S	.	.			trans	100.8	159.5	-176.5	0	0	0	0	0	112.7	S139 G143 V144	S139-G141 PolarHBondContact O-N 2.93Å; S139-G141 VanDerWaalsContact O-N 3.16Å; G141-G143 PolarHBondContact O-N 3.49Å; G141-V144 PolarHBondContact O-N 3.09Å
142	W	91.4	Very high	87.4	Confident	94 Å²	94	57.5 Å²	57.5	36%	0.356	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	119.9	-172.3	-62.2	101.1	0	0	0	112.9	P56 V73 H75 L121 L122 V144	P56-W142 HydrophobicContact CG-CH2 4.15Å; V73-W142 HydrophobicContact CG1-CZ3 4.14Å; V73-W142 HydrophobicContact CG2-CH2 4.1Å; V73-W142 HydrophobicContact CG2-CZ3 4.03Å; H75-W142 HydrophobicContact CB-CD2 4.35Å; H75-W142 HydrophobicContact CB-CE3 3.71Å; H75-W142 HydrophobicContact CB-CH2 4.34Å; H75-W142 HydrophobicContact CB-CZ3 3.7Å; H75-W142 AromaticContact CD2-CD2 3.91Å; H75-W142 AromaticContact CD2-CG 3.96Å; H75-W142 AromaticContact CE1-CD1 3.55Å; H75-W142 AromaticContact CE1-CD2 3.45Å; H75-W142 VanDerWaalsContact CE1-CD2 3.45Å; H75-W142 AromaticContact CE1-CE2 3.4Å; H75-W142 AromaticContact CE1-CG 3.56Å; H75-W142 AromaticContact CE1-NE1 3.46Å; H75-W142 PolarHBondContact CE1-NE1 2.95Å; H75-W142 AromaticContact CG-CD2 3.62Å; H75-W142 AromaticContact CG-CE3 3.49Å; H75-W142 VanDerWaalsContact CG-CE3 3.49Å; H75-W142 AromaticContact CG-CZ3 3.83Å; H75-W142 AromaticContact ND1-CD2 3.32Å; H75-W142 VanDerWaalsContact ND1-CD2 3.32Å; H75-W142 AromaticContact ND1-CE2 3.3Å; H75-W142 VanDerWaalsContact ND1-CE2 3.3Å; H75-W142 AromaticContact ND1-CE3 3.56Å; H75-W142 AromaticContact ND1-CG 3.92Å; H75-W142 AromaticContact ND1-CH2 3.75Å; H75-W142 AromaticContact ND1-CZ2 3.53Å; H75-W142 AromaticContact ND1-CZ3 3.76Å; H75-W142 AromaticContact ND1-NE1 3.86Å; H75-W142 AromaticContact NE2-CD1 3.86Å; H75-W142 AromaticContact NE2-CD2 3.85Å; H75-W142 AromaticContact NE2-CG 3.61Å; L121-W142 HydrophobicContact CB-CE3 4.28Å; L121-W142 WeakPolarHBondContact O-CA 3.26Å; L122-W142 HydrophobicContact CD1-CH2 4.41Å; L122-W142 HydrophobicContact CD1-CZ3 4.15Å; L122-W142 HydrophobicContact CD2-CD2 4.24Å; L122-W142 HydrophobicContact CD2-CE3 3.76Å; L122-W142 HydrophobicContact CD2-CH2 4.13Å; L122-W142 HydrophobicContact CD2-CZ3 3.71Å; L122-W142 HydrophobicContact CG-CE3 4.22Å; L122-W142 HydrophobicContact CG-CZ3 3.88Å; W142-V144 PolarHBondContact O-N 2.89Å
143	G	88.8	Confident	87.5	Confident	40 Å²	40	55 Å²	55	41%	0.412	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	11.6	177.8	0	0	0	0	0	114.9	L121 G141	L121-G143 PolarHBondContact O-N 3.3Å; G141-G143 PolarHBondContact O-N 3.49Å
144	V	91.5	Very high	87.4	Confident	79 Å²	79	56.1 Å²	56.1	48%	0.479	30%	0.298	S	S	.	.			trans	-98	106.4	173	-179.5	0	0	0	0	107.7	D123 R140 G141 W142	D123-V144 WeakPolarHBondContact CB-O 3.39Å; R140-V144 HydrophobicContact CB-CB 4.45Å; R140-V144 HydrophobicContact CB-CG1 4.27Å; G141-V144 PolarHBondContact O-N 3.09Å; W142-V144 PolarHBondContact O-N 2.89Å
145	H	89.6	Confident	87.2	Confident	74 Å²	74	55.9 Å²	55.9	34%	0.343	30%	0.296	S	S	.	.			trans	-152.2	157.4	-178.8	66.4	89.4	0	0	0	112.1	I120 D123 C147	I120-H145 HydrophobicContact CG2-CB 4.26Å; I120-H145 PolarHBondContact O-CD2 3.32Å; D123-H145 HydrophobicContact CB-CB 3.59Å; D123-H145 WeakPolarHBondContact OD2-CA 3.49Å; H145-C147 PolarHBondContact CE1-O 3.16Å; H145-C147 VanDerWaalsContact CE1-O 3.24Å; H145-C147 PolarHBondContact ND1-N 2.05Å; H145-C147 PolarHBondContact ND1-O 2.85Å
146	N	84.6	Confident	87.1	Confident	87 Å²	87	55 Å²	55	47%	0.465	29%	0.289	S	S	.	.	S	Bend	trans	-102.1	4.8	165.2	49.1	-87.6	0	0	0	113.6	D85 D123 R140	D85-N146 PolarHBondContact OD2-ND2 3.04Å; D85-N146 VanDerWaalsContact OD2-ND2 3.08Å; D123-N146 PolarHBondContact OD2-N 3.49Å; R140-N146 PolarHBondContact NH1-OD1 3.24Å
147	C	84.3	Confident	86.8	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.034	27%	0.267	C	S	.	.			trans	-88.8	164.5	-169.9	-44.6	0	0	0	0	114.9	C83 I120 D123 H145 E151	C83-C147 HydrophobicContact CB-CB 3.63Å; C83-C147 WeakPolarHBondContact CB-SG 3.35Å; C83-C147 WeakPolarHBondContact SG-CB 3.19Å; C83-C147 CovalentContact SG-SG 2Å; C83-C147 PolarHBondContact SG-SG 2.97Å; I120-C147 HydrophobicContact CD1-CB 4.21Å; I120-C147 VanDerWaalsContact CD1-O 3.31Å; I120-C147 WeakPolarHBondContact CD1-O 3.37Å; D123-C147 PolarHBondContact OD1-SG 3.3Å; H145-C147 PolarHBondContact CE1-O 3.16Å; H145-C147 VanDerWaalsContact CE1-O 3.24Å; H145-C147 PolarHBondContact ND1-N 2.05Å; H145-C147 PolarHBondContact ND1-O 2.85Å; C147-E151 WeakPolarHBondContact CA-OE2 3.06Å; C147-E151 HydrophobicContact CB-CB 4.12Å
148	F	80.4	Confident	86.2	Confident	127 Å²	127	50.8 Å²	50.8	56%	0.557	27%	0.268	S	S	*	.			trans	-118.7	163.6	170.3	-59.7	-87.3	0	0	0	110.1	Y150 E151	F148-Y150 HydrophobicContact CB-CD1 3.59Å; F148-Y150 HydrophobicContact CB-CE1 3.31Å; F148-Y150 AromaticContact CD2-CE1 3.75Å; F148-Y150 HydrophobicContact CD2-CE1 3.75Å; F148-Y150 AromaticContact CD2-CZ 3.92Å; F148-Y150 HydrophobicContact CG-CD1 4.44Å; F148-Y150 AromaticContact CG-CE1 3.72Å; F148-Y150 HydrophobicContact CG-CE1 3.72Å; F148-Y150 PolarHBondContact O-N 3.25Å; F148-E151 PolarHBondContact N-OE2 3.43Å; F148-E151 WeakPolarHBondContact O-CA 3.23Å; F148-E151 VanDerWaalsContact O-CB 3.32Å; F148-E151 WeakPolarHBondContact O-CB 3.33Å; F148-E151 PolarHBondContact O-N 3.3Å
149	H	83.3	Confident	85.1	Confident	45 Å²	45	54.3 Å²	54.3	21%	0.208	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-66.4	-7.7	-174.2	-72.3	-55.9	0	0	0	116.3	S81 Q115 G118 D152	S81-H149 PolarHBondContact OG-CE1 3.17Å; S81-H149 PolarHBondContact OG-ND1 2.02Å; Q115-H149 HydrophobicContact CB-CB 3.93Å; Q115-H149 HydrophobicContact CG-CB 4.43Å; Q115-H149 WeakPolarHBondContact CG-O 3.48Å; G118-H149 PolarHBondContact O-CE1 2.75Å; G118-H149 VanDerWaalsContact O-CE1 3.25Å; G118-H149 PolarHBondContact O-NE2 3.14Å; H149-D152 IonicContact CG-OD2 3.44Å; H149-D152 IonicContact ND1-OD1 3.21Å; H149-D152 PolarHBondContact ND1-OD1 3.01Å; H149-D152 IonicContact ND1-OD2 2.79Å; H149-D152 PolarHBondContact ND1-OD2 3.41Å; H149-D152 VanDerWaalsContact ND1-OD2 3.08Å; H149-D152 PolarHBondContact O-N 2.01Å
150	Y	76.8	Confident	83.4	Confident	150 Å²	150	59.5 Å²	59.5	59%	0.588	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-74.8	-14.9	169	64.5	-99.3	0	0	0	112.3	F148	F148-Y150 HydrophobicContact CB-CD1 3.59Å; F148-Y150 HydrophobicContact CB-CE1 3.31Å; F148-Y150 AromaticContact CD2-CE1 3.75Å; F148-Y150 HydrophobicContact CD2-CE1 3.75Å; F148-Y150 AromaticContact CD2-CZ 3.92Å; F148-Y150 HydrophobicContact CG-CD1 4.44Å; F148-Y150 AromaticContact CG-CE1 3.72Å; F148-Y150 HydrophobicContact CG-CE1 3.72Å; F148-Y150 PolarHBondContact O-N 3.25Å
151	E	82	Confident	81.9	Confident	32 Å²	32	53.7 Å²	53.7	15%	0.15	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-97.6	18.5	174.8	-61.4	159.9	120.5	0	0	110.9	C83 D84 C147 F148	C83-E151 CarbonylContact C-O 3.42Å; C83-E151 WeakPolarHBondContact CA-O 3.32Å; D84-E151 WeakPolarHBondContact CB-O 3.41Å; D84-E151 PolarHBondContact N-O 2.72Å; D84-E151 WeakPolarHBondContact OD1-CB 3.31Å; D84-E151 WeakPolarHBondContact OD2-CA 3.48Å; C147-E151 WeakPolarHBondContact CA-OE2 3.06Å; C147-E151 HydrophobicContact CB-CB 4.12Å; F148-E151 PolarHBondContact N-OE2 3.43Å; F148-E151 WeakPolarHBondContact O-CA 3.23Å; F148-E151 VanDerWaalsContact O-CB 3.32Å; F148-E151 WeakPolarHBondContact O-CB 3.33Å; F148-E151 PolarHBondContact O-N 3.3Å
152	D	85.3	Confident	80	Confident	19 Å²	19	58 Å²	58	10%	0.102	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-76	130.9	175.4	-71.2	-22.2	0	0	0	111	R70 S81 V82 G116 H149	R70-D152 WeakPolarHBondContact CD-OD2 3.26Å; R70-D152 HydrophobicContact CG-CB 4.03Å; S81-D152 WeakPolarHBondContact CB-OD1 3.36Å; S81-D152 WeakPolarHBondContact CB-OD2 3.42Å; S81-D152 VanDerWaalsContact OG-CG 3.25Å; S81-D152 PolarHBondContact OG-OD1 3.1Å; S81-D152 PolarHBondContact OG-OD2 3.31Å; V82-D152 WeakPolarHBondContact O-CA 3.43Å; G116-D152 WeakPolarHBondContact CA-OD2 3.5Å; G116-D152 PolarHBondContact N-OD2 3.07Å; H149-D152 IonicContact CG-OD2 3.44Å; H149-D152 IonicContact ND1-OD1 3.21Å; H149-D152 PolarHBondContact ND1-OD1 3.01Å; H149-D152 IonicContact ND1-OD2 2.79Å; H149-D152 PolarHBondContact ND1-OD2 3.41Å; H149-D152 VanDerWaalsContact ND1-OD2 3.08Å; H149-D152 PolarHBondContact O-N 2.01Å
153	V	88.3	Confident	77.8	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	29%	0.294	C	S	.	.			trans	-69.3	142.4	-176.6	-56.5	0	0	0	0	113.1	R70 L71 V82 C83 D84 W87	R70-V153 WeakPolarHBondContact CA-O 3.03Å; L71-V153 HydrophobicContact CB-CG2 3.5Å; L71-V153 HydrophobicContact CD2-CG2 3.8Å; L71-V153 HydrophobicContact CG-CG2 4.26Å; L71-V153 PolarHBondContact N-O 3.01Å; V82-V153 HydrophobicContact CB-CG2 3.85Å; V82-V153 HydrophobicContact CG1-CG2 4.12Å; V82-V153 PolarHBondContact O-N 3.25Å; C83-V153 VanDerWaalsContact C-CG1 3.47Å; C83-V153 WeakPolarHBondContact O-CG1 3.31Å; D84-V153 HydrophobicContact CB-CB 4.34Å; D84-V153 HydrophobicContact CB-CG1 3.33Å; W87-V153 HydrophobicContact CB-CG1 3.66Å; W87-V153 HydrophobicContact CD2-CB 3.92Å; W87-V153 HydrophobicContact CD2-CG1 3.45Å; W87-V153 VanDerWaalsContact CD2-CG1 3.45Å; W87-V153 HydrophobicContact CD2-CG2 4.05Å; W87-V153 HydrophobicContact CE3-CB 4.44Å; W87-V153 HydrophobicContact CE3-CG1 3.85Å; W87-V153 HydrophobicContact CE3-CG2 4.2Å; W87-V153 HydrophobicContact CG-CB 4.02Å; W87-V153 HydrophobicContact CG-CG1 3.33Å; W87-V153 HydrophobicContact CH2-CG2 4.32Å; W87-V153 HydrophobicContact CZ2-CG2 4.13Å; W87-V153 HydrophobicContact CZ3-CG2 4.34Å
154	A	87.3	Confident	75.4	Confident	24 Å²	24	62.8 Å²	62.8	20%	0.198	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.7	168.9	0	0	0	0	0	110.1	F113	F113-A154 HydrophobicContact CD2-CB 3.74Å; F113-A154 HydrophobicContact CE2-CB 3.98Å
155	V	88.8	Confident	72.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.5	176.9	178.8	0	0	0	0	109.3	L60 R68 G69 L71 W87 A92 V95 C96	L60-V155 HydrophobicContact CD1-CB 4.22Å; L60-V155 HydrophobicContact CD1-CG1 4.25Å; L60-V155 HydrophobicContact CD2-CB 3.84Å; L60-V155 HydrophobicContact CD2-CG1 4.5Å; L60-V155 HydrophobicContact CD2-CG2 4.38Å; R68-V155 WeakPolarHBondContact CA-O 3.49Å; G69-V155 PolarHBondContact N-O 3.09Å; G69-V155 PolarHBondContact O-N 2.83Å; L71-V155 HydrophobicContact CB-CG2 4.19Å; L71-V155 HydrophobicContact CD2-CG2 4.31Å; W87-V155 HydrophobicContact CZ2-CG2 3.69Å; A92-V155 HydrophobicContact CB-CG1 4.32Å; A92-V155 HydrophobicContact CB-CG2 4.48Å; V95-V155 HydrophobicContact CB-CG1 4.42Å; V95-V155 HydrophobicContact CG1-CG1 4.05Å; V95-V155 HydrophobicContact CG1-CG2 4.33Å; C96-V155 VanDerWaalsContact SG-CG1 3.56Å
156	L	85.4	Confident	70.1	Confident	26 Å²	26	66.3 Å²	66.3	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.1	170.6	-82.6	73.8	0	0	0	108.6	R68 A104 L105 V107 L111 F113	R68-L156 HydrophobicContact CG-CG 4.38Å; A104-L156 WeakPolarHBondContact CA-O 3.42Å; L105-L156 HydrophobicContact CB-CB 4.23Å; L105-L156 PolarHBondContact N-O 2.74Å; V107-L156 HydrophobicContact CB-CD1 4.47Å; V107-L156 HydrophobicContact CG1-CD1 3.95Å; V107-L156 HydrophobicContact CG2-CB 4.05Å; V107-L156 HydrophobicContact CG2-CD1 3.64Å; V107-L156 HydrophobicContact CG2-CG 4.33Å; L111-L156 HydrophobicContact CD1-CD2 4.48Å; F113-L156 HydrophobicContact CE2-CD1 3.53Å; F113-L156 HydrophobicContact CZ-CD1 3.82Å; F113-L156 HydrophobicContact CZ-CG 4.45Å
157	C	85.5	Confident	67.7	Low	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	152.2	172.5	-45.7	0	0	0	0	111.1	C67 C96 C101 L103	C67-C157 HydrophobicContact CB-CB 4.15Å; C67-C157 WeakPolarHBondContact O-CB 3.42Å; C67-C157 PolarHBondContact O-N 2.83Å; C96-C157 WeakPolarHBondContact CA-SG 3.36Å; C96-C157 HydrophobicContact CB-CB 3.74Å; C96-C157 WeakPolarHBondContact CB-SG 3.48Å; C96-C157 VanDerWaalsContact SG-CA 3.51Å; C96-C157 WeakPolarHBondContact SG-CB 3.28Å; C96-C157 CovalentContact SG-SG 2.03Å; C96-C157 PolarHBondContact SG-SG 3.28Å; C101-C157 HydrophobicContact CB-CB 3.47Å; C101-C157 VanDerWaalsContact CB-CB 3.47Å; C101-C157 VanDerWaalsContact O-CB 3.3Å; C101-C157 WeakPolarHBondContact O-CB 3.42Å; L103-C157 CarbonylContact O-C 3.4Å; L103-C157 WeakPolarHBondContact O-CA 3.11Å
158	D	77.2	Confident	65.8	Low	21 Å²	21	79.1 Å²	79.1	11%	0.112	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	107.9	171.7	-164.4	9.1	0	0	0	111.4	C101 L103 L105 F160 H250	C101-D158 CarbonylContact O-C 3.58Å; C101-D158 VanDerWaalsContact O-C 3.25Å; C101-D158 VanDerWaalsContact O-O 3.06Å; L103-D158 PolarHBondContact O-N 3.27Å; L105-D158 HydrophobicContact CD1-CB 4.3Å; L105-D158 HydrophobicContact CG-CB 4.26Å; D158-F160 PolarHBondContact O-N 3.33Å; D158-F160 WeakPolarHBondContact OD1-CD2 3.22Å; D158-H250 IonicContact OD2-CD2 3.08Å; D158-H250 IonicContact OD2-CE1 3.22Å; D158-H250 PolarHBondContact OD2-CE1 2.95Å; D158-H250 IonicContact OD2-NE2 3.99Å; D158-H250 PolarHBondContact OD2-NE2 3.25Å
159	E	68.8	Low	63.6	Low	111 Å²	111	80.8 Å²	80.8	52%	0.519	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-6.1	-173.6	-61.5	-172.5	160.4	0	0	113.9	C67	C67-E159 HydrophobicContact CB-CG 3.92Å; C67-E159 WeakPolarHBondContact CB-OE1 3.46Å; C67-E159 PolarHBondContact SG-OE1 3.37Å
160	F	58.5	Low	61.8	Low	161 Å²	161	87.7 Å²	87.7	71%	0.706	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-10.4	-174.7	-74.1	-77.9	0	0	0	115.2	D158 P162 L209	D158-F160 PolarHBondContact O-N 3.33Å; D158-F160 WeakPolarHBondContact OD1-CD2 3.22Å; F160-P162 VanDerWaalsContact O-CD 3.31Å; F160-P162 WeakPolarHBondContact O-CD 3.28Å; F160-L209 HydrophobicContact CB-CD1 4.4Å
161	L	54.4	Low	60	Low	5 Å²	5	87.3 Å²	87.3	3%	0.026	45%	0.447	C	S	.	.			trans	-112.6	94.3	-179.5	-65.6	176.9	0	0	0	110.9	G102 L103 T163 L209	G102-L161 WeakPolarHBondContact CA-O 3.49Å; L103-L161 HydrophobicContact CD1-CD1 3.58Å; L103-L161 HydrophobicContact CG-CB 4.47Å; L103-L161 HydrophobicContact CG-CD1 4.15Å; L161-T163 PolarHBondContact O-N 2.83Å; L161-T163 VanDerWaalsContact O-N 3.07Å; L161-L209 HydrophobicContact CD1-CD1 4.08Å; L161-L209 HydrophobicContact CD2-CD1 3.98Å; L161-L209 HydrophobicContact CD2-CG 4.36Å; L161-L209 HydrophobicContact CG-CD1 3.91Å
162	P	47.8	Very low	57.9	Low	115 Å²	115	91.9 Å²	91.9	75%	0.747	48%	0.477	S	S	*	.			trans	-69	108	173.4	25.5	-30.2	0	0	0	109.8	F160 Q164	F160-P162 VanDerWaalsContact O-CD 3.31Å; F160-P162 WeakPolarHBondContact O-CD 3.28Å; P162-Q164 PolarHBondContact O-N 2.78Å; P162-Q164 VanDerWaalsContact O-N 3.08Å
163	T	44.7	Very low	55.7	Low	62 Å²	62	95.9 Å²	95.9	38%	0.38	51%	0.506	S	S	.	.			trans	-63.7	105.6	167	40.8	0	0	0	0	108.4	L103 L161	L103-T163 HydrophobicContact CD2-CG2 4.14Å; L161-T163 PolarHBondContact O-N 2.83Å; L161-T163 VanDerWaalsContact O-N 3.07Å
164	Q	39.4	Very low	53.7	Low	174 Å²	174	107.3 Å²	107.3	81%	0.813	55%	0.549	S	S	*	.			trans	-70	134.3	166.1	-71.4	-156.4	-14.7	0	0	108.6	P162	P162-Q164 PolarHBondContact O-N 2.78Å; P162-Q164 VanDerWaalsContact O-N 3.08Å
165	P	33.8	Very low	51.1	Low	96 Å²	96	112.4 Å²	112.4	62%	0.623	58%	0.577	S	S	*	*			trans	-60.8	149.2	176.1	24.7	-32.5	0	0	0	110.1	T167	P165-T167 PolarHBondContact O-N 3.16Å
166	P	36.1	Very low	48.7	Very low	130 Å²	130	117.5 Å²	117.5	84%	0.844	61%	0.611	S	S	*	*			trans	-70.1	84.3	179.5	29.6	-33	0	0	0	109	R168	P166-R168 PolarHBondContact O-N 2.76Å
167	T	33.1	Very low	46.5	Very low	110 Å²	110	122 Å²	122	68%	0.675	64%	0.641	S	S	*	*			trans	-75.7	101.7	170	54.3	0	0	0	0	107.8	P165 K169	P165-T167 PolarHBondContact O-N 3.16Å; T167-K169 PolarHBondContact O-N 3.24Å
168	R	44.6	Very low	44.2	Very low	252 Å²	252	128.4 Å²	128.4	95%	0.951	68%	0.681	S	S	*	*			trans	-58.9	83.6	162.7	-171.1	-177.8	-174.7	-173.9	3.4	108.7	P166	P166-R168 PolarHBondContact O-N 2.76Å
169	K	34.7	Very low	42.1	Very low	162 Å²	162	133.7 Å²	133.7	70%	0.704	71%	0.714	S	S	*	*			trans	-131.5	101.6	162.2	-78.1	-170.9	178.7	177.5	0	108.3	T167 L171	T167-K169 PolarHBondContact O-N 3.24Å; K169-L171 HydrophobicContact CB-CD1 4.11Å; K169-L171 HydrophobicContact CD-CD1 4.26Å; K169-L171 PolarHBondContact O-N 2.85Å; K169-L171 VanDerWaalsContact O-N 3.1Å
170	M	45.8	Very low	40.7	Very low	190 Å²	190	132.3 Å²	132.3	94%	0.936	72%	0.715	S	S	*	*			trans	-51.7	115.5	149.9	-73.1	-155.7	94.8	0	0	107.4
171	L	38.3	Very low	40.1	Very low	142 Å²	142	131 Å²	131	74%	0.743	72%	0.722	S	S	*	*			trans	-132.1	99.8	167.6	-92.9	157.4	0	0	0	108.1	K169	K169-L171 HydrophobicContact CB-CD1 4.11Å; K169-L171 HydrophobicContact CD-CD1 4.26Å; K169-L171 PolarHBondContact O-N 2.85Å; K169-L171 VanDerWaalsContact O-N 3.1Å
172	T	38.1	Very low	39.7	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	76%	0.756	S	S	*	*			trans	-53.1	147.2	150.2	43.2	0	0	0	0	109.9
173	S	38.8	Very low	40	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	77%	0.765	S	S	*	*	S	Bend	trans	93.8	102.9	158.5	-167.1	0	0	0	0	119.4
174	R	46	Very low	41.1	Very low	242 Å²	242	138.9 Å²	138.9	91%	0.913	77%	0.772	S	S	*	*			trans	45.7	93.1	133.1	-70.2	178.2	174	175.5	-1.6	117.6
175	V	33	Very low	43.1	Very low	131 Å²	131	134.4 Å²	134.4	79%	0.794	76%	0.759	S	S	*	*			trans	-125	133.9	147.5	-179.3	0	0	0	0	107.4
176	P	38.8	Very low	45.7	Very low	108 Å²	108	134.2 Å²	134.2	70%	0.701	75%	0.75	S	S	*	*			trans	-69.7	142.6	179.5	-6.8	22.6	0	0	0	110.3	T178	P176-T178 PolarHBondContact O-N 3.07Å; P176-T178 VanDerWaalsContact O-N 3.16Å
177	P	39.7	Very low	48.3	Very low	119 Å²	119	128.1 Å²	128.1	77%	0.773	71%	0.711	S	S	*	*			trans	-73.9	110.9	-178.1	28.8	-31.1	0	0	0	110.3	T179	P177-T179 PolarHBondContact O-N 2.79Å
178	T	36.5	Very low	51.2	Low	136 Å²	136	124 Å²	124	83%	0.834	69%	0.686	S	S	*	*			trans	-66.7	111	160.6	40.4	0	0	0	0	108.5	P176 P180	P176-T178 PolarHBondContact O-N 3.07Å; P176-T178 VanDerWaalsContact O-N 3.16Å; T178-P180 WeakPolarHBondContact O-CD 3.17Å
179	T	33.5	Very low	53.7	Low	131 Å²	131	112.6 Å²	112.6	80%	0.804	65%	0.645	S	S	*	*			trans	-73.1	124.4	-179.6	-14.9	0	0	0	0	110	P177	P177-T179 PolarHBondContact O-N 2.79Å
180	P	39.3	Very low	56.6	Low	83 Å²	83	109.3 Å²	109.3	54%	0.539	63%	0.628	S	S	.	*			trans	-72.4	155.7	168.9	-13.6	29.4	0	0	0	111.4	T178 N182	T178-P180 WeakPolarHBondContact O-CD 3.17Å; P180-N182 PolarHBondContact O-N 2.92Å
181	P	45.3	Very low	59	Low	134 Å²	134	101.4 Å²	101.4	87%	0.87	59%	0.589	S	S	*	*	S	Bend	trans	-81.8	27.6	-163.6	33.7	-35.9	0	0	0	115.5
182	N	46.5	Very low	61.5	Low	136 Å²	136	96.9 Å²	96.9	73%	0.727	57%	0.567	S	S	*	*	S	Bend	trans	-138.4	125.4	164.3	-88.4	-29.4	0	0	0	105.3	P180 K184	P180-N182 PolarHBondContact O-N 2.92Å; N182-K184 PolarHBondContact O-N 3.46Å
183	G	54.8	Low	63.3	Low	91 Å²	91	93.5 Å²	93.5	94%	0.938	56%	0.558	S	S	*	*	S	Bend	trans	-64.6	38.3	-169.2	0	0	0	0	0	117.2
184	K	66.1	Low	65.1	Low	120 Å²	120	89.9 Å²	89.9	52%	0.522	54%	0.537	S	S	.	.			trans	-126.8	118.9	175.4	-65.2	175.9	172.9	-175.3	0	107.4	N182 L205 W210	N182-K184 PolarHBondContact O-N 3.46Å; K184-L205 HydrophobicContact CB-CD2 3.98Å; K184-W210 HydrophobicContact CD-CZ2 4.14Å
185	S	82.9	Confident	66.5	Low	79 Å²	79	82.8 Å²	82.8	55%	0.552	53%	0.53	S	S	*	.			trans	-93.3	162.3	179.2	57.7	0	0	0	0	111.4	G187 S188	S185-G187 PolarHBondContact O-N 3.24Å; S185-S188 PolarHBondContact N-OG 3.33Å; S185-S188 VanDerWaalsContact O-CB 3.3Å; S185-S188 WeakPolarHBondContact O-CB 3.44Å; S185-S188 PolarHBondContact O-N 3.06Å; S185-S188 VanDerWaalsContact O-N 3.08Å; S185-S188 PolarHBondContact O-OG 3.35Å
186	E	87.5	Confident	68.8	Low	93 Å²	93	79.8 Å²	79.8	44%	0.435	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.5	134.1	170.5	-164.9	66.1	-169.7	0	0	112.6	S188 H206 G207	E186-S188 VanDerWaalsContact C-N 3.32Å; E186-H206 VanDerWaalsContact OE1-CA 3.27Å; E186-H206 WeakPolarHBondContact OE1-CA 3.43Å; E186-H206 IonicContact OE1-CE1 3.67Å; E186-H206 PolarHBondContact OE1-CE1 2.93Å; E186-H206 IonicContact OE1-CG 3.5Å; E186-H206 IonicContact OE1-ND1 3.25Å; E186-H206 PolarHBondContact OE1-ND1 3.06Å; E186-G207 PolarHBondContact OE1-N 2.85Å; E186-G207 PolarHBondContact OE2-N 3.23Å; E186-G207 VanDerWaalsContact OE2-N 3.17Å
187	G	90.1	Very high	71.1	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.01	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	14.5	-177.3	0	0	0	0	0	114.9	S185 L205 Q229	S185-G187 PolarHBondContact O-N 3.24Å; G187-L205 WeakPolarHBondContact CA-O 3.2Å; G187-L205 PolarHBondContact N-O 3.25Å; G187-Q229 PolarHBondContact O-NE2 3Å
188	S	95.1	Very high	73.7	Confident	23 Å²	23	77.4 Å²	77.4	16%	0.161	48%	0.484	C	S	.	.			trans	-64.1	140.1	170.2	-66.9	0	0	0	0	110.6	S185 E186 I204 L205 W210	S185-S188 PolarHBondContact N-OG 3.33Å; S185-S188 VanDerWaalsContact O-CB 3.3Å; S185-S188 WeakPolarHBondContact O-CB 3.44Å; S185-S188 PolarHBondContact O-N 3.06Å; S185-S188 VanDerWaalsContact O-N 3.08Å; S185-S188 PolarHBondContact O-OG 3.35Å; E186-S188 VanDerWaalsContact C-N 3.32Å; S188-I204 CarbonylContact O-C 3.5Å; S188-I204 WeakPolarHBondContact O-CA 3.41Å; S188-L205 PolarHBondContact O-N 3.35Å; S188-W210 VanDerWaalsContact O-CZ3 3.28Å; S188-W210 WeakPolarHBondContact O-CZ3 3.36Å
189	V	96.6	Very high	76.3	Confident	13 Å²	13	73 Å²	73	8%	0.079	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	152.1	177.6	177	0	0	0	0	110.3	V202 E203 I204 V226 L230 L265	V189-V202 HydrophobicContact CG1-CG1 3.85Å; V189-E203 CarbonylContact C-O 3.4Å; V189-E203 VanDerWaalsContact CA-O 3.27Å; V189-E203 WeakPolarHBondContact CA-O 3.29Å; V189-E203 WeakPolarHBondContact CG1-O 3.38Å; V189-I204 HydrophobicContact CG2-CB 4.4Å; V189-I204 HydrophobicContact CG2-CD1 4.26Å; V189-I204 HydrophobicContact CG2-CG1 4.09Å; V189-V226 HydrophobicContact CG1-CG1 3.78Å; V189-V226 HydrophobicContact CG1-CG2 4.34Å; V189-L230 HydrophobicContact CG1-CD1 4.5Å; V189-L230 VanDerWaalsContact O-CD2 3.28Å; V189-L230 WeakPolarHBondContact O-CD2 3.37Å; V189-L265 HydrophobicContact CG2-CB 3.94Å; V189-L265 HydrophobicContact CG2-CD2 4.24Å
190	R	95.6	Very high	78.9	Confident	94 Å²	94	66.7 Å²	66.7	36%	0.355	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.3	166.8	70.9	-177.2	-178.9	-175.2	-4.6	110.6	V192 E203 W210	R190-V192 HydrophobicContact CG-CG2 4.01Å; R190-E203 HydrophobicContact CG-CB 3.91Å; R190-E203 IonicContact CZ-OE2 3.45Å; R190-E203 PolarHBondContact N-O 2.75Å; R190-E203 IonicContact NE-OE2 3.39Å; R190-E203 PolarHBondContact NE-OE2 3.27Å; R190-E203 IonicContact NH2-OE2 2.9Å; R190-E203 PolarHBondContact NH2-OE2 2.99Å; R190-E203 PolarHBondContact O-N 3.02Å; R190-W210 HydrophobicContact CB-CH2 3.82Å; R190-W210 HydrophobicContact CB-CZ3 3.93Å; R190-W210 HydrophobicContact CG-CD2 4.36Å; R190-W210 HydrophobicContact CG-CE3 3.79Å; R190-W210 HydrophobicContact CG-CH2 3.76Å; R190-W210 HydrophobicContact CG-CZ2 4.32Å; R190-W210 HydrophobicContact CG-CZ3 3.48Å; R190-W210 VanDerWaalsContact CG-CZ3 3.48Å
191	L	95.6	Very high	81.6	Confident	24 Å²	24	63.8 Å²	63.8	13%	0.126	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129	173	-59.9	177.8	0	0	0	110.2	R201 V202 V226 L230 A286	L191-R201 VanDerWaalsContact CA-O 3.31Å; L191-R201 WeakPolarHBondContact CA-O 3.12Å; L191-V202 HydrophobicContact CD2-CG2 3.79Å; L191-V226 HydrophobicContact CD2-CG1 3.96Å; L191-L230 HydrophobicContact CD1-CD1 3.71Å; L191-L230 HydrophobicContact CD2-CD1 4.29Å; L191-L230 HydrophobicContact CG-CD1 3.58Å; L191-A286 HydrophobicContact CD2-CB 4.19Å
192	V	91.8	Very high	84.1	Confident	47 Å²	47	57.4 Å²	57.4	29%	0.285	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148	-176.7	-175.1	0	0	0	0	110.5	R190 G194 G200 R201 E203	R190-V192 HydrophobicContact CG-CG2 4.01Å; V192-G194 VanDerWaalsContact C-N 3.27Å; V192-G194 PolarHBondContact O-N 3.17Å; V192-G200 CarbonylContact O-C 3.49Å; V192-G200 VanDerWaalsContact O-CA 3.27Å; V192-G200 WeakPolarHBondContact O-CA 3.34Å; V192-R201 PolarHBondContact N-O 2.93Å; V192-R201 PolarHBondContact O-N 2.79Å; V192-E203 HydrophobicContact CG2-CG 4.31Å
193	G	75.3	Confident	86.6	Confident	57 Å²	57	51.5 Å²	51.5	59%	0.588	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	80.8	-4.5	173.8	0	0	0	0	0	115.7
194	G	77.1	Confident	88.6	Confident	26 Å²	26	47.2 Å²	47.2	27%	0.268	28%	0.276	S	S	.	.	S	Bend	trans	-87	162.4	174.7	0	0	0	0	0	114.6	V192 N196 Q199	V192-G194 VanDerWaalsContact C-N 3.27Å; V192-G194 PolarHBondContact O-N 3.17Å; G194-N196 PolarHBondContact O-N 2.97Å; G194-Q199 WeakPolarHBondContact CA-O 3.49Å
195	A	75.4	Confident	89.8	Confident	92 Å²	92	42.2 Å²	42.2	76%	0.76	26%	0.255	S	S	*	.	S	Bend	trans	-67.5	-15.5	-179.9	0	0	0	0	0	114.3
196	N	82.1	Confident	90.1	Very high	68 Å²	68	40.2 Å²	40.2	36%	0.364	24%	0.237	S	C	.	.	S	Bend	trans	-151.8	174.8	176.9	65.7	66.7	0	0	0	110.7	G194 C198 Q199	G194-N196 PolarHBondContact O-N 2.97Å; N196-C198 PolarHBondContact O-N 2.63Å; N196-C198 VanDerWaalsContact O-N 3.16Å; N196-C198 WeakPolarHBondContact OD1-CA 3.44Å; N196-C198 PolarHBondContact OD1-N 2.95Å; N196-Q199 PolarHBondContact ND2-OE1 3.35Å; N196-Q199 PolarHBondContact O-N 3.21Å; N196-Q199 VanDerWaalsContact O-O 3.04Å
197	L	87.2	Confident	89.6	Confident	157 Å²	157	37.9 Å²	37.9	82%	0.822	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-11.9	-174.6	-63.4	174.6	0	0	0	115.1
198	C	93.1	Very high	89.2	Confident	20 Å²	20	40.6 Å²	40.6	14%	0.135	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	18.6	-175.1	-69	0	0	0	0	112.8	N196 C232 C288 V290	N196-C198 PolarHBondContact O-N 2.63Å; N196-C198 VanDerWaalsContact O-N 3.16Å; N196-C198 WeakPolarHBondContact OD1-CA 3.44Å; N196-C198 PolarHBondContact OD1-N 2.95Å; C198-C232 WeakPolarHBondContact CA-SG 3.46Å; C198-C232 HydrophobicContact CB-CB 3.6Å; C198-C232 WeakPolarHBondContact CB-SG 3.01Å; C198-C232 WeakPolarHBondContact SG-CB 3.26Å; C198-C232 CovalentContact SG-SG 2.05Å; C198-C232 PolarHBondContact SG-SG 2.03Å; C198-C288 HydrophobicContact CB-CB 4.15Å; C198-C288 VanDerWaalsContact O-CB 3.27Å; C198-C288 WeakPolarHBondContact O-CB 3.5Å; C198-C288 PolarHBondContact O-N 2.81Å; C198-C288 PolarHBondContact O-SG 2.78Å; C198-C288 VanDerWaalsContact O-SG 3.39Å; C198-V290 HydrophobicContact CB-CG2 3.74Å
199	Q	91.2	Very high	88.6	Confident	43 Å²	43	42.2 Å²	42.2	20%	0.201	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.7	168.3	65.2	-173.8	58.7	0	0	109.6	G194 N196 F244 A286 L287	G194-Q199 WeakPolarHBondContact CA-O 3.49Å; N196-Q199 PolarHBondContact ND2-OE1 3.35Å; N196-Q199 PolarHBondContact O-N 3.21Å; N196-Q199 VanDerWaalsContact O-O 3.04Å; Q199-F244 HydrophobicContact CB-CE1 4.31Å; Q199-F244 HydrophobicContact CB-CZ 4.01Å; Q199-F244 HydrophobicContact CG-CE1 4.34Å; Q199-A286 CarbonylContact C-O 3.57Å; Q199-A286 VanDerWaalsContact CA-O 3.24Å; Q199-A286 WeakPolarHBondContact CA-O 3.01Å; Q199-L287 HydrophobicContact CB-CG 4.16Å
200	G	88.3	Confident	88.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.7	178.3	178.6	0	0	0	0	0	113.1	V192 F244 G285 A286	V192-G200 CarbonylContact O-C 3.49Å; V192-G200 VanDerWaalsContact O-CA 3.27Å; V192-G200 WeakPolarHBondContact O-CA 3.34Å; G200-F244 VanDerWaalsContact C-CG 3.49Å; G200-F244 VanDerWaalsContact CA-CD2 3.42Å; G200-F244 WeakPolarHBondContact O-CD2 3.42Å; G200-G285 CarbonylContact O-C 3.4Å; G200-G285 VanDerWaalsContact O-CA 3.23Å; G200-G285 WeakPolarHBondContact O-CA 3.38Å; G200-A286 PolarHBondContact N-O 3.07Å; G200-A286 PolarHBondContact O-N 2.8Å
201	R	96.4	Very high	88.1	Confident	22 Å²	22	40 Å²	40	8%	0.083	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.8	167.8	-179.5	-178.3	61.4	-112.9	6.3	109.3	L191 V192 E203 F244 G245 Y246 D283	L191-R201 VanDerWaalsContact CA-O 3.31Å; L191-R201 WeakPolarHBondContact CA-O 3.12Å; V192-R201 PolarHBondContact N-O 2.93Å; V192-R201 PolarHBondContact O-N 2.79Å; R201-E203 IonicContact CZ-OE1 3.19Å; R201-E203 IonicContact NE-OE1 2.69Å; R201-E203 PolarHBondContact NE-OE1 2.77Å; R201-E203 IonicContact NH2-OE1 3.3Å; R201-E203 PolarHBondContact NH2-OE1 2.89Å; R201-F244 HydrophobicContact CB-CB 4.07Å; R201-F244 VanDerWaalsContact N-CB 3.28Å; R201-G245 WeakPolarHBondContact CD-O 3.48Å; R201-G245 PolarHBondContact NH1-O 2.66Å; R201-Y246 VanDerWaalsContact NH1-C 3.27Å; R201-Y246 PolarHBondContact NH1-O 2.8Å; R201-D283 WeakPolarHBondContact CD-OD2 3.42Å; R201-D283 HydrophobicContact CG-CB 4.01Å
202	V	98.1	Very high	88.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.8	179.3	-180	0	0	0	0	109.1	V189 L191 V213 W218 V226 L265 A284 A286	V189-V202 HydrophobicContact CG1-CG1 3.85Å; L191-V202 HydrophobicContact CD2-CG2 3.79Å; V202-V213 HydrophobicContact CB-CB 4.5Å; V202-V213 HydrophobicContact CB-CG2 4.44Å; V202-V213 HydrophobicContact CG1-CB 4.31Å; V202-V213 HydrophobicContact CG1-CG2 3.8Å; V202-V213 PolarHBondContact O-N 3.47Å; V202-W218 HydrophobicContact CG1-CH2 4.39Å; V202-W218 HydrophobicContact CG2-CH2 4.25Å; V202-W218 HydrophobicContact CG2-CZ2 3.88Å; V202-V226 HydrophobicContact CG1-CG2 4.05Å; V202-V226 HydrophobicContact CG2-CG1 4.28Å; V202-V226 HydrophobicContact CG2-CG2 4.3Å; V202-L265 HydrophobicContact CG1-CD2 3.86Å; V202-A284 PolarHBondContact N-O 3.28Å; V202-A286 HydrophobicContact CG2-CB 4.01Å
203	E	97.6	Very high	88.4	Confident	12 Å²	12	36.6 Å²	36.6	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.5	168.4	-64.5	-177.8	-174.9	0	0	109.4	V189 R190 V192 R201 W210 G211 T212	V189-E203 CarbonylContact C-O 3.4Å; V189-E203 VanDerWaalsContact CA-O 3.27Å; V189-E203 WeakPolarHBondContact CA-O 3.29Å; V189-E203 WeakPolarHBondContact CG1-O 3.38Å; R190-E203 HydrophobicContact CG-CB 3.91Å; R190-E203 IonicContact CZ-OE2 3.45Å; R190-E203 PolarHBondContact N-O 2.75Å; R190-E203 IonicContact NE-OE2 3.39Å; R190-E203 PolarHBondContact NE-OE2 3.27Å; R190-E203 IonicContact NH2-OE2 2.9Å; R190-E203 PolarHBondContact NH2-OE2 2.99Å; R190-E203 PolarHBondContact O-N 3.02Å; V192-E203 HydrophobicContact CG2-CG 4.31Å; R201-E203 IonicContact CZ-OE1 3.19Å; R201-E203 IonicContact NE-OE1 2.69Å; R201-E203 PolarHBondContact NE-OE1 2.77Å; R201-E203 IonicContact NH2-OE1 3.3Å; R201-E203 PolarHBondContact NH2-OE1 2.89Å; E203-W210 HydrophobicContact CB-CE3 3.92Å; E203-W210 HydrophobicContact CB-CZ3 4.46Å; E203-W210 VanDerWaalsContact O-CZ3 3.27Å; E203-W210 WeakPolarHBondContact O-CZ3 3.36Å; E203-G211 CarbonylContact C-O 3.25Å; E203-G211 WeakPolarHBondContact CA-O 3.46Å; E203-G211 WeakPolarHBondContact CB-O 3.24Å; E203-T212 HydrophobicContact CG-CG2 4.16Å
204	I	96.6	Very high	89.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.5	-179	-167.3	167.9	0	0	0	110.9	S188 V189 W210 G211 V213 L252 L253 L265 A266 W273	S188-I204 CarbonylContact O-C 3.5Å; S188-I204 WeakPolarHBondContact O-CA 3.41Å; V189-I204 HydrophobicContact CG2-CB 4.4Å; V189-I204 HydrophobicContact CG2-CD1 4.26Å; V189-I204 HydrophobicContact CG2-CG1 4.09Å; I204-W210 VanDerWaalsContact C-CE3 3.49Å; I204-W210 WeakPolarHBondContact O-CA 3.46Å; I204-G211 PolarHBondContact N-O 3.36Å; I204-G211 PolarHBondContact O-N 3.4Å; I204-V213 HydrophobicContact CB-CG2 4.42Å; I204-V213 HydrophobicContact CG2-CG2 3.99Å; I204-L252 HydrophobicContact CG2-CB 3.84Å; I204-L252 HydrophobicContact CG2-CD1 4.04Å; I204-L252 VanDerWaalsContact O-CD1 3.27Å; I204-L252 WeakPolarHBondContact O-CD1 3.42Å; I204-L253 HydrophobicContact CD1-CD1 3.65Å; I204-L253 HydrophobicContact CG2-CD1 4.25Å; I204-L253 HydrophobicContact CG2-CG 4.33Å; I204-L265 HydrophobicContact CD1-CB 4.22Å; I204-L265 HydrophobicContact CD1-CD2 4.35Å; I204-A266 HydrophobicContact CD1-CB 4.05Å; I204-W273 HydrophobicContact CD1-CH2 3.86Å; I204-W273 HydrophobicContact CD1-CZ3 4.05Å; I204-W273 HydrophobicContact CG1-CZ3 4.48Å; I204-W273 HydrophobicContact CG2-CZ3 4.24Å
205	L	91.9	Very high	89.9	Confident	15 Å²	15	33.4 Å²	33.4	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.1	180	-176.3	69.8	0	0	0	110.4	K184 G187 S188 L209 W210	K184-L205 HydrophobicContact CB-CD2 3.98Å; G187-L205 WeakPolarHBondContact CA-O 3.2Å; G187-L205 PolarHBondContact N-O 3.25Å; S188-L205 PolarHBondContact O-N 3.35Å; L205-L209 WeakPolarHBondContact CA-O 3.27Å; L205-L209 WeakPolarHBondContact CD1-O 3.3Å; L205-W210 HydrophobicContact CB-CD2 4.24Å; L205-W210 HydrophobicContact CB-CE3 4.15Å; L205-W210 HydrophobicContact CB-CH2 4.11Å; L205-W210 HydrophobicContact CB-CZ2 4.19Å; L205-W210 HydrophobicContact CB-CZ3 4.07Å; L205-W210 HydrophobicContact CD1-CD2 4.22Å; L205-W210 HydrophobicContact CD1-CG 4.23Å
206	H	88.7	Confident	90.5	Very high	38 Å²	38	31.6 Å²	31.6	18%	0.176	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.9	173.2	-176	59	0	0	0	110.6	E186 G208 L209 L252 W273	E186-H206 VanDerWaalsContact OE1-CA 3.27Å; E186-H206 WeakPolarHBondContact OE1-CA 3.43Å; E186-H206 IonicContact OE1-CE1 3.67Å; E186-H206 PolarHBondContact OE1-CE1 2.93Å; E186-H206 IonicContact OE1-CG 3.5Å; E186-H206 IonicContact OE1-ND1 3.25Å; E186-H206 PolarHBondContact OE1-ND1 3.06Å; H206-G208 PolarHBondContact O-N 3.14Å; H206-L209 PolarHBondContact N-O 3.28Å; H206-L209 PolarHBondContact O-N 2.92Å; H206-L252 HydrophobicContact CB-CD1 3.92Å; H206-L252 HydrophobicContact CB-CD2 4.42Å; H206-W273 HydrophobicContact CB-CD2 4.3Å; H206-W273 HydrophobicContact CB-CE3 3.79Å; H206-W273 HydrophobicContact CB-CH2 4.46Å; H206-W273 HydrophobicContact CB-CZ3 3.87Å; H206-W273 AromaticContact CD2-CD2 3.86Å; H206-W273 AromaticContact CD2-CG 3.77Å; H206-W273 AromaticContact CE1-CD1 3.52Å; H206-W273 AromaticContact CE1-CD2 3.7Å; H206-W273 AromaticContact CE1-CE2 3.77Å; H206-W273 AromaticContact CE1-CG 3.56Å; H206-W273 AromaticContact CE1-NE1 3.65Å; H206-W273 AromaticContact CG-CD2 3.63Å; H206-W273 AromaticContact CG-CE3 3.62Å; H206-W273 AromaticContact ND1-CD2 3.51Å; H206-W273 AromaticContact ND1-CE2 3.54Å; H206-W273 AromaticContact ND1-CE3 3.9Å; H206-W273 AromaticContact ND1-CG 3.88Å; H206-W273 AromaticContact ND1-CZ2 3.96Å; H206-W273 AromaticContact ND1-NE1 3.9Å; H206-W273 AromaticContact NE2-CD1 3.77Å; H206-W273 AromaticContact NE2-CD2 3.94Å; H206-W273 AromaticContact NE2-CG 3.49Å
207	G	78.3	Confident	90.8	Very high	43 Å²	43	33.5 Å²	33.5	44%	0.443	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	25.7	177	0	0	0	0	0	114.6	E186 L209	E186-G207 PolarHBondContact OE1-N 2.85Å; E186-G207 PolarHBondContact OE2-N 3.23Å; E186-G207 VanDerWaalsContact OE2-N 3.17Å; G207-L209 VanDerWaalsContact C-N 3.35Å
208	G	80.6	Confident	91.2	Very high	59 Å²	59	26.8 Å²	26.8	61%	0.608	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	0.9	-176.5	0	0	0	0	0	115.6	H206	H206-G208 PolarHBondContact O-N 3.14Å
209	L	82.4	Confident	91	Very high	57 Å²	57	26.9 Å²	26.9	30%	0.298	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141	177.2	-64.2	178.1	0	0	0	111.6	F160 L161 L205 H206 G207	F160-L209 HydrophobicContact CB-CD1 4.4Å; L161-L209 HydrophobicContact CD1-CD1 4.08Å; L161-L209 HydrophobicContact CD2-CD1 3.98Å; L161-L209 HydrophobicContact CD2-CG 4.36Å; L161-L209 HydrophobicContact CG-CD1 3.91Å; L205-L209 WeakPolarHBondContact CA-O 3.27Å; L205-L209 WeakPolarHBondContact CD1-O 3.3Å; H206-L209 PolarHBondContact N-O 3.28Å; H206-L209 PolarHBondContact O-N 2.92Å; G207-L209 VanDerWaalsContact C-N 3.35Å
210	W	91.5	Very high	90.9	Very high	58 Å²	58	29.2 Å²	29.2	22%	0.22	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	136	169.2	-73.2	95.3	0	0	0	109.2	K184 S188 R190 E203 I204 L205	K184-W210 HydrophobicContact CD-CZ2 4.14Å; S188-W210 VanDerWaalsContact O-CZ3 3.28Å; S188-W210 WeakPolarHBondContact O-CZ3 3.36Å; R190-W210 HydrophobicContact CB-CH2 3.82Å; R190-W210 HydrophobicContact CB-CZ3 3.93Å; R190-W210 HydrophobicContact CG-CD2 4.36Å; R190-W210 HydrophobicContact CG-CE3 3.79Å; R190-W210 HydrophobicContact CG-CH2 3.76Å; R190-W210 HydrophobicContact CG-CZ2 4.32Å; R190-W210 HydrophobicContact CG-CZ3 3.48Å; R190-W210 VanDerWaalsContact CG-CZ3 3.48Å; E203-W210 HydrophobicContact CB-CE3 3.92Å; E203-W210 HydrophobicContact CB-CZ3 4.46Å; E203-W210 VanDerWaalsContact O-CZ3 3.27Å; E203-W210 WeakPolarHBondContact O-CZ3 3.36Å; I204-W210 VanDerWaalsContact C-CE3 3.49Å; I204-W210 WeakPolarHBondContact O-CA 3.46Å; L205-W210 HydrophobicContact CB-CD2 4.24Å; L205-W210 HydrophobicContact CB-CE3 4.15Å; L205-W210 HydrophobicContact CB-CH2 4.11Å; L205-W210 HydrophobicContact CB-CZ2 4.19Å; L205-W210 HydrophobicContact CB-CZ3 4.07Å; L205-W210 HydrophobicContact CD1-CD2 4.22Å; L205-W210 HydrophobicContact CD1-CG 4.23Å
211	G	91.8	Very high	91.1	Very high	1 Å²	1	32 Å²	32	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	170.7	168.6	0	0	0	0	0	110.9	E203 I204 H250 L252	E203-G211 CarbonylContact C-O 3.25Å; E203-G211 WeakPolarHBondContact CA-O 3.46Å; E203-G211 WeakPolarHBondContact CB-O 3.24Å; I204-G211 PolarHBondContact N-O 3.36Å; I204-G211 PolarHBondContact O-N 3.4Å; G211-H250 CarbonylContact C-O 3.58Å; G211-H250 WeakPolarHBondContact CA-O 3.38Å; G211-L252 VanDerWaalsContact N-CD1 3.27Å
212	T	95.2	Very high	91.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	177.9	-174.2	62.9	0	0	0	0	111.3	E203 H250 I251 L252 H280 D283	E203-T212 HydrophobicContact CG-CG2 4.16Å; T212-H250 PolarHBondContact N-O 2.93Å; T212-I251 WeakPolarHBondContact OG1-CG1 3.49Å; T212-L252 PolarHBondContact O-N 3.19Å; T212-H280 PolarHBondContact OG1-CE1 3.02Å; T212-H280 PolarHBondContact OG1-ND1 3.49Å; T212-D283 WeakPolarHBondContact CB-OD1 3.13Å; T212-D283 WeakPolarHBondContact CG2-OD2 3.38Å; T212-D283 PolarHBondContact OG1-OD1 3.33Å
213	V	97.4	Very high	91.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133	176	177.9	0	0	0	0	106.4	V202 I204 W218 L253 V256 L265 D283 A284	V202-V213 HydrophobicContact CB-CB 4.5Å; V202-V213 HydrophobicContact CB-CG2 4.44Å; V202-V213 HydrophobicContact CG1-CB 4.31Å; V202-V213 HydrophobicContact CG1-CG2 3.8Å; V202-V213 PolarHBondContact O-N 3.47Å; I204-V213 HydrophobicContact CB-CG2 4.42Å; I204-V213 HydrophobicContact CG2-CG2 3.99Å; V213-W218 HydrophobicContact CG1-CE3 3.96Å; V213-W218 HydrophobicContact CG1-CZ3 3.73Å; V213-L253 CarbonylContact C-O 3.57Å; V213-L253 WeakPolarHBondContact CA-O 3.44Å; V213-L253 HydrophobicContact CG1-CB 4.04Å; V213-L253 HydrophobicContact CG2-CB 4.23Å; V213-L253 HydrophobicContact CG2-CD1 4.41Å; V213-V256 HydrophobicContact CG1-CG2 3.74Å; V213-L265 HydrophobicContact CG2-CD2 4.01Å; V213-D283 CarbonylContact O-C 3.58Å; V213-D283 WeakPolarHBondContact O-CA 3.31Å; V213-A284 HydrophobicContact CB-CB 4.34Å; V213-A284 HydrophobicContact CG1-CB 4.31Å; V213-A284 VanDerWaalsContact O-CB 3.32Å; V213-A284 WeakPolarHBondContact O-CB 3.33Å; V213-A284 PolarHBondContact O-N 2.88Å
214	C	94.1	Very high	90.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-72.7	151.2	174.8	-174.8	0	0	0	0	111	D216 I251 L253 D254 C278 E282	C214-D216 PolarHBondContact SG-N 3.14Å; C214-I251 HydrophobicContact CB-CG2 4.07Å; C214-L253 PolarHBondContact N-O 3.01Å; C214-D254 HydrophobicContact CB-CB 4.03Å; C214-D254 VanDerWaalsContact CB-OD1 3.29Å; C214-D254 WeakPolarHBondContact CB-OD1 3.04Å; C214-D254 PolarHBondContact SG-OD1 3.36Å; C214-C278 HydrophobicContact CB-CB 3.65Å; C214-C278 WeakPolarHBondContact CB-SG 3.01Å; C214-C278 WeakPolarHBondContact SG-CB 2.95Å; C214-C278 CovalentContact SG-SG 2Å; C214-C278 PolarHBondContact SG-SG 2.8Å; C214-E282 CarbonylContact C-O 3.56Å; C214-E282 VanDerWaalsContact CA-O 3.28Å; C214-E282 WeakPolarHBondContact CA-O 3.43Å
215	D	91.1	Very high	90.9	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.08	20%	0.201	C	C	.	.			trans	-91.9	1.2	179.1	60.7	28.5	0	0	0	115.6	D217 W218 T240 N241 E282 A284	D215-D217 PolarHBondContact O-N 3.21Å; D215-W218 VanDerWaalsContact CA-CB 3.44Å; D215-W218 HydrophobicContact CB-CB 4.02Å; D215-W218 WeakPolarHBondContact O-CB 3.5Å; D215-W218 PolarHBondContact O-N 3.07Å; D215-T240 HydrophobicContact CB-CG2 3.79Å; D215-T240 VanDerWaalsContact OD2-C 3.24Å; D215-T240 WeakPolarHBondContact OD2-CA 3.45Å; D215-T240 VanDerWaalsContact OD2-CB 3.3Å; D215-T240 WeakPolarHBondContact OD2-CB 3.02Å; D215-N241 WeakPolarHBondContact OD2-CA 3.49Å; D215-N241 PolarHBondContact OD2-N 2.93Å; D215-E282 PolarHBondContact N-O 3.01Å; D215-E282 WeakPolarHBondContact OD1-CB 3.43Å; D215-E282 VanDerWaalsContact OD2-C 3.25Å; D215-E282 WeakPolarHBondContact OD2-CA 3.43Å; D215-A284 HydrophobicContact CB-CB 3.93Å
216	D	87.5	Confident	91.2	Very high	55 Å²	55	31.4 Å²	31.4	29%	0.294	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	128.5	165.7	-92.1	9	0	0	0	110.5	C214 W218 D254 N255	C214-D216 PolarHBondContact SG-N 3.14Å; D216-W218 PolarHBondContact O-N 3.4Å; D216-D254 WeakPolarHBondContact CB-OD1 3.17Å; D216-N255 WeakPolarHBondContact O-CA 3.48Å
217	D	88.9	Confident	91.5	Very high	107 Å²	107	29.6 Å²	29.6	57%	0.572	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	11.6	-168.9	-67.7	-43.2	0	0	0	115.7	D215 G219 N255	D215-D217 PolarHBondContact O-N 3.21Å; D217-G219 PolarHBondContact O-N 2.72Å; D217-N255 HydrophobicContact CB-CB 4.38Å; D217-N255 PolarHBondContact OD2-ND2 2.75Å
218	W	95.3	Very high	92.2	Very high	17 Å²	17	33.3 Å²	33.3	6%	0.064	19%	0.19	C	C	.	.			trans	-74.9	116.7	-176.7	-176.9	-105.2	0	0	0	112.9	V202 V213 D215 D216 D222 A223 V226 V256 L265 A284 G285	V202-W218 HydrophobicContact CG1-CH2 4.39Å; V202-W218 HydrophobicContact CG2-CH2 4.25Å; V202-W218 HydrophobicContact CG2-CZ2 3.88Å; V213-W218 HydrophobicContact CG1-CE3 3.96Å; V213-W218 HydrophobicContact CG1-CZ3 3.73Å; D215-W218 VanDerWaalsContact CA-CB 3.44Å; D215-W218 HydrophobicContact CB-CB 4.02Å; D215-W218 WeakPolarHBondContact O-CB 3.5Å; D215-W218 PolarHBondContact O-N 3.07Å; D216-W218 PolarHBondContact O-N 3.4Å; W218-D222 HydrophobicContact CD2-CB 3.97Å; W218-D222 HydrophobicContact CE3-CB 3.57Å; W218-D222 HydrophobicContact CH2-CB 3.72Å; W218-D222 HydrophobicContact CZ2-CB 4.12Å; W218-D222 HydrophobicContact CZ3-CB 3.45Å; W218-D222 VanDerWaalsContact CZ3-CB 3.45Å; W218-A223 HydrophobicContact CZ2-CB 4.32Å; W218-V226 HydrophobicContact CH2-CG2 3.8Å; W218-V226 HydrophobicContact CZ2-CG2 4.27Å; W218-V256 HydrophobicContact CE3-CB 4.01Å; W218-V256 HydrophobicContact CE3-CG1 4.41Å; W218-V256 HydrophobicContact CZ3-CB 4.07Å; W218-V256 HydrophobicContact CZ3-CG1 4.05Å; W218-V256 HydrophobicContact CZ3-CG2 4.42Å; W218-L265 HydrophobicContact CH2-CD1 3.89Å; W218-L265 HydrophobicContact CH2-CD2 4.07Å; W218-L265 HydrophobicContact CZ3-CD1 3.88Å; W218-L265 HydrophobicContact CZ3-CD2 4.2Å; W218-A284 HydrophobicContact CB-CB 4.42Å; W218-A284 HydrophobicContact CD2-CB 3.65Å; W218-A284 HydrophobicContact CE3-CB 4.16Å; W218-A284 HydrophobicContact CG-CB 3.73Å; W218-A284 HydrophobicContact CZ2-CB 4.4Å; W218-G285 PolarHBondContact NE1-O 2.88Å
219	G	87.3	Confident	92.9	Very high	22 Å²	22	33.1 Å²	33.1	23%	0.227	17%	0.173	C	C	.	.			trans	-125.9	177.2	-174.4	0	0	0	0	0	115	D217 P221 D222 A223 A238	D217-G219 PolarHBondContact O-N 2.72Å; G219-P221 VanDerWaalsContact C-N 3.32Å; G219-D222 WeakPolarHBondContact CA-OD2 3.28Å; G219-D222 PolarHBondContact N-OD2 2.79Å; G219-D222 PolarHBondContact O-N 3.31Å; G219-D222 VanDerWaalsContact O-N 3.13Å; G219-A223 PolarHBondContact O-N 3.17Å; G219-A223 VanDerWaalsContact O-N 3.14Å; G219-A238 VanDerWaalsContact C-CB 3.4Å; G219-A238 WeakPolarHBondContact O-CB 3.03Å
220	L	89.3	Confident	93.4	Very high	92 Å²	92	33.2 Å²	33.2	48%	0.482	17%	0.174	S	C	.	.	H	α-helix	trans	-57.4	-35.7	176.1	-163.8	69	0	0	0	113.7	D222 A224 A235	L220-D222 VanDerWaalsContact C-N 3.34Å; L220-D222 PolarHBondContact O-N 2.97Å; L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.34Å; L220-A224 PolarHBondContact O-N 3.22Å; L220-A235 HydrophobicContact CD1-CB 4.06Å
221	P	93.9	Very high	93.5	Very high	58 Å²	58	33.7 Å²	33.7	38%	0.377	20%	0.197	S	C	.	.	H	α-helix	trans	-59.1	-40.1	172.5	-26.2	37.3	0	0	0	113.7	G219 A224 V225 C258	G219-P221 VanDerWaalsContact C-N 3.32Å; P221-A224 WeakPolarHBondContact O-CB 3.04Å; P221-A224 PolarHBondContact O-N 3.47Å; P221-V225 PolarHBondContact O-N 2.92Å; P221-V225 VanDerWaalsContact O-N 3.09Å; P221-C258 VanDerWaalsContact CB-O 3.24Å; P221-C258 WeakPolarHBondContact CB-O 3.44Å
222	D	97.4	Very high	93.4	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-69.3	-47.4	-179.6	-44.1	-67.2	0	0	0	110.9	W218 G219 L220 A224 V225 V226 V256 C258	W218-D222 HydrophobicContact CD2-CB 3.97Å; W218-D222 HydrophobicContact CE3-CB 3.57Å; W218-D222 HydrophobicContact CH2-CB 3.72Å; W218-D222 HydrophobicContact CZ2-CB 4.12Å; W218-D222 HydrophobicContact CZ3-CB 3.45Å; W218-D222 VanDerWaalsContact CZ3-CB 3.45Å; G219-D222 WeakPolarHBondContact CA-OD2 3.28Å; G219-D222 PolarHBondContact N-OD2 2.79Å; G219-D222 PolarHBondContact O-N 3.31Å; G219-D222 VanDerWaalsContact O-N 3.13Å; L220-D222 VanDerWaalsContact C-N 3.34Å; L220-D222 PolarHBondContact O-N 2.97Å; D222-A224 PolarHBondContact O-N 3.06Å; D222-V225 WeakPolarHBondContact O-CB 3.01Å; D222-V225 PolarHBondContact O-N 2.9Å; D222-V225 VanDerWaalsContact O-N 3.11Å; D222-V226 PolarHBondContact O-N 3.14Å; D222-V256 HydrophobicContact CB-CG1 4.33Å; D222-C258 WeakPolarHBondContact OD1-CA 3.41Å; D222-C258 WeakPolarHBondContact OD1-CB 3.25Å; D222-C258 PolarHBondContact OD1-N 3.19Å; D222-C258 PolarHBondContact OD1-SG 2.03Å
223	A	95.6	Very high	93.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-34.7	172.3	0	0	0	0	0	112	W218 G219 V226 C227 A235 A238 A286	W218-A223 HydrophobicContact CZ2-CB 4.32Å; G219-A223 PolarHBondContact O-N 3.17Å; G219-A223 VanDerWaalsContact O-N 3.14Å; A223-V226 PolarHBondContact O-N 2.78Å; A223-C227 WeakPolarHBondContact O-CB 3.24Å; A223-C227 PolarHBondContact O-N 3.18Å; A223-C227 PolarHBondContact O-SG 2.84Å; A223-A235 HydrophobicContact CB-CB 4.01Å; A223-A238 HydrophobicContact CB-CB 3.81Å; A223-A286 HydrophobicContact CB-CB 4.07Å
224	A	94.5	Very high	92.7	Very high	33 Å²	33	38.3 Å²	38.3	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-39.4	176	0	0	0	0	0	112.2	L220 P221 D222 R228 A235	L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.34Å; L220-A224 PolarHBondContact O-N 3.22Å; P221-A224 WeakPolarHBondContact O-CB 3.04Å; P221-A224 PolarHBondContact O-N 3.47Å; D222-A224 PolarHBondContact O-N 3.06Å; A224-R228 VanDerWaalsContact O-CB 3.27Å; A224-R228 WeakPolarHBondContact O-CB 3.4Å; A224-R228 PolarHBondContact O-N 3.22Å; A224-A235 HydrophobicContact CB-CB 4.01Å
225	V	97.4	Very high	92.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-45	172.4	172.5	0	0	0	0	110.5	P221 D222 R228 Q229 C258 E262 R264 L265	P221-V225 PolarHBondContact O-N 2.92Å; P221-V225 VanDerWaalsContact O-N 3.09Å; D222-V225 WeakPolarHBondContact O-CB 3.01Å; D222-V225 PolarHBondContact O-N 2.9Å; D222-V225 VanDerWaalsContact O-N 3.11Å; V225-R228 PolarHBondContact O-N 2.92Å; V225-Q229 WeakPolarHBondContact O-CB 3.27Å; V225-Q229 PolarHBondContact O-N 2.93Å; V225-C258 HydrophobicContact CG2-CB 3.94Å; V225-E262 HydrophobicContact CG1-CB 4.42Å; V225-E262 WeakPolarHBondContact CG1-O 3.35Å; V225-E262 HydrophobicContact CG2-CB 4.17Å; V225-R264 VanDerWaalsContact CG1-C 3.42Å; V225-L265 HydrophobicContact CG1-CB 4.46Å; V225-L265 HydrophobicContact CG1-CD1 4.5Å
226	V	97.1	Very high	92.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-53	176	172.4	0	0	0	0	111.8	V189 L191 V202 W218 D222 A223 R228 Q229 L230 L265 A286	V189-V226 HydrophobicContact CG1-CG1 3.78Å; V189-V226 HydrophobicContact CG1-CG2 4.34Å; L191-V226 HydrophobicContact CD2-CG1 3.96Å; V202-V226 HydrophobicContact CG1-CG2 4.05Å; V202-V226 HydrophobicContact CG2-CG1 4.28Å; V202-V226 HydrophobicContact CG2-CG2 4.3Å; W218-V226 HydrophobicContact CH2-CG2 3.8Å; W218-V226 HydrophobicContact CZ2-CG2 4.27Å; D222-V226 PolarHBondContact O-N 3.14Å; A223-V226 PolarHBondContact O-N 2.78Å; V226-R228 VanDerWaalsContact C-N 3.28Å; V226-R228 PolarHBondContact O-N 2.66Å; V226-Q229 PolarHBondContact O-N 3.16Å; V226-Q229 VanDerWaalsContact O-N 3.17Å; V226-L230 HydrophobicContact CG1-CD1 3.79Å; V226-L230 WeakPolarHBondContact O-CG 3.27Å; V226-L230 PolarHBondContact O-N 3.27Å; V226-L265 HydrophobicContact CG2-CB 4.48Å; V226-L265 HydrophobicContact CG2-CD1 3.93Å; V226-L265 HydrophobicContact CG2-CD2 3.85Å; V226-L265 HydrophobicContact CG2-CG 4.32Å; V226-A286 HydrophobicContact CG1-CB 4.24Å
227	C	95	Very high	92.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-40.2	-178.6	-69.2	0	0	0	0	111.8	A223 G231 C232 G233 A235 C288	A223-C227 WeakPolarHBondContact O-CB 3.24Å; A223-C227 PolarHBondContact O-N 3.18Å; A223-C227 PolarHBondContact O-SG 2.84Å; C227-G231 PolarHBondContact O-N 2.79Å; C227-C232 PolarHBondContact O-N 2.76Å; C227-G233 WeakPolarHBondContact CB-O 3.43Å; C227-A235 HydrophobicContact CB-CB 4.41Å; C227-C288 WeakPolarHBondContact CA-SG 3.43Å; C227-C288 HydrophobicContact CB-CB 3.74Å; C227-C288 WeakPolarHBondContact CB-SG 3.43Å; C227-C288 VanDerWaalsContact SG-CA 3.53Å; C227-C288 WeakPolarHBondContact SG-CB 3.09Å; C227-C288 CovalentContact SG-SG 2.03Å; C227-C288 PolarHBondContact SG-SG 3.49Å
228	R	93.8	Very high	92	Very high	121 Å²	121	39.8 Å²	39.8	46%	0.457	25%	0.253	S	S	.	.	H	α-helix	trans	-68.8	-43.7	175.6	-176.2	172.9	62.3	153.7	-1.5	112.2	A224 V225 V226 L230 G231 G260 G261 E262	A224-R228 VanDerWaalsContact O-CB 3.27Å; A224-R228 WeakPolarHBondContact O-CB 3.4Å; A224-R228 PolarHBondContact O-N 3.22Å; V225-R228 PolarHBondContact O-N 2.92Å; V226-R228 VanDerWaalsContact C-N 3.28Å; V226-R228 PolarHBondContact O-N 2.66Å; R228-L230 PolarHBondContact O-N 3.11Å; R228-G231 PolarHBondContact O-N 3.47Å; R228-G260 PolarHBondContact NH2-O 2.05Å; R228-G261 PolarHBondContact NH2-O 3.42Å; R228-E262 PolarHBondContact NH2-O 3.39Å
229	Q	95	Very high	91	Very high	55 Å²	55	39.8 Å²	39.8	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-34.3	178.6	-178.2	175.6	-10.7	0	0	111.7	G187 V225 V226 R264	G187-Q229 PolarHBondContact O-NE2 3Å; V225-Q229 WeakPolarHBondContact O-CB 3.27Å; V225-Q229 PolarHBondContact O-N 2.93Å; V226-Q229 PolarHBondContact O-N 3.16Å; V226-Q229 VanDerWaalsContact O-N 3.17Å; Q229-R264 HydrophobicContact CG-CB 4.47Å; Q229-R264 VanDerWaalsContact OE1-CA 3.24Å
230	L	93.3	Very high	90.6	Very high	59 Å²	59	41.5 Å²	41.5	31%	0.309	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.7	177.2	-64.8	171.3	0	0	0	114	V189 L191 V226 R228 C232	V189-L230 HydrophobicContact CG1-CD1 4.5Å; V189-L230 VanDerWaalsContact O-CD2 3.28Å; V189-L230 WeakPolarHBondContact O-CD2 3.37Å; L191-L230 HydrophobicContact CD1-CD1 3.71Å; L191-L230 HydrophobicContact CD2-CD1 4.29Å; L191-L230 HydrophobicContact CG-CD1 3.58Å; V226-L230 HydrophobicContact CG1-CD1 3.79Å; V226-L230 WeakPolarHBondContact O-CG 3.27Å; V226-L230 PolarHBondContact O-N 3.27Å; R228-L230 PolarHBondContact O-N 3.11Å; L230-C232 VanDerWaalsContact C-N 3.28Å; L230-C232 HydrophobicContact CB-CB 4.41Å; L230-C232 PolarHBondContact O-N 2.77Å
231	G	91.9	Very high	89.1	Confident	68 Å²	68	39 Å²	39	70%	0.701	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	22.4	-174.1	0	0	0	0	0	113.9	C227 R228 G233	C227-G231 PolarHBondContact O-N 2.79Å; R228-G231 PolarHBondContact O-N 3.47Å; G231-G233 VanDerWaalsContact C-N 3.34Å
232	C	91	Very high	87.9	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.074	23%	0.231	C	C	.	.			trans	-89.8	11.6	-176.5	-79.2	0	0	0	0	114.3	C198 C227 L230 C288 A289	C198-C232 WeakPolarHBondContact CA-SG 3.46Å; C198-C232 HydrophobicContact CB-CB 3.6Å; C198-C232 WeakPolarHBondContact CB-SG 3.01Å; C198-C232 WeakPolarHBondContact SG-CB 3.26Å; C198-C232 CovalentContact SG-SG 2.05Å; C198-C232 PolarHBondContact SG-SG 2.03Å; C227-C232 PolarHBondContact O-N 2.76Å; L230-C232 VanDerWaalsContact C-N 3.28Å; L230-C232 HydrophobicContact CB-CB 4.41Å; L230-C232 PolarHBondContact O-N 2.77Å; C232-C288 HydrophobicContact CB-CB 3.64Å; C232-C288 WeakPolarHBondContact O-CB 3.25Å; C232-A289 CarbonylContact O-C 3.53Å
233	G	88.1	Confident	86.5	Confident	23 Å²	23	41 Å²	41	24%	0.237	25%	0.252	C	S	.	.			trans	83.8	-149.2	179.4	0	0	0	0	0	113.6	C227 G231	C227-G233 WeakPolarHBondContact CB-O 3.43Å; G231-G233 VanDerWaalsContact C-N 3.34Å
234	A	88.9	Confident	85.4	Confident	65 Å²	65	42.3 Å²	42.3	54%	0.537	26%	0.257	S	S	.	.	S	Bend	trans	-78.8	147.8	-179.2	0	0	0	0	0	111.5	C288 A289	A234-C288 CarbonylContact O-C 2.95Å; A234-C288 WeakPolarHBondContact O-CA 3.46Å; A234-A289 WeakPolarHBondContact O-CB 3.27Å; A234-A289 PolarHBondContact O-N 2.83Å
235	A	91.3	Very high	83.8	Confident	20 Å²	20	41.9 Å²	41.9	17%	0.165	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.3	168.7	0	0	0	0	0	110.6	L220 A223 A224 C227	L220-A235 HydrophobicContact CD1-CB 4.06Å; A223-A235 HydrophobicContact CB-CB 4.01Å; A224-A235 HydrophobicContact CB-CB 4.01Å; C227-A235 HydrophobicContact CB-CB 4.41Å
236	M	87.6	Confident	82.7	Confident	126 Å²	126	45.3 Å²	45.3	62%	0.621	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	-34.8	171.4	-66.2	-177.8	62.7	0	0	111.4	L287 A289	M236-L287 HydrophobicContact CB-CD2 3.65Å; M236-L287 WeakPolarHBondContact CB-O 3.42Å; M236-L287 HydrophobicContact CE-CD2 4.4Å; M236-L287 HydrophobicContact CG-CD2 4.15Å; M236-L287 PolarHBondContact N-O 2.92Å; M236-L287 HydrophobicContact SD-CD2 3.76Å; M236-A289 HydrophobicContact CG-CB 3.75Å; M236-A289 HydrophobicContact SD-CB 3.88Å
237	A	82.3	Confident	81.7	Confident	33 Å²	33	45.5 Å²	45.5	27%	0.273	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	145.4	176.6	0	0	0	0	0	111.7	T239 L287	A237-T239 HydrophobicContact CB-CG2 4.49Å; A237-L287 HydrophobicContact CB-CB 4.18Å; A237-L287 PolarHBondContact N-O 3.33Å; A237-L287 VanDerWaalsContact N-O 3.17Å; A237-L287 PolarHBondContact O-N 3.07Å
238	A	86.4	Confident	80.7	Confident	29 Å²	29	51.2 Å²	51.2	24%	0.24	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.8	155.9	0	0	0	0	0	106.7	G219 A223	G219-A238 VanDerWaalsContact C-CB 3.4Å; G219-A238 WeakPolarHBondContact O-CB 3.03Å; A223-A238 HydrophobicContact CB-CB 3.81Å
239	T	73.8	Confident	79.9	Confident	17 Å²	17	47.2 Å²	47.2	10%	0.104	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.7	-179.8	62	0	0	0	0	109.6	A237 F243 F244 G285	A237-T239 HydrophobicContact CB-CG2 4.49Å; T239-F243 HydrophobicContact CG2-CB 4.41Å; T239-F243 HydrophobicContact CG2-CD1 3.98Å; T239-F243 HydrophobicContact CG2-CE1 4.47Å; T239-F243 HydrophobicContact CG2-CG 4.16Å; T239-F244 HydrophobicContact CG2-CE2 3.97Å; T239-F244 WeakPolarHBondContact OG1-CE2 3.24Å; T239-G285 PolarHBondContact N-O 2.98Å; T239-G285 PolarHBondContact O-N 3.36Å; T239-G285 WeakPolarHBondContact OG1-CA 3.31Å; T239-G285 PolarHBondContact OG1-N 3.24Å; T239-G285 PolarHBondContact OG1-O 3.17Å
240	T	78.3	Confident	79.1	Confident	58 Å²	58	45.3 Å²	45.3	36%	0.356	29%	0.294	S	S	.	.			trans	-115.6	-172.5	179.7	65.7	0	0	0	0	110	D215 A242 F243	D215-T240 HydrophobicContact CB-CG2 3.79Å; D215-T240 VanDerWaalsContact OD2-C 3.24Å; D215-T240 WeakPolarHBondContact OD2-CA 3.45Å; D215-T240 VanDerWaalsContact OD2-CB 3.3Å; D215-T240 WeakPolarHBondContact OD2-CB 3.02Å; T240-A242 VanDerWaalsContact C-N 3.28Å; T240-A242 PolarHBondContact O-N 2.79Å; T240-F243 WeakPolarHBondContact O-CB 3.37Å; T240-F243 PolarHBondContact O-N 2.97Å; T240-F243 VanDerWaalsContact O-N 3.09Å
241	N	58.7	Low	78.8	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.203	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	44.6	177.9	-54.1	-25.9	0	0	0	113.5	D215 F243 H281 H431	D215-N241 WeakPolarHBondContact OD2-CA 3.49Å; D215-N241 PolarHBondContact OD2-N 2.93Å; N241-F243 PolarHBondContact O-N 3.09Å; N241-F243 VanDerWaalsContact O-N 3.08Å; N241-H281 CarbonylContact C-O 2.89Å; N241-H281 WeakPolarHBondContact CA-O 3.47Å; N241-H431 WeakPolarHBondContact CB-CE1 3.36Å; N241-H431 PolarHBondContact ND2-CE1 3.02Å; N241-H431 PolarHBondContact ND2-O 3.31Å
242	A	69.4	Low	78.8	Confident	3 Å²	3	39.4 Å²	39.4	3%	0.025	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	38.8	-178.9	0	0	0	0	0	113.4	T240 F244 G245 Y246 H280 H281 D283	T240-A242 VanDerWaalsContact C-N 3.28Å; T240-A242 PolarHBondContact O-N 2.79Å; A242-F244 PolarHBondContact O-N 3.08Å; A242-G245 CarbonylContact O-C 3.59Å; A242-G245 VanDerWaalsContact O-CA 3.26Å; A242-G245 WeakPolarHBondContact O-CA 3.38Å; A242-G245 PolarHBondContact O-N 3.12Å; A242-Y246 HydrophobicContact CB-CD2 4.35Å; A242-Y246 HydrophobicContact CB-CE2 4.24Å; A242-H280 WeakPolarHBondContact CB-O 3.26Å; A242-H281 WeakPolarHBondContact CB-O 3.38Å; A242-H281 PolarHBondContact N-O 2.72Å; A242-D283 VanDerWaalsContact CA-O 3.27Å; A242-D283 WeakPolarHBondContact CA-O 3.5Å; A242-D283 HydrophobicContact CB-CB 4.24Å; A242-D283 PolarHBondContact N-O 3.11Å
243	F	68.1	Low	79	Confident	102 Å²	102	39 Å²	39	45%	0.447	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-35.4	-176	179.8	-91.5	0	0	0	114.6	T239 T240 N241 G245	T239-F243 HydrophobicContact CG2-CB 4.41Å; T239-F243 HydrophobicContact CG2-CD1 3.98Å; T239-F243 HydrophobicContact CG2-CE1 4.47Å; T239-F243 HydrophobicContact CG2-CG 4.16Å; T240-F243 WeakPolarHBondContact O-CB 3.37Å; T240-F243 PolarHBondContact O-N 2.97Å; T240-F243 VanDerWaalsContact O-N 3.09Å; N241-F243 PolarHBondContact O-N 3.09Å; N241-F243 VanDerWaalsContact O-N 3.08Å; F243-G245 VanDerWaalsContact C-N 3.3Å
244	F	72.2	Confident	79.2	Confident	27 Å²	27	37.9 Å²	37.9	12%	0.118	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	18.7	178.1	-69	-72.9	0	0	0	113.9	Q199 G200 R201 T239 A242	Q199-F244 HydrophobicContact CB-CE1 4.31Å; Q199-F244 HydrophobicContact CB-CZ 4.01Å; Q199-F244 HydrophobicContact CG-CE1 4.34Å; G200-F244 VanDerWaalsContact C-CG 3.49Å; G200-F244 VanDerWaalsContact CA-CD2 3.42Å; G200-F244 WeakPolarHBondContact O-CD2 3.42Å; R201-F244 HydrophobicContact CB-CB 4.07Å; R201-F244 VanDerWaalsContact N-CB 3.28Å; T239-F244 HydrophobicContact CG2-CE2 3.97Å; T239-F244 WeakPolarHBondContact OG1-CE2 3.24Å; A242-F244 PolarHBondContact O-N 3.08Å
245	G	60.2	Low	79.3	Confident	24 Å²	24	36.8 Å²	36.8	25%	0.247	22%	0.217	C	C	.	.			trans	86.6	159.9	-173.7	0	0	0	0	0	113	R201 A242 F243	R201-G245 WeakPolarHBondContact CD-O 3.48Å; R201-G245 PolarHBondContact NH1-O 2.66Å; A242-G245 CarbonylContact O-C 3.59Å; A242-G245 VanDerWaalsContact O-CA 3.26Å; A242-G245 WeakPolarHBondContact O-CA 3.38Å; A242-G245 PolarHBondContact O-N 3.12Å; F243-G245 VanDerWaalsContact C-N 3.3Å
246	Y	73.7	Confident	79.5	Confident	72 Å²	72	35.9 Å²	35.9	28%	0.282	21%	0.21	S	C	.	.			trans	-60	138.3	177.3	-69.6	-105.2	0	0	0	111.8	R201 A242 H280 H281 G434 H435	R201-Y246 VanDerWaalsContact NH1-C 3.27Å; R201-Y246 PolarHBondContact NH1-O 2.8Å; A242-Y246 HydrophobicContact CB-CD2 4.35Å; A242-Y246 HydrophobicContact CB-CE2 4.24Å; Y246-H280 HydrophobicContact CD1-CB 3.83Å; Y246-H280 VanDerWaalsContact CD1-O 3.28Å; Y246-H280 WeakPolarHBondContact CD1-O 3.48Å; Y246-H281 HydrophobicContact CE1-CB 3.54Å; Y246-H281 WeakPolarHBondContact OH-CB 3.36Å; Y246-G434 VanDerWaalsContact OH-C 3.29Å; Y246-G434 WeakPolarHBondContact OH-CA 3.45Å; Y246-H435 HydrophobicContact CE2-CB 3.86Å; Y246-H435 AromaticContact CE2-CD2 3.37Å; Y246-H435 WeakPolarHBondContact CE2-CD2 3.48Å; Y246-H435 AromaticContact CE2-CG 3.84Å; Y246-H435 PolarHBondContact OH-N 3.34Å
247	G	75.8	Confident	79.7	Confident	4 Å²	4	35.2 Å²	35.2	4%	0.041	21%	0.205	C	C	.	.			trans	-75.8	-176	158.1	0	0	0	0	0	111.9	D283	G247-D283 WeakPolarHBondContact CA-OD2 3.36Å; G247-D283 PolarHBondContact N-OD2 2.98Å
248	T	74	Confident	80.4	Confident	120 Å²	120	33.8 Å²	33.8	74%	0.736	19%	0.193	S	C	*	.			trans	-146.5	144.5	178.4	58.6	0	0	0	0	108.7	H280	T248-H280 VanDerWaalsContact CA-NE2 3.35Å; T248-H280 WeakPolarHBondContact CA-NE2 3.45Å
249	G	77.1	Confident	80.6	Confident	38 Å²	38	41.1 Å²	41.1	39%	0.392	22%	0.222	S	C	.	.	S	Bend	trans	93.8	-125.2	176.2	0	0	0	0	0	111.6	H280	G249-H280 PolarHBondContact N-NE2 3.34Å; G249-H280 PolarHBondContact O-NE2 2.81Å; G249-H280 VanDerWaalsContact O-NE2 3.09Å
250	H	79.9	Confident	81	Confident	14 Å²	14	41.5 Å²	41.5	7%	0.065	23%	0.23	C	C	.	.			trans	-89.6	140.2	-173.4	-64.1	-75.6	0	0	0	111.3	L105 D158 G211 T212 L252	L105-H250 WeakPolarHBondContact CD2-CE1 3.28Å; D158-H250 IonicContact OD2-CD2 3.08Å; D158-H250 IonicContact OD2-CE1 3.22Å; D158-H250 PolarHBondContact OD2-CE1 2.95Å; D158-H250 IonicContact OD2-NE2 3.99Å; D158-H250 PolarHBondContact OD2-NE2 3.25Å; G211-H250 CarbonylContact C-O 3.58Å; G211-H250 WeakPolarHBondContact CA-O 3.38Å; T212-H250 PolarHBondContact N-O 2.93Å; H250-L252 HydrophobicContact CB-CD2 3.96Å; H250-L252 HydrophobicContact CB-CG 4.22Å
251	I	86.3	Confident	81.3	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120	159.5	-44.3	-175.4	0	0	0	105.8	T212 C214 H276 C278	T212-I251 WeakPolarHBondContact OG1-CG1 3.49Å; C214-I251 HydrophobicContact CB-CG2 4.07Å; I251-H276 PolarHBondContact O-CD2 3.08Å; I251-H276 PolarHBondContact O-NE2 3.36Å; I251-C278 HydrophobicContact CD1-CB 4.07Å; I251-C278 WeakPolarHBondContact CD1-O 3.39Å
252	L	92	Very high	83.1	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-21.8	-166.2	-72.7	176.3	0	0	0	113.9	L103 I204 H206 G211 T212 H250 W273 G274	L103-L252 HydrophobicContact CD1-CD2 4.25Å; I204-L252 HydrophobicContact CG2-CB 3.84Å; I204-L252 HydrophobicContact CG2-CD1 4.04Å; I204-L252 VanDerWaalsContact O-CD1 3.27Å; I204-L252 WeakPolarHBondContact O-CD1 3.42Å; H206-L252 HydrophobicContact CB-CD1 3.92Å; H206-L252 HydrophobicContact CB-CD2 4.42Å; G211-L252 VanDerWaalsContact N-CD1 3.27Å; T212-L252 PolarHBondContact O-N 3.19Å; H250-L252 HydrophobicContact CB-CD2 3.96Å; H250-L252 HydrophobicContact CB-CG 4.22Å; L252-W273 HydrophobicContact CB-CE3 4.29Å; L252-W273 WeakPolarHBondContact O-CA 3.49Å; L252-G274 PolarHBondContact O-N 3.28Å
253	L	94.5	Very high	84	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	144.9	178.5	-68.5	179.1	0	0	0	109.7	I204 V213 C214 V256 L265 W273	I204-L253 HydrophobicContact CD1-CD1 3.65Å; I204-L253 HydrophobicContact CG2-CD1 4.25Å; I204-L253 HydrophobicContact CG2-CG 4.33Å; V213-L253 CarbonylContact C-O 3.57Å; V213-L253 WeakPolarHBondContact CA-O 3.44Å; V213-L253 HydrophobicContact CG1-CB 4.04Å; V213-L253 HydrophobicContact CG2-CB 4.23Å; V213-L253 HydrophobicContact CG2-CD1 4.41Å; C214-L253 PolarHBondContact N-O 3.01Å; L253-V256 HydrophobicContact CB-CG2 3.66Å; L253-V256 HydrophobicContact CD1-CG2 4.23Å; L253-L265 HydrophobicContact CD1-CD2 4.27Å; L253-L265 HydrophobicContact CD1-CG 4.24Å; L253-W273 HydrophobicContact CD1-CH2 4.47Å; L253-W273 HydrophobicContact CD1-CZ3 4.17Å; L253-W273 HydrophobicContact CD2-CD2 4.26Å; L253-W273 HydrophobicContact CD2-CE3 3.68Å; L253-W273 HydrophobicContact CD2-CH2 4.13Å; L253-W273 HydrophobicContact CD2-CZ3 3.61Å; L253-W273 HydrophobicContact CG-CE3 4.16Å; L253-W273 HydrophobicContact CG-CH2 4.48Å; L253-W273 HydrophobicContact CG-CZ3 3.78Å
254	D	93.4	Very high	85.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.268	C	S	.	.			trans	-148.6	154.9	179.1	-168	10.6	0	0	0	110.2	C214 D216 V256 S270 L271 V275 H276 N277 C278	C214-D254 HydrophobicContact CB-CB 4.03Å; C214-D254 VanDerWaalsContact CB-OD1 3.29Å; C214-D254 WeakPolarHBondContact CB-OD1 3.04Å; C214-D254 PolarHBondContact SG-OD1 3.36Å; D216-D254 WeakPolarHBondContact CB-OD1 3.17Å; D254-V256 PolarHBondContact O-N 3.36Å; D254-S270 WeakPolarHBondContact O-CA 3.28Å; D254-S270 WeakPolarHBondContact O-CB 2.98Å; D254-L271 HydrophobicContact CB-CD1 4.35Å; D254-L271 PolarHBondContact O-N 2.98Å; D254-V275 WeakPolarHBondContact CB-O 3.4Å; D254-H276 HydrophobicContact CB-CB 3.46Å; D254-H276 VanDerWaalsContact CB-CB 3.46Å; D254-H276 WeakPolarHBondContact OD2-CA 3.23Å; D254-H276 WeakPolarHBondContact OD2-CB 3.46Å; D254-N277 PolarHBondContact OD2-N 3.01Å; D254-N277 PolarHBondContact OD2-OD1 2.64Å; D254-C278 VanDerWaalsContact CG-SG 3.56Å; D254-C278 PolarHBondContact OD1-SG 3.45Å; D254-C278 PolarHBondContact OD2-SG 2.68Å; D254-C278 VanDerWaalsContact OD2-SG 3.36Å
255	N	90.3	Very high	86.4	Confident	41 Å²	41	45.4 Å²	45.4	22%	0.219	26%	0.262	C	S	.	.	S	Bend	trans	43.2	51.1	-166.9	-58.1	70.5	0	0	0	111.4	D216 D217 H257 L271	D216-N255 WeakPolarHBondContact O-CA 3.48Å; D217-N255 HydrophobicContact CB-CB 4.38Å; D217-N255 PolarHBondContact OD2-ND2 2.75Å; N255-H257 PolarHBondContact O-N 3.24Å; N255-L271 HydrophobicContact CB-CD2 4.44Å; N255-L271 HydrophobicContact CB-CG 4.04Å; N255-L271 VanDerWaalsContact OD1-CD1 3.23Å; N255-L271 WeakPolarHBondContact OD1-CD1 3.34Å
256	V	95.9	Very high	88.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	26%	0.261	C	S	.	.			trans	-69.8	120.7	-179.7	-178.4	0	0	0	0	108.5	V213 W218 D222 L253 D254 L265 C268 Q269	V213-V256 HydrophobicContact CG1-CG2 3.74Å; W218-V256 HydrophobicContact CE3-CB 4.01Å; W218-V256 HydrophobicContact CE3-CG1 4.41Å; W218-V256 HydrophobicContact CZ3-CB 4.07Å; W218-V256 HydrophobicContact CZ3-CG1 4.05Å; W218-V256 HydrophobicContact CZ3-CG2 4.42Å; D222-V256 HydrophobicContact CB-CG1 4.33Å; L253-V256 HydrophobicContact CB-CG2 3.66Å; L253-V256 HydrophobicContact CD1-CG2 4.23Å; D254-V256 PolarHBondContact O-N 3.36Å; V256-L265 HydrophobicContact CG1-CD1 3.88Å; V256-L265 HydrophobicContact CG1-CG 4.47Å; V256-C268 HydrophobicContact CG1-CB 3.98Å; V256-Q269 WeakPolarHBondContact CA-O 3.23Å
257	H	92.6	Very high	89	Confident	112 Å²	112	44.5 Å²	44.5	52%	0.519	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-129.2	94.2	-177.7	-164	77.5	0	0	0	110.5	N255 Q269	N255-H257 PolarHBondContact O-N 3.24Å; H257-Q269 PolarHBondContact N-O 3.49Å; H257-Q269 PolarHBondContact O-N 2.87Å
258	C	95.7	Very high	89.9	Confident	4 Å²	4	45 Å²	45	3%	0.027	27%	0.27	C	S	.	.			trans	-94	144.6	175	-56.2	0	0	0	0	111.1	P221 D222 V225 G260 E262 C268	P221-C258 VanDerWaalsContact CB-O 3.24Å; P221-C258 WeakPolarHBondContact CB-O 3.44Å; D222-C258 WeakPolarHBondContact OD1-CA 3.41Å; D222-C258 WeakPolarHBondContact OD1-CB 3.25Å; D222-C258 PolarHBondContact OD1-N 3.19Å; D222-C258 PolarHBondContact OD1-SG 2.03Å; V225-C258 HydrophobicContact CG2-CB 3.94Å; C258-G260 VanDerWaalsContact C-N 3.25Å; C258-E262 VanDerWaalsContact CA-OE1 3.31Å; C258-E262 WeakPolarHBondContact CA-OE1 2.88Å; C258-C268 HydrophobicContact CB-CB 3.95Å; C258-C268 WeakPolarHBondContact CB-SG 2.91Å; C258-C268 WeakPolarHBondContact SG-CB 3.07Å; C258-C268 CovalentContact SG-SG 2.02Å; C258-C268 PolarHBondContact SG-SG 3.15Å
259	E	90.4	Very high	90.8	Very high	182 Å²	182	46.4 Å²	46.4	85%	0.85	27%	0.268	S	S	*	.			trans	-78.3	-13	164.6	-62.4	-175.2	171.2	0	0	112	E262	E259-E262 PolarHBondContact N-OE1 2.84Å; E259-E262 PolarHBondContact N-OE2 2.88Å
260	G	83	Confident	91.6	Very high	25 Å²	25	46.5 Å²	46.5	26%	0.258	26%	0.263	S	S	.	.	S	Bend	trans	95.4	-7.9	-179.5	0	0	0	0	0	114	R228 C258 E262	R228-G260 PolarHBondContact NH2-O 2.05Å; C258-G260 VanDerWaalsContact C-N 3.25Å; G260-E262 WeakPolarHBondContact CA-OE2 3Å; G260-E262 PolarHBondContact N-OE2 3.18Å
261	G	84.9	Confident	91.7	Very high	56 Å²	56	49 Å²	49	58%	0.577	28%	0.277	S	S	*	.			trans	-91.4	-12	-179.4	0	0	0	0	0	114.4	R228	R228-G261 PolarHBondContact NH2-O 3.42Å
262	E	95.4	Very high	91.5	Very high	28 Å²	28	50 Å²	50	13%	0.131	29%	0.287	C	S	.	.			trans	-69.5	133.3	-170	-64.1	85.1	168.9	0	0	113.4	V225 R228 C258 E259 G260 R264 A267	V225-E262 HydrophobicContact CG1-CB 4.42Å; V225-E262 WeakPolarHBondContact CG1-O 3.35Å; V225-E262 HydrophobicContact CG2-CB 4.17Å; R228-E262 PolarHBondContact NH2-O 3.39Å; C258-E262 VanDerWaalsContact CA-OE1 3.31Å; C258-E262 WeakPolarHBondContact CA-OE1 2.88Å; E259-E262 PolarHBondContact N-OE1 2.84Å; E259-E262 PolarHBondContact N-OE2 2.88Å; G260-E262 WeakPolarHBondContact CA-OE2 3Å; G260-E262 PolarHBondContact N-OE2 3.18Å; E262-R264 PolarHBondContact O-N 3.14Å; E262-A267 HydrophobicContact CB-CB 4.4Å
263	P	88.7	Confident	91.3	Very high	99 Å²	99	53.8 Å²	53.8	64%	0.643	30%	0.301	S	S	*	.	S	Bend	trans	-66	-17.6	-173	27.8	-35.9	0	0	0	114.3
264	R	94.7	Very high	90.6	Very high	126 Å²	126	53.7 Å²	53.7	48%	0.475	30%	0.302	S	S	.	.	S	Bend	trans	-159.8	156.9	178.8	60	-176.3	121.4	113.8	0.9	110	V225 Q229 E262 A266 A267	V225-R264 VanDerWaalsContact CG1-C 3.42Å; Q229-R264 HydrophobicContact CG-CB 4.47Å; Q229-R264 VanDerWaalsContact OE1-CA 3.24Å; E262-R264 PolarHBondContact O-N 3.14Å; R264-A266 VanDerWaalsContact C-N 3.28Å; R264-A266 HydrophobicContact CG-CB 4.31Å; R264-A266 PolarHBondContact O-N 2.71Å; R264-A267 HydrophobicContact CG-CB 4.06Å; R264-A267 WeakPolarHBondContact O-CB 3.3Å; R264-A267 PolarHBondContact O-N 3.16Å
265	L	96.6	Very high	89.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-59	-39.3	-178.7	-166	65.8	0	0	0	112.6	V189 V202 I204 V213 W218 V225 V226 L253 V256 A267 C268	V189-L265 HydrophobicContact CG2-CB 3.94Å; V189-L265 HydrophobicContact CG2-CD2 4.24Å; V202-L265 HydrophobicContact CG1-CD2 3.86Å; I204-L265 HydrophobicContact CD1-CB 4.22Å; I204-L265 HydrophobicContact CD1-CD2 4.35Å; V213-L265 HydrophobicContact CG2-CD2 4.01Å; W218-L265 HydrophobicContact CH2-CD1 3.89Å; W218-L265 HydrophobicContact CH2-CD2 4.07Å; W218-L265 HydrophobicContact CZ3-CD1 3.88Å; W218-L265 HydrophobicContact CZ3-CD2 4.2Å; V225-L265 HydrophobicContact CG1-CB 4.46Å; V225-L265 HydrophobicContact CG1-CD1 4.5Å; V226-L265 HydrophobicContact CG2-CB 4.48Å; V226-L265 HydrophobicContact CG2-CD1 3.93Å; V226-L265 HydrophobicContact CG2-CD2 3.85Å; V226-L265 HydrophobicContact CG2-CG 4.32Å; L253-L265 HydrophobicContact CD1-CD2 4.27Å; L253-L265 HydrophobicContact CD1-CG 4.24Å; V256-L265 HydrophobicContact CG1-CD1 3.88Å; V256-L265 HydrophobicContact CG1-CG 4.47Å; L265-A267 PolarHBondContact O-N 3Å; L265-C268 WeakPolarHBondContact O-CB 3.15Å; L265-C268 PolarHBondContact O-N 2.78Å
266	A	94.4	Very high	89.6	Confident	26 Å²	26	52.4 Å²	52.4	22%	0.215	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-62.2	-5.2	176.1	0	0	0	0	0	115.4	I204 R264 W273	I204-A266 HydrophobicContact CD1-CB 4.05Å; R264-A266 VanDerWaalsContact C-N 3.28Å; R264-A266 HydrophobicContact CG-CB 4.31Å; R264-A266 PolarHBondContact O-N 2.71Å; A266-W273 HydrophobicContact CB-CH2 3.68Å; A266-W273 HydrophobicContact CB-CZ2 3.85Å
267	A	93.3	Very high	88.5	Confident	52 Å²	52	56.6 Å²	56.6	43%	0.43	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-103	-6	176.6	0	0	0	0	0	113.1	E262 R264 L265	E262-A267 HydrophobicContact CB-CB 4.4Å; R264-A267 HydrophobicContact CG-CB 4.06Å; R264-A267 WeakPolarHBondContact O-CB 3.3Å; R264-A267 PolarHBondContact O-N 3.16Å; L265-A267 PolarHBondContact O-N 3Å
268	C	94.8	Very high	87.8	Confident	13 Å²	13	51.5 Å²	51.5	9%	0.088	29%	0.294	C	S	.	.	S	Bend	trans	-74.2	160.8	173.2	-56.6	0	0	0	0	110.7	V256 C258 L265	V256-C268 HydrophobicContact CG1-CB 3.98Å; C258-C268 HydrophobicContact CB-CB 3.95Å; C258-C268 WeakPolarHBondContact CB-SG 2.91Å; C258-C268 WeakPolarHBondContact SG-CB 3.07Å; C258-C268 CovalentContact SG-SG 2.02Å; C258-C268 PolarHBondContact SG-SG 3.15Å; L265-C268 WeakPolarHBondContact O-CB 3.15Å; L265-C268 PolarHBondContact O-N 2.78Å
269	Q	93.7	Very high	86.5	Confident	150 Å²	150	52.3 Å²	52.3	70%	0.701	30%	0.303	S	S	*	.	B	Isolated β-bridge	trans	-68.8	141.7	171.7	-173.5	170.8	-7.7	0	0	109.2	V256 H257	V256-Q269 WeakPolarHBondContact CA-O 3.23Å; H257-Q269 PolarHBondContact N-O 3.49Å; H257-Q269 PolarHBondContact O-N 2.87Å
270	S	92.2	Very high	85.9	Confident	41 Å²	41	45.1 Å²	45.1	29%	0.287	27%	0.269	S	S	.	.			trans	-156.6	170.9	178	64.1	0	0	0	0	109.2	D254 G272	D254-S270 WeakPolarHBondContact O-CA 3.28Å; D254-S270 WeakPolarHBondContact O-CB 2.98Å; S270-G272 PolarHBondContact O-N 2.99Å; S270-G272 PolarHBondContact OG-N 3.01Å
271	L	82.4	Confident	84.9	Confident	67 Å²	67	45.8 Å²	45.8	35%	0.351	27%	0.266	S	S	.	.	S	Bend	trans	-63.9	-23.2	172.5	-66.4	-174.8	0	0	0	113.8	D254 N255 V275	D254-L271 HydrophobicContact CB-CD1 4.35Å; D254-L271 PolarHBondContact O-N 2.98Å; N255-L271 HydrophobicContact CB-CD2 4.44Å; N255-L271 HydrophobicContact CB-CG 4.04Å; N255-L271 VanDerWaalsContact OD1-CD1 3.23Å; N255-L271 WeakPolarHBondContact OD1-CD1 3.34Å; L271-V275 HydrophobicContact CB-CB 4.14Å; L271-V275 HydrophobicContact CB-CG1 3.95Å
272	G	83.4	Confident	84.8	Confident	22 Å²	22	44.9 Å²	44.9	23%	0.227	25%	0.246	C	C	.	.			trans	124.1	169	179.7	0	0	0	0	0	111.2	S270 G274 V275	S270-G272 PolarHBondContact O-N 2.99Å; S270-G272 PolarHBondContact OG-N 3.01Å; G272-G274 PolarHBondContact O-N 3.36Å; G272-V275 PolarHBondContact O-N 3.36Å
273	W	86.2	Confident	84.4	Confident	80 Å²	80	43.6 Å²	43.6	30%	0.303	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	120.4	-175.7	-63.4	109.2	0	0	0	111.9	L103 I204 H206 L252 L253 A266 V275	L103-W273 WeakPolarHBondContact CD2-O 3.32Å; I204-W273 HydrophobicContact CD1-CH2 3.86Å; I204-W273 HydrophobicContact CD1-CZ3 4.05Å; I204-W273 HydrophobicContact CG1-CZ3 4.48Å; I204-W273 HydrophobicContact CG2-CZ3 4.24Å; H206-W273 HydrophobicContact CB-CD2 4.3Å; H206-W273 HydrophobicContact CB-CE3 3.79Å; H206-W273 HydrophobicContact CB-CH2 4.46Å; H206-W273 HydrophobicContact CB-CZ3 3.87Å; H206-W273 AromaticContact CD2-CD2 3.86Å; H206-W273 AromaticContact CD2-CG 3.77Å; H206-W273 AromaticContact CE1-CD1 3.52Å; H206-W273 AromaticContact CE1-CD2 3.7Å; H206-W273 AromaticContact CE1-CE2 3.77Å; H206-W273 AromaticContact CE1-CG 3.56Å; H206-W273 AromaticContact CE1-NE1 3.65Å; H206-W273 AromaticContact CG-CD2 3.63Å; H206-W273 AromaticContact CG-CE3 3.62Å; H206-W273 AromaticContact ND1-CD2 3.51Å; H206-W273 AromaticContact ND1-CE2 3.54Å; H206-W273 AromaticContact ND1-CE3 3.9Å; H206-W273 AromaticContact ND1-CG 3.88Å; H206-W273 AromaticContact ND1-CZ2 3.96Å; H206-W273 AromaticContact ND1-NE1 3.9Å; H206-W273 AromaticContact NE2-CD1 3.77Å; H206-W273 AromaticContact NE2-CD2 3.94Å; H206-W273 AromaticContact NE2-CG 3.49Å; L252-W273 HydrophobicContact CB-CE3 4.29Å; L252-W273 WeakPolarHBondContact O-CA 3.49Å; L253-W273 HydrophobicContact CD1-CH2 4.47Å; L253-W273 HydrophobicContact CD1-CZ3 4.17Å; L253-W273 HydrophobicContact CD2-CD2 4.26Å; L253-W273 HydrophobicContact CD2-CE3 3.68Å; L253-W273 HydrophobicContact CD2-CH2 4.13Å; L253-W273 HydrophobicContact CD2-CZ3 3.61Å; L253-W273 HydrophobicContact CG-CE3 4.16Å; L253-W273 HydrophobicContact CG-CH2 4.48Å; L253-W273 HydrophobicContact CG-CZ3 3.78Å; A266-W273 HydrophobicContact CB-CH2 3.68Å; A266-W273 HydrophobicContact CB-CZ2 3.85Å; W273-V275 PolarHBondContact O-N 3.32Å
274	G	79.8	Confident	84.7	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.021	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	0.8	178.9	0	0	0	0	0	115.3	N93 L252 G272 H276	N93-G274 PolarHBondContact ND2-O 3.32Å; L252-G274 PolarHBondContact O-N 3.28Å; G272-G274 PolarHBondContact O-N 3.36Å; G274-H276 PolarHBondContact O-CD2 1.99Å; G274-H276 PolarHBondContact O-N 2.91Å
275	V	79.8	Confident	84.6	Confident	10 Å²	10	33 Å²	33	6%	0.061	19%	0.188	C	C	.	.			trans	-87.6	107.3	175.2	-178	0	0	0	0	106.7	V90 D254 L271 G272 W273	V90-V275 HydrophobicContact CG1-CG1 4.35Å; D254-V275 WeakPolarHBondContact CB-O 3.4Å; L271-V275 HydrophobicContact CB-CB 4.14Å; L271-V275 HydrophobicContact CB-CG1 3.95Å; G272-V275 PolarHBondContact O-N 3.36Å; W273-V275 PolarHBondContact O-N 3.32Å
276	H	83.6	Confident	84.5	Confident	3 Å²	3	32.9 Å²	32.9	1%	0.014	19%	0.187	C	C	.	.			trans	-154.9	157	178.9	68.4	91.7	0	0	0	109.2	V89 V90 I251 D254 G274 C278	V89-H276 WeakPolarHBondContact CG1-CE1 3.23Å; V89-H276 WeakPolarHBondContact CG1-O 3.39Å; V90-H276 VanDerWaalsContact CG2-C 3.48Å; V90-H276 WeakPolarHBondContact CG2-O 3.39Å; I251-H276 PolarHBondContact O-CD2 3.08Å; I251-H276 PolarHBondContact O-NE2 3.36Å; D254-H276 HydrophobicContact CB-CB 3.46Å; D254-H276 VanDerWaalsContact CB-CB 3.46Å; D254-H276 WeakPolarHBondContact OD2-CA 3.23Å; D254-H276 WeakPolarHBondContact OD2-CB 3.46Å; G274-H276 PolarHBondContact O-CD2 1.99Å; G274-H276 PolarHBondContact O-N 2.91Å; H276-C278 PolarHBondContact CE1-O 3.45Å; H276-C278 PolarHBondContact ND1-N 3.25Å; H276-C278 PolarHBondContact ND1-O 3.37Å
277	N	72.8	Confident	84.3	Confident	90 Å²	90	33.9 Å²	33.9	48%	0.481	19%	0.189	S	C	.	.			trans	-104.2	-1	164.8	60.8	-11.9	0	0	0	111.7	V90 D254	V90-N277 HydrophobicContact CG2-CB 4.05Å; D254-N277 PolarHBondContact OD2-N 3.01Å; D254-N277 PolarHBondContact OD2-OD1 2.64Å
278	C	77.2	Confident	84.2	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.034	17%	0.169	C	C	.	.			trans	-74.4	157.8	-174	-50.1	0	0	0	0	115.2	C214 I251 D254 H276 E282	C214-C278 HydrophobicContact CB-CB 3.65Å; C214-C278 WeakPolarHBondContact CB-SG 3.01Å; C214-C278 WeakPolarHBondContact SG-CB 2.95Å; C214-C278 CovalentContact SG-SG 2Å; C214-C278 PolarHBondContact SG-SG 2.8Å; I251-C278 HydrophobicContact CD1-CB 4.07Å; I251-C278 WeakPolarHBondContact CD1-O 3.39Å; D254-C278 VanDerWaalsContact CG-SG 3.56Å; D254-C278 PolarHBondContact OD1-SG 3.45Å; D254-C278 PolarHBondContact OD2-SG 2.68Å; D254-C278 VanDerWaalsContact OD2-SG 3.36Å; H276-C278 PolarHBondContact CE1-O 3.45Å; H276-C278 PolarHBondContact ND1-N 3.25Å; H276-C278 PolarHBondContact ND1-O 3.37Å; C278-E282 WeakPolarHBondContact CA-OE2 3.44Å; C278-E282 HydrophobicContact CB-CB 4.01Å; C278-E282 VanDerWaalsContact CB-OE2 3.31Å; C278-E282 WeakPolarHBondContact CB-OE2 3.28Å
279	G	69.2	Low	83.6	Confident	20 Å²	20	32.2 Å²	32.2	21%	0.206	18%	0.176	C	C	.	.			trans	-103.8	171.1	160.1	0	0	0	0	0	112.3	H281 E282	G279-H281 PolarHBondContact O-N 2.88Å; G279-E282 PolarHBondContact N-OE2 3.36Å; G279-E282 WeakPolarHBondContact O-CB 3.25Å; G279-E282 PolarHBondContact O-N 2.92Å
280	H	78.8	Confident	82.6	Confident	31 Å²	31	29.3 Å²	29.3	14%	0.144	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-65.5	-4.7	178.8	-77.1	-50.8	0	0	0	114.8	T212 A242 Y246 T248 G249 D283	T212-H280 PolarHBondContact OG1-CE1 3.02Å; T212-H280 PolarHBondContact OG1-ND1 3.49Å; A242-H280 WeakPolarHBondContact CB-O 3.26Å; Y246-H280 HydrophobicContact CD1-CB 3.83Å; Y246-H280 VanDerWaalsContact CD1-O 3.28Å; Y246-H280 WeakPolarHBondContact CD1-O 3.48Å; T248-H280 VanDerWaalsContact CA-NE2 3.35Å; T248-H280 WeakPolarHBondContact CA-NE2 3.45Å; G249-H280 PolarHBondContact N-NE2 3.34Å; G249-H280 PolarHBondContact O-NE2 2.81Å; G249-H280 VanDerWaalsContact O-NE2 3.09Å; H280-D283 IonicContact CG-OD1 2.83Å; H280-D283 IonicContact CG-OD2 3.52Å; H280-D283 IonicContact ND1-OD1 2.7Å; H280-D283 PolarHBondContact ND1-OD1 2.86Å; H280-D283 IonicContact ND1-OD2 3.56Å; H280-D283 PolarHBondContact ND1-OD2 3.24Å
281	H	60.1	Low	80.9	Confident	40 Å²	40	34 Å²	34	19%	0.185	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-72.3	-20.7	169.3	58.2	-73.2	0	0	0	111.9	N241 A242 Y246 G279 H436	N241-H281 CarbonylContact C-O 2.89Å; N241-H281 WeakPolarHBondContact CA-O 3.47Å; A242-H281 WeakPolarHBondContact CB-O 3.38Å; A242-H281 PolarHBondContact N-O 2.72Å; Y246-H281 HydrophobicContact CE1-CB 3.54Å; Y246-H281 WeakPolarHBondContact OH-CB 3.36Å; G279-H281 PolarHBondContact O-N 2.88Å; H281-H436 AromaticContact CG-CE1 3.87Å; H281-H436 AromaticContact ND1-CE1 3.86Å
282	E	82.8	Confident	79.4	Confident	37 Å²	37	33.1 Å²	33.1	17%	0.173	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-100.3	22.2	177.4	-65.2	156.2	115.7	0	0	110.7	C214 D215 C278 G279 A284	C214-E282 CarbonylContact C-O 3.56Å; C214-E282 VanDerWaalsContact CA-O 3.28Å; C214-E282 WeakPolarHBondContact CA-O 3.43Å; D215-E282 PolarHBondContact N-O 3.01Å; D215-E282 WeakPolarHBondContact OD1-CB 3.43Å; D215-E282 VanDerWaalsContact OD2-C 3.25Å; D215-E282 WeakPolarHBondContact OD2-CA 3.43Å; C278-E282 WeakPolarHBondContact CA-OE2 3.44Å; C278-E282 HydrophobicContact CB-CB 4.01Å; C278-E282 VanDerWaalsContact CB-OE2 3.31Å; C278-E282 WeakPolarHBondContact CB-OE2 3.28Å; G279-E282 PolarHBondContact N-OE2 3.36Å; G279-E282 WeakPolarHBondContact O-CB 3.25Å; G279-E282 PolarHBondContact O-N 2.92Å; E282-A284 PolarHBondContact O-N 3.22Å; E282-A284 VanDerWaalsContact O-N 3.14Å
283	D	87	Confident	77.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-70.2	114.7	178.6	-78.6	-19.1	0	0	0	111	R201 T212 V213 A242 G247 H280	R201-D283 WeakPolarHBondContact CD-OD2 3.42Å; R201-D283 HydrophobicContact CG-CB 4.01Å; T212-D283 WeakPolarHBondContact CB-OD1 3.13Å; T212-D283 WeakPolarHBondContact CG2-OD2 3.38Å; T212-D283 PolarHBondContact OG1-OD1 3.33Å; V213-D283 CarbonylContact O-C 3.58Å; V213-D283 WeakPolarHBondContact O-CA 3.31Å; A242-D283 VanDerWaalsContact CA-O 3.27Å; A242-D283 WeakPolarHBondContact CA-O 3.5Å; A242-D283 HydrophobicContact CB-CB 4.24Å; A242-D283 PolarHBondContact N-O 3.11Å; G247-D283 WeakPolarHBondContact CA-OD2 3.36Å; G247-D283 PolarHBondContact N-OD2 2.98Å; H280-D283 IonicContact CG-OD1 2.83Å; H280-D283 IonicContact CG-OD2 3.52Å; H280-D283 IonicContact ND1-OD1 2.7Å; H280-D283 PolarHBondContact ND1-OD1 2.86Å; H280-D283 IonicContact ND1-OD2 3.56Å; H280-D283 PolarHBondContact ND1-OD2 3.24Å
284	A	95.1	Very high	74.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.242	C	C	.	.			trans	-62.1	148.7	177.3	0	0	0	0	0	113.3	V202 V213 D215 W218 E282	V202-A284 PolarHBondContact N-O 3.28Å; V213-A284 HydrophobicContact CB-CB 4.34Å; V213-A284 HydrophobicContact CG1-CB 4.31Å; V213-A284 VanDerWaalsContact O-CB 3.32Å; V213-A284 WeakPolarHBondContact O-CB 3.33Å; V213-A284 PolarHBondContact O-N 2.88Å; D215-A284 HydrophobicContact CB-CB 3.93Å; W218-A284 HydrophobicContact CB-CB 4.42Å; W218-A284 HydrophobicContact CD2-CB 3.65Å; W218-A284 HydrophobicContact CE3-CB 4.16Å; W218-A284 HydrophobicContact CG-CB 3.73Å; W218-A284 HydrophobicContact CZ2-CB 4.4Å; E282-A284 PolarHBondContact O-N 3.22Å; E282-A284 VanDerWaalsContact O-N 3.14Å
285	G	93.1	Very high	72.7	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	167.7	174.6	0	0	0	0	0	113	G200 W218 T239	G200-G285 CarbonylContact O-C 3.4Å; G200-G285 VanDerWaalsContact O-CA 3.23Å; G200-G285 WeakPolarHBondContact O-CA 3.38Å; W218-G285 PolarHBondContact NE1-O 2.88Å; T239-G285 PolarHBondContact N-O 2.98Å; T239-G285 PolarHBondContact O-N 3.36Å; T239-G285 WeakPolarHBondContact OG1-CA 3.31Å; T239-G285 PolarHBondContact OG1-N 3.24Å; T239-G285 PolarHBondContact OG1-O 3.17Å
286	A	94.7	Very high	70.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.4	177.6	0	0	0	0	0	110.8	L191 Q199 G200 V202 A223 V226	L191-A286 HydrophobicContact CD2-CB 4.19Å; Q199-A286 CarbonylContact C-O 3.57Å; Q199-A286 VanDerWaalsContact CA-O 3.24Å; Q199-A286 WeakPolarHBondContact CA-O 3.01Å; G200-A286 PolarHBondContact N-O 3.07Å; G200-A286 PolarHBondContact O-N 2.8Å; V202-A286 HydrophobicContact CG2-CB 4.01Å; A223-A286 HydrophobicContact CB-CB 4.07Å; V226-A286 HydrophobicContact CG1-CB 4.24Å
287	L	89.6	Confident	68.3	Low	46 Å²	46	58 Å²	58	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	115.9	170.1	-166.4	153.9	0	0	0	108.8	Q199 M236 A237	Q199-L287 HydrophobicContact CB-CG 4.16Å; M236-L287 HydrophobicContact CB-CD2 3.65Å; M236-L287 WeakPolarHBondContact CB-O 3.42Å; M236-L287 HydrophobicContact CE-CD2 4.4Å; M236-L287 HydrophobicContact CG-CD2 4.15Å; M236-L287 PolarHBondContact N-O 2.92Å; M236-L287 HydrophobicContact SD-CD2 3.76Å; A237-L287 HydrophobicContact CB-CB 4.18Å; A237-L287 PolarHBondContact N-O 3.33Å; A237-L287 VanDerWaalsContact N-O 3.17Å; A237-L287 PolarHBondContact O-N 3.07Å
288	C	92.2	Very high	66.4	Low	4 Å²	4	58.3 Å²	58.3	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	148.7	-177.6	-45.3	0	0	0	0	111.8	C198 C227 C232 A234 V290	C198-C288 HydrophobicContact CB-CB 4.15Å; C198-C288 VanDerWaalsContact O-CB 3.27Å; C198-C288 WeakPolarHBondContact O-CB 3.5Å; C198-C288 PolarHBondContact O-N 2.81Å; C198-C288 PolarHBondContact O-SG 2.78Å; C198-C288 VanDerWaalsContact O-SG 3.39Å; C227-C288 WeakPolarHBondContact CA-SG 3.43Å; C227-C288 HydrophobicContact CB-CB 3.74Å; C227-C288 WeakPolarHBondContact CB-SG 3.43Å; C227-C288 VanDerWaalsContact SG-CA 3.53Å; C227-C288 WeakPolarHBondContact SG-CB 3.09Å; C227-C288 CovalentContact SG-SG 2.03Å; C227-C288 PolarHBondContact SG-SG 3.49Å; C232-C288 HydrophobicContact CB-CB 3.64Å; C232-C288 WeakPolarHBondContact O-CB 3.25Å; A234-C288 CarbonylContact O-C 2.95Å; A234-C288 WeakPolarHBondContact O-CA 3.46Å; C288-V290 PolarHBondContact O-N 3.03Å
289	A	82.4	Confident	64.4	Low	27 Å²	27	65.7 Å²	65.7	22%	0.223	40%	0.403	C	S	.	.			trans	-72.5	97.5	170.3	0	0	0	0	0	108.8	C232 A234 M236 L291	C232-A289 CarbonylContact O-C 3.53Å; A234-A289 WeakPolarHBondContact O-CB 3.27Å; A234-A289 PolarHBondContact O-N 2.83Å; M236-A289 HydrophobicContact CG-CB 3.75Å; M236-A289 HydrophobicContact SD-CB 3.88Å; A289-L291 PolarHBondContact O-N 3.19Å
290	V	72.3	Confident	62.6	Low	89 Å²	89	70.4 Å²	70.4	54%	0.539	43%	0.43	S	S	.	.			trans	-56.6	101.4	172.1	-177.8	0	0	0	0	108.1	C198 C288 G292	C198-V290 HydrophobicContact CB-CG2 3.74Å; C288-V290 PolarHBondContact O-N 3.03Å; V290-G292 PolarHBondContact O-N 2.98Å
291	L	57.5	Low	60.4	Low	140 Å²	140	74.6 Å²	74.6	73%	0.733	46%	0.463	S	S	*	.			trans	-69.3	91.1	169.2	-67.1	177.4	0	0	0	106.8	A289	A289-L291 PolarHBondContact O-N 3.19Å
292	G	50.2	Low	59.1	Low	47 Å²	47	78.3 Å²	78.3	49%	0.485	49%	0.493	S	S	.	.			trans	-55	148.1	158.5	0	0	0	0	0	108.9	V290	V290-G292 PolarHBondContact O-N 2.98Å
293	P	38.3	Very low	56.5	Low	117 Å²	117	80.6 Å²	80.6	76%	0.76	52%	0.519	S	S	*	.			trans	-53.5	138.9	175.2	22	-31.1	0	0	0	109.3	T295	P293-T295 PolarHBondContact O-N 2.96Å
294	P	37.3	Very low	53.9	Low	114 Å²	114	86.9 Å²	86.9	74%	0.74	56%	0.557	S	S	*	*			trans	-69.1	102.7	-167.9	28	-33.3	0	0	0	109.3	L296	P294-L296 PolarHBondContact O-N 2.87Å
295	T	33.2	Very low	50.8	Low	129 Å²	129	97.9 Å²	97.9	79%	0.791	60%	0.599	S	S	*	*			trans	-68.2	91.7	154	19.6	0	0	0	0	106.6	P293 T297	P293-T295 PolarHBondContact O-N 2.96Å; T295-T297 PolarHBondContact O-N 2.76Å; T295-T297 PolarHBondContact O-OG1 2.75Å
296	L	39.3	Very low	47.7	Very low	166 Å²	166	105.4 Å²	105.4	87%	0.869	63%	0.634	S	S	*	*			trans	-53.5	86.1	163	-84	161.4	0	0	0	108.6	P294	P294-L296 PolarHBondContact O-N 2.87Å
297	T	31.5	Very low	44.4	Very low	115 Å²	115	111.2 Å²	111.2	71%	0.706	67%	0.665	S	S	*	*			trans	-101	89	163.4	-29.9	0	0	0	0	105	T295 L299	T295-T297 PolarHBondContact O-N 2.76Å; T295-T297 PolarHBondContact O-OG1 2.75Å; T297-L299 PolarHBondContact O-N 3.24Å
298	A	33.5	Very low	41.3	Very low	96 Å²	96	120.9 Å²	120.9	79%	0.793	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-55.3	117.6	169.8	0	0	0	0	0	108.7
299	L	34.7	Very low	38.1	Very low	160 Å²	160	123.7 Å²	123.7	84%	0.838	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-101.9	130	160.1	-86.5	156.6	0	0	0	107.4	T297	T297-L299 PolarHBondContact O-N 3.24Å
300	P	31.9	Very low	35.4	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-72.4	141.7	-174.9	29.8	-31.4	0	0	0	110.4
301	S	31.7	Very low	33.3	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.4	120.9	173	29.2	0	0	0	0	111.1
302	S	32.7	Very low	31.9	Very low	117 Å²	117	136.2 Å²	136.2	82%	0.818	76%	0.764	S	S	*	*			trans	-174.4	141.8	145.2	54.1	0	0	0	0	113.1
303	A	29.2	Very low	30.9	Very low	86 Å²	86	141.1 Å²	141.1	71%	0.711	78%	0.779	S	S	*	*			trans	96.3	83.7	154.4	0	0	0	0	0	119.9
304	T	31.5	Very low	31.2	Very low	132 Å²	132	140 Å²	140	81%	0.81	77%	0.772	S	S	*	*				35.8	116.2	119.3	52.6	0	0	0	0	121.7
305	R	30.6	Very low	30.7	Very low	231 Å²	231	140.2 Å²	140.2	87%	0.872	78%	0.776	S	S	*	*				32.5	108.9	118.7	-151.5	-165.2	-76.8	175.3	-4.4	118.4
306	Q	26.5	Very low	30.4	Very low	160 Å²	160	138.8 Å²	138.8	75%	0.748	78%	0.778	S	S	*	*				162.3	134.3	113.6	-88.9	-169.2	-69.8	0	0	113.2
307	D	25.5	Very low	30	Very low	121 Å²	121	138 Å²	138	65%	0.647	78%	0.78	S	S	*	*			trans	51.7	132.8	136.3	-54.2	-32.6	0	0	0	123.1
308	W	25.5	Very low	29.8	Very low	250 Å²	250	136.2 Å²	136.2	95%	0.947	78%	0.784	S	S	*	*			trans	124.4	133	138.5	-120.4	-70.1	0	0	0	117.6
309	A	25.8	Very low	29.6	Very low	62 Å²	62	139 Å²	139	51%	0.512	79%	0.791	S	S	.	*			trans	-82.8	167.9	-173.2	0	0	0	0	0	114.5
310	W	25.3	Very low	29.2	Very low	218 Å²	218	134.5 Å²	134.5	83%	0.826	78%	0.784	S	S	*	*			trans	64.3	118.3	161	-58.2	106.1	0	0	0	117.6
311	H	28.3	Very low	29.2	Very low	185 Å²	185	135 Å²	135	86%	0.856	79%	0.787	S	S	*	*				-173	145.3	112.5	-91.5	-62.1	0	0	0	111.7
312	T	28.2	Very low	29.1	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	78%	0.784	S	S	*	*			trans	-77.7	156.2	178.4	41.3	0	0	0	0	113.8
313	D	28.6	Very low	28.9	Very low	151 Å²	151	137 Å²	137	81%	0.807	78%	0.78	S	S	*	*			trans	99.9	164.3	143.3	-125.3	21.8	0	0	0	119.1
314	P	44.3	Very low	28.9	Very low	93 Å²	93	138.2 Å²	138.2	60%	0.604	78%	0.783	S	S	*	*				-128	-178.7	-107.8	40.2	-20.6	0	0	0	113.4
315	S	27.1	Very low	28.9	Very low	118 Å²	118	142.9 Å²	142.9	83%	0.825	79%	0.786	S	S	*	*			trans	69	113.8	162.8	-55.4	0	0	0	0	118.5
316	A	27.2	Very low	28.8	Very low	100 Å²	100	140.4 Å²	140.4	83%	0.826	79%	0.785	S	S	*	*				-163.9	130.3	129	0	0	0	0	0	111.9
317	T	30.6	Very low	28.8	Very low	148 Å²	148	140.1 Å²	140.1	91%	0.908	79%	0.794	S	S	*	*			trans	-54.5	145.4	168.6	47.1	0	0	0	0	114.9
318	G	27.6	Very low	29	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	80%	0.798	S	S	*	*			trans	-179.7	122	162.1	0	0	0	0	0	112.6
319	V	28.9	Very low	29.4	Very low	154 Å²	154	134.6 Å²	134.6	93%	0.933	79%	0.794	S	S	*	*			trans	-101.7	142.4	-164.8	166.4	0	0	0	0	112.4
320	G	25.8	Very low	29.6	Very low	67 Å²	67	139.2 Å²	139.2	69%	0.691	81%	0.81	S	S	*	*			trans	118.9	154	143.6	0	0	0	0	0	116.7
321	P	33.4	Very low	29.6	Very low	129 Å²	129	135.2 Å²	135.2	84%	0.838	81%	0.809	S	S	*	*			cis	-126.3	165	-11.7	36.5	-18.6	0	0	0	115.2
322	Q	29.4	Very low	29.8	Very low	165 Å²	165	133.3 Å²	133.3	77%	0.771	81%	0.811	S	S	*	*			trans	-61.8	159.8	172.1	-86	-141.9	-80.7	0	0	115
323	P	26.8	Very low	30.1	Very low	113 Å²	113	132.4 Å²	132.4	73%	0.734	82%	0.815	S	S	*	*			trans	-111.6	128.9	135.1	12.7	6.2	0	0	0	113.1
324	S	29.3	Very low	30	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	81%	0.813	S	S	*	*			trans	10.4	124.9	157.5	54.8	0	0	0	0	122
325	R	31.8	Very low	29.3	Very low	230 Å²	230	137.4 Å²	137.4	87%	0.868	83%	0.831	S	S	*	*			trans	-74.3	110.3	163.8	-171.6	-175	-165.5	-179.2	3.1	110.2
326	E	28.3	Very low	29.5	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	83%	0.831	S	S	*	*			trans	172.1	77.3	141.3	-97.1	170.1	-175.8	0	0	111.8
327	T	27.9	Very low	29.6	Very low	154 Å²	154	136.3 Å²	136.3	95%	0.945	83%	0.829	S	S	*	*			trans	-145.5	51.3	139.3	-42	0	0	0	0	108.2
328	A	29.7	Very low	29.4	Very low	89 Å²	89	133 Å²	133	74%	0.736	83%	0.825	S	S	*	*			trans	-105.9	97.5	163.9	0	0	0	0	0	107
329	L	33.2	Very low	30.1	Very low	165 Å²	165	139.3 Å²	139.3	86%	0.864	83%	0.83	S	S	*	*			trans	-155	120.7	154	-100.2	162.8	0	0	0	107
330	L	30.3	Very low	30.5	Very low	160 Å²	160	139.9 Å²	139.9	84%	0.838	82%	0.82	S	S	*	*	S	Bend	trans	81	98.2	-173	-49.4	165.1	0	0	0	112.4
331	T	25.5	Very low	31.3	Very low	133 Å²	133	143.1 Å²	143.1	82%	0.816	83%	0.832	S	S	*	*			cis	-166.5	116.2	24.4	-1.2	0	0	0	0	107.7
332	T	33.1	Very low	32.2	Very low	146 Å²	146	138.2 Å²	138.2	90%	0.896	80%	0.804	S	S	*	*			trans	-135.7	130.1	155.5	39.1	0	0	0	0	110.4
333	A	33.4	Very low	34.6	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	79%	0.787	S	S	*	*			trans	67.4	91.4	148.8	0	0	0	0	0	119.2
334	A	26.9	Very low	37.8	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	75%	0.754	S	S	*	*	S	Bend	trans	-150.1	64.9	142	0	0	0	0	0	111.3
335	W	28.6	Very low	40.9	Very low	255 Å²	255	129.9 Å²	129.9	97%	0.966	74%	0.735	S	S	*	*			trans	-167.5	62.2	140.3	-99.1	-45.8	0	0	0	109.9
336	A	32.5	Very low	43.8	Very low	101 Å²	101	120 Å²	120	84%	0.835	70%	0.699	S	S	*	*			trans	-92.7	92	153.4	0	0	0	0	0	107
337	A	27.9	Very low	46.8	Very low	95 Å²	95	113.4 Å²	113.4	79%	0.785	67%	0.671	S	S	*	*			trans	-141.5	85.9	163.7	0	0	0	0	0	108.2
338	G	27.2	Very low	49.3	Very low	79 Å²	79	108.9 Å²	108.9	81%	0.814	66%	0.655	S	S	*	*	S	Bend	trans	138.1	79.8	175.4	0	0	0	0	0	112.9
339	K	42.6	Very low	51.6	Low	209 Å²	209	105.6 Å²	105.6	91%	0.909	63%	0.63	S	S	*	*			trans	-50	134.7	173.2	-76.4	175.8	173.8	177.4	0	111.8
340	K	37.5	Very low	53.3	Low	167 Å²	167	102 Å²	102	73%	0.726	62%	0.616	S	S	*	*				-151	128	103.2	-73.5	-164.2	-174.6	164.4	0	110.1	G342	K340-G342 PolarHBondContact O-N 2.65Å
341	S	43.2	Very low	55.4	Low	134 Å²	134	96.4 Å²	96.4	94%	0.937	60%	0.598	S	S	*	*			trans	-80.7	102.3	174.4	176.7	0	0	0	0	108
342	G	51.2	Low	58.2	Low	26 Å²	26	95.5 Å²	95.5	27%	0.268	59%	0.594	S	S	.	*			trans	-108	140.8	171.2	0	0	0	0	0	110.4	K340 L344	K340-G342 PolarHBondContact O-N 2.65Å; G342-L344 PolarHBondContact O-N 3.32Å
343	R	80.3	Confident	60.8	Low	105 Å²	105	89.1 Å²	89.1	40%	0.396	56%	0.555	S	S	.	*	S	Bend	trans	-72.3	8.8	159.7	-71.5	180	69.9	-179.2	-0.3	110.9	V359 L360	R343-V359 CarbonylContact O-C 2.83Å; R343-V359 VanDerWaalsContact O-CA 3.27Å; R343-V359 WeakPolarHBondContact O-CA 3.23Å; R343-L360 HydrophobicContact CB-CB 4.36Å; R343-L360 PolarHBondContact NE-O 3.14Å; R343-L360 PolarHBondContact NH2-O 2.92Å; R343-L360 PolarHBondContact O-N 3.49Å
344	L	93.9	Very high	63.3	Low	8 Å²	8	86.6 Å²	86.6	4%	0.042	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.7	-178.1	-172.3	150.3	0	0	0	109.6	G342 L346 V357 E358 V359 A381 E384 A385 L420	G342-L344 PolarHBondContact O-N 3.32Å; L344-L346 HydrophobicContact CD2-CD2 4.22Å; L344-V357 HydrophobicContact CD1-CG1 3.73Å; L344-V357 HydrophobicContact CD2-CG1 4.3Å; L344-V357 HydrophobicContact CG-CG1 4.01Å; L344-E358 CarbonylContact C-O 3.54Å; L344-E358 VanDerWaalsContact CA-O 3.26Å; L344-E358 WeakPolarHBondContact CA-O 3.08Å; L344-V359 HydrophobicContact CD1-CG1 4.06Å; L344-V359 HydrophobicContact CG-CG1 4.29Å; L344-A381 HydrophobicContact CD1-CB 3.94Å; L344-A381 HydrophobicContact CD2-CB 4.46Å; L344-E384 HydrophobicContact CB-CG 3.97Å; L344-E384 HydrophobicContact CD1-CB 4.46Å; L344-A385 HydrophobicContact CD2-CB 3.77Å; L344-L420 HydrophobicContact CD1-CB 4.1Å; L344-L420 HydrophobicContact CD1-CD2 3.95Å
345	R	93.4	Very high	66.2	Low	101 Å²	101	82.1 Å²	82.1	38%	0.381	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	155.2	172.8	68.2	-178.3	-175.6	-170	-0.1	110.9	V347 E358 W365	R345-V347 HydrophobicContact CG-CG2 3.76Å; R345-E358 HydrophobicContact CG-CB 3.89Å; R345-E358 IonicContact CZ-OE2 3.12Å; R345-E358 PolarHBondContact N-O 2.96Å; R345-E358 IonicContact NE-OE2 2.77Å; R345-E358 PolarHBondContact NE-OE2 3.43Å; R345-E358 IonicContact NH2-OE2 3.2Å; R345-E358 PolarHBondContact NH2-OE2 3.28Å; R345-E358 PolarHBondContact O-N 3.2Å; R345-W365 HydrophobicContact CB-CH2 4.04Å; R345-W365 HydrophobicContact CB-CZ3 4.02Å; R345-W365 HydrophobicContact CG-CE3 3.86Å; R345-W365 HydrophobicContact CG-CH2 3.88Å; R345-W365 HydrophobicContact CG-CZ3 3.51Å
346	L	93.4	Very high	69.4	Low	22 Å²	22	71 Å²	71	12%	0.115	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126	172.5	-58.4	178.7	0	0	0	109.2	L344 R356 V357 A385 A441 C443	L344-L346 HydrophobicContact CD2-CD2 4.22Å; L346-R356 CarbonylContact C-O 3.43Å; L346-R356 VanDerWaalsContact CA-O 3.31Å; L346-R356 WeakPolarHBondContact CA-O 3.4Å; L346-V357 HydrophobicContact CD2-CB 4.47Å; L346-V357 HydrophobicContact CD2-CG2 3.81Å; L346-A385 HydrophobicContact CD1-CB 4.32Å; L346-A385 HydrophobicContact CG-CB 4.33Å; L346-A441 HydrophobicContact CD2-CB 3.98Å; L346-C443 VanDerWaalsContact CD1-SG 3.57Å
347	V	92	Very high	72.5	Confident	43 Å²	43	66.1 Å²	66.1	26%	0.261	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.6	-171.9	-172.4	0	0	0	0	111.4	R345 G349 G355 R356 E358	R345-V347 HydrophobicContact CG-CG2 3.76Å; V347-G349 VanDerWaalsContact C-N 3.3Å; V347-G349 PolarHBondContact O-N 2.85Å; V347-G355 CarbonylContact O-C 3.53Å; V347-G355 VanDerWaalsContact O-CA 3.22Å; V347-G355 WeakPolarHBondContact O-CA 3.27Å; V347-R356 PolarHBondContact N-O 3.3Å; V347-R356 PolarHBondContact O-N 3.22Å; V347-E358 HydrophobicContact CG2-CG 4.32Å
348	G	79.1	Confident	75.7	Confident	58 Å²	58	62 Å²	62	60%	0.598	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	82.5	-5.3	170	0	0	0	0	0	115.9
349	G	77.9	Confident	78.9	Confident	20 Å²	20	58.6 Å²	58.6	21%	0.206	33%	0.334	C	S	.	.	S	Bend	trans	-90.4	168.5	176.7	0	0	0	0	0	115	V347 G351 R354	V347-G349 VanDerWaalsContact C-N 3.3Å; V347-G349 PolarHBondContact O-N 2.85Å; G349-G351 VanDerWaalsContact C-N 3.3Å; G349-G351 PolarHBondContact O-N 2.9Å; G349-R354 VanDerWaalsContact CA-O 3.24Å; G349-R354 WeakPolarHBondContact CA-O 3.28Å; G349-R354 PolarHBondContact N-O 3.29Å
350	P	69.4	Low	80.9	Confident	90 Å²	90	51.1 Å²	51.1	58%	0.584	30%	0.303	S	S	*	.	S	Bend	trans	-75	81.3	177.8	31.4	-33.8	0	0	0	110.5
351	G	75.3	Confident	83	Confident	43 Å²	43	46 Å²	46	44%	0.443	28%	0.282	S	S	.	.	S	Bend	trans	111.8	174.5	179	0	0	0	0	0	113.6	G349 C353	G349-G351 VanDerWaalsContact C-N 3.3Å; G349-G351 PolarHBondContact O-N 2.9Å; G351-C353 VanDerWaalsContact C-N 3.29Å; G351-C353 PolarHBondContact O-N 2.79Å
352	P	82.8	Confident	84.4	Confident	113 Å²	113	44.3 Å²	44.3	73%	0.734	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14	-170.7	30	-36.2	0	0	0	114.6
353	C	88	Confident	85.3	Confident	12 Å²	12	46.7 Å²	46.7	8%	0.081	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	21.7	-173.9	-70.6	0	0	0	0	113.5	G351 C387 C443	G351-C353 VanDerWaalsContact C-N 3.29Å; G351-C353 PolarHBondContact O-N 2.79Å; C353-C387 WeakPolarHBondContact CA-SG 3.47Å; C353-C387 HydrophobicContact CB-CB 3.52Å; C353-C387 WeakPolarHBondContact CB-SG 3.19Å; C353-C387 VanDerWaalsContact SG-CA 3.55Å; C353-C387 WeakPolarHBondContact SG-CB 2.99Å; C353-C387 CovalentContact SG-SG 2.05Å; C353-C387 PolarHBondContact SG-SG 3.01Å; C353-C443 HydrophobicContact CB-CB 4.15Å; C353-C443 WeakPolarHBondContact O-CA 3.35Å; C353-C443 VanDerWaalsContact O-CB 3.24Å; C353-C443 WeakPolarHBondContact O-CB 3.37Å; C353-C443 PolarHBondContact O-N 3.5Å; C353-C443 PolarHBondContact O-SG 2.83Å
354	R	85.9	Confident	85.2	Confident	43 Å²	43	43.4 Å²	43.4	16%	0.162	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	133.3	178.4	-59.9	178.9	-177.8	-171	-5.6	107.8	G349 F399 A441 L442 E448 D470	G349-R354 VanDerWaalsContact CA-O 3.24Å; G349-R354 WeakPolarHBondContact CA-O 3.28Å; G349-R354 PolarHBondContact N-O 3.29Å; R354-F399 HydrophobicContact CB-CE1 4.45Å; R354-F399 HydrophobicContact CB-CZ 4.38Å; R354-A441 WeakPolarHBondContact CA-O 3.16Å; R354-L442 HydrophobicContact CB-CD2 4.24Å; R354-L442 HydrophobicContact CG-CD2 3.95Å; R354-E448 IonicContact CZ-OE1 2.75Å; R354-E448 IonicContact NH2-OE1 3.24Å; R354-E448 PolarHBondContact NH2-OE1 2.62Å; R354-E448 IonicContact NH2-OE2 3.43Å; R354-E448 PolarHBondContact NH2-OE2 2.81Å; R354-D470 IonicContact CZ-OD2 3.1Å; R354-D470 IonicContact NH1-OD2 2.75Å; R354-D470 PolarHBondContact NH1-OD2 2.75Å; R354-D470 IonicContact NH2-OD2 2.65Å; R354-D470 PolarHBondContact NH2-OD2 2.89Å
355	G	89.1	Confident	84.8	Confident	0 Å²	0	47 Å²	47	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.2	175.8	178	0	0	0	0	0	113.8	V347 F399 G440 A441	V347-G355 CarbonylContact O-C 3.53Å; V347-G355 VanDerWaalsContact O-CA 3.22Å; V347-G355 WeakPolarHBondContact O-CA 3.27Å; G355-F399 VanDerWaalsContact CA-CD2 3.47Å; G355-F399 VanDerWaalsContact CA-CG 3.46Å; G355-G440 CarbonylContact O-C 3.58Å; G355-G440 VanDerWaalsContact O-CA 3.29Å; G355-G440 WeakPolarHBondContact O-CA 3.39Å; G355-A441 PolarHBondContact N-O 2.75Å; G355-A441 VanDerWaalsContact N-O 3.07Å; G355-A441 PolarHBondContact O-N 3.14Å
356	R	94.4	Very high	84.4	Confident	21 Å²	21	42.2 Å²	42.2	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	134.6	166.9	-179.8	177.9	58.9	-100.3	-0.9	109.4	L346 V347 E358 F399 G400 D438 A439	L346-R356 CarbonylContact C-O 3.43Å; L346-R356 VanDerWaalsContact CA-O 3.31Å; L346-R356 WeakPolarHBondContact CA-O 3.4Å; V347-R356 PolarHBondContact N-O 3.3Å; V347-R356 PolarHBondContact O-N 3.22Å; R356-E358 HydrophobicContact CG-CG 4.49Å; R356-E358 IonicContact CZ-OE1 3.34Å; R356-E358 VanDerWaalsContact CZ-OE1 3.27Å; R356-E358 IonicContact NE-OE1 3.06Å; R356-E358 PolarHBondContact NE-OE1 2.9Å; R356-E358 IonicContact NH2-OE1 2.75Å; R356-E358 PolarHBondContact NH2-OE1 3.26Å; R356-F399 HydrophobicContact CB-CB 4.21Å; R356-F399 PolarHBondContact NH1-O 2.77Å; R356-G400 PolarHBondContact NH1-O 2.96Å; R356-D438 WeakPolarHBondContact CD-OD2 3.33Å; R356-D438 HydrophobicContact CG-CB 3.96Å; R356-A439 WeakPolarHBondContact CA-O 3.31Å
357	V	97.3	Very high	84.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.2	178.8	-177.3	0	0	0	0	109	L344 L346 V368 W373 A381 L420 A439 A441	L344-V357 HydrophobicContact CD1-CG1 3.73Å; L344-V357 HydrophobicContact CD2-CG1 4.3Å; L344-V357 HydrophobicContact CG-CG1 4.01Å; L346-V357 HydrophobicContact CD2-CB 4.47Å; L346-V357 HydrophobicContact CD2-CG2 3.81Å; V357-V368 HydrophobicContact CB-CG2 4.36Å; V357-V368 HydrophobicContact CG1-CG2 3.9Å; V357-V368 PolarHBondContact O-N 2.71Å; V357-W373 HydrophobicContact CB-CH2 4.45Å; V357-W373 HydrophobicContact CG1-CH2 4.27Å; V357-W373 HydrophobicContact CG2-CH2 4.06Å; V357-W373 HydrophobicContact CG2-CZ2 3.74Å; V357-A381 HydrophobicContact CG1-CB 4.26Å; V357-A381 HydrophobicContact CG2-CB 4.21Å; V357-L420 HydrophobicContact CG1-CD2 3.93Å; V357-A439 PolarHBondContact N-O 3.22Å; V357-A441 HydrophobicContact CG2-CB 3.77Å
358	E	96.2	Very high	84.6	Confident	9 Å²	9	39.1 Å²	39.1	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.1	173.8	-67.8	-178.8	-169.7	0	0	110.3	L344 R345 V347 R356 W365 G366 T367	L344-E358 CarbonylContact C-O 3.54Å; L344-E358 VanDerWaalsContact CA-O 3.26Å; L344-E358 WeakPolarHBondContact CA-O 3.08Å; R345-E358 HydrophobicContact CG-CB 3.89Å; R345-E358 IonicContact CZ-OE2 3.12Å; R345-E358 PolarHBondContact N-O 2.96Å; R345-E358 IonicContact NE-OE2 2.77Å; R345-E358 PolarHBondContact NE-OE2 3.43Å; R345-E358 IonicContact NH2-OE2 3.2Å; R345-E358 PolarHBondContact NH2-OE2 3.28Å; R345-E358 PolarHBondContact O-N 3.2Å; V347-E358 HydrophobicContact CG2-CG 4.32Å; R356-E358 HydrophobicContact CG-CG 4.49Å; R356-E358 IonicContact CZ-OE1 3.34Å; R356-E358 VanDerWaalsContact CZ-OE1 3.27Å; R356-E358 IonicContact NE-OE1 3.06Å; R356-E358 PolarHBondContact NE-OE1 2.9Å; R356-E358 IonicContact NH2-OE1 2.75Å; R356-E358 PolarHBondContact NH2-OE1 3.26Å; E358-W365 HydrophobicContact CB-CE3 4.18Å; E358-W365 WeakPolarHBondContact O-CZ3 3.32Å; E358-G366 CarbonylContact C-O 3.59Å; E358-G366 WeakPolarHBondContact CA-O 3.15Å; E358-G366 WeakPolarHBondContact CB-O 3.48Å; E358-T367 HydrophobicContact CG-CG2 4.11Å
359	V	93.7	Very high	85.1	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.2	-179.1	-63.5	0	0	0	0	111.8	R343 L344 W365 G366 V368 L407 L408 L420 W428	R343-V359 CarbonylContact O-C 2.83Å; R343-V359 VanDerWaalsContact O-CA 3.27Å; R343-V359 WeakPolarHBondContact O-CA 3.23Å; L344-V359 HydrophobicContact CD1-CG1 4.06Å; L344-V359 HydrophobicContact CG-CG1 4.29Å; V359-W365 WeakPolarHBondContact O-CA 3.3Å; V359-G366 PolarHBondContact N-O 3.2Å; V359-G366 PolarHBondContact O-N 2.75Å; V359-V368 HydrophobicContact CG1-CG2 4.06Å; V359-V368 HydrophobicContact CG2-CG2 4.31Å; V359-L407 HydrophobicContact CG2-CB 3.88Å; V359-L407 HydrophobicContact CG2-CD1 3.94Å; V359-L407 WeakPolarHBondContact O-CD1 3.12Å; V359-L408 HydrophobicContact CG1-CD1 4.17Å; V359-L408 HydrophobicContact CG2-CD1 4.01Å; V359-L408 HydrophobicContact CG2-CG 4.2Å; V359-L420 HydrophobicContact CG1-CD2 4.07Å; V359-W428 HydrophobicContact CG2-CZ3 4.11Å
360	L	84.9	Confident	85.4	Confident	52 Å²	52	35.5 Å²	35.5	27%	0.272	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	114.4	179.7	-175.4	73.3	0	0	0	109.9	R343 G364 W365	R343-L360 HydrophobicContact CB-CB 4.36Å; R343-L360 PolarHBondContact NE-O 3.14Å; R343-L360 PolarHBondContact NH2-O 2.92Å; R343-L360 PolarHBondContact O-N 3.49Å; L360-G364 WeakPolarHBondContact CD1-O 3.17Å; L360-W365 HydrophobicContact CB-CD2 4.25Å; L360-W365 HydrophobicContact CB-CE3 4.02Å; L360-W365 HydrophobicContact CB-CH2 3.99Å; L360-W365 HydrophobicContact CB-CZ2 4.21Å; L360-W365 HydrophobicContact CB-CZ3 3.87Å; L360-W365 HydrophobicContact CD1-CD2 3.98Å; L360-W365 HydrophobicContact CD1-CG 4.14Å; L360-W365 HydrophobicContact CD1-CZ2 4.26Å
361	H	81.4	Confident	86.1	Confident	58 Å²	58	33.2 Å²	33.2	27%	0.269	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	135.8	177.1	-170.4	86.3	0	0	0	111	G363 G364 L407 W428	H361-G363 PolarHBondContact O-N 3.01Å; H361-G364 PolarHBondContact N-O 2.92Å; H361-G364 PolarHBondContact O-N 2.59Å; H361-L407 HydrophobicContact CB-CD1 3.99Å; H361-W428 HydrophobicContact CB-CD2 4.42Å; H361-W428 HydrophobicContact CB-CE3 3.77Å; H361-W428 HydrophobicContact CB-CH2 4.27Å; H361-W428 HydrophobicContact CB-CZ3 3.69Å; H361-W428 AromaticContact CE1-CD1 3.52Å; H361-W428 AromaticContact CE1-CD2 3.39Å; H361-W428 AromaticContact CE1-CE2 3.35Å; H361-W428 AromaticContact CE1-CG 3.49Å; H361-W428 VanDerWaalsContact CE1-CG 3.49Å; H361-W428 AromaticContact CE1-CZ2 3.96Å; H361-W428 AromaticContact CE1-NE1 3.46Å; H361-W428 PolarHBondContact CE1-NE1 3.01Å; H361-W428 AromaticContact CG-CD2 3.68Å; H361-W428 AromaticContact CG-CE3 3.52Å; H361-W428 AromaticContact CG-CZ3 3.81Å; H361-W428 AromaticContact ND1-CD2 3.15Å; H361-W428 AromaticContact ND1-CE2 3.14Å; H361-W428 AromaticContact ND1-CE3 3.38Å; H361-W428 AromaticContact ND1-CG 3.77Å; H361-W428 AromaticContact ND1-CH2 3.56Å; H361-W428 AromaticContact ND1-CZ2 3.35Å; H361-W428 VanDerWaalsContact ND1-CZ2 3.35Å; H361-W428 WeakPolarHBondContact ND1-CZ2 3.12Å; H361-W428 AromaticContact ND1-CZ3 3.58Å; H361-W428 AromaticContact ND1-NE1 3.76Å; H361-W428 AromaticContact NE2-CG 3.84Å
362	A	72.9	Confident	86.5	Confident	99 Å²	99	36 Å²	36	82%	0.818	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	29.6	178.8	0	0	0	0	0	115.7
363	G	70	Confident	86.8	Confident	76 Å²	76	30.7 Å²	30.7	78%	0.784	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	-0.8	-179.5	0	0	0	0	0	115.3	H361	H361-G363 PolarHBondContact O-N 3.01Å
364	G	77.4	Confident	86.2	Confident	36 Å²	36	33 Å²	33	37%	0.371	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	147.9	174.6	0	0	0	0	0	112.7	L360 H361	L360-G364 WeakPolarHBondContact CD1-O 3.17Å; H361-G364 PolarHBondContact N-O 2.92Å; H361-G364 PolarHBondContact O-N 2.59Å
365	W	86.3	Confident	85.8	Confident	85 Å²	85	31.4 Å²	31.4	32%	0.322	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	144.7	169.9	-70.4	96.7	0	0	0	109.8	R345 E358 V359 L360	R345-W365 HydrophobicContact CB-CH2 4.04Å; R345-W365 HydrophobicContact CB-CZ3 4.02Å; R345-W365 HydrophobicContact CG-CE3 3.86Å; R345-W365 HydrophobicContact CG-CH2 3.88Å; R345-W365 HydrophobicContact CG-CZ3 3.51Å; E358-W365 HydrophobicContact CB-CE3 4.18Å; E358-W365 WeakPolarHBondContact O-CZ3 3.32Å; V359-W365 WeakPolarHBondContact O-CA 3.3Å; L360-W365 HydrophobicContact CB-CD2 4.25Å; L360-W365 HydrophobicContact CB-CE3 4.02Å; L360-W365 HydrophobicContact CB-CH2 3.99Å; L360-W365 HydrophobicContact CB-CZ2 4.21Å; L360-W365 HydrophobicContact CB-CZ3 3.87Å; L360-W365 HydrophobicContact CD1-CD2 3.98Å; L360-W365 HydrophobicContact CD1-CG 4.14Å; L360-W365 HydrophobicContact CD1-CZ2 4.26Å
366	G	85.8	Confident	85.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	170.7	169.9	0	0	0	0	0	111.4	E358 V359 P405 L407	E358-G366 CarbonylContact C-O 3.59Å; E358-G366 WeakPolarHBondContact CA-O 3.15Å; E358-G366 WeakPolarHBondContact CB-O 3.48Å; V359-G366 PolarHBondContact N-O 3.2Å; V359-G366 PolarHBondContact O-N 2.75Å; G366-P405 CarbonylContact C-O 3.59Å; G366-P405 WeakPolarHBondContact CA-O 3.12Å; G366-L407 VanDerWaalsContact CA-CD1 3.47Å; G366-L407 VanDerWaalsContact N-CD1 3.32Å
367	T	92.9	Very high	85.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	177.4	-171.4	62.5	0	0	0	0	111.6	E358 P405 V406 L407 H435 D438	E358-T367 HydrophobicContact CG-CG2 4.11Å; T367-P405 PolarHBondContact N-O 3.05Å; T367-V406 WeakPolarHBondContact OG1-CG2 3.1Å; T367-L407 PolarHBondContact O-N 2.8Å; T367-H435 PolarHBondContact OG1-CE1 2.74Å; T367-H435 PolarHBondContact OG1-ND1 3.32Å; T367-D438 WeakPolarHBondContact CB-OD1 3.26Å; T367-D438 WeakPolarHBondContact CG2-OD2 3.41Å; T367-D438 PolarHBondContact OG1-OD1 2.96Å
368	V	96.3	Very high	85.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.4	177.1	179.5	0	0	0	0	106.8	V357 V359 W373 L408 V411 L420 D438 A439	V357-V368 HydrophobicContact CB-CG2 4.36Å; V357-V368 HydrophobicContact CG1-CG2 3.9Å; V357-V368 PolarHBondContact O-N 2.71Å; V359-V368 HydrophobicContact CG1-CG2 4.06Å; V359-V368 HydrophobicContact CG2-CG2 4.31Å; V368-W373 HydrophobicContact CG1-CE3 3.86Å; V368-W373 HydrophobicContact CG1-CZ3 3.7Å; V368-L408 HydrophobicContact CG1-CB 4.07Å; V368-L408 HydrophobicContact CG2-CB 4.24Å; V368-L408 HydrophobicContact CG2-CD1 4.25Å; V368-V411 HydrophobicContact CG1-CG2 3.71Å; V368-L420 HydrophobicContact CG1-CD2 4.4Å; V368-L420 HydrophobicContact CG2-CD2 3.93Å; V368-D438 WeakPolarHBondContact O-CA 3.4Å; V368-A439 HydrophobicContact CB-CB 4.22Å; V368-A439 HydrophobicContact CG1-CB 4.2Å; V368-A439 WeakPolarHBondContact O-CB 3.07Å; V368-A439 PolarHBondContact O-N 3.29Å
369	C	89.8	Confident	84.8	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-71.2	149	175.2	-175.6	0	0	0	0	111.3	D371 V406 L408 D409 C433 E437	C369-D371 VanDerWaalsContact C-N 3.34Å; C369-D371 PolarHBondContact SG-N 3.43Å; C369-V406 HydrophobicContact CB-CG1 4.08Å; C369-L408 PolarHBondContact N-O 2.65Å; C369-D409 HydrophobicContact CB-CB 4.17Å; C369-D409 VanDerWaalsContact CB-OD1 3.3Å; C369-D409 WeakPolarHBondContact CB-OD1 3.3Å; C369-D409 PolarHBondContact SG-OD1 3.47Å; C369-C433 HydrophobicContact CB-CB 3.53Å; C369-C433 WeakPolarHBondContact CB-SG 3.12Å; C369-C433 WeakPolarHBondContact SG-CB 3.36Å; C369-C433 CovalentContact SG-SG 1.99Å; C369-C433 PolarHBondContact SG-SG 2.8Å; C369-E437 CarbonylContact C-O 3.53Å; C369-E437 WeakPolarHBondContact CA-O 3.4Å
370	D	83.4	Confident	84.9	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.011	21%	0.212	C	C	.	.			trans	-86.1	-0.5	175.2	80.5	-31.7	0	0	0	114	D372 W373 G395 L396 E437 A439 R556	D370-D372 PolarHBondContact O-N 2.66Å; D370-W373 VanDerWaalsContact CA-CB 3.45Å; D370-W373 HydrophobicContact CB-CB 4.1Å; D370-W373 VanDerWaalsContact O-CB 3.24Å; D370-W373 WeakPolarHBondContact O-CB 3.33Å; D370-W373 PolarHBondContact O-N 2.75Å; D370-G395 WeakPolarHBondContact OD2-CA 3.46Å; D370-L396 PolarHBondContact OD2-N 3.34Å; D370-E437 WeakPolarHBondContact CB-O 3.42Å; D370-E437 PolarHBondContact N-O 3.02Å; D370-E437 VanDerWaalsContact OD1-CA 3.28Å; D370-E437 WeakPolarHBondContact OD1-CA 3.49Å; D370-E437 WeakPolarHBondContact OD1-CB 3.41Å; D370-E437 VanDerWaalsContact OD1-O 3.12Å; D370-A439 HydrophobicContact CB-CB 4.14Å; D370-R556 PolarHBondContact O-NH1 3.06Å; D370-R556 PolarHBondContact O-NH2 3.07Å; D370-R556 IonicContact OD2-NE 2.95Å
371	D	83.6	Confident	85.4	Confident	41 Å²	41	32.2 Å²	32.2	22%	0.219	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	127.3	167.3	-83.8	0.1	0	0	0	110.7	C369 W373 D409 N410	C369-D371 VanDerWaalsContact C-N 3.34Å; C369-D371 PolarHBondContact SG-N 3.43Å; D371-W373 PolarHBondContact O-N 2.82Å; D371-D409 WeakPolarHBondContact CB-OD1 3.12Å; D371-N410 WeakPolarHBondContact O-CA 3.28Å
372	D	83.4	Confident	85.9	Confident	102 Å²	102	29.4 Å²	29.4	55%	0.545	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	0.8	-167.4	-62.6	-36.2	0	0	0	116.4	D370 D374 N410	D370-D372 PolarHBondContact O-N 2.66Å; D372-D374 PolarHBondContact O-N 3.32Å; D372-N410 PolarHBondContact OD2-ND2 3.01Å
373	W	89.4	Confident	86.7	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	17%	0.168	C	C	.	.			trans	-62.6	120.2	-180	-176.4	-104.5	0	0	0	111.3	V357 V368 D370 D371 D377 A378 A381 V411 L420 A439 G440 R556	V357-W373 HydrophobicContact CB-CH2 4.45Å; V357-W373 HydrophobicContact CG1-CH2 4.27Å; V357-W373 HydrophobicContact CG2-CH2 4.06Å; V357-W373 HydrophobicContact CG2-CZ2 3.74Å; V368-W373 HydrophobicContact CG1-CE3 3.86Å; V368-W373 HydrophobicContact CG1-CZ3 3.7Å; D370-W373 VanDerWaalsContact CA-CB 3.45Å; D370-W373 HydrophobicContact CB-CB 4.1Å; D370-W373 VanDerWaalsContact O-CB 3.24Å; D370-W373 WeakPolarHBondContact O-CB 3.33Å; D370-W373 PolarHBondContact O-N 2.75Å; D371-W373 PolarHBondContact O-N 2.82Å; W373-D377 WeakPolarHBondContact CA-OD2 2.98Å; W373-D377 HydrophobicContact CD2-CB 3.86Å; W373-D377 HydrophobicContact CE3-CB 3.48Å; W373-D377 VanDerWaalsContact CE3-CB 3.48Å; W373-D377 HydrophobicContact CH2-CB 3.81Å; W373-D377 HydrophobicContact CZ2-CB 4.17Å; W373-D377 HydrophobicContact CZ3-CB 3.45Å; W373-D377 VanDerWaalsContact CZ3-CB 3.45Å; W373-A378 HydrophobicContact CZ2-CB 4.26Å; W373-A381 HydrophobicContact CH2-CB 3.96Å; W373-A381 HydrophobicContact CZ2-CB 4.26Å; W373-V411 HydrophobicContact CE3-CB 4.09Å; W373-V411 HydrophobicContact CE3-CG1 4.44Å; W373-V411 HydrophobicContact CE3-CG2 4.48Å; W373-V411 HydrophobicContact CZ3-CB 4.23Å; W373-V411 HydrophobicContact CZ3-CG1 4.17Å; W373-V411 HydrophobicContact CZ3-CG2 4.45Å; W373-L420 HydrophobicContact CH2-CD1 3.81Å; W373-L420 HydrophobicContact CH2-CD2 3.87Å; W373-L420 HydrophobicContact CH2-CG 4.47Å; W373-L420 HydrophobicContact CZ3-CD1 3.77Å; W373-L420 HydrophobicContact CZ3-CD2 3.81Å; W373-L420 HydrophobicContact CZ3-CG 4.27Å; W373-A439 HydrophobicContact CB-CB 4.29Å; W373-A439 HydrophobicContact CD2-CB 3.53Å; W373-A439 HydrophobicContact CE3-CB 4.02Å; W373-A439 HydrophobicContact CG-CB 3.62Å; W373-A439 HydrophobicContact CZ2-CB 4.33Å; W373-G440 PolarHBondContact NE1-O 3.24Å; W373-G440 VanDerWaalsContact NE1-O 3.07Å; W373-R556 WeakPolarHBondContact O-CD 3.22Å; W373-R556 WeakPolarHBondContact O-CG 3.32Å; W373-R556 PolarHBondContact O-NH1 3.26Å
374	D	75.9	Confident	87.8	Confident	62 Å²	62	28 Å²	28	33%	0.332	14%	0.137	S	C	.	.			trans	-133.9	-173.2	-175.5	80.7	12.9	0	0	0	113.5	D372 A376 D377 A378 A393	D372-D374 PolarHBondContact O-N 3.32Å; D374-A376 VanDerWaalsContact C-N 3.31Å; D374-A376 PolarHBondContact O-N 3.18Å; D374-A376 WeakPolarHBondContact OD1-CA 3.2Å; D374-A376 VanDerWaalsContact OD1-CB 3.23Å; D374-A376 WeakPolarHBondContact OD1-CB 3.06Å; D374-A376 PolarHBondContact OD1-N 2.8Å; D374-D377 PolarHBondContact N-OD2 2.01Å; D374-D377 PolarHBondContact O-N 3.46Å; D374-D377 PolarHBondContact OD1-N 2.77Å; D374-D377 VanDerWaalsContact OD1-N 3.14Å; D374-A378 PolarHBondContact O-N 3.25Å; D374-A393 VanDerWaalsContact O-CB 3.27Å; D374-A393 WeakPolarHBondContact O-CB 3.35Å
375	F	77.4	Confident	88.5	Confident	9 Å²	9	27.6 Å²	27.6	4%	0.039	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-32.7	-179.7	-173.5	-99.6	0	0	0	113.6	D377 R379 A390 L550 L551 H554	F375-D377 VanDerWaalsContact C-N 3.33Å; F375-R379 WeakPolarHBondContact O-CB 3.05Å; F375-R379 PolarHBondContact O-N 3.24Å; F375-A390 HydrophobicContact CE2-CB 4.15Å; F375-A390 HydrophobicContact CZ-CB 4.28Å; F375-L550 WeakPolarHBondContact CE2-O 3.03Å; F375-L550 VanDerWaalsContact CZ-O 3.26Å; F375-L550 WeakPolarHBondContact CZ-O 3.31Å; F375-L551 HydrophobicContact CZ-CD2 4.32Å; F375-H554 AromaticContact CD2-CE1 3.62Å; F375-H554 AromaticContact CD2-NE2 3.6Å; F375-H554 AromaticContact CE2-NE2 3.95Å
376	A	81.8	Confident	88.6	Confident	15 Å²	15	24.8 Å²	24.8	12%	0.124	13%	0.128	C	C	.	.	H	α-helix	trans	-67.3	-37	176.8	0	0	0	0	0	111.1	D374 R379 V380 C413 G415	D374-A376 VanDerWaalsContact C-N 3.31Å; D374-A376 PolarHBondContact O-N 3.18Å; D374-A376 WeakPolarHBondContact OD1-CA 3.2Å; D374-A376 VanDerWaalsContact OD1-CB 3.23Å; D374-A376 WeakPolarHBondContact OD1-CB 3.06Å; D374-A376 PolarHBondContact OD1-N 2.8Å; A376-R379 WeakPolarHBondContact O-CB 3.42Å; A376-R379 PolarHBondContact O-N 2.77Å; A376-V380 PolarHBondContact O-N 2.65Å; A376-C413 WeakPolarHBondContact CB-O 3.45Å; A376-G415 WeakPolarHBondContact O-CA 3.29Å
377	D	94	Very high	88.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.3	-47.8	174.8	-50.8	-48.2	0	0	0	111.6	W373 D374 F375 R379 V380 A381 V411 C413 L420	W373-D377 WeakPolarHBondContact CA-OD2 2.98Å; W373-D377 HydrophobicContact CD2-CB 3.86Å; W373-D377 HydrophobicContact CE3-CB 3.48Å; W373-D377 VanDerWaalsContact CE3-CB 3.48Å; W373-D377 HydrophobicContact CH2-CB 3.81Å; W373-D377 HydrophobicContact CZ2-CB 4.17Å; W373-D377 HydrophobicContact CZ3-CB 3.45Å; W373-D377 VanDerWaalsContact CZ3-CB 3.45Å; D374-D377 PolarHBondContact N-OD2 2.01Å; D374-D377 PolarHBondContact O-N 3.46Å; D374-D377 PolarHBondContact OD1-N 2.77Å; D374-D377 VanDerWaalsContact OD1-N 3.14Å; F375-D377 VanDerWaalsContact C-N 3.33Å; D377-R379 PolarHBondContact O-N 3.21Å; D377-V380 WeakPolarHBondContact O-CA 3.46Å; D377-V380 WeakPolarHBondContact O-CB 3.19Å; D377-V380 PolarHBondContact O-N 3.47Å; D377-A381 PolarHBondContact O-N 2.75Å; D377-V411 HydrophobicContact CB-CG1 4.27Å; D377-V411 VanDerWaalsContact OD2-O 3.12Å; D377-C413 WeakPolarHBondContact OD1-CA 3.1Å; D377-C413 WeakPolarHBondContact OD1-CB 2.96Å; D377-C413 PolarHBondContact OD1-N 2.82Å; D377-C413 PolarHBondContact OD1-SG 2.95Å; D377-L420 HydrophobicContact CB-CD1 4.44Å
378	A	92	Very high	88.2	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-34.2	175.1	0	0	0	0	0	111.9	W373 D374 A381 C382 A390 A393 A441	W373-A378 HydrophobicContact CZ2-CB 4.26Å; D374-A378 PolarHBondContact O-N 3.25Å; A378-A381 PolarHBondContact O-N 3.29Å; A378-C382 VanDerWaalsContact O-CB 3.31Å; A378-C382 WeakPolarHBondContact O-CB 3.4Å; A378-C382 PolarHBondContact O-N 3Å; A378-C382 PolarHBondContact O-SG 3.17Å; A378-C382 VanDerWaalsContact O-SG 3.36Å; A378-A390 HydrophobicContact CB-CB 4.32Å; A378-A393 HydrophobicContact CB-CB 3.66Å; A378-A441 HydrophobicContact CB-CB 4.32Å
379	R	88.7	Confident	87.5	Confident	90 Å²	90	29.9 Å²	29.9	34%	0.34	17%	0.167	S	C	.	.	H	α-helix	trans	-61.8	-41.2	173.4	-179	170.6	69.5	-136.2	4.2	112.2	F375 A376 D377 R383 A390 A414 G415	F375-R379 WeakPolarHBondContact O-CB 3.05Å; F375-R379 PolarHBondContact O-N 3.24Å; A376-R379 WeakPolarHBondContact O-CB 3.42Å; A376-R379 PolarHBondContact O-N 2.77Å; D377-R379 PolarHBondContact O-N 3.21Å; R379-R383 WeakPolarHBondContact O-CB 3.28Å; R379-R383 PolarHBondContact O-N 2.87Å; R379-A390 HydrophobicContact CB-CB 4.24Å; R379-A414 PolarHBondContact NH2-O 3.36Å; R379-G415 PolarHBondContact NE-O 2.86Å
380	V	94.9	Very high	87.2	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-47.9	174	177.7	0	0	0	0	110.3	A376 D377 C382 R383 E384 C413 E417 L420	A376-V380 PolarHBondContact O-N 2.65Å; D377-V380 WeakPolarHBondContact O-CA 3.46Å; D377-V380 WeakPolarHBondContact O-CB 3.19Å; D377-V380 PolarHBondContact O-N 3.47Å; V380-C382 PolarHBondContact O-N 2.84Å; V380-R383 PolarHBondContact O-N 2.82Å; V380-E384 WeakPolarHBondContact O-CB 3.27Å; V380-E384 PolarHBondContact O-N 3.09Å; V380-C413 HydrophobicContact CG2-CB 3.88Å; V380-E417 HydrophobicContact CG1-CB 4.37Å; V380-E417 WeakPolarHBondContact CG1-O 3.08Å; V380-E417 HydrophobicContact CG2-CB 4.14Å; V380-L420 HydrophobicContact CB-CD1 4.16Å; V380-L420 HydrophobicContact CG1-CB 4.41Å; V380-L420 HydrophobicContact CG1-CD1 4.16Å
381	A	95.3	Very high	86.7	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-47.7	-179.5	0	0	0	0	0	112.4	L344 V357 W373 D377 A378 R383 E384 A385 L420 A441	L344-A381 HydrophobicContact CD1-CB 3.94Å; L344-A381 HydrophobicContact CD2-CB 4.46Å; V357-A381 HydrophobicContact CG1-CB 4.26Å; V357-A381 HydrophobicContact CG2-CB 4.21Å; W373-A381 HydrophobicContact CH2-CB 3.96Å; W373-A381 HydrophobicContact CZ2-CB 4.26Å; D377-A381 PolarHBondContact O-N 2.75Å; A378-A381 PolarHBondContact O-N 3.29Å; A381-R383 VanDerWaalsContact C-N 3.33Å; A381-R383 PolarHBondContact O-N 3.45Å; A381-E384 PolarHBondContact O-N 3.4Å; A381-A385 VanDerWaalsContact O-CB 3.25Å; A381-A385 WeakPolarHBondContact O-CB 3.22Å; A381-A385 PolarHBondContact O-N 3.49Å; A381-L420 HydrophobicContact CB-CD1 4.39Å; A381-A441 HydrophobicContact CB-CB 4.4Å
382	C	91.7	Very high	86.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-39.9	177.8	-76.6	0	0	0	0	112.7	A378 V380 G386 C387 G388 A390 C443	A378-C382 VanDerWaalsContact O-CB 3.31Å; A378-C382 WeakPolarHBondContact O-CB 3.4Å; A378-C382 PolarHBondContact O-N 3Å; A378-C382 PolarHBondContact O-SG 3.17Å; A378-C382 VanDerWaalsContact O-SG 3.36Å; V380-C382 PolarHBondContact O-N 2.84Å; C382-G386 PolarHBondContact O-N 3.05Å; C382-C387 PolarHBondContact O-N 2.6Å; C382-G388 CarbonylContact C-O 3.53Å; C382-A390 HydrophobicContact CB-CB 4.09Å; C382-C443 WeakPolarHBondContact CA-SG 3.37Å; C382-C443 HydrophobicContact CB-CB 3.68Å; C382-C443 WeakPolarHBondContact CB-SG 3.38Å; C382-C443 WeakPolarHBondContact SG-CA 3.42Å; C382-C443 WeakPolarHBondContact SG-CB 3.44Å; C382-C443 CovalentContact SG-SG 2.03Å; C382-C443 PolarHBondContact SG-SG 3.06Å
383	R	90.8	Very high	86.1	Confident	117 Å²	117	24.4 Å²	24.4	44%	0.442	14%	0.139	S	C	.	.	H	α-helix	trans	-68.6	-44	176.7	-178.3	170.8	60.4	-176.2	-0.9	111.8	R379 V380 A381 G386 T416 E417	R379-R383 WeakPolarHBondContact O-CB 3.28Å; R379-R383 PolarHBondContact O-N 2.87Å; V380-R383 PolarHBondContact O-N 2.82Å; A381-R383 VanDerWaalsContact C-N 3.33Å; A381-R383 PolarHBondContact O-N 3.45Å; R383-G386 WeakPolarHBondContact O-CA 3.5Å; R383-G386 PolarHBondContact O-N 3.01Å; R383-T416 PolarHBondContact NH2-O 2.85Å; R383-E417 VanDerWaalsContact NH2-C 3.29Å; R383-E417 PolarHBondContact NH2-O 3.07Å
384	E	94	Very high	85.4	Confident	29 Å²	29	24.4 Å²	24.4	14%	0.136	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-40.8	177.6	-175.1	174.1	-178.4	0	0	111.5	L344 V380 A381 G386 R419 L420	L344-E384 HydrophobicContact CB-CG 3.97Å; L344-E384 HydrophobicContact CD1-CB 4.46Å; V380-E384 WeakPolarHBondContact O-CB 3.27Å; V380-E384 PolarHBondContact O-N 3.09Å; A381-E384 PolarHBondContact O-N 3.4Å; E384-G386 PolarHBondContact O-N 2.59Å; E384-G386 VanDerWaalsContact O-N 3.14Å; E384-R419 WeakPolarHBondContact OE2-CA 3.28Å; E384-L420 PolarHBondContact OE2-N 2.81Å
385	A	91.6	Very high	85.4	Confident	26 Å²	26	21.9 Å²	21.9	22%	0.215	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.8	171.8	0	0	0	0	0	112.8	L344 L346 A381 C387	L344-A385 HydrophobicContact CD2-CB 3.77Å; L346-A385 HydrophobicContact CD1-CB 4.32Å; L346-A385 HydrophobicContact CG-CB 4.33Å; A381-A385 VanDerWaalsContact O-CB 3.25Å; A381-A385 WeakPolarHBondContact O-CB 3.22Å; A381-A385 PolarHBondContact O-N 3.49Å; A385-C387 VanDerWaalsContact C-N 3.33Å; A385-C387 HydrophobicContact CB-CB 4.3Å
386	G	88.9	Confident	84.7	Confident	27 Å²	27	27.3 Å²	27.3	28%	0.278	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	78	19.1	-177.6	0	0	0	0	0	114	C382 R383 E384	C382-G386 PolarHBondContact O-N 3.05Å; R383-G386 WeakPolarHBondContact O-CA 3.5Å; R383-G386 PolarHBondContact O-N 3.01Å; E384-G386 PolarHBondContact O-N 2.59Å; E384-G386 VanDerWaalsContact O-N 3.14Å
387	C	85.9	Confident	83.9	Confident	11 Å²	11	26.9 Å²	26.9	7%	0.074	15%	0.153	C	C	.	.			trans	-99.2	17.9	-171.2	-83.6	0	0	0	0	114.4	C353 C382 A385 C443 A444	C353-C387 WeakPolarHBondContact CA-SG 3.47Å; C353-C387 HydrophobicContact CB-CB 3.52Å; C353-C387 WeakPolarHBondContact CB-SG 3.19Å; C353-C387 VanDerWaalsContact SG-CA 3.55Å; C353-C387 WeakPolarHBondContact SG-CB 2.99Å; C353-C387 CovalentContact SG-SG 2.05Å; C353-C387 PolarHBondContact SG-SG 3.01Å; C382-C387 PolarHBondContact O-N 2.6Å; A385-C387 VanDerWaalsContact C-N 3.33Å; A385-C387 HydrophobicContact CB-CB 4.3Å; C387-C443 HydrophobicContact CB-CB 3.57Å; C387-C443 WeakPolarHBondContact O-CB 3.27Å; C387-A444 CarbonylContact O-C 3.57Å
388	G	84	Confident	82.9	Confident	34 Å²	34	31.1 Å²	31.1	35%	0.351	17%	0.173	S	C	.	.			trans	78.6	-158.3	178.2	0	0	0	0	0	113	C382	C382-G388 CarbonylContact C-O 3.53Å
389	P	81.4	Confident	82.1	Confident	61 Å²	61	32.1 Å²	32.1	40%	0.396	18%	0.177	S	C	.	.	S	Bend	trans	-68.1	148.8	179.3	27.5	-32	0	0	0	111.5	A444	P389-A444 HydrophobicContact CG-CB 3.83Å; P389-A444 PolarHBondContact O-N 2.98Å
390	A	83	Confident	81.2	Confident	2 Å²	2	29.6 Å²	29.6	2%	0.017	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	143	169.2	0	0	0	0	0	110.8	F375 A378 R379 C382 L551	F375-A390 HydrophobicContact CE2-CB 4.15Å; F375-A390 HydrophobicContact CZ-CB 4.28Å; A378-A390 HydrophobicContact CB-CB 4.32Å; R379-A390 HydrophobicContact CB-CB 4.24Å; C382-A390 HydrophobicContact CB-CB 4.09Å; A390-L551 WeakPolarHBondContact O-CD2 3.2Å
391	L	73.6	Confident	80.3	Confident	24 Å²	24	37 Å²	37	13%	0.126	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-17.9	169.7	-63.4	179.1	0	0	0	111.6	L442 A444 L550	L391-L442 HydrophobicContact CB-CB 4.28Å; L391-L442 PolarHBondContact N-O 3.17Å; L391-A444 HydrophobicContact CD1-CB 4.15Å; L391-A444 HydrophobicContact CD2-CB 3.97Å; L391-A444 HydrophobicContact CG-CB 3.96Å; L391-L550 HydrophobicContact CB-CD1 4.44Å; L391-L550 WeakPolarHBondContact O-CD2 3.33Å
392	G	73.1	Confident	79.2	Confident	3 Å²	3	37.3 Å²	37.3	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.9	158.3	178	0	0	0	0	0	113.5	L442	G392-L442 PolarHBondContact N-O 2.95Å; G392-L442 PolarHBondContact O-N 2.97Å
393	A	81.8	Confident	78.3	Confident	1 Å²	1	48 Å²	48	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.4	168.7	0	0	0	0	0	108.7	D374 A378 W557	D374-A393 VanDerWaalsContact O-CB 3.27Å; D374-A393 WeakPolarHBondContact O-CB 3.35Å; A378-A393 HydrophobicContact CB-CB 3.66Å; A393-W557 PolarHBondContact O-N 3.33Å; A393-W557 VanDerWaalsContact O-N 3.14Å
394	T	72.9	Confident	77.3	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.5	174.8	62.4	0	0	0	0	109.5	H398 F399 G440 L442 W557	T394-H398 HydrophobicContact CG2-CB 4.46Å; T394-F399 HydrophobicContact CG2-CE2 4.05Å; T394-F399 WeakPolarHBondContact OG1-CE2 3.32Å; T394-G440 PolarHBondContact N-O 2.83Å; T394-G440 PolarHBondContact O-N 3.27Å; T394-G440 WeakPolarHBondContact OG1-CA 3.26Å; T394-G440 PolarHBondContact OG1-O 2.55Å; T394-L442 HydrophobicContact CG2-CD1 3.79Å; T394-L442 HydrophobicContact CG2-CG 4.24Å; T394-W557 HydrophobicContact CG2-CE3 3.75Å; T394-W557 HydrophobicContact CG2-CZ3 4.4Å
395	G	76.6	Confident	76	Confident	8 Å²	8	44.6 Å²	44.6	8%	0.082	25%	0.253	C	S	.	.			trans	-119.2	-159.9	173.9	0	0	0	0	0	112.1	D370 G397 H398	D370-G395 WeakPolarHBondContact OD2-CA 3.46Å; G395-G397 PolarHBondContact O-N 3.09Å; G395-H398 WeakPolarHBondContact O-CB 3.49Å; G395-H398 PolarHBondContact O-N 3.13Å
396	L	62	Low	75.5	Confident	124 Å²	124	43.6 Å²	43.6	65%	0.649	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.3	168.1	-57	178	0	0	0	114.4	D370 H398 H436	D370-L396 PolarHBondContact OD2-N 3.34Å; L396-H398 VanDerWaalsContact C-N 3.27Å; L396-H398 PolarHBondContact O-N 2.7Å; L396-H436 CarbonylContact C-O 3.57Å; L396-H436 WeakPolarHBondContact CA-O 3.48Å
397	G	65.2	Low	75.3	Confident	6 Å²	6	43.1 Å²	43.1	6%	0.062	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	31.6	-178.7	0	0	0	0	0	114	G395 F399 G400 H436 D438	G395-G397 PolarHBondContact O-N 3.09Å; G397-F399 PolarHBondContact O-N 3.12Å; G397-G400 CarbonylContact O-C 3.52Å; G397-G400 VanDerWaalsContact O-CA 3.25Å; G397-G400 WeakPolarHBondContact O-CA 3.43Å; G397-G400 PolarHBondContact O-N 2Å; G397-H436 PolarHBondContact N-O 3.11Å; G397-H436 VanDerWaalsContact N-O 3.16Å; G397-D438 WeakPolarHBondContact CA-O 3.08Å; G397-D438 PolarHBondContact N-O 3.36Å
398	H	72.7	Confident	75.6	Confident	88 Å²	88	42.6 Å²	42.6	41%	0.407	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-35.3	-176.4	175.1	-88.1	0	0	0	114.3	T394 G395 L396 G400 W557	T394-H398 HydrophobicContact CG2-CB 4.46Å; G395-H398 WeakPolarHBondContact O-CB 3.49Å; G395-H398 PolarHBondContact O-N 3.13Å; L396-H398 VanDerWaalsContact C-N 3.27Å; L396-H398 PolarHBondContact O-N 2.7Å; H398-G400 VanDerWaalsContact C-N 3.29Å; H398-G400 PolarHBondContact O-N 3.44Å; H398-W557 AromaticContact CE1-CZ3 3.89Å; H398-W557 AromaticContact NE2-CH2 3.83Å; H398-W557 AromaticContact NE2-CZ3 3.65Å
399	F	76	Confident	75.9	Confident	22 Å²	22	41 Å²	41	10%	0.096	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	25.7	177.1	-65.6	-70.5	0	0	0	113.7	R354 G355 R356 T394 G397 L442	R354-F399 HydrophobicContact CB-CE1 4.45Å; R354-F399 HydrophobicContact CB-CZ 4.38Å; G355-F399 VanDerWaalsContact CA-CD2 3.47Å; G355-F399 VanDerWaalsContact CA-CG 3.46Å; R356-F399 HydrophobicContact CB-CB 4.21Å; R356-F399 PolarHBondContact NH1-O 2.77Å; T394-F399 HydrophobicContact CG2-CE2 4.05Å; T394-F399 WeakPolarHBondContact OG1-CE2 3.32Å; G397-F399 PolarHBondContact O-N 3.12Å; F399-L442 HydrophobicContact CE2-CD2 4.49Å; F399-L442 HydrophobicContact CE2-CG 4.43Å; F399-L442 HydrophobicContact CZ-CD2 3.67Å; F399-L442 HydrophobicContact CZ-CG 4.05Å
400	G	70.1	Confident	76.2	Confident	37 Å²	37	39.8 Å²	39.8	38%	0.381	21%	0.205	S	C	.	.			trans	83.9	155.1	-171.9	0	0	0	0	0	112.5	R356 G397 H398	R356-G400 PolarHBondContact NH1-O 2.96Å; G397-G400 CarbonylContact O-C 3.52Å; G397-G400 VanDerWaalsContact O-CA 3.25Å; G397-G400 WeakPolarHBondContact O-CA 3.43Å; G397-G400 PolarHBondContact O-N 2Å; H398-G400 VanDerWaalsContact C-N 3.29Å; H398-G400 PolarHBondContact O-N 3.44Å
401	Y	77	Confident	76.8	Confident	156 Å²	156	39.7 Å²	39.7	61%	0.612	20%	0.204	S	C	*	.			trans	-68.4	136.3	175.4	-53	-25.2	0	0	0	110.5	H435 H436	Y401-H435 VanDerWaalsContact CD1-O 3.24Å; Y401-H435 WeakPolarHBondContact CD1-O 3.4Å; Y401-H436 HydrophobicContact CD1-CB 4.43Å; Y401-H436 HydrophobicContact CE1-CB 3.95Å
402	G	71.9	Confident	77.6	Confident	6 Å²	6	40.4 Å²	40.4	6%	0.062	22%	0.217	C	C	.	.			trans	-72.5	-172.7	173.2	0	0	0	0	0	112.6	H435 D438	G402-H435 PolarHBondContact O-CD2 2.02Å; G402-D438 WeakPolarHBondContact CA-OD2 3.43Å; G402-D438 PolarHBondContact N-OD2 3.44Å
403	R	72.3	Confident	78.5	Confident	224 Å²	224	40.9 Å²	40.9	85%	0.845	22%	0.22	S	C	*	.			trans	-144.6	145.3	178.7	-61.5	-177.2	-179	-173.2	-1.6	108.5	H435	R403-H435 VanDerWaalsContact C-NE2 3.32Å; R403-H435 VanDerWaalsContact CA-NE2 3.28Å; R403-H435 WeakPolarHBondContact CA-NE2 3.46Å; R403-H435 PolarHBondContact N-NE2 3.45Å
404	G	68.9	Low	78.7	Confident	30 Å²	30	44 Å²	44	31%	0.309	25%	0.246	S	C	.	.	S	Bend	trans	93.2	-155.2	179.9	0	0	0	0	0	111	H435	G404-H435 PolarHBondContact N-NE2 2.81Å; G404-H435 PolarHBondContact O-CE1 2.73Å; G404-H435 VanDerWaalsContact O-CE1 3.23Å; G404-H435 PolarHBondContact O-NE2 3.04Å
405	P	68	Low	79.3	Confident	45 Å²	45	44 Å²	44	29%	0.292	25%	0.246	S	C	.	.			trans	-75.8	145.8	-176.7	30.4	-33.7	0	0	0	111.7	G366 T367 L407	G366-P405 CarbonylContact C-O 3.59Å; G366-P405 WeakPolarHBondContact CA-O 3.12Å; T367-P405 PolarHBondContact N-O 3.05Å; P405-L407 HydrophobicContact CB-CD2 4.1Å; P405-L407 HydrophobicContact CB-CG 4.46Å; P405-L407 HydrophobicContact CG-CD2 3.97Å; P405-L407 HydrophobicContact CG-CG 4.22Å
406	V	80.3	Confident	79.9	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.6	155.3	-170.7	0	0	0	0	106.5	T367 C369 H431	T367-V406 WeakPolarHBondContact OG1-CG2 3.1Å; C369-V406 HydrophobicContact CB-CG1 4.08Å; V406-H431 PolarHBondContact O-CD2 3.07Å; V406-H431 VanDerWaalsContact O-CD2 3.25Å; V406-H431 PolarHBondContact O-NE2 3.44Å
407	L	85.1	Confident	81.5	Confident	17 Å²	17	44.7 Å²	44.7	9%	0.089	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-25.9	-169.5	-74.1	177.5	0	0	0	114	V359 H361 G366 T367 P405 W428 G429	V359-L407 HydrophobicContact CG2-CB 3.88Å; V359-L407 HydrophobicContact CG2-CD1 3.94Å; V359-L407 WeakPolarHBondContact O-CD1 3.12Å; H361-L407 HydrophobicContact CB-CD1 3.99Å; G366-L407 VanDerWaalsContact CA-CD1 3.47Å; G366-L407 VanDerWaalsContact N-CD1 3.32Å; T367-L407 PolarHBondContact O-N 2.8Å; P405-L407 HydrophobicContact CB-CD2 4.1Å; P405-L407 HydrophobicContact CB-CG 4.46Å; P405-L407 HydrophobicContact CG-CD2 3.97Å; P405-L407 HydrophobicContact CG-CG 4.22Å; L407-W428 HydrophobicContact CB-CE3 4.24Å; L407-W428 HydrophobicContact CB-CZ3 4.42Å; L407-W428 WeakPolarHBondContact O-CA 3.46Å; L407-G429 PolarHBondContact O-N 2.94Å
408	L	91.8	Very high	82.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142	-179.1	-65.1	177	0	0	0	109.2	V359 V368 C369 V411 L420 H425 W428	V359-L408 HydrophobicContact CG1-CD1 4.17Å; V359-L408 HydrophobicContact CG2-CD1 4.01Å; V359-L408 HydrophobicContact CG2-CG 4.2Å; V368-L408 HydrophobicContact CG1-CB 4.07Å; V368-L408 HydrophobicContact CG2-CB 4.24Å; V368-L408 HydrophobicContact CG2-CD1 4.25Å; C369-L408 PolarHBondContact N-O 2.65Å; L408-V411 HydrophobicContact CB-CG2 3.79Å; L408-V411 HydrophobicContact CD1-CG2 4.49Å; L408-L420 HydrophobicContact CD1-CD2 4.09Å; L408-L420 HydrophobicContact CD1-CG 4.28Å; L408-H425 HydrophobicContact CD2-CB 4.1Å; L408-W428 HydrophobicContact CD1-CZ3 4.43Å; L408-W428 HydrophobicContact CD2-CD2 4.34Å; L408-W428 HydrophobicContact CD2-CE3 3.83Å; L408-W428 HydrophobicContact CD2-CH2 4.12Å; L408-W428 HydrophobicContact CD2-CZ3 3.71Å; L408-W428 HydrophobicContact CG-CE3 4.4Å; L408-W428 HydrophobicContact CG-CZ3 4.02Å
409	D	90.8	Very high	83.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.278	C	S	.	.			trans	-147.2	152.4	-179.1	-166.9	10.9	0	0	0	110.3	C369 D371 V411 H425 L426 Q430 H431 N432 C433	C369-D409 HydrophobicContact CB-CB 4.17Å; C369-D409 VanDerWaalsContact CB-OD1 3.3Å; C369-D409 WeakPolarHBondContact CB-OD1 3.3Å; C369-D409 PolarHBondContact SG-OD1 3.47Å; D371-D409 WeakPolarHBondContact CB-OD1 3.12Å; D409-V411 VanDerWaalsContact C-N 3.25Å; D409-V411 PolarHBondContact O-N 2.97Å; D409-H425 WeakPolarHBondContact O-CA 3.46Å; D409-H425 WeakPolarHBondContact O-CB 3.33Å; D409-L426 HydrophobicContact CB-CD1 4.43Å; D409-L426 PolarHBondContact O-N 2.6Å; D409-L426 VanDerWaalsContact O-N 3.14Å; D409-Q430 WeakPolarHBondContact CB-O 3.26Å; D409-H431 HydrophobicContact CB-CB 3.56Å; D409-H431 WeakPolarHBondContact OD2-CA 3.35Å; D409-H431 VanDerWaalsContact OD2-CB 3.23Å; D409-H431 WeakPolarHBondContact OD2-CB 3.22Å; D409-N432 PolarHBondContact OD2-N 3.3Å; D409-N432 PolarHBondContact OD2-OD1 2.75Å; D409-C433 VanDerWaalsContact CG-SG 3.59Å; D409-C433 PolarHBondContact OD1-SG 3.16Å; D409-C433 VanDerWaalsContact OD1-SG 3.32Å
410	N	87.8	Confident	84.5	Confident	36 Å²	36	48.2 Å²	48.2	19%	0.193	27%	0.273	C	S	.	.	S	Bend	trans	43.2	53.3	-167.8	-60.3	71	0	0	0	111.1	D371 D372 G412 F424 L426	D371-N410 WeakPolarHBondContact O-CA 3.28Å; D372-N410 PolarHBondContact OD2-ND2 3.01Å; N410-G412 PolarHBondContact O-N 3.33Å; N410-F424 HydrophobicContact CB-CE1 4.45Å; N410-F424 WeakPolarHBondContact O-CD1 3.24Å; N410-L426 HydrophobicContact CB-CD1 4.5Å; N410-L426 HydrophobicContact CB-CG 4.12Å; N410-L426 VanDerWaalsContact OD1-CD1 3.25Å; N410-L426 WeakPolarHBondContact OD1-CD1 3.48Å
411	V	94.6	Very high	85.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.264	C	S	.	.			trans	-67.5	121.1	179.1	-177.6	0	0	0	0	107.9	V368 W373 D377 L408 D409 L420 C423 F424	V368-V411 HydrophobicContact CG1-CG2 3.71Å; W373-V411 HydrophobicContact CE3-CB 4.09Å; W373-V411 HydrophobicContact CE3-CG1 4.44Å; W373-V411 HydrophobicContact CE3-CG2 4.48Å; W373-V411 HydrophobicContact CZ3-CB 4.23Å; W373-V411 HydrophobicContact CZ3-CG1 4.17Å; W373-V411 HydrophobicContact CZ3-CG2 4.45Å; D377-V411 HydrophobicContact CB-CG1 4.27Å; D377-V411 VanDerWaalsContact OD2-O 3.12Å; L408-V411 HydrophobicContact CB-CG2 3.79Å; L408-V411 HydrophobicContact CD1-CG2 4.49Å; D409-V411 VanDerWaalsContact C-N 3.25Å; D409-V411 PolarHBondContact O-N 2.97Å; V411-L420 HydrophobicContact CG1-CD1 3.98Å; V411-L420 HydrophobicContact CG1-CG 4.12Å; V411-C423 HydrophobicContact CG1-CB 4.14Å; V411-F424 WeakPolarHBondContact CA-O 3.38Å
412	G	89.9	Confident	86.2	Confident	39 Å²	39	44.2 Å²	44.2	40%	0.402	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-127.5	85.1	-178.2	0	0	0	0	0	111.4	N410 F424	N410-G412 PolarHBondContact O-N 3.33Å; G412-F424 PolarHBondContact N-O 3.07Å; G412-F424 PolarHBondContact O-N 3.11Å
413	C	93.4	Very high	87.3	Confident	13 Å²	13	44.3 Å²	44.3	9%	0.088	26%	0.256	C	S	.	.			trans	-87.5	142.9	176.2	-59.8	0	0	0	0	111.6	A376 D377 V380 G415 C423	A376-C413 WeakPolarHBondContact CB-O 3.45Å; D377-C413 WeakPolarHBondContact OD1-CA 3.1Å; D377-C413 WeakPolarHBondContact OD1-CB 2.96Å; D377-C413 PolarHBondContact OD1-N 2.82Å; D377-C413 PolarHBondContact OD1-SG 2.95Å; V380-C413 HydrophobicContact CG2-CB 3.88Å; C413-G415 PolarHBondContact O-N 3.15Å; C413-C423 HydrophobicContact CB-CB 3.94Å; C413-C423 WeakPolarHBondContact CB-SG 3.36Å; C413-C423 WeakPolarHBondContact SG-CB 3.31Å; C413-C423 CovalentContact SG-SG 2.02Å; C413-C423 PolarHBondContact SG-SG 2.71Å
414	A	86.4	Confident	88.3	Confident	67 Å²	67	40 Å²	40	55%	0.554	24%	0.244	S	C	*	.			trans	-70	-12.8	158.9	0	0	0	0	0	111.6	R379 E417	R379-A414 PolarHBondContact NH2-O 3.36Å; A414-E417 WeakPolarHBondContact CB-OE1 3.09Å; A414-E417 PolarHBondContact N-OE1 3.3Å; A414-E417 PolarHBondContact N-OE2 3Å
415	G	85.7	Confident	89.4	Confident	2 Å²	2	40.4 Å²	40.4	2%	0.021	24%	0.237	C	C	.	.	S	Bend	trans	80.1	18.7	-179.2	0	0	0	0	0	114	A376 R379 C413 E417	A376-G415 WeakPolarHBondContact O-CA 3.29Å; R379-G415 PolarHBondContact NE-O 2.86Å; C413-G415 PolarHBondContact O-N 3.15Å; G415-E417 VanDerWaalsContact CA-OE2 3.31Å; G415-E417 WeakPolarHBondContact CA-OE2 3.47Å; G415-E417 PolarHBondContact N-OE2 3.17Å
416	T	88.4	Confident	89.9	Confident	108 Å²	108	42 Å²	42	66%	0.663	24%	0.243	S	C	*	.			trans	-114.1	-7.2	175.7	60.6	0	0	0	0	113	R383	R383-T416 PolarHBondContact NH2-O 2.85Å
417	E	94.6	Very high	89.3	Confident	37 Å²	37	42.6 Å²	42.6	17%	0.173	25%	0.25	C	C	.	.			trans	-64.4	137.4	-179.3	-63.3	81.5	-179.1	0	0	112.5	V380 R383 A414 G415 R419 D422 C423	V380-E417 HydrophobicContact CG1-CB 4.37Å; V380-E417 WeakPolarHBondContact CG1-O 3.08Å; V380-E417 HydrophobicContact CG2-CB 4.14Å; R383-E417 VanDerWaalsContact NH2-C 3.29Å; R383-E417 PolarHBondContact NH2-O 3.07Å; A414-E417 WeakPolarHBondContact CB-OE1 3.09Å; A414-E417 PolarHBondContact N-OE1 3.3Å; A414-E417 PolarHBondContact N-OE2 3Å; G415-E417 VanDerWaalsContact CA-OE2 3.31Å; G415-E417 WeakPolarHBondContact CA-OE2 3.47Å; G415-E417 PolarHBondContact N-OE2 3.17Å; E417-R419 VanDerWaalsContact C-N 3.25Å; E417-R419 PolarHBondContact O-N 3.03Å; E417-D422 HydrophobicContact CB-CB 4.34Å; E417-C423 VanDerWaalsContact CG-SG 3.58Å
418	A	90.4	Very high	88.9	Confident	69 Å²	69	45.9 Å²	45.9	57%	0.57	26%	0.261	S	S	*	.	S	Bend	trans	-67.9	-28.6	-177.2	0	0	0	0	0	112.8
419	R	92.9	Very high	87.9	Confident	121 Å²	121	47.6 Å²	47.6	46%	0.457	28%	0.279	S	S	.	.	S	Bend	trans	-139	153.5	-179.6	-52.9	-177.8	-174.9	111.5	0.4	110.8	E384 E417 S421 D422	E384-R419 WeakPolarHBondContact OE2-CA 3.28Å; E417-R419 VanDerWaalsContact C-N 3.25Å; E417-R419 PolarHBondContact O-N 3.03Å; R419-S421 PolarHBondContact O-N 2.72Å; R419-D422 PolarHBondContact N-OD2 3.14Å; R419-D422 WeakPolarHBondContact O-CB 3.18Å; R419-D422 PolarHBondContact O-N 3.02Å
420	L	94.6	Very high	87	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-63.3	-32.6	176.5	-156.1	70	0	0	0	111.8	L344 V357 V359 V368 W373 D377 V380 A381 E384 L408 V411 D422 C423	L344-L420 HydrophobicContact CD1-CB 4.1Å; L344-L420 HydrophobicContact CD1-CD2 3.95Å; V357-L420 HydrophobicContact CG1-CD2 3.93Å; V359-L420 HydrophobicContact CG1-CD2 4.07Å; V368-L420 HydrophobicContact CG1-CD2 4.4Å; V368-L420 HydrophobicContact CG2-CD2 3.93Å; W373-L420 HydrophobicContact CH2-CD1 3.81Å; W373-L420 HydrophobicContact CH2-CD2 3.87Å; W373-L420 HydrophobicContact CH2-CG 4.47Å; W373-L420 HydrophobicContact CZ3-CD1 3.77Å; W373-L420 HydrophobicContact CZ3-CD2 3.81Å; W373-L420 HydrophobicContact CZ3-CG 4.27Å; D377-L420 HydrophobicContact CB-CD1 4.44Å; V380-L420 HydrophobicContact CB-CD1 4.16Å; V380-L420 HydrophobicContact CG1-CB 4.41Å; V380-L420 HydrophobicContact CG1-CD1 4.16Å; A381-L420 HydrophobicContact CB-CD1 4.39Å; E384-L420 PolarHBondContact OE2-N 2.81Å; L408-L420 HydrophobicContact CD1-CD2 4.09Å; L408-L420 HydrophobicContact CD1-CG 4.28Å; V411-L420 HydrophobicContact CG1-CD1 3.98Å; V411-L420 HydrophobicContact CG1-CG 4.12Å; L420-D422 PolarHBondContact O-N 3.01Å; L420-C423 WeakPolarHBondContact O-CB 3.29Å; L420-C423 PolarHBondContact O-N 2.73Å
421	S	90.9	Very high	86.5	Confident	27 Å²	27	53.3 Å²	53.3	19%	0.189	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-70	-8.9	174.7	65.1	0	0	0	0	114.9	R419	R419-S421 PolarHBondContact O-N 2.72Å
422	D	92.6	Very high	85.2	Confident	82 Å²	82	58.2 Å²	58.2	44%	0.439	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-93.7	-9.8	177.9	-55.5	-22.9	0	0	0	111.3	E417 R419 L420	E417-D422 HydrophobicContact CB-CB 4.34Å; R419-D422 PolarHBondContact N-OD2 3.14Å; R419-D422 WeakPolarHBondContact O-CB 3.18Å; R419-D422 PolarHBondContact O-N 3.02Å; L420-D422 PolarHBondContact O-N 3.01Å
423	C	93.6	Very high	84.2	Confident	9 Å²	9	56.4 Å²	56.4	6%	0.061	31%	0.312	C	S	.	.	S	Bend	trans	-76.8	168.7	174.8	-54.7	0	0	0	0	111.2	V411 C413 E417 L420 H425	V411-C423 HydrophobicContact CG1-CB 4.14Å; C413-C423 HydrophobicContact CB-CB 3.94Å; C413-C423 WeakPolarHBondContact CB-SG 3.36Å; C413-C423 WeakPolarHBondContact SG-CB 3.31Å; C413-C423 CovalentContact SG-SG 2.02Å; C413-C423 PolarHBondContact SG-SG 2.71Å; E417-C423 VanDerWaalsContact CG-SG 3.58Å; L420-C423 WeakPolarHBondContact O-CB 3.29Å; L420-C423 PolarHBondContact O-N 2.73Å; C423-H425 PolarHBondContact O-CD2 2.66Å; C423-H425 VanDerWaalsContact O-CD2 3.3Å
424	F	93.8	Very high	82.6	Confident	134 Å²	134	55.9 Å²	55.9	59%	0.588	31%	0.308	S	S	*	.	B	Isolated β-bridge	trans	-62.5	141.2	167.2	175.2	-96.1	0	0	0	109.8	N410 V411 G412 L426	N410-F424 HydrophobicContact CB-CE1 4.45Å; N410-F424 WeakPolarHBondContact O-CD1 3.24Å; V411-F424 WeakPolarHBondContact CA-O 3.38Å; G412-F424 PolarHBondContact N-O 3.07Å; G412-F424 PolarHBondContact O-N 3.11Å; F424-L426 HydrophobicContact CZ-CD2 4.4Å
425	H	92.2	Very high	82.2	Confident	38 Å²	38	52.9 Å²	52.9	18%	0.176	28%	0.283	C	S	.	.			trans	-161.2	160.1	171.3	61.8	91.9	0	0	0	108.9	L408 D409 C423 G427	L408-H425 HydrophobicContact CD2-CB 4.1Å; D409-H425 WeakPolarHBondContact O-CA 3.46Å; D409-H425 WeakPolarHBondContact O-CB 3.33Å; C423-H425 PolarHBondContact O-CD2 2.66Å; C423-H425 VanDerWaalsContact O-CD2 3.3Å; H425-G427 WeakPolarHBondContact ND1-CA 3.35Å; H425-G427 PolarHBondContact ND1-N 3.25Å; H425-G427 VanDerWaalsContact ND1-N 3.16Å; H425-G427 PolarHBondContact O-N 3.45Å
426	L	77.3	Confident	80.9	Confident	78 Å²	78	55.7 Å²	55.7	41%	0.408	30%	0.295	S	S	.	.	S	Bend	trans	-67.8	-2.6	-176.8	-66.4	-177.1	0	0	0	115.5	D409 N410 F424 Q430	D409-L426 HydrophobicContact CB-CD1 4.43Å; D409-L426 PolarHBondContact O-N 2.6Å; D409-L426 VanDerWaalsContact O-N 3.14Å; N410-L426 HydrophobicContact CB-CD1 4.5Å; N410-L426 HydrophobicContact CB-CG 4.12Å; N410-L426 VanDerWaalsContact OD1-CD1 3.25Å; N410-L426 WeakPolarHBondContact OD1-CD1 3.48Å; F424-L426 HydrophobicContact CZ-CD2 4.4Å; L426-Q430 HydrophobicContact CB-CB 4.33Å
427	G	67.8	Low	80.5	Confident	17 Å²	17	52.3 Å²	52.3	18%	0.175	27%	0.272	C	S	.	.			trans	109.4	165.2	-170.8	0	0	0	0	0	112.2	H425 G429 Q430	H425-G427 WeakPolarHBondContact ND1-CA 3.35Å; H425-G427 PolarHBondContact ND1-N 3.25Å; H425-G427 VanDerWaalsContact ND1-N 3.16Å; H425-G427 PolarHBondContact O-N 3.45Å; G427-G429 PolarHBondContact O-N 2.83Å; G427-Q430 PolarHBondContact O-N 3.04Å
428	W	77.6	Confident	80	Confident	86 Å²	86	50.6 Å²	50.6	33%	0.326	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	122.3	-175.6	-66.4	99.8	0	0	0	111.5	V359 H361 L407 L408 Q430	V359-W428 HydrophobicContact CG2-CZ3 4.11Å; H361-W428 HydrophobicContact CB-CD2 4.42Å; H361-W428 HydrophobicContact CB-CE3 3.77Å; H361-W428 HydrophobicContact CB-CH2 4.27Å; H361-W428 HydrophobicContact CB-CZ3 3.69Å; H361-W428 AromaticContact CE1-CD1 3.52Å; H361-W428 AromaticContact CE1-CD2 3.39Å; H361-W428 AromaticContact CE1-CE2 3.35Å; H361-W428 AromaticContact CE1-CG 3.49Å; H361-W428 VanDerWaalsContact CE1-CG 3.49Å; H361-W428 AromaticContact CE1-CZ2 3.96Å; H361-W428 AromaticContact CE1-NE1 3.46Å; H361-W428 PolarHBondContact CE1-NE1 3.01Å; H361-W428 AromaticContact CG-CD2 3.68Å; H361-W428 AromaticContact CG-CE3 3.52Å; H361-W428 AromaticContact CG-CZ3 3.81Å; H361-W428 AromaticContact ND1-CD2 3.15Å; H361-W428 AromaticContact ND1-CE2 3.14Å; H361-W428 AromaticContact ND1-CE3 3.38Å; H361-W428 AromaticContact ND1-CG 3.77Å; H361-W428 AromaticContact ND1-CH2 3.56Å; H361-W428 AromaticContact ND1-CZ2 3.35Å; H361-W428 VanDerWaalsContact ND1-CZ2 3.35Å; H361-W428 WeakPolarHBondContact ND1-CZ2 3.12Å; H361-W428 AromaticContact ND1-CZ3 3.58Å; H361-W428 AromaticContact ND1-NE1 3.76Å; H361-W428 AromaticContact NE2-CG 3.84Å; L407-W428 HydrophobicContact CB-CE3 4.24Å; L407-W428 HydrophobicContact CB-CZ3 4.42Å; L407-W428 WeakPolarHBondContact O-CA 3.46Å; L408-W428 HydrophobicContact CD1-CZ3 4.43Å; L408-W428 HydrophobicContact CD2-CD2 4.34Å; L408-W428 HydrophobicContact CD2-CE3 3.83Å; L408-W428 HydrophobicContact CD2-CH2 4.12Å; L408-W428 HydrophobicContact CD2-CZ3 3.71Å; L408-W428 HydrophobicContact CG-CE3 4.4Å; L408-W428 HydrophobicContact CG-CZ3 4.02Å; W428-Q430 PolarHBondContact O-N 3.08Å
429	G	70.5	Confident	80.1	Confident	36 Å²	36	47.3 Å²	47.3	37%	0.371	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	10.4	179.5	0	0	0	0	0	114.5	L407 G427 H431	L407-G429 PolarHBondContact O-N 2.94Å; G427-G429 PolarHBondContact O-N 2.83Å; G429-H431 PolarHBondContact O-CD2 2.83Å
430	Q	71.2	Confident	80.1	Confident	127 Å²	127	41.6 Å²	41.6	59%	0.593	22%	0.215	S	C	*	.			trans	-92.4	110	168.7	-68.6	-168	52.5	0	0	107.5	D409 L426 G427 W428	D409-Q430 WeakPolarHBondContact CB-O 3.26Å; L426-Q430 HydrophobicContact CB-CB 4.33Å; G427-Q430 PolarHBondContact O-N 3.04Å; W428-Q430 PolarHBondContact O-N 3.08Å
431	H	78.9	Confident	80	Confident	28 Å²	28	41.6 Å²	41.6	13%	0.13	22%	0.215	C	C	.	.			trans	-159.5	157.4	-179.4	67.2	95.3	0	0	0	110.3	N241 V406 D409 G429 C433	N241-H431 WeakPolarHBondContact CB-CE1 3.36Å; N241-H431 PolarHBondContact ND2-CE1 3.02Å; N241-H431 PolarHBondContact ND2-O 3.31Å; V406-H431 PolarHBondContact O-CD2 3.07Å; V406-H431 VanDerWaalsContact O-CD2 3.25Å; V406-H431 PolarHBondContact O-NE2 3.44Å; D409-H431 HydrophobicContact CB-CB 3.56Å; D409-H431 WeakPolarHBondContact OD2-CA 3.35Å; D409-H431 VanDerWaalsContact OD2-CB 3.23Å; D409-H431 WeakPolarHBondContact OD2-CB 3.22Å; G429-H431 PolarHBondContact O-CD2 2.83Å; H431-C433 PolarHBondContact CE1-O 3.02Å; H431-C433 PolarHBondContact ND1-N 3.07Å; H431-C433 PolarHBondContact ND1-O 2.95Å
432	N	65.6	Low	79.6	Confident	105 Å²	105	40.5 Å²	40.5	56%	0.561	21%	0.208	S	C	*	.			trans	-104.8	1.1	164.2	60	-34.1	0	0	0	112.1	D409	D409-N432 PolarHBondContact OD2-N 3.3Å; D409-N432 PolarHBondContact OD2-OD1 2.75Å
433	C	70.6	Confident	79.3	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	19%	0.187	C	C	.	.			trans	-82.2	153.2	-173.2	-49.7	0	0	0	0	115.1	C369 D409 H431 E437	C369-C433 HydrophobicContact CB-CB 3.53Å; C369-C433 WeakPolarHBondContact CB-SG 3.12Å; C369-C433 WeakPolarHBondContact SG-CB 3.36Å; C369-C433 CovalentContact SG-SG 1.99Å; C369-C433 PolarHBondContact SG-SG 2.8Å; D409-C433 VanDerWaalsContact CG-SG 3.59Å; D409-C433 PolarHBondContact OD1-SG 3.16Å; D409-C433 VanDerWaalsContact OD1-SG 3.32Å; H431-C433 PolarHBondContact CE1-O 3.02Å; H431-C433 PolarHBondContact ND1-N 3.07Å; H431-C433 PolarHBondContact ND1-O 2.95Å; C433-E437 WeakPolarHBondContact CA-OE2 3.27Å; C433-E437 HydrophobicContact CB-CB 4.08Å
434	G	59.9	Low	78.3	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.01	19%	0.187	C	C	.	.			trans	-98.6	173.5	162	0	0	0	0	0	114.4	Y246 H436 E437	Y246-G434 VanDerWaalsContact OH-C 3.29Å; Y246-G434 WeakPolarHBondContact OH-CA 3.45Å; G434-H436 PolarHBondContact O-N 3.32Å; G434-E437 PolarHBondContact N-OE2 3.47Å; G434-E437 CarbonylContact O-C 3.44Å; G434-E437 WeakPolarHBondContact O-CA 3.46Å; G434-E437 VanDerWaalsContact O-CB 3.28Å; G434-E437 WeakPolarHBondContact O-CB 3.4Å; G434-E437 PolarHBondContact O-N 3.08Å
435	H	76.4	Confident	76.9	Confident	5 Å²	5	30.7 Å²	30.7	2%	0.023	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-67.2	-15.6	172.9	-71.5	-38.1	0	0	0	114.7	Y246 T367 Y401 G402 R403 G404 E437 D438	Y246-H435 HydrophobicContact CE2-CB 3.86Å; Y246-H435 AromaticContact CE2-CD2 3.37Å; Y246-H435 WeakPolarHBondContact CE2-CD2 3.48Å; Y246-H435 AromaticContact CE2-CG 3.84Å; Y246-H435 PolarHBondContact OH-N 3.34Å; T367-H435 PolarHBondContact OG1-CE1 2.74Å; T367-H435 PolarHBondContact OG1-ND1 3.32Å; Y401-H435 VanDerWaalsContact CD1-O 3.24Å; Y401-H435 WeakPolarHBondContact CD1-O 3.4Å; G402-H435 PolarHBondContact O-CD2 2.02Å; R403-H435 VanDerWaalsContact C-NE2 3.32Å; R403-H435 VanDerWaalsContact CA-NE2 3.28Å; R403-H435 WeakPolarHBondContact CA-NE2 3.46Å; R403-H435 PolarHBondContact N-NE2 3.45Å; G404-H435 PolarHBondContact N-NE2 2.81Å; G404-H435 PolarHBondContact O-CE1 2.73Å; G404-H435 VanDerWaalsContact O-CE1 3.23Å; G404-H435 PolarHBondContact O-NE2 3.04Å; H435-E437 PolarHBondContact O-N 3.23Å; H435-D438 VanDerWaalsContact CA-CG 3.45Å; H435-D438 WeakPolarHBondContact CA-OD1 3.08Å; H435-D438 WeakPolarHBondContact CB-OD2 3.02Å; H435-D438 IonicContact CE1-OD1 2.66Å; H435-D438 IonicContact CG-OD1 2.72Å; H435-D438 IonicContact CG-OD2 3.6Å; H435-D438 IonicContact ND1-OD1 3.27Å; H435-D438 PolarHBondContact ND1-OD1 2.85Å; H435-D438 IonicContact ND1-OD2 3.01Å; H435-D438 PolarHBondContact ND1-OD2 3.38Å; H435-D438 VanDerWaalsContact ND1-OD2 3.12Å; H435-D438 WeakPolarHBondContact O-CB 3.3Å; H435-D438 VanDerWaalsContact O-CG 3.28Å; H435-D438 PolarHBondContact O-N 3.11Å
436	H	60.2	Low	75	Confident	61 Å²	61	34.3 Å²	34.3	28%	0.282	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-66.8	-17	167.2	72.2	-70.8	0	0	0	112	H281 L396 G397 Y401 G434	H281-H436 AromaticContact CG-CE1 3.87Å; H281-H436 AromaticContact ND1-CE1 3.86Å; L396-H436 CarbonylContact C-O 3.57Å; L396-H436 WeakPolarHBondContact CA-O 3.48Å; G397-H436 PolarHBondContact N-O 3.11Å; G397-H436 VanDerWaalsContact N-O 3.16Å; Y401-H436 HydrophobicContact CD1-CB 4.43Å; Y401-H436 HydrophobicContact CE1-CB 3.95Å; G434-H436 PolarHBondContact O-N 3.32Å
437	E	78.6	Confident	73.8	Confident	36 Å²	36	38.9 Å²	38.9	17%	0.168	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-104.9	21.5	174.4	-68.1	160.3	127.8	0	0	110.5	C369 D370 C433 G434 H435 A439	C369-E437 CarbonylContact C-O 3.53Å; C369-E437 WeakPolarHBondContact CA-O 3.4Å; D370-E437 WeakPolarHBondContact CB-O 3.42Å; D370-E437 PolarHBondContact N-O 3.02Å; D370-E437 VanDerWaalsContact OD1-CA 3.28Å; D370-E437 WeakPolarHBondContact OD1-CA 3.49Å; D370-E437 WeakPolarHBondContact OD1-CB 3.41Å; D370-E437 VanDerWaalsContact OD1-O 3.12Å; C433-E437 WeakPolarHBondContact CA-OE2 3.27Å; C433-E437 HydrophobicContact CB-CB 4.08Å; G434-E437 PolarHBondContact N-OE2 3.47Å; G434-E437 CarbonylContact O-C 3.44Å; G434-E437 WeakPolarHBondContact O-CA 3.46Å; G434-E437 VanDerWaalsContact O-CB 3.28Å; G434-E437 WeakPolarHBondContact O-CB 3.4Å; G434-E437 PolarHBondContact O-N 3.08Å; H435-E437 PolarHBondContact O-N 3.23Å; E437-A439 PolarHBondContact O-N 2.87Å
438	D	83.8	Confident	73	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-69.7	122.4	177.3	-77.6	-24.2	0	0	0	111.1	R356 T367 V368 G397 G402 H435	R356-D438 WeakPolarHBondContact CD-OD2 3.33Å; R356-D438 HydrophobicContact CG-CB 3.96Å; T367-D438 WeakPolarHBondContact CB-OD1 3.26Å; T367-D438 WeakPolarHBondContact CG2-OD2 3.41Å; T367-D438 PolarHBondContact OG1-OD1 2.96Å; V368-D438 WeakPolarHBondContact O-CA 3.4Å; G397-D438 WeakPolarHBondContact CA-O 3.08Å; G397-D438 PolarHBondContact N-O 3.36Å; G402-D438 WeakPolarHBondContact CA-OD2 3.43Å; G402-D438 PolarHBondContact N-OD2 3.44Å; H435-D438 VanDerWaalsContact CA-CG 3.45Å; H435-D438 WeakPolarHBondContact CA-OD1 3.08Å; H435-D438 WeakPolarHBondContact CB-OD2 3.02Å; H435-D438 IonicContact CE1-OD1 2.66Å; H435-D438 IonicContact CG-OD1 2.72Å; H435-D438 IonicContact CG-OD2 3.6Å; H435-D438 IonicContact ND1-OD1 3.27Å; H435-D438 PolarHBondContact ND1-OD1 2.85Å; H435-D438 IonicContact ND1-OD2 3.01Å; H435-D438 PolarHBondContact ND1-OD2 3.38Å; H435-D438 VanDerWaalsContact ND1-OD2 3.12Å; H435-D438 WeakPolarHBondContact O-CB 3.3Å; H435-D438 VanDerWaalsContact O-CG 3.28Å; H435-D438 PolarHBondContact O-N 3.11Å
439	A	93.8	Very high	71.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.			trans	-65.4	146.5	174.2	0	0	0	0	0	112.5	R356 V357 V368 D370 W373 E437	R356-A439 WeakPolarHBondContact CA-O 3.31Å; V357-A439 PolarHBondContact N-O 3.22Å; V368-A439 HydrophobicContact CB-CB 4.22Å; V368-A439 HydrophobicContact CG1-CB 4.2Å; V368-A439 WeakPolarHBondContact O-CB 3.07Å; V368-A439 PolarHBondContact O-N 3.29Å; D370-A439 HydrophobicContact CB-CB 4.14Å; W373-A439 HydrophobicContact CB-CB 4.29Å; W373-A439 HydrophobicContact CD2-CB 3.53Å; W373-A439 HydrophobicContact CE3-CB 4.02Å; W373-A439 HydrophobicContact CG-CB 3.62Å; W373-A439 HydrophobicContact CZ2-CB 4.33Å; E437-A439 PolarHBondContact O-N 2.87Å
440	G	92.2	Very high	70	Confident	1 Å²	1	43 Å²	43	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.8	174.8	0	0	0	0	0	112.5	G355 W373 T394	G355-G440 CarbonylContact O-C 3.58Å; G355-G440 VanDerWaalsContact O-CA 3.29Å; G355-G440 WeakPolarHBondContact O-CA 3.39Å; W373-G440 PolarHBondContact NE1-O 3.24Å; W373-G440 VanDerWaalsContact NE1-O 3.07Å; T394-G440 PolarHBondContact N-O 2.83Å; T394-G440 PolarHBondContact O-N 3.27Å; T394-G440 WeakPolarHBondContact OG1-CA 3.26Å; T394-G440 PolarHBondContact OG1-O 2.55Å
441	A	92.1	Very high	68.2	Low	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.5	178.7	0	0	0	0	0	111.1	L346 R354 G355 V357 A378 A381	L346-A441 HydrophobicContact CD2-CB 3.98Å; R354-A441 WeakPolarHBondContact CA-O 3.16Å; G355-A441 PolarHBondContact N-O 2.75Å; G355-A441 VanDerWaalsContact N-O 3.07Å; G355-A441 PolarHBondContact O-N 3.14Å; V357-A441 HydrophobicContact CG2-CB 3.77Å; A378-A441 HydrophobicContact CB-CB 4.32Å; A381-A441 HydrophobicContact CB-CB 4.4Å
442	L	82.8	Confident	66.1	Low	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.3	169.7	-72.3	159.2	0	0	0	107.7	R354 L391 G392 T394 F399 L490 W557	R354-L442 HydrophobicContact CB-CD2 4.24Å; R354-L442 HydrophobicContact CG-CD2 3.95Å; L391-L442 HydrophobicContact CB-CB 4.28Å; L391-L442 PolarHBondContact N-O 3.17Å; G392-L442 PolarHBondContact N-O 2.95Å; G392-L442 PolarHBondContact O-N 2.97Å; T394-L442 HydrophobicContact CG2-CD1 3.79Å; T394-L442 HydrophobicContact CG2-CG 4.24Å; F399-L442 HydrophobicContact CE2-CD2 4.49Å; F399-L442 HydrophobicContact CE2-CG 4.43Å; F399-L442 HydrophobicContact CZ-CD2 3.67Å; F399-L442 HydrophobicContact CZ-CG 4.05Å; L442-L490 HydrophobicContact CD1-CD1 4.26Å; L442-L490 HydrophobicContact CD1-CG 4.47Å; L442-W557 HydrophobicContact CD1-CE3 3.67Å; L442-W557 HydrophobicContact CD1-CZ3 3.84Å
443	C	86	Confident	64.4	Low	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	151.5	179.4	-40.4	0	0	0	0	110.8	L346 C353 C382 C387 G445	L346-C443 VanDerWaalsContact CD1-SG 3.57Å; C353-C443 HydrophobicContact CB-CB 4.15Å; C353-C443 WeakPolarHBondContact O-CA 3.35Å; C353-C443 VanDerWaalsContact O-CB 3.24Å; C353-C443 WeakPolarHBondContact O-CB 3.37Å; C353-C443 PolarHBondContact O-N 3.5Å; C353-C443 PolarHBondContact O-SG 2.83Å; C382-C443 WeakPolarHBondContact CA-SG 3.37Å; C382-C443 HydrophobicContact CB-CB 3.68Å; C382-C443 WeakPolarHBondContact CB-SG 3.38Å; C382-C443 WeakPolarHBondContact SG-CA 3.42Å; C382-C443 WeakPolarHBondContact SG-CB 3.44Å; C382-C443 CovalentContact SG-SG 2.03Å; C382-C443 PolarHBondContact SG-SG 3.06Å; C387-C443 HydrophobicContact CB-CB 3.57Å; C387-C443 WeakPolarHBondContact O-CB 3.27Å; C443-G445 PolarHBondContact O-N 2.78Å
444	A	74.1	Confident	62.7	Low	7 Å²	7	61.6 Å²	61.6	6%	0.058	33%	0.334	C	S	.	.			trans	-71.1	101.3	174.3	0	0	0	0	0	108.9	C387 P389 L391	C387-A444 CarbonylContact O-C 3.57Å; P389-A444 HydrophobicContact CG-CB 3.83Å; P389-A444 PolarHBondContact O-N 2.98Å; L391-A444 HydrophobicContact CD1-CB 4.15Å; L391-A444 HydrophobicContact CD2-CB 3.97Å; L391-A444 HydrophobicContact CG-CB 3.96Å
445	G	62.7	Low	61.6	Low	12 Å²	12	70.5 Å²	70.5	12%	0.124	38%	0.375	C	S	.	.			trans	-59.5	161.4	179.1	0	0	0	0	0	112	C443 E447 E448	C443-G445 PolarHBondContact O-N 2.78Å; G445-E447 PolarHBondContact O-N 3.43Å; G445-E447 VanDerWaalsContact O-N 3.08Å; G445-E448 PolarHBondContact N-OE2 3.04Å; G445-E448 WeakPolarHBondContact O-CB 3.12Å; G445-E448 PolarHBondContact O-N 3.38Å
446	P	52.4	Low	59.9	Low	113 Å²	113	78.5 Å²	78.5	73%	0.734	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.5	175.8	-24	32.4	0	0	0	114.3	E448	P446-E448 VanDerWaalsContact C-N 3.32Å
447	E	52.1	Low	58.9	Low	175 Å²	175	78.9 Å²	78.9	82%	0.818	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-16.5	174.5	-104.4	-176.8	149.1	0	0	114.2	G445 R469	G445-E447 PolarHBondContact O-N 3.43Å; G445-E447 VanDerWaalsContact O-N 3.08Å; E447-R469 PolarHBondContact O-NH1 2.82Å
448	E	50.5	Low	57.5	Low	54 Å²	54	83.1 Å²	83.1	25%	0.252	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-18.6	-177.2	-95.6	170.3	154.9	0	0	113.5	R354 G445 P446 G450	R354-E448 IonicContact CZ-OE1 2.75Å; R354-E448 IonicContact NH2-OE1 3.24Å; R354-E448 PolarHBondContact NH2-OE1 2.62Å; R354-E448 IonicContact NH2-OE2 3.43Å; R354-E448 PolarHBondContact NH2-OE2 2.81Å; G445-E448 PolarHBondContact N-OE2 3.04Å; G445-E448 WeakPolarHBondContact O-CB 3.12Å; G445-E448 PolarHBondContact O-N 3.38Å; P446-E448 VanDerWaalsContact C-N 3.32Å; E448-G450 VanDerWaalsContact C-N 3.33Å; E448-G450 PolarHBondContact O-N 3.07Å
449	L	47.4	Very low	55.2	Low	116 Å²	116	91.1 Å²	91.1	61%	0.607	51%	0.509	S	S	*	.	S	Bend	trans	-87.3	7.9	176.4	-77.5	164.7	0	0	0	114.6	L451	L449-L451 PolarHBondContact O-N 3.22Å
450	G	39.6	Very low	52.7	Low	55 Å²	55	98.3 Å²	98.3	57%	0.567	55%	0.554	S	S	*	*			trans	65.8	29.2	162	0	0	0	0	0	116.9	E448 Q452	E448-G450 VanDerWaalsContact C-N 3.33Å; E448-G450 PolarHBondContact O-N 3.07Å; G450-Q452 VanDerWaalsContact C-N 3.31Å; G450-Q452 PolarHBondContact O-N 3.19Å; G450-Q452 VanDerWaalsContact O-N 3.08Å
451	L	32.1	Very low	49.9	Very low	168 Å²	168	103.2 Å²	103.2	88%	0.88	58%	0.583	S	S	*	*			trans	-81.2	82.6	165	-78	164.4	0	0	0	109.4	L449 V453	L449-L451 PolarHBondContact O-N 3.22Å; L451-V453 PolarHBondContact O-N 2.94Å
452	Q	34.9	Very low	47.4	Very low	172 Å²	172	115.5 Å²	115.5	80%	0.804	63%	0.63	S	S	*	*			trans	-60.7	116.5	166.9	-69.1	-168.8	-20.4	0	0	109.5	G450 Q454	G450-Q452 VanDerWaalsContact C-N 3.31Å; G450-Q452 PolarHBondContact O-N 3.19Å; G450-Q452 VanDerWaalsContact O-N 3.08Å; Q452-Q454 PolarHBondContact O-N 3.22Å
453	V	29.4	Very low	45.1	Very low	136 Å²	136	120.7 Å²	120.7	82%	0.824	66%	0.662	S	S	*	*			trans	-75.3	107.2	154.1	176.8	0	0	0	0	105.9	L451 Q455	L451-V453 PolarHBondContact O-N 2.94Å; V453-Q455 PolarHBondContact O-N 3.45Å
454	Q	36.7	Very low	43	Very low	176 Å²	176	125.9 Å²	125.9	82%	0.822	70%	0.695	S	S	*	*			trans	-58	125.1	166.7	-71.9	178.2	-19.8	0	0	108.9	Q452	Q452-Q454 PolarHBondContact O-N 3.22Å
455	Q	34.9	Very low	41.3	Very low	188 Å²	188	131.8 Å²	131.8	88%	0.879	73%	0.731	S	S	*	*			trans	-123.1	121.2	143.6	-88.5	-157.1	-33.9	0	0	109.5	V453	V453-Q455 PolarHBondContact O-N 3.45Å
456	D	40.8	Very low	41.1	Very low	173 Å²	173	136.9 Å²	136.9	93%	0.925	76%	0.761	S	S	*	*			trans	-52.9	136.6	173.2	-162.4	11.5	0	0	0	111.2
457	G	39.8	Very low	41.3	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	76%	0.76	S	S	*	*			trans	161.5	94.6	178.3	0	0	0	0	0	113.7	E459	G457-E459 PolarHBondContact O-N 3.32Å
458	S	50.5	Low	42.1	Very low	124 Å²	124	134 Å²	134	87%	0.867	73%	0.734	S	S	*	*			trans	-52.5	112.6	174.8	-177.9	0	0	0	0	113.8
459	E	35.6	Very low	42.9	Very low	169 Å²	169	138.9 Å²	138.9	79%	0.79	75%	0.75	S	S	*	*			trans	-163.7	117.8	146.5	-132.4	172.2	180	0	0	111.3	G457 T461	G457-E459 PolarHBondContact O-N 3.32Å; E459-T461 PolarHBondContact O-N 2.7Å; E459-T461 VanDerWaalsContact O-N 3.09Å
460	T	40.3	Very low	43.8	Very low	152 Å²	152	134.3 Å²	134.3	93%	0.933	73%	0.726	S	S	*	*			trans	-81.7	78.3	175.7	20.5	0	0	0	0	110.7
461	T	32.5	Very low	45.4	Very low	103 Å²	103	132.3 Å²	132.3	63%	0.632	71%	0.705	S	S	*	*			trans	-80.8	122.2	161.2	40.6	0	0	0	0	109.7	E459 V463	E459-T461 PolarHBondContact O-N 2.7Å; E459-T461 VanDerWaalsContact O-N 3.09Å; T461-V463 WeakPolarHBondContact O-CG2 3.31Å; T461-V463 PolarHBondContact O-N 2.81Å
462	R	41.4	Very low	47.8	Very low	259 Å²	259	129 Å²	129	98%	0.977	69%	0.685	S	S	*	*			trans	-63.4	101.7	169.7	-72.9	-179.7	-179.6	167.4	0.1	109
463	V	34.3	Very low	50.4	Low	114 Å²	114	121.2 Å²	121.2	69%	0.691	65%	0.649	S	S	*	*			trans	-79.2	137.2	175.2	-176.1	0	0	0	0	108.9	T461 T465	T461-V463 WeakPolarHBondContact O-CG2 3.31Å; T461-V463 PolarHBondContact O-N 2.81Å; V463-T465 PolarHBondContact O-N 2.84Å
464	P	40.2	Very low	53.5	Low	108 Å²	108	119.5 Å²	119.5	70%	0.701	63%	0.628	S	S	*	*			trans	-56.2	139	172.7	-16.8	28.6	0	0	0	109.7	P466	P464-P466 VanDerWaalsContact O-N 3.09Å
465	T	40.1	Very low	56.3	Low	131 Å²	131	112.5 Å²	112.5	80%	0.804	60%	0.596	S	S	*	*			trans	-37.5	116.7	176.1	42.9	0	0	0	0	111.1	V463 R467	V463-T465 PolarHBondContact O-N 2.84Å; T465-R467 PolarHBondContact O-N 3.33Å
466	P	56.8	Low	59.3	Low	119 Å²	119	105.2 Å²	105.2	77%	0.773	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-61	136.9	179.5	25.6	-33.1	0	0	0	108.2	P464	P464-P466 VanDerWaalsContact O-N 3.09Å
467	R	58.4	Low	61.9	Low	186 Å²	186	102 Å²	102	70%	0.702	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-52.3	140.2	168	-67.7	-178.2	-174.6	174.1	2.2	108.1	T465	T465-R467 PolarHBondContact O-N 3.33Å
468	P	67.4	Low	64.4	Low	42 Å²	42	100 Å²	100	27%	0.273	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-55.6	149.6	176.8	-17	27.6	0	0	0	110.4	H472 Y489 W494	P468-H472 HydrophobicContact CB-CB 3.88Å; P468-Y489 HydrophobicContact CB-CD1 3.73Å; P468-Y489 HydrophobicContact CB-CD2 4.2Å; P468-Y489 HydrophobicContact CB-CE1 4.1Å; P468-Y489 HydrophobicContact CB-CG 3.74Å; P468-Y489 HydrophobicContact CG-CD1 4.45Å; P468-Y489 HydrophobicContact CG-CD2 4.18Å; P468-Y489 HydrophobicContact CG-CE2 4.28Å; P468-Y489 HydrophobicContact CG-CG 4.23Å; P468-Y489 VanDerWaalsContact O-CD1 3.24Å; P468-Y489 WeakPolarHBondContact O-CD1 2.98Å; P468-Y489 WeakPolarHBondContact O-CE1 3.42Å; P468-W494 HydrophobicContact CB-CZ2 4.15Å; P468-W494 HydrophobicContact CG-CZ2 3.69Å
469	R	67.9	Low	66.3	Low	156 Å²	156	98.8 Å²	98.8	59%	0.589	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-85.2	160.2	173.8	-63	-177.5	179	-153.9	-4.4	109.7	E447 G471 H472	E447-R469 PolarHBondContact O-NH1 2.82Å; R469-G471 PolarHBondContact O-N 3.41Å; R469-H472 WeakPolarHBondContact O-CB 3.36Å; R469-H472 PolarHBondContact O-N 3.26Å
470	D	67.1	Low	68.8	Low	21 Å²	21	94.6 Å²	94.6	11%	0.112	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	137.5	173.3	-68.4	-23.6	0	0	0	109.7	R354 H472 Y489 L490 G491	R354-D470 IonicContact CZ-OD2 3.1Å; R354-D470 IonicContact NH1-OD2 2.75Å; R354-D470 PolarHBondContact NH1-OD2 2.75Å; R354-D470 IonicContact NH2-OD2 2.65Å; R354-D470 PolarHBondContact NH2-OD2 2.89Å; D470-H472 VanDerWaalsContact C-N 3.33Å; D470-Y489 CarbonylContact C-O 3.58Å; D470-Y489 WeakPolarHBondContact CA-O 3.45Å; D470-L490 HydrophobicContact CB-CD1 3.77Å; D470-L490 WeakPolarHBondContact OD1-CA 3.04Å; D470-G491 PolarHBondContact OD1-N 2.73Å
471	G	72.1	Confident	71.3	Confident	12 Å²	12	95.7 Å²	95.7	12%	0.124	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-4.5	-170.7	0	0	0	0	0	114.8	R469 Y489 Q513	R469-G471 PolarHBondContact O-N 3.41Å; G471-Y489 PolarHBondContact N-O 3.21Å; G471-Q513 PolarHBondContact O-NE2 2.97Å
472	H	82	Confident	74.3	Confident	100 Å²	100	91 Å²	91	46%	0.463	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	132.3	176.5	-167.3	68.6	0	0	0	110.8	P468 R469 D470 Y489 W494	P468-H472 HydrophobicContact CB-CB 3.88Å; R469-H472 WeakPolarHBondContact O-CB 3.36Å; R469-H472 PolarHBondContact O-N 3.26Å; D470-H472 VanDerWaalsContact C-N 3.33Å; H472-Y489 PolarHBondContact O-N 3.02Å; H472-W494 AromaticContact CD2-CH2 3.63Å
473	L	91.1	Very high	76.9	Confident	8 Å²	8	80.2 Å²	80.2	4%	0.042	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.8	-176.8	-68	170.6	0	0	0	110.6	V486 E487 L488 L510 Q513 L514 L549	L473-V486 HydrophobicContact CD2-CG1 4.47Å; L473-E487 WeakPolarHBondContact CA-O 3.21Å; L473-L488 HydrophobicContact CD2-CB 4.06Å; L473-L488 HydrophobicContact CD2-CD1 3.7Å; L473-L488 HydrophobicContact CD2-CG 4.49Å; L473-L488 HydrophobicContact CG-CD1 4.38Å; L473-L510 HydrophobicContact CD1-CD1 4.5Å; L473-L510 HydrophobicContact CD1-CG 4.06Å; L473-Q513 HydrophobicContact CD1-CB 4.26Å; L473-Q513 HydrophobicContact CD1-CG 4.04Å; L473-L514 HydrophobicContact CB-CD2 3.67Å; L473-L514 HydrophobicContact CB-CG 4.31Å; L473-L549 HydrophobicContact CD1-CB 4.42Å; L473-L549 HydrophobicContact CD2-CD2 4.18Å
474	R	93.6	Very high	80	Confident	100 Å²	100	74.8 Å²	74.8	38%	0.377	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.5	165	73.2	-177	-178.5	-171.6	0	110.2	V476 E487 W494	R474-V476 HydrophobicContact CG-CG2 3.91Å; R474-E487 HydrophobicContact CG-CB 3.8Å; R474-E487 IonicContact CZ-OE2 3.92Å; R474-E487 PolarHBondContact N-O 3.33Å; R474-E487 IonicContact NE-OE2 3.99Å; R474-E487 PolarHBondContact NE-OE2 2.92Å; R474-E487 IonicContact NH2-OE2 3.01Å; R474-E487 PolarHBondContact NH2-OE2 3.32Å; R474-E487 PolarHBondContact O-N 3.07Å; R474-W494 HydrophobicContact CB-CH2 3.82Å; R474-W494 HydrophobicContact CB-CZ3 3.97Å; R474-W494 HydrophobicContact CG-CE3 3.95Å; R474-W494 HydrophobicContact CG-CH2 3.67Å; R474-W494 HydrophobicContact CG-CZ2 4.41Å; R474-W494 HydrophobicContact CG-CZ3 3.44Å; R474-W494 VanDerWaalsContact CG-CZ3 3.44Å
475	L	96.3	Very high	82.7	Confident	29 Å²	29	70.3 Å²	70.3	15%	0.152	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	171.9	-59.1	-178.3	0	0	0	109.4	E483 R485 V486 L510 L514 V570	L475-E483 WeakPolarHBondContact CB-O 3.29Å; L475-R485 WeakPolarHBondContact CA-O 3.06Å; L475-V486 HydrophobicContact CD2-CG2 4.17Å; L475-L510 HydrophobicContact CD2-CD2 4.28Å; L475-L514 HydrophobicContact CD1-CD1 3.63Å; L475-L514 HydrophobicContact CD2-CD1 4.14Å; L475-L514 HydrophobicContact CG-CD1 3.64Å; L475-V570 HydrophobicContact CD1-CG1 3.53Å; L475-V570 HydrophobicContact CD2-CG1 3.44Å; L475-V570 VanDerWaalsContact CD2-CG1 3.44Å; L475-V570 HydrophobicContact CG-CG1 4.13Å
476	V	96.7	Very high	85.5	Confident	34 Å²	34	64.1 Å²	64.1	21%	0.206	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.1	-174.7	-173	0	0	0	0	110.2	R474 G478 G484 R485 E487	R474-V476 HydrophobicContact CG-CG2 3.91Å; V476-G478 PolarHBondContact O-N 3.22Å; V476-G484 CarbonylContact O-C 3.53Å; V476-G484 VanDerWaalsContact O-CA 3.3Å; V476-G484 WeakPolarHBondContact O-CA 3.34Å; V476-R485 PolarHBondContact N-O 2.68Å; V476-R485 PolarHBondContact O-N 2.7Å; V476-E487 VanDerWaalsContact CG2-CD 3.48Å; V476-E487 HydrophobicContact CG2-CG 4.17Å
477	N	94.8	Very high	87.3	Confident	106 Å²	106	59 Å²	59	57%	0.567	29%	0.287	S	S	*	.	S	Bend	trans	60.2	20.3	178.2	-62.2	-14.7	0	0	0	115.9	R485 F528	N477-R485 PolarHBondContact ND2-NH1 3.42Å; N477-F528 HydrophobicContact CB-CB 4.29Å; N477-F528 WeakPolarHBondContact CB-O 3.43Å; N477-F528 PolarHBondContact ND2-O 2.83Å; N477-F528 WeakPolarHBondContact O-CD1 3.37Å
478	G	92.2	Very high	88.7	Confident	27 Å²	27	50.1 Å²	50.1	28%	0.278	25%	0.253	S	S	.	.	S	Bend	trans	-84.6	163.9	165.6	0	0	0	0	0	112.8	V476 H480 E483	V476-G478 PolarHBondContact O-N 3.22Å; G478-H480 PolarHBondContact O-N 2.86Å; G478-E483 WeakPolarHBondContact CA-O 3.35Å
479	A	91.1	Very high	89.2	Confident	98 Å²	98	49 Å²	49	81%	0.81	24%	0.244	S	C	*	.	S	Bend	trans	-73.9	-19.9	174.8	0	0	0	0	0	112	E483	A479-E483 VanDerWaalsContact CA-OE1 3.26Å; A479-E483 WeakPolarHBondContact CA-OE1 3.27Å; A479-E483 WeakPolarHBondContact CB-OE1 3.18Å; A479-E483 PolarHBondContact N-OE1 3.08Å
480	H	89.4	Confident	89.4	Confident	82 Å²	82	41.7 Å²	41.7	38%	0.38	22%	0.216	S	C	.	.	S	Bend	trans	-148	170.7	174.1	61	38	0	0	0	113.5	G478 C482 E483	G478-H480 PolarHBondContact O-N 2.86Å; H480-C482 PolarHBondContact ND1-N 3.35Å; H480-C482 PolarHBondContact O-N 3.16Å; H480-E483 IonicContact CD2-OE1 2.78Å; H480-E483 IonicContact CE1-OE1 3.07Å; H480-E483 IonicContact CG-OE1 3.43Å; H480-E483 PolarHBondContact N-OE1 3.16Å; H480-E483 WeakPolarHBondContact ND1-CG 3.49Å; H480-E483 PolarHBondContact ND1-N 2.71Å; H480-E483 IonicContact ND1-OE1 3.69Å; H480-E483 IonicContact NE2-OE1 3.05Å; H480-E483 PolarHBondContact O-N 2.7Å; H480-E483 VanDerWaalsContact O-N 3.11Å; H480-E483 VanDerWaalsContact O-O 3.05Å
481	R	92	Very high	89.3	Confident	175 Å²	175	42.2 Å²	42.2	66%	0.66	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-12.4	-175.1	68.1	171.9	-73.8	-99.3	-3.5	116.9	L514	R481-L514 PolarHBondContact NH2-O 2.96Å
482	C	95.8	Very high	89.1	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.027	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	18.3	-177.9	-66.8	0	0	0	0	113.1	H480 C516 C572 P574	H480-C482 PolarHBondContact ND1-N 3.35Å; H480-C482 PolarHBondContact O-N 3.16Å; C482-C516 WeakPolarHBondContact CA-SG 3.01Å; C482-C516 HydrophobicContact CB-CB 3.62Å; C482-C516 WeakPolarHBondContact CB-SG 3.41Å; C482-C516 WeakPolarHBondContact SG-CB 3.02Å; C482-C516 CovalentContact SG-SG 2.05Å; C482-C516 PolarHBondContact SG-SG 2.79Å; C482-C572 HydrophobicContact CB-CB 4.18Å; C482-C572 VanDerWaalsContact O-CB 3.3Å; C482-C572 WeakPolarHBondContact O-CB 3.23Å; C482-C572 PolarHBondContact O-N 3.44Å; C482-P574 HydrophobicContact CB-CG 4.46Å
483	E	96.5	Very high	88.8	Confident	32 Å²	32	48.3 Å²	48.3	15%	0.15	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	157.1	167.8	73.4	-170.6	159	0	0	109.8	L475 G478 A479 H480 F528 V570 L571	L475-E483 WeakPolarHBondContact CB-O 3.29Å; G478-E483 WeakPolarHBondContact CA-O 3.35Å; A479-E483 VanDerWaalsContact CA-OE1 3.26Å; A479-E483 WeakPolarHBondContact CA-OE1 3.27Å; A479-E483 WeakPolarHBondContact CB-OE1 3.18Å; A479-E483 PolarHBondContact N-OE1 3.08Å; H480-E483 IonicContact CD2-OE1 2.78Å; H480-E483 IonicContact CE1-OE1 3.07Å; H480-E483 IonicContact CG-OE1 3.43Å; H480-E483 PolarHBondContact N-OE1 3.16Å; H480-E483 WeakPolarHBondContact ND1-CG 3.49Å; H480-E483 PolarHBondContact ND1-N 2.71Å; H480-E483 IonicContact ND1-OE1 3.69Å; H480-E483 IonicContact NE2-OE1 3.05Å; H480-E483 PolarHBondContact O-N 2.7Å; H480-E483 VanDerWaalsContact O-N 3.11Å; H480-E483 VanDerWaalsContact O-O 3.05Å; E483-F528 HydrophobicContact CB-CZ 4.21Å; E483-F528 HydrophobicContact CG-CE1 4.32Å; E483-F528 HydrophobicContact CG-CZ 4.47Å; E483-V570 CarbonylContact C-O 3.46Å; E483-V570 VanDerWaalsContact CA-O 3.23Å; E483-V570 WeakPolarHBondContact CA-O 3.11Å; E483-L571 HydrophobicContact CB-CG 4.21Å
484	G	97.5	Very high	88.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143	-178.6	176.6	0	0	0	0	0	113.5	V476 F528 G569 V570	V476-G484 CarbonylContact O-C 3.53Å; V476-G484 VanDerWaalsContact O-CA 3.3Å; V476-G484 WeakPolarHBondContact O-CA 3.34Å; G484-F528 WeakPolarHBondContact O-CD2 3.38Å; G484-G569 CarbonylContact O-C 3.46Å; G484-G569 WeakPolarHBondContact O-CA 3.36Å; G484-V570 PolarHBondContact N-O 3.25Å; G484-V570 PolarHBondContact O-N 3.04Å
485	R	98.3	Very high	88.3	Confident	15 Å²	15	46.2 Å²	46.2	6%	0.057	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	135.5	168.9	-178	177.7	57.7	-97.9	-2.9	109.4	L475 V476 N477 E487 F528 G529 D567	L475-R485 WeakPolarHBondContact CA-O 3.06Å; V476-R485 PolarHBondContact N-O 2.68Å; V476-R485 PolarHBondContact O-N 2.7Å; N477-R485 PolarHBondContact ND2-NH1 3.42Å; R485-E487 IonicContact CZ-OE1 3.98Å; R485-E487 IonicContact NE-OE1 2.62Å; R485-E487 PolarHBondContact NE-OE1 2.85Å; R485-E487 IonicContact NH2-OE1 3.38Å; R485-E487 PolarHBondContact NH2-OE1 2.03Å; R485-E487 PolarHBondContact O-N 2.84Å; R485-F528 HydrophobicContact CB-CB 4.01Å; R485-F528 PolarHBondContact NH1-O 3.3Å; R485-G529 PolarHBondContact NH1-O 3.29Å; R485-D567 WeakPolarHBondContact CD-OD2 3.08Å; R485-D567 HydrophobicContact CG-CB 4.13Å
486	V	97.8	Very high	88.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.1	179.7	-179.3	0	0	0	0	109.5	L473 L475 V497 W502 L510 L549 A568 V570	L473-V486 HydrophobicContact CD2-CG1 4.47Å; L475-V486 HydrophobicContact CD2-CG2 4.17Å; V486-V497 HydrophobicContact CB-CB 4.43Å; V486-V497 HydrophobicContact CB-CG2 4.4Å; V486-V497 HydrophobicContact CG1-CB 4.21Å; V486-V497 HydrophobicContact CG1-CG2 3.71Å; V486-W502 HydrophobicContact CG2-CH2 4.23Å; V486-W502 HydrophobicContact CG2-CZ2 3.83Å; V486-L510 HydrophobicContact CB-CD1 4.07Å; V486-L510 HydrophobicContact CG1-CD1 3.4Å; V486-L510 VanDerWaalsContact CG1-CD1 3.4Å; V486-L510 HydrophobicContact CG2-CD1 3.47Å; V486-L510 VanDerWaalsContact CG2-CD1 3.47Å; V486-L549 HydrophobicContact CG1-CD2 4.34Å; V486-A568 PolarHBondContact N-O 3.26Å; V486-V570 HydrophobicContact CG2-CB 4.2Å; V486-V570 HydrophobicContact CG2-CG1 4.17Å
487	E	95.2	Very high	88.2	Confident	11 Å²	11	43.2 Å²	43.2	5%	0.051	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.1	171.1	-69.6	-177.4	-163.8	0	0	110.7	L473 R474 V476 R485 W494 G495 T496	L473-E487 WeakPolarHBondContact CA-O 3.21Å; R474-E487 HydrophobicContact CG-CB 3.8Å; R474-E487 IonicContact CZ-OE2 3.92Å; R474-E487 PolarHBondContact N-O 3.33Å; R474-E487 IonicContact NE-OE2 3.99Å; R474-E487 PolarHBondContact NE-OE2 2.92Å; R474-E487 IonicContact NH2-OE2 3.01Å; R474-E487 PolarHBondContact NH2-OE2 3.32Å; R474-E487 PolarHBondContact O-N 3.07Å; V476-E487 VanDerWaalsContact CG2-CD 3.48Å; V476-E487 HydrophobicContact CG2-CG 4.17Å; R485-E487 IonicContact CZ-OE1 3.98Å; R485-E487 IonicContact NE-OE1 2.62Å; R485-E487 PolarHBondContact NE-OE1 2.85Å; R485-E487 IonicContact NH2-OE1 3.38Å; R485-E487 PolarHBondContact NH2-OE1 2.03Å; R485-E487 PolarHBondContact O-N 2.84Å; E487-W494 HydrophobicContact CB-CE3 4.14Å; E487-G495 CarbonylContact C-O 3.37Å; E487-G495 VanDerWaalsContact CA-O 3.23Å; E487-G495 WeakPolarHBondContact CA-O 3.48Å; E487-T496 HydrophobicContact CG-CG2 4Å
488	L	87.9	Confident	88.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.6	-177.8	173.2	70.7	0	0	0	109.5	L473 L490 W494 G495 L536 L537 L550	L473-L488 HydrophobicContact CD2-CB 4.06Å; L473-L488 HydrophobicContact CD2-CD1 3.7Å; L473-L488 HydrophobicContact CD2-CG 4.49Å; L473-L488 HydrophobicContact CG-CD1 4.38Å; L488-L490 HydrophobicContact CD2-CB 4.49Å; L488-W494 VanDerWaalsContact C-CE3 3.48Å; L488-W494 WeakPolarHBondContact O-CA 3.37Å; L488-G495 PolarHBondContact N-O 3.27Å; L488-G495 PolarHBondContact O-N 2.84Å; L488-L536 HydrophobicContact CB-CD1 4.17Å; L488-L536 HydrophobicContact CD2-CD1 4.46Å; L488-L536 HydrophobicContact CG-CD1 4.36Å; L488-L536 WeakPolarHBondContact O-CD1 3.1Å; L488-L537 HydrophobicContact CD2-CD1 3.7Å; L488-L537 HydrophobicContact CD2-CG 3.99Å; L488-L550 HydrophobicContact CD1-CD1 4.47Å; L488-L550 HydrophobicContact CD1-CG 4.32Å; L488-L550 HydrophobicContact CD2-CD2 3.66Å; L488-L550 HydrophobicContact CD2-CG 4.23Å
489	Y	78.1	Confident	88.2	Confident	18 Å²	18	38.3 Å²	38.3	7%	0.071	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.1	169	-164.2	-102.4	0	0	0	109.6	P468 D470 G471 H472 Q492 R493 W494	P468-Y489 HydrophobicContact CB-CD1 3.73Å; P468-Y489 HydrophobicContact CB-CD2 4.2Å; P468-Y489 HydrophobicContact CB-CE1 4.1Å; P468-Y489 HydrophobicContact CB-CG 3.74Å; P468-Y489 HydrophobicContact CG-CD1 4.45Å; P468-Y489 HydrophobicContact CG-CD2 4.18Å; P468-Y489 HydrophobicContact CG-CE2 4.28Å; P468-Y489 HydrophobicContact CG-CG 4.23Å; P468-Y489 VanDerWaalsContact O-CD1 3.24Å; P468-Y489 WeakPolarHBondContact O-CD1 2.98Å; P468-Y489 WeakPolarHBondContact O-CE1 3.42Å; D470-Y489 CarbonylContact C-O 3.58Å; D470-Y489 WeakPolarHBondContact CA-O 3.45Å; G471-Y489 PolarHBondContact N-O 3.21Å; H472-Y489 PolarHBondContact O-N 3.02Å; Y489-Q492 VanDerWaalsContact CZ-C 3.41Å; Y489-Q492 VanDerWaalsContact CZ-CA 3.47Å; Y489-Q492 VanDerWaalsContact OH-C 3.29Å; Y489-Q492 WeakPolarHBondContact OH-CA 3.46Å; Y489-Q492 PolarHBondContact OH-O 2.88Å; Y489-Q492 VanDerWaalsContact OH-O 3.06Å; Y489-R493 WeakPolarHBondContact CA-O 2.92Å; Y489-R493 WeakPolarHBondContact CD2-O 3.12Å; Y489-W494 AromaticContact CD2-CD1 3.66Å; Y489-W494 AromaticContact CD2-CD2 3.69Å; Y489-W494 HydrophobicContact CD2-CD2 3.69Å; Y489-W494 AromaticContact CD2-CE2 3.57Å; Y489-W494 HydrophobicContact CD2-CE3 4.35Å; Y489-W494 AromaticContact CD2-CG 3.78Å; Y489-W494 HydrophobicContact CD2-CG 3.78Å; Y489-W494 HydrophobicContact CD2-CZ2 4.19Å; Y489-W494 AromaticContact CD2-NE1 3.52Å; Y489-W494 AromaticContact CE2-CD1 3.92Å; Y489-W494 HydrophobicContact CE2-CG 4.42Å; Y489-W494 AromaticContact CE2-NE1 3.86Å; Y489-W494 HydrophobicContact CG-CD2 4.4Å
490	L	71.9	Confident	88	Confident	2 Å²	2	36 Å²	36	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	134	178.5	-167.3	60.3	0	0	0	109.8	L442 D470 L488 Q492 R493 L536 L550 W557	L442-L490 HydrophobicContact CD1-CD1 4.26Å; L442-L490 HydrophobicContact CD1-CG 4.47Å; D470-L490 HydrophobicContact CB-CD1 3.77Å; D470-L490 WeakPolarHBondContact OD1-CA 3.04Å; L488-L490 HydrophobicContact CD2-CB 4.49Å; L490-Q492 VanDerWaalsContact C-N 3.34Å; L490-Q492 PolarHBondContact O-N 2.91Å; L490-R493 PolarHBondContact N-O 2.85Å; L490-R493 VanDerWaalsContact O-CG 3.29Å; L490-R493 WeakPolarHBondContact O-CG 3.24Å; L490-R493 PolarHBondContact O-N 2.85Å; L490-R493 VanDerWaalsContact O-N 3.17Å; L490-R493 VanDerWaalsContact O-O 3.08Å; L490-L536 HydrophobicContact CB-CD1 4.15Å; L490-L550 HydrophobicContact CD1-CD1 4.26Å; L490-L550 HydrophobicContact CD2-CD2 4.47Å; L490-W557 HydrophobicContact CB-CH2 4.37Å; L490-W557 HydrophobicContact CB-CZ2 4.25Å; L490-W557 HydrophobicContact CD2-CD2 3.52Å; L490-W557 HydrophobicContact CD2-CE3 3.61Å; L490-W557 HydrophobicContact CD2-CG 3.95Å; L490-W557 HydrophobicContact CD2-CH2 4.4Å; L490-W557 HydrophobicContact CD2-CZ2 4.29Å; L490-W557 HydrophobicContact CD2-CZ3 4.06Å; L490-W557 HydrophobicContact CG-CD2 4.18Å; L490-W557 HydrophobicContact CG-CE3 3.93Å; L490-W557 HydrophobicContact CG-CH2 3.98Å; L490-W557 HydrophobicContact CG-CZ2 4.16Å; L490-W557 HydrophobicContact CG-CZ3 3.85Å
491	G	64.6	Low	87.8	Confident	32 Å²	32	34 Å²	34	33%	0.33	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	44.6	177.9	0	0	0	0	0	113.9	D470 R493	D470-G491 PolarHBondContact OD1-N 2.73Å; G491-R493 PolarHBondContact O-N 3.26Å
492	Q	68.7	Low	87.9	Confident	129 Å²	129	26.7 Å²	26.7	60%	0.603	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.1	6.9	-179.4	-58.6	-179	83.3	0	0	116.5	Y489 L490	Y489-Q492 VanDerWaalsContact CZ-C 3.41Å; Y489-Q492 VanDerWaalsContact CZ-CA 3.47Å; Y489-Q492 VanDerWaalsContact OH-C 3.29Å; Y489-Q492 WeakPolarHBondContact OH-CA 3.46Å; Y489-Q492 PolarHBondContact OH-O 2.88Å; Y489-Q492 VanDerWaalsContact OH-O 3.06Å; L490-Q492 VanDerWaalsContact C-N 3.34Å; L490-Q492 PolarHBondContact O-N 2.91Å
493	R	75.4	Confident	87.6	Confident	112 Å²	112	28.3 Å²	28.3	42%	0.423	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.1	177.4	64.9	-167.3	-58.4	-149.4	3.2	111.4	Y489 L490 G491 P534 L536 W557 D558	Y489-R493 WeakPolarHBondContact CA-O 2.92Å; Y489-R493 WeakPolarHBondContact CD2-O 3.12Å; L490-R493 PolarHBondContact N-O 2.85Å; L490-R493 VanDerWaalsContact O-CG 3.29Å; L490-R493 WeakPolarHBondContact O-CG 3.24Å; L490-R493 PolarHBondContact O-N 2.85Å; L490-R493 VanDerWaalsContact O-N 3.17Å; L490-R493 VanDerWaalsContact O-O 3.08Å; G491-R493 PolarHBondContact O-N 3.26Å; R493-P534 VanDerWaalsContact NH2-CD 3.32Å; R493-P534 VanDerWaalsContact NH2-CG 3.29Å; R493-L536 HydrophobicContact CG-CD2 4.48Å; R493-W557 HydrophobicContact CG-CZ2 4.44Å; R493-D558 IonicContact NH1-OD2 2.66Å; R493-D558 PolarHBondContact NH1-OD2 3.3Å
494	W	84.8	Confident	87.4	Confident	62 Å²	62	31.7 Å²	31.7	24%	0.235	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	147.2	166.8	-74.1	100.4	0	0	0	109.2	P468 H472 R474 E487 L488 Y489 P534	P468-W494 HydrophobicContact CB-CZ2 4.15Å; P468-W494 HydrophobicContact CG-CZ2 3.69Å; H472-W494 AromaticContact CD2-CH2 3.63Å; R474-W494 HydrophobicContact CB-CH2 3.82Å; R474-W494 HydrophobicContact CB-CZ3 3.97Å; R474-W494 HydrophobicContact CG-CE3 3.95Å; R474-W494 HydrophobicContact CG-CH2 3.67Å; R474-W494 HydrophobicContact CG-CZ2 4.41Å; R474-W494 HydrophobicContact CG-CZ3 3.44Å; R474-W494 VanDerWaalsContact CG-CZ3 3.44Å; E487-W494 HydrophobicContact CB-CE3 4.14Å; L488-W494 VanDerWaalsContact C-CE3 3.48Å; L488-W494 WeakPolarHBondContact O-CA 3.37Å; Y489-W494 AromaticContact CD2-CD1 3.66Å; Y489-W494 AromaticContact CD2-CD2 3.69Å; Y489-W494 HydrophobicContact CD2-CD2 3.69Å; Y489-W494 AromaticContact CD2-CE2 3.57Å; Y489-W494 HydrophobicContact CD2-CE3 4.35Å; Y489-W494 AromaticContact CD2-CG 3.78Å; Y489-W494 HydrophobicContact CD2-CG 3.78Å; Y489-W494 HydrophobicContact CD2-CZ2 4.19Å; Y489-W494 AromaticContact CD2-NE1 3.52Å; Y489-W494 AromaticContact CE2-CD1 3.92Å; Y489-W494 HydrophobicContact CE2-CG 4.42Å; Y489-W494 AromaticContact CE2-NE1 3.86Å; Y489-W494 HydrophobicContact CG-CD2 4.4Å; W494-P534 WeakPolarHBondContact O-CD 3.45Å
495	G	90.4	Very high	87	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	176.5	168.1	0	0	0	0	0	112.3	E487 L488 P534	E487-G495 CarbonylContact C-O 3.37Å; E487-G495 VanDerWaalsContact CA-O 3.23Å; E487-G495 WeakPolarHBondContact CA-O 3.48Å; L488-G495 PolarHBondContact N-O 3.27Å; L488-G495 PolarHBondContact O-N 2.84Å; G495-P534 CarbonylContact C-O 3.51Å; G495-P534 WeakPolarHBondContact CA-O 3.33Å
496	T	94.8	Very high	86.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	176.3	-171.4	56.6	0	0	0	0	111.5	E487 P534 I535 L536 H564 D567	E487-T496 HydrophobicContact CG-CG2 4Å; T496-P534 PolarHBondContact N-O 3.21Å; T496-I535 VanDerWaalsContact OG1-CG1 3.26Å; T496-I535 WeakPolarHBondContact OG1-CG1 3.48Å; T496-L536 PolarHBondContact O-N 3.45Å; T496-H564 PolarHBondContact OG1-CE1 2.69Å; T496-H564 PolarHBondContact OG1-ND1 3Å; T496-D567 WeakPolarHBondContact CB-OD1 3.15Å; T496-D567 WeakPolarHBondContact CG2-OD2 3.32Å; T496-D567 PolarHBondContact OG1-OD1 2.81Å
497	V	94.4	Very high	86.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.8	176.8	177.1	0	0	0	0	106.6	V486 W502 L537 V540 L549 A568	V486-V497 HydrophobicContact CB-CB 4.43Å; V486-V497 HydrophobicContact CB-CG2 4.4Å; V486-V497 HydrophobicContact CG1-CB 4.21Å; V486-V497 HydrophobicContact CG1-CG2 3.71Å; V497-W502 HydrophobicContact CG1-CE3 4.06Å; V497-W502 HydrophobicContact CG1-CZ3 4.01Å; V497-L537 CarbonylContact C-O 3.57Å; V497-L537 WeakPolarHBondContact CA-O 3.31Å; V497-L537 HydrophobicContact CG1-CB 4.09Å; V497-L537 HydrophobicContact CG2-CB 4.22Å; V497-L537 HydrophobicContact CG2-CD1 4.29Å; V497-V540 HydrophobicContact CG1-CG2 3.89Å; V497-L549 HydrophobicContact CG2-CD2 4.41Å; V497-A568 HydrophobicContact CB-CB 4.28Å; V497-A568 HydrophobicContact CG1-CB 4.27Å; V497-A568 VanDerWaalsContact O-CB 3.29Å; V497-A568 WeakPolarHBondContact O-CB 3.43Å; V497-A568 PolarHBondContact O-N 2.97Å
498	C	93.3	Very high	86.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-71.7	147	174.2	-173.5	0	0	0	0	110.9	D500 I535 L537 D538 C562 E566	C498-D500 VanDerWaalsContact C-N 3.26Å; C498-D500 PolarHBondContact SG-N 2.91Å; C498-I535 HydrophobicContact CB-CG2 3.96Å; C498-L537 PolarHBondContact N-O 2.82Å; C498-D538 HydrophobicContact CB-CB 4.08Å; C498-C562 HydrophobicContact CB-CB 3.73Å; C498-C562 WeakPolarHBondContact CB-SG 3.4Å; C498-C562 WeakPolarHBondContact SG-CB 3.43Å; C498-C562 CovalentContact SG-SG 2.01Å; C498-C562 PolarHBondContact SG-SG 3.22Å; C498-E566 CarbonylContact C-O 3.55Å
499	D	93.4	Very high	86.7	Confident	30 Å²	30	38.2 Å²	38.2	16%	0.16	19%	0.192	C	C	.	.			trans	-80.3	-3.4	177.5	71.4	-14.3	0	0	0	114.1	A501 W502 G524 E525 E566 A568	D499-A501 PolarHBondContact O-N 2.79Å; D499-W502 HydrophobicContact CB-CB 4.28Å; D499-W502 WeakPolarHBondContact O-CB 3.22Å; D499-W502 PolarHBondContact O-N 3.36Å; D499-G524 WeakPolarHBondContact OD2-CA 3.38Å; D499-E525 PolarHBondContact OD2-N 3.19Å; D499-E566 WeakPolarHBondContact CB-O 3.37Å; D499-E566 VanDerWaalsContact CG-O 3.27Å; D499-E566 PolarHBondContact N-O 3.1Å; D499-E566 WeakPolarHBondContact OD1-CB 3.4Å; D499-E566 VanDerWaalsContact OD1-O 3.13Å; D499-A568 HydrophobicContact CB-CB 4.19Å
500	D	88.3	Confident	87.5	Confident	51 Å²	51	37.3 Å²	37.3	27%	0.273	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	120.8	171.3	-104.1	10.8	0	0	0	111.1	C498 W502 D538 N539	C498-D500 VanDerWaalsContact C-N 3.26Å; C498-D500 PolarHBondContact SG-N 2.91Å; D500-W502 PolarHBondContact O-N 3.25Å; D500-D538 WeakPolarHBondContact CB-OD1 3.11Å; D500-N539 VanDerWaalsContact O-CA 3.28Å; D500-N539 WeakPolarHBondContact O-CA 3.16Å; D500-N539 PolarHBondContact O-N 3.25Å
501	A	85.4	Confident	88.6	Confident	40 Å²	40	37.2 Å²	37.2	33%	0.331	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	12.9	-171	0	0	0	0	0	116.1	D499 D503 K541	D499-A501 PolarHBondContact O-N 2.79Å; A501-D503 PolarHBondContact O-N 3.08Å; A501-K541 HydrophobicContact CB-CD 4.17Å; A501-K541 HydrophobicContact CB-CG 3.74Å
502	W	94.3	Very high	90	Very high	20 Å²	20	41.1 Å²	41.1	8%	0.076	19%	0.193	C	C	.	.			trans	-69.7	116.5	176.1	-175.3	-111.3	0	0	0	110.9	V486 V497 D499 D500 A506 A507 L510 V540 L549 A568 G569	V486-W502 HydrophobicContact CG2-CH2 4.23Å; V486-W502 HydrophobicContact CG2-CZ2 3.83Å; V497-W502 HydrophobicContact CG1-CE3 4.06Å; V497-W502 HydrophobicContact CG1-CZ3 4.01Å; D499-W502 HydrophobicContact CB-CB 4.28Å; D499-W502 WeakPolarHBondContact O-CB 3.22Å; D499-W502 PolarHBondContact O-N 3.36Å; D500-W502 PolarHBondContact O-N 3.25Å; W502-A506 HydrophobicContact CD2-CB 4.3Å; W502-A506 HydrophobicContact CE3-CB 3.79Å; W502-A506 HydrophobicContact CH2-CB 4.24Å; W502-A506 HydrophobicContact CZ3-CB 3.78Å; W502-A507 HydrophobicContact CZ2-CB 4.46Å; W502-L510 HydrophobicContact CH2-CB 4.44Å; W502-L510 HydrophobicContact CH2-CD1 3.81Å; W502-L510 HydrophobicContact CZ2-CD1 4.1Å; W502-V540 HydrophobicContact CE3-CB 4.23Å; W502-V540 HydrophobicContact CE3-CG1 4.46Å; W502-V540 HydrophobicContact CZ3-CB 4.4Å; W502-V540 HydrophobicContact CZ3-CG1 4.21Å; W502-L549 HydrophobicContact CH2-CD1 3.88Å; W502-L549 HydrophobicContact CH2-CD2 4.13Å; W502-L549 HydrophobicContact CZ3-CD1 3.77Å; W502-L549 HydrophobicContact CZ3-CD2 4.11Å; W502-L549 HydrophobicContact CZ3-CG 4.48Å; W502-A568 HydrophobicContact CB-CB 4.45Å; W502-A568 HydrophobicContact CD2-CB 3.82Å; W502-A568 HydrophobicContact CE3-CB 4.38Å; W502-A568 HydrophobicContact CG-CB 3.81Å; W502-G569 PolarHBondContact NE1-O 2.6Å
503	D	88.9	Confident	91	Very high	39 Å²	39	38 Å²	38	21%	0.209	18%	0.178	C	C	.	.			trans	-130.5	177.2	-174.7	74.7	15.8	0	0	0	113.7	A501 R505 A506 A507 A522	A501-D503 PolarHBondContact O-N 3.08Å; D503-R505 PolarHBondContact O-N 3.48Å; D503-R505 WeakPolarHBondContact OD1-CA 3.31Å; D503-R505 VanDerWaalsContact OD1-CB 3.25Å; D503-R505 WeakPolarHBondContact OD1-CB 3.21Å; D503-R505 PolarHBondContact OD1-N 2.97Å; D503-R505 IonicContact OD2-CZ 3.98Å; D503-R505 IonicContact OD2-NE 2.71Å; D503-R505 PolarHBondContact OD2-NE 2.85Å; D503-R505 VanDerWaalsContact OD2-NE 3.11Å; D503-R505 IonicContact OD2-NH2 2.94Å; D503-R505 PolarHBondContact OD2-NH2 3.09Å; D503-A506 PolarHBondContact O-N 2.78Å; D503-A506 VanDerWaalsContact O-N 3.14Å; D503-A506 PolarHBondContact OD1-N 2.8Å; D503-A507 PolarHBondContact O-N 3.41Å; D503-A522 WeakPolarHBondContact O-CB 3.38Å
504	L	92	Very high	91.7	Very high	102 Å²	102	34.3 Å²	34.3	53%	0.534	17%	0.167	S	C	.	.	H	α-helix	trans	-61.9	-23.3	178.2	-84.5	174.5	0	0	0	113.9	G508 A519	L504-G508 PolarHBondContact O-N 3.23Å; L504-A519 HydrophobicContact CD2-CB 4.4Å
505	R	89.8	Confident	92	Very high	142 Å²	142	33.7 Å²	33.7	54%	0.536	18%	0.179	S	C	.	.	H	α-helix	trans	-73.7	-42.7	174.6	-66.6	175.6	-74.9	-102.6	-1.5	109.9	D503 G508 V509 C542	D503-R505 PolarHBondContact O-N 3.48Å; D503-R505 WeakPolarHBondContact OD1-CA 3.31Å; D503-R505 VanDerWaalsContact OD1-CB 3.25Å; D503-R505 WeakPolarHBondContact OD1-CB 3.21Å; D503-R505 PolarHBondContact OD1-N 2.97Å; D503-R505 IonicContact OD2-CZ 3.98Å; D503-R505 IonicContact OD2-NE 2.71Å; D503-R505 PolarHBondContact OD2-NE 2.85Å; D503-R505 VanDerWaalsContact OD2-NE 3.11Å; D503-R505 IonicContact OD2-NH2 2.94Å; D503-R505 PolarHBondContact OD2-NH2 3.09Å; R505-G508 PolarHBondContact O-N 3.43Å; R505-V509 PolarHBondContact O-N 3.45Å; R505-C542 HydrophobicContact CB-CB 4.43Å; R505-C542 PolarHBondContact NE-O 3.04Å
506	A	91.6	Very high	92.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-46.5	174.4	0	0	0	0	0	112.4	W502 D503 G508 V509 L510 V540 C542	W502-A506 HydrophobicContact CD2-CB 4.3Å; W502-A506 HydrophobicContact CE3-CB 3.79Å; W502-A506 HydrophobicContact CH2-CB 4.24Å; W502-A506 HydrophobicContact CZ3-CB 3.78Å; D503-A506 PolarHBondContact O-N 2.78Å; D503-A506 VanDerWaalsContact O-N 3.14Å; D503-A506 PolarHBondContact OD1-N 2.8Å; A506-G508 VanDerWaalsContact C-N 3.25Å; A506-G508 PolarHBondContact O-N 2.95Å; A506-V509 PolarHBondContact O-N 3.4Å; A506-L510 PolarHBondContact O-N 2.85Å; A506-V540 HydrophobicContact CB-CG1 4.44Å; A506-C542 WeakPolarHBondContact CA-SG 3.35Å; A506-C542 HydrophobicContact CB-CB 4.23Å
507	A	95.5	Very high	92	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-38.8	170.7	0	0	0	0	0	112.2	W502 D503 L510 C511 A519 A522 V570	W502-A507 HydrophobicContact CZ2-CB 4.46Å; D503-A507 PolarHBondContact O-N 3.41Å; A507-L510 PolarHBondContact O-N 3.31Å; A507-C511 WeakPolarHBondContact O-CB 3.41Å; A507-C511 PolarHBondContact O-N 2.98Å; A507-C511 PolarHBondContact O-SG 2.97Å; A507-A519 HydrophobicContact CB-CB 3.76Å; A507-A522 HydrophobicContact CB-CB 3.69Å; A507-V570 HydrophobicContact CB-CG2 3.7Å
508	G	93.2	Very high	92	Very high	22 Å²	22	41.9 Å²	41.9	23%	0.227	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-45.4	176.8	0	0	0	0	0	113.4	L504 R505 A506 L510 R512	L504-G508 PolarHBondContact O-N 3.23Å; R505-G508 PolarHBondContact O-N 3.43Å; A506-G508 VanDerWaalsContact C-N 3.25Å; A506-G508 PolarHBondContact O-N 2.95Å; G508-L510 VanDerWaalsContact C-N 3.34Å; G508-R512 WeakPolarHBondContact O-CB 3.26Å; G508-R512 PolarHBondContact O-N 3.21Å; G508-R512 VanDerWaalsContact O-N 3.09Å
509	V	92.8	Very high	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-47	173.5	170.3	0	0	0	0	110.4	R505 A506 R512 Q513 C542 E546 A548	R505-V509 PolarHBondContact O-N 3.45Å; A506-V509 PolarHBondContact O-N 3.4Å; V509-R512 PolarHBondContact O-N 2Å; V509-Q513 WeakPolarHBondContact O-CB 3.3Å; V509-Q513 PolarHBondContact O-N 3.2Å; V509-C542 HydrophobicContact CG2-CB 3.95Å; V509-E546 HydrophobicContact CG1-CB 4.13Å; V509-E546 WeakPolarHBondContact CG1-O 2.93Å; V509-E546 HydrophobicContact CG2-CB 4.01Å; V509-A548 VanDerWaalsContact CG1-C 3.44Å
510	L	94.9	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-51.8	178.6	-179.6	156	0	0	0	112.2	L473 L475 V486 W502 A506 A507 G508 R512 Q513 L514 L549 V570	L473-L510 HydrophobicContact CD1-CD1 4.5Å; L473-L510 HydrophobicContact CD1-CG 4.06Å; L475-L510 HydrophobicContact CD2-CD2 4.28Å; V486-L510 HydrophobicContact CB-CD1 4.07Å; V486-L510 HydrophobicContact CG1-CD1 3.4Å; V486-L510 VanDerWaalsContact CG1-CD1 3.4Å; V486-L510 HydrophobicContact CG2-CD1 3.47Å; V486-L510 VanDerWaalsContact CG2-CD1 3.47Å; W502-L510 HydrophobicContact CH2-CB 4.44Å; W502-L510 HydrophobicContact CH2-CD1 3.81Å; W502-L510 HydrophobicContact CZ2-CD1 4.1Å; A506-L510 PolarHBondContact O-N 2.85Å; A507-L510 PolarHBondContact O-N 3.31Å; G508-L510 VanDerWaalsContact C-N 3.34Å; L510-R512 VanDerWaalsContact C-N 3.25Å; L510-R512 PolarHBondContact O-N 3.24Å; L510-Q513 WeakPolarHBondContact O-CB 3.46Å; L510-Q513 PolarHBondContact O-N 3.22Å; L510-Q513 VanDerWaalsContact O-N 3.09Å; L510-L514 HydrophobicContact CD2-CD1 3.49Å; L510-L514 VanDerWaalsContact CD2-CD1 3.49Å; L510-L514 HydrophobicContact CD2-CG 4.19Å; L510-L514 HydrophobicContact CG-CD1 4.35Å; L510-L514 PolarHBondContact O-N 3.08Å; L510-L549 HydrophobicContact CB-CD1 4.39Å; L510-L549 HydrophobicContact CD1-CD2 4.37Å; L510-V570 HydrophobicContact CD1-CG1 4.45Å; L510-V570 HydrophobicContact CD2-CB 4.27Å; L510-V570 HydrophobicContact CD2-CG1 3.65Å; L510-V570 HydrophobicContact CD2-CG2 4.16Å
511	C	94.6	Very high	92.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-38.5	-177.7	-68.4	0	0	0	0	111.3	A507 L514 G515 C516 G517 A519 C572	A507-C511 WeakPolarHBondContact O-CB 3.41Å; A507-C511 PolarHBondContact O-N 2.98Å; A507-C511 PolarHBondContact O-SG 2.97Å; C511-L514 PolarHBondContact O-N 2.81Å; C511-G515 PolarHBondContact O-N 3.14Å; C511-C516 PolarHBondContact O-N 2.85Å; C511-G517 VanDerWaalsContact CB-O 3.31Å; C511-G517 WeakPolarHBondContact CB-O 3.15Å; C511-A519 HydrophobicContact CB-CB 4.46Å; C511-C572 VanDerWaalsContact CA-SG 3.51Å; C511-C572 HydrophobicContact CB-CB 3.73Å; C511-C572 WeakPolarHBondContact CB-SG 3.46Å; C511-C572 WeakPolarHBondContact SG-CB 3.35Å; C511-C572 CovalentContact SG-SG 2.03Å; C511-C572 PolarHBondContact SG-SG 3.14Å
512	R	93.1	Very high	93.1	Very high	114 Å²	114	44.1 Å²	44.1	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-66	-44.1	173.5	179.5	165.3	48.6	120.9	-0.6	111.8	G508 V509 L510 L514 G515 G544 E545 E546	G508-R512 WeakPolarHBondContact O-CB 3.26Å; G508-R512 PolarHBondContact O-N 3.21Å; G508-R512 VanDerWaalsContact O-N 3.09Å; V509-R512 PolarHBondContact O-N 2Å; L510-R512 VanDerWaalsContact C-N 3.25Å; L510-R512 PolarHBondContact O-N 3.24Å; R512-L514 VanDerWaalsContact C-N 3.3Å; R512-L514 PolarHBondContact O-N 2.78Å; R512-G515 PolarHBondContact O-N 3.41Å; R512-G515 VanDerWaalsContact O-N 3.1Å; R512-G544 PolarHBondContact NH2-O 2.03Å; R512-E545 PolarHBondContact NH1-O 3.15Å; R512-E545 PolarHBondContact NH2-O 2.93Å; R512-E545 VanDerWaalsContact NH2-O 3.16Å; R512-E546 VanDerWaalsContact CZ-O 3.3Å; R512-E546 PolarHBondContact NH2-O 2.03Å
513	Q	89.5	Confident	92.9	Very high	62 Å²	62	44.3 Å²	44.3	29%	0.29	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-35.7	177.5	-173.1	-179.6	-10.5	0	0	112.5	G471 L473 V509 L510 G515	G471-Q513 PolarHBondContact O-NE2 2.97Å; L473-Q513 HydrophobicContact CD1-CB 4.26Å; L473-Q513 HydrophobicContact CD1-CG 4.04Å; V509-Q513 WeakPolarHBondContact O-CB 3.3Å; V509-Q513 PolarHBondContact O-N 3.2Å; L510-Q513 WeakPolarHBondContact O-CB 3.46Å; L510-Q513 PolarHBondContact O-N 3.22Å; L510-Q513 VanDerWaalsContact O-N 3.09Å; Q513-G515 VanDerWaalsContact C-N 3.3Å
514	L	89.9	Confident	93.1	Very high	36 Å²	36	43.5 Å²	43.5	19%	0.188	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.7	175.9	-72	179.9	0	0	0	114.4	L473 L475 R481 L510 C511 R512 C516	L473-L514 HydrophobicContact CB-CD2 3.67Å; L473-L514 HydrophobicContact CB-CG 4.31Å; L475-L514 HydrophobicContact CD1-CD1 3.63Å; L475-L514 HydrophobicContact CD2-CD1 4.14Å; L475-L514 HydrophobicContact CG-CD1 3.64Å; R481-L514 PolarHBondContact NH2-O 2.96Å; L510-L514 HydrophobicContact CD2-CD1 3.49Å; L510-L514 VanDerWaalsContact CD2-CD1 3.49Å; L510-L514 HydrophobicContact CD2-CG 4.19Å; L510-L514 HydrophobicContact CG-CD1 4.35Å; L510-L514 PolarHBondContact O-N 3.08Å; C511-L514 PolarHBondContact O-N 2.81Å; R512-L514 VanDerWaalsContact C-N 3.3Å; R512-L514 PolarHBondContact O-N 2.78Å; L514-C516 VanDerWaalsContact C-N 3.3Å; L514-C516 HydrophobicContact CB-CB 4.21Å
515	G	91.2	Very high	93.1	Very high	49 Å²	49	46.7 Å²	46.7	51%	0.505	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	38.2	-171.5	0	0	0	0	0	112.3	C511 R512 Q513	C511-G515 PolarHBondContact O-N 3.14Å; R512-G515 PolarHBondContact O-N 3.41Å; R512-G515 VanDerWaalsContact O-N 3.1Å; Q513-G515 VanDerWaalsContact C-N 3.3Å
516	C	93.8	Very high	93.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.238	C	C	.	.			trans	-110.4	19.7	-177.3	-83.8	0	0	0	0	112.6	C482 C511 L514 C572 Q573	C482-C516 WeakPolarHBondContact CA-SG 3.01Å; C482-C516 HydrophobicContact CB-CB 3.62Å; C482-C516 WeakPolarHBondContact CB-SG 3.41Å; C482-C516 WeakPolarHBondContact SG-CB 3.02Å; C482-C516 CovalentContact SG-SG 2.05Å; C482-C516 PolarHBondContact SG-SG 2.79Å; C511-C516 PolarHBondContact O-N 2.85Å; L514-C516 VanDerWaalsContact C-N 3.3Å; L514-C516 HydrophobicContact CB-CB 4.21Å; C516-C572 HydrophobicContact CB-CB 3.76Å; C516-C572 VanDerWaalsContact O-CB 3.28Å; C516-C572 WeakPolarHBondContact O-CB 3.42Å; C516-Q573 CarbonylContact C-O 3.59Å; C516-Q573 CarbonylContact O-C 3.49Å
517	G	91.8	Very high	93.4	Very high	31 Å²	31	46.2 Å²	46.2	32%	0.32	26%	0.264	S	S	.	.			trans	75.3	-145.3	175.5	0	0	0	0	0	114.3	C511 S575	C511-G517 VanDerWaalsContact CB-O 3.31Å; C511-G517 WeakPolarHBondContact CB-O 3.15Å; G517-S575 WeakPolarHBondContact CA-OG 3.37Å; G517-S575 PolarHBondContact N-OG 2.86Å
518	Q	94.3	Very high	93.4	Very high	141 Å²	141	47.5 Å²	47.5	66%	0.659	27%	0.27	S	S	*	.	S	Bend	trans	-83.2	144	-176.3	-173.2	176.9	4.5	0	0	111.4	C572 Q573	Q518-C572 CarbonylContact O-C 3.56Å; Q518-C572 WeakPolarHBondContact O-CA 3.07Å; Q518-Q573 PolarHBondContact O-N 3.09Å
519	A	96.1	Very high	93.4	Very high	13 Å²	13	47.6 Å²	47.6	11%	0.107	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.8	170.6	0	0	0	0	0	111.6	L504 A507 C511	L504-A519 HydrophobicContact CD2-CB 4.4Å; A507-A519 HydrophobicContact CB-CB 3.76Å; C511-A519 HydrophobicContact CB-CB 4.46Å
520	L	95.9	Very high	93.4	Very high	97 Å²	97	51.6 Å²	51.6	51%	0.508	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-36.8	175.2	-63.1	177.3	0	0	0	111.6	L571 Q573	L520-L571 WeakPolarHBondContact CA-O 3.07Å; L520-L571 HydrophobicContact CB-CB 4.41Å; L520-L571 WeakPolarHBondContact CB-O 3.31Å; L520-L571 PolarHBondContact N-O 3.2Å; L520-Q573 HydrophobicContact CD1-CB 3.89Å; L520-Q573 HydrophobicContact CD1-CG 4.48Å; L520-Q573 HydrophobicContact CD2-CB 4.02Å; L520-Q573 HydrophobicContact CG-CB 3.9Å
521	A	95.6	Very high	93.2	Very high	35 Å²	35	52 Å²	52	29%	0.289	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	155.3	178.2	0	0	0	0	0	112.1	P523 L571	A521-P523 VanDerWaalsContact C-CD 3.45Å; A521-L571 HydrophobicContact CB-CB 4.17Å; A521-L571 HydrophobicContact CB-CD1 4.11Å; A521-L571 PolarHBondContact N-O 3.26Å; A521-L571 PolarHBondContact O-N 2.99Å
522	A	96	Very high	92.7	Very high	24 Å²	24	62.6 Å²	62.6	20%	0.198	34%	0.341	C	S	.	.			trans	-124.5	67.9	175.2	0	0	0	0	0	109.1	D503 A507	D503-A522 WeakPolarHBondContact O-CB 3.38Å; A507-A522 HydrophobicContact CB-CB 3.69Å
523	P	91.8	Very high	92.3	Very high	23 Å²	23	59.8 Å²	59.8	15%	0.149	35%	0.348	C	S	.	.			trans	-67.6	141.5	-177.6	29.1	-36.9	0	0	0	111.7	A521 H527 F528 G569 L571	A521-P523 VanDerWaalsContact C-CD 3.45Å; P523-H527 HydrophobicContact CB-CB 3.77Å; P523-H527 HydrophobicContact CG-CB 4.27Å; P523-F528 HydrophobicContact CG-CD2 4.45Å; P523-F528 HydrophobicContact CG-CE2 3.81Å; P523-G569 VanDerWaalsContact CD-O 3.31Å; P523-G569 WeakPolarHBondContact CD-O 3.33Å; P523-G569 WeakPolarHBondContact O-CA 3.37Å; P523-G569 PolarHBondContact O-N 3.46Å; P523-L571 HydrophobicContact CG-CD1 3.62Å
524	G	92.7	Very high	91.9	Very high	22 Å²	22	57.6 Å²	57.6	23%	0.227	34%	0.339	C	S	.	.			trans	-102.8	-153.8	170.5	0	0	0	0	0	112.5	D499 A526 H527	D499-G524 WeakPolarHBondContact OD2-CA 3.38Å; G524-A526 PolarHBondContact O-N 3.45Å; G524-A526 VanDerWaalsContact O-N 3.14Å; G524-H527 WeakPolarHBondContact O-CB 3.45Å; G524-H527 PolarHBondContact O-N 2.9Å; G524-H527 VanDerWaalsContact O-N 3.07Å
525	E	91.9	Very high	91.5	Very high	169 Å²	169	56.2 Å²	56.2	79%	0.79	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	39.1	171.6	-61	177.7	-168.6	0	0	113	D499 H527 S565	D499-E525 PolarHBondContact OD2-N 3.19Å; E525-H527 PolarHBondContact O-N 3.37Å; E525-H527 VanDerWaalsContact O-N 3.11Å; E525-S565 CarbonylContact C-O 3.58Å; E525-S565 WeakPolarHBondContact CA-O 3.24Å
526	A	92.1	Very high	91	Very high	14 Å²	14	53.9 Å²	53.9	12%	0.116	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	41.2	-178.8	0	0	0	0	0	113.1	G524 F528 G529 P530 H564 S565 D567	G524-A526 PolarHBondContact O-N 3.45Å; G524-A526 VanDerWaalsContact O-N 3.14Å; A526-F528 PolarHBondContact O-N 3.45Å; A526-G529 CarbonylContact O-C 3.53Å; A526-G529 WeakPolarHBondContact O-CA 3.49Å; A526-G529 PolarHBondContact O-N 2.91Å; A526-P530 HydrophobicContact CB-CB 4.47Å; A526-H564 VanDerWaalsContact CB-O 3.26Å; A526-H564 WeakPolarHBondContact CB-O 3.48Å; A526-S565 WeakPolarHBondContact CB-O 3.34Å; A526-S565 PolarHBondContact N-O 3.07Å; A526-D567 WeakPolarHBondContact CA-O 3.46Å; A526-D567 HydrophobicContact CB-CB 4.41Å; A526-D567 PolarHBondContact N-O 3.16Å
527	H	95.6	Very high	90.5	Very high	119 Å²	119	54 Å²	54	55%	0.551	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-34.1	-178.2	176.4	-87.1	0	0	0	114	P523 G524 E525 G529	P523-H527 HydrophobicContact CB-CB 3.77Å; P523-H527 HydrophobicContact CG-CB 4.27Å; G524-H527 WeakPolarHBondContact O-CB 3.45Å; G524-H527 PolarHBondContact O-N 2.9Å; G524-H527 VanDerWaalsContact O-N 3.07Å; E525-H527 PolarHBondContact O-N 3.37Å; E525-H527 VanDerWaalsContact O-N 3.11Å; H527-G529 VanDerWaalsContact C-N 3.31Å
528	F	95.8	Very high	90.2	Very high	26 Å²	26	52.6 Å²	52.6	11%	0.114	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	22.8	176.2	-65.2	-78.9	0	0	0	113.3	N477 E483 G484 R485 P523 A526 L571	N477-F528 HydrophobicContact CB-CB 4.29Å; N477-F528 WeakPolarHBondContact CB-O 3.43Å; N477-F528 PolarHBondContact ND2-O 2.83Å; N477-F528 WeakPolarHBondContact O-CD1 3.37Å; E483-F528 HydrophobicContact CB-CZ 4.21Å; E483-F528 HydrophobicContact CG-CE1 4.32Å; E483-F528 HydrophobicContact CG-CZ 4.47Å; G484-F528 WeakPolarHBondContact O-CD2 3.38Å; R485-F528 HydrophobicContact CB-CB 4.01Å; R485-F528 PolarHBondContact NH1-O 3.3Å; P523-F528 HydrophobicContact CG-CD2 4.45Å; P523-F528 HydrophobicContact CG-CE2 3.81Å; A526-F528 PolarHBondContact O-N 3.45Å; F528-L571 HydrophobicContact CE2-CD1 3.8Å; F528-L571 HydrophobicContact CZ-CD1 3.57Å; F528-L571 HydrophobicContact CZ-CG 4.03Å
529	G	93.3	Very high	89.6	Confident	24 Å²	24	47.9 Å²	47.9	25%	0.247	27%	0.273	C	S	.	.			trans	80.1	154.8	-173.7	0	0	0	0	0	113.1	R485 A526 H527	R485-G529 PolarHBondContact NH1-O 3.29Å; A526-G529 CarbonylContact O-C 3.53Å; A526-G529 WeakPolarHBondContact O-CA 3.49Å; A526-G529 PolarHBondContact O-N 2.91Å; H527-G529 VanDerWaalsContact C-N 3.31Å
530	P	92.1	Very high	89	Confident	84 Å²	84	47.3 Å²	47.3	55%	0.545	27%	0.268	S	S	.	.			trans	-65.4	142.3	179.2	27.7	-35.2	0	0	0	110.8	A526 H564	A526-P530 HydrophobicContact CB-CB 4.47Å; P530-H564 WeakPolarHBondContact CA-O 3.42Å; P530-H564 HydrophobicContact CB-CB 3.8Å; P530-H564 VanDerWaalsContact CB-O 3.29Å; P530-H564 WeakPolarHBondContact CB-O 3.46Å
531	G	90.8	Very high	88.4	Confident	9 Å²	9	48 Å²	48	9%	0.093	27%	0.267	C	S	.	.			trans	-79.4	-166.3	174.2	0	0	0	0	0	112.6	H564 D567	G531-H564 PolarHBondContact O-CD2 3.07Å; G531-D567 WeakPolarHBondContact CA-OD2 3.2Å; G531-D567 PolarHBondContact N-OD2 3.13Å
532	R	84.4	Confident	87.7	Confident	222 Å²	222	46.7 Å²	46.7	84%	0.838	26%	0.256	S	S	*	.			trans	-146.5	144	180	-62	-176.7	-179.4	-174.2	-1.3	109.2	H564	R532-H564 WeakPolarHBondContact CA-NE2 3.41Å
533	G	84.3	Confident	86.9	Confident	56 Å²	56	55.9 Å²	55.9	58%	0.577	29%	0.285	S	S	*	.	S	Bend	trans	98.9	-146.9	177	0	0	0	0	0	110.5	H564	G533-H564 PolarHBondContact N-NE2 2.93Å; G533-H564 PolarHBondContact O-NE2 2.94Å
534	P	79.8	Confident	86.5	Confident	15 Å²	15	55.8 Å²	55.8	10%	0.097	29%	0.288	C	S	.	.			trans	-79.8	154.6	179.2	36.3	-37.2	0	0	0	111.8	R493 W494 G495 T496 L536	R493-P534 VanDerWaalsContact NH2-CD 3.32Å; R493-P534 VanDerWaalsContact NH2-CG 3.29Å; W494-P534 WeakPolarHBondContact O-CD 3.45Å; G495-P534 CarbonylContact C-O 3.51Å; G495-P534 WeakPolarHBondContact CA-O 3.33Å; T496-P534 PolarHBondContact N-O 3.21Å; P534-L536 HydrophobicContact CB-CD2 3.82Å; P534-L536 HydrophobicContact CG-CD2 3.44Å; P534-L536 VanDerWaalsContact CG-CD2 3.44Å; P534-L536 HydrophobicContact CG-CG 4.16Å
535	I	82.1	Confident	85.9	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.036	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	110.3	161.4	-61.8	159.7	0	0	0	105.9	T496 C498 H560 C562	T496-I535 VanDerWaalsContact OG1-CG1 3.26Å; T496-I535 WeakPolarHBondContact OG1-CG1 3.48Å; C498-I535 HydrophobicContact CB-CG2 3.96Å; I535-H560 HydrophobicContact CG2-CB 4.46Å; I535-H560 PolarHBondContact O-CD2 2.64Å; I535-C562 HydrophobicContact CD1-CB 4.18Å; I535-C562 WeakPolarHBondContact CD1-O 3.34Å
536	L	80.3	Confident	85.4	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-27.8	-166.9	-56.7	173	0	0	0	112.9	L488 L490 R493 T496 P534 W557	L488-L536 HydrophobicContact CB-CD1 4.17Å; L488-L536 HydrophobicContact CD2-CD1 4.46Å; L488-L536 HydrophobicContact CG-CD1 4.36Å; L488-L536 WeakPolarHBondContact O-CD1 3.1Å; L490-L536 HydrophobicContact CB-CD1 4.15Å; R493-L536 HydrophobicContact CG-CD2 4.48Å; T496-L536 PolarHBondContact O-N 3.45Å; P534-L536 HydrophobicContact CB-CD2 3.82Å; P534-L536 HydrophobicContact CG-CD2 3.44Å; P534-L536 VanDerWaalsContact CG-CD2 3.44Å; P534-L536 HydrophobicContact CG-CG 4.16Å; L536-W557 HydrophobicContact CD2-CZ2 3.83Å
537	L	83.4	Confident	84.6	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.6	-178.4	-65.2	179.2	0	0	0	109.5	L488 V497 C498 V540 L549 L550	L488-L537 HydrophobicContact CD2-CD1 3.7Å; L488-L537 HydrophobicContact CD2-CG 3.99Å; V497-L537 CarbonylContact C-O 3.57Å; V497-L537 WeakPolarHBondContact CA-O 3.31Å; V497-L537 HydrophobicContact CG1-CB 4.09Å; V497-L537 HydrophobicContact CG2-CB 4.22Å; V497-L537 HydrophobicContact CG2-CD1 4.29Å; C498-L537 PolarHBondContact N-O 2.82Å; L537-V540 HydrophobicContact CB-CG2 3.64Å; L537-V540 HydrophobicContact CD1-CG2 4.15Å; L537-V540 HydrophobicContact CG-CG2 4.49Å; L537-L549 HydrophobicContact CD1-CD2 4.36Å; L537-L550 HydrophobicContact CD1-CD2 4.25Å; L537-L550 HydrophobicContact CD2-CD2 4.3Å
538	D	86	Confident	83.7	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.011	29%	0.288	C	S	.	.			trans	-138.7	157.2	174.3	177.3	32.4	0	0	0	109.4	C498 D500 V540 H554 I555 H560	C498-D538 HydrophobicContact CB-CB 4.08Å; D500-D538 WeakPolarHBondContact CB-OD1 3.11Å; D538-V540 PolarHBondContact O-N 3.44Å; D538-H554 WeakPolarHBondContact O-CB 3.35Å; D538-I555 HydrophobicContact CB-CD1 3.88Å; D538-I555 HydrophobicContact CB-CG1 3.89Å; D538-I555 PolarHBondContact O-N 2.73Å; D538-I555 WeakPolarHBondContact OD2-CD1 3.47Å; D538-H560 HydrophobicContact CB-CB 3.65Å
539	N	80.9	Confident	83.1	Confident	42 Å²	42	53.4 Å²	53.4	23%	0.225	28%	0.283	C	S	.	.	S	Bend	trans	56.6	37.6	178.1	-84.7	-76.2	0	0	0	112.9	D500 K541 I555	D500-N539 VanDerWaalsContact O-CA 3.28Å; D500-N539 WeakPolarHBondContact O-CA 3.16Å; D500-N539 PolarHBondContact O-N 3.25Å; N539-K541 PolarHBondContact O-N 3.25Å; N539-I555 HydrophobicContact CB-CG1 4.45Å; N539-I555 HydrophobicContact CB-CG2 3.98Å
540	V	85.3	Confident	82.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.			trans	-72.4	101.2	-174.2	-176.3	0	0	0	0	111	V497 W502 A506 L537 D538 L549 C552 S553 H554	V497-V540 HydrophobicContact CG1-CG2 3.89Å; W502-V540 HydrophobicContact CE3-CB 4.23Å; W502-V540 HydrophobicContact CE3-CG1 4.46Å; W502-V540 HydrophobicContact CZ3-CB 4.4Å; W502-V540 HydrophobicContact CZ3-CG1 4.21Å; A506-V540 HydrophobicContact CB-CG1 4.44Å; L537-V540 HydrophobicContact CB-CG2 3.64Å; L537-V540 HydrophobicContact CD1-CG2 4.15Å; L537-V540 HydrophobicContact CG-CG2 4.49Å; D538-V540 PolarHBondContact O-N 3.44Å; V540-L549 HydrophobicContact CG1-CD1 4.04Å; V540-L549 HydrophobicContact CG1-CG 4.33Å; V540-C552 HydrophobicContact CG1-CB 4.02Å; V540-S553 CarbonylContact C-O 3.58Å; V540-S553 WeakPolarHBondContact CA-O 3.47Å; V540-H554 HydrophobicContact CG2-CB 4.08Å
541	K	81.5	Confident	80.9	Confident	112 Å²	112	51.1 Å²	51.1	49%	0.487	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-110.7	105.9	-179.4	-68.9	168.5	-171.6	165.3	0	110.7	A501 N539 S553	A501-K541 HydrophobicContact CB-CD 4.17Å; A501-K541 HydrophobicContact CB-CG 3.74Å; N539-K541 PolarHBondContact O-N 3.25Å; K541-S553 PolarHBondContact N-O 2.87Å; K541-S553 WeakPolarHBondContact O-CB 3.06Å; K541-S553 PolarHBondContact O-N 3.01Å
542	C	82.3	Confident	80.1	Confident	8 Å²	8	50.7 Å²	50.7	5%	0.054	26%	0.255	C	S	.	.			trans	-97.7	147.1	174.7	-55.8	0	0	0	0	111.7	R505 A506 V509 G544 C552	R505-C542 HydrophobicContact CB-CB 4.43Å; R505-C542 PolarHBondContact NE-O 3.04Å; A506-C542 WeakPolarHBondContact CA-SG 3.35Å; A506-C542 HydrophobicContact CB-CB 4.23Å; V509-C542 HydrophobicContact CG2-CB 3.95Å; C542-G544 VanDerWaalsContact C-N 3.31Å; C542-C552 HydrophobicContact CB-CB 3.92Å; C542-C552 WeakPolarHBondContact CB-SG 2.99Å; C542-C552 WeakPolarHBondContact SG-CB 3.45Å; C542-C552 CovalentContact SG-SG 2.01Å; C542-C552 PolarHBondContact SG-SG 3.5Å
543	R	78.9	Confident	79.5	Confident	217 Å²	217	43.6 Å²	43.6	82%	0.819	24%	0.24	S	C	*	.			trans	-76.1	-24.6	166.4	-61.9	-178.9	-180	180	1	111.5	E546	R543-E546 WeakPolarHBondContact CB-OE1 3.4Å; R543-E546 VanDerWaalsContact N-CD 3.35Å; R543-E546 PolarHBondContact N-OE1 3.23Å; R543-E546 PolarHBondContact N-OE2 3.28Å; R543-E546 VanDerWaalsContact N-OE2 3.16Å
544	G	83.8	Confident	79	Confident	20 Å²	20	41.3 Å²	41.3	21%	0.206	21%	0.214	C	C	.	.	S	Bend	trans	108.9	-14.6	178.6	0	0	0	0	0	113.9	R512 C542 E546	R512-G544 PolarHBondContact NH2-O 2.03Å; C542-G544 VanDerWaalsContact C-N 3.31Å; G544-E546 PolarHBondContact N-OE2 3.2Å
545	E	79.3	Confident	78.4	Confident	162 Å²	162	43.6 Å²	43.6	76%	0.757	23%	0.225	S	C	*	.			trans	-95.6	-14.3	-176.3	-64	-59	146.1	0	0	113	R512	R512-E545 PolarHBondContact NH1-O 3.15Å; R512-E545 PolarHBondContact NH2-O 2.93Å; R512-E545 VanDerWaalsContact NH2-O 3.16Å
546	E	80.6	Confident	77.6	Confident	30 Å²	30	46.3 Å²	46.3	14%	0.14	23%	0.234	C	C	.	.			trans	-55.9	137.9	-177.9	-64.1	84.4	173.8	0	0	111.7	V509 R512 R543 G544 A548 L551	V509-E546 HydrophobicContact CG1-CB 4.13Å; V509-E546 WeakPolarHBondContact CG1-O 2.93Å; V509-E546 HydrophobicContact CG2-CB 4.01Å; R512-E546 VanDerWaalsContact CZ-O 3.3Å; R512-E546 PolarHBondContact NH2-O 2.03Å; R543-E546 WeakPolarHBondContact CB-OE1 3.4Å; R543-E546 VanDerWaalsContact N-CD 3.35Å; R543-E546 PolarHBondContact N-OE1 3.23Å; R543-E546 PolarHBondContact N-OE2 3.28Å; R543-E546 VanDerWaalsContact N-OE2 3.16Å; G544-E546 PolarHBondContact N-OE2 3.2Å; E546-A548 VanDerWaalsContact C-N 3.29Å; E546-A548 PolarHBondContact O-N 3.16Å; E546-L551 HydrophobicContact CB-CB 4.22Å; E546-L551 HydrophobicContact CG-CB 4.34Å
547	S	75.4	Confident	77	Confident	87 Å²	87	47 Å²	47	61%	0.608	24%	0.237	S	C	*	.	S	Bend	trans	-78.2	-13.4	-178.9	55.7	0	0	0	0	113.9	L551	S547-L551 VanDerWaalsContact OG-CD1 3.32Å; S547-L551 WeakPolarHBondContact OG-CD1 3Å
548	A	77.8	Confident	75.9	Confident	21 Å²	21	49.9 Å²	49.9	17%	0.174	25%	0.252	C	S	.	.	S	Bend	trans	-153	153.4	179.1	0	0	0	0	0	110.8	V509 E546 L550 L551	V509-A548 VanDerWaalsContact CG1-C 3.44Å; E546-A548 VanDerWaalsContact C-N 3.29Å; E546-A548 PolarHBondContact O-N 3.16Å; A548-L550 VanDerWaalsContact C-N 3.29Å; A548-L550 PolarHBondContact O-N 3.16Å; A548-L551 HydrophobicContact CB-CD1 4.35Å; A548-L551 HydrophobicContact CB-CG 4.39Å; A548-L551 WeakPolarHBondContact O-CB 3.5Å; A548-L551 PolarHBondContact O-N 3.2Å
549	L	81.9	Confident	74.9	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-61	-37.3	-178	-164.6	69.4	0	0	0	112.6	L473 V486 V497 W502 L510 L537 V540 L551 C552	L473-L549 HydrophobicContact CD1-CB 4.42Å; L473-L549 HydrophobicContact CD2-CD2 4.18Å; V486-L549 HydrophobicContact CG1-CD2 4.34Å; V497-L549 HydrophobicContact CG2-CD2 4.41Å; W502-L549 HydrophobicContact CH2-CD1 3.88Å; W502-L549 HydrophobicContact CH2-CD2 4.13Å; W502-L549 HydrophobicContact CZ3-CD1 3.77Å; W502-L549 HydrophobicContact CZ3-CD2 4.11Å; W502-L549 HydrophobicContact CZ3-CG 4.48Å; L510-L549 HydrophobicContact CB-CD1 4.39Å; L510-L549 HydrophobicContact CD1-CD2 4.37Å; L537-L549 HydrophobicContact CD1-CD2 4.36Å; V540-L549 HydrophobicContact CG1-CD1 4.04Å; V540-L549 HydrophobicContact CG1-CG 4.33Å; L549-L551 PolarHBondContact O-N 3.4Å; L549-L551 VanDerWaalsContact O-N 3.1Å; L549-C552 WeakPolarHBondContact O-CB 3.43Å; L549-C552 PolarHBondContact O-N 3.23Å; L549-C552 VanDerWaalsContact O-N 3.1Å
550	L	73.6	Confident	74.7	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.026	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-64.5	-8	175.1	-77	-177.6	0	0	0	114.7	F375 L391 L488 L490 L537 A548	F375-L550 WeakPolarHBondContact CE2-O 3.03Å; F375-L550 VanDerWaalsContact CZ-O 3.26Å; F375-L550 WeakPolarHBondContact CZ-O 3.31Å; L391-L550 HydrophobicContact CB-CD1 4.44Å; L391-L550 WeakPolarHBondContact O-CD2 3.33Å; L488-L550 HydrophobicContact CD1-CD1 4.47Å; L488-L550 HydrophobicContact CD1-CG 4.32Å; L488-L550 HydrophobicContact CD2-CD2 3.66Å; L488-L550 HydrophobicContact CD2-CG 4.23Å; L490-L550 HydrophobicContact CD1-CD1 4.26Å; L490-L550 HydrophobicContact CD2-CD2 4.47Å; L537-L550 HydrophobicContact CD1-CD2 4.25Å; L537-L550 HydrophobicContact CD2-CD2 4.3Å; A548-L550 VanDerWaalsContact C-N 3.29Å; A548-L550 PolarHBondContact O-N 3.16Å
551	L	67.6	Low	74.1	Confident	54 Å²	54	58.7 Å²	58.7	28%	0.283	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-98.5	-4.7	176.5	-62.2	175.8	0	0	0	112.6	F375 A390 E546 S547 A548 L549	F375-L551 HydrophobicContact CZ-CD2 4.32Å; A390-L551 WeakPolarHBondContact O-CD2 3.2Å; E546-L551 HydrophobicContact CB-CB 4.22Å; E546-L551 HydrophobicContact CG-CB 4.34Å; S547-L551 VanDerWaalsContact OG-CD1 3.32Å; S547-L551 WeakPolarHBondContact OG-CD1 3Å; A548-L551 HydrophobicContact CB-CD1 4.35Å; A548-L551 HydrophobicContact CB-CG 4.39Å; A548-L551 WeakPolarHBondContact O-CB 3.5Å; A548-L551 PolarHBondContact O-N 3.2Å; L549-L551 PolarHBondContact O-N 3.4Å; L549-L551 VanDerWaalsContact O-N 3.1Å
552	C	73.6	Confident	74.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-73.4	159.2	173.6	-60.4	0	0	0	0	110.6	V540 C542 L549 H554	V540-C552 HydrophobicContact CG1-CB 4.02Å; C542-C552 HydrophobicContact CB-CB 3.92Å; C542-C552 WeakPolarHBondContact CB-SG 2.99Å; C542-C552 WeakPolarHBondContact SG-CB 3.45Å; C542-C552 CovalentContact SG-SG 2.01Å; C542-C552 PolarHBondContact SG-SG 3.5Å; L549-C552 WeakPolarHBondContact O-CB 3.43Å; L549-C552 PolarHBondContact O-N 3.23Å; L549-C552 VanDerWaalsContact O-N 3.1Å; C552-H554 PolarHBondContact O-CD2 2.76Å; C552-H554 PolarHBondContact O-N 3.1Å
553	S	72.1	Confident	74.2	Confident	73 Å²	73	57.7 Å²	57.7	51%	0.51	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-65.9	131.4	170.5	-167.4	0	0	0	0	108.3	V540 K541	V540-S553 CarbonylContact C-O 3.58Å; V540-S553 WeakPolarHBondContact CA-O 3.47Å; K541-S553 PolarHBondContact N-O 2.87Å; K541-S553 WeakPolarHBondContact O-CB 3.06Å; K541-S553 PolarHBondContact O-N 3.01Å
554	H	73.3	Confident	74.9	Confident	9 Å²	9	49.4 Å²	49.4	4%	0.042	27%	0.272	C	S	.	.			trans	-154.8	163	175.1	55.2	70.9	0	0	0	107.8	F375 D538 V540 C552	F375-H554 AromaticContact CD2-CE1 3.62Å; F375-H554 AromaticContact CD2-NE2 3.6Å; F375-H554 AromaticContact CE2-NE2 3.95Å; D538-H554 WeakPolarHBondContact O-CB 3.35Å; V540-H554 HydrophobicContact CG2-CB 4.08Å; C552-H554 PolarHBondContact O-CD2 2.76Å; C552-H554 PolarHBondContact O-N 3.1Å
555	I	66	Low	75.1	Confident	62 Å²	62	51.6 Å²	51.6	32%	0.318	28%	0.284	S	S	.	.			trans	-74.7	-178.6	174.2	63	168.9	0	0	0	111.1	D538 N539 A559	D538-I555 HydrophobicContact CB-CD1 3.88Å; D538-I555 HydrophobicContact CB-CG1 3.89Å; D538-I555 PolarHBondContact O-N 2.73Å; D538-I555 WeakPolarHBondContact OD2-CD1 3.47Å; N539-I555 HydrophobicContact CB-CG1 4.45Å; N539-I555 HydrophobicContact CB-CG2 3.98Å; I555-A559 HydrophobicContact CD1-CB 4.27Å; I555-A559 WeakPolarHBondContact CD1-O 3.21Å; I555-A559 WeakPolarHBondContact CG1-O 3.29Å
556	R	66.3	Low	75.8	Confident	64 Å²	64	46.8 Å²	46.8	24%	0.242	26%	0.262	C	S	.	.			trans	-52.3	149.1	177.2	-67.9	-167.6	-72.8	-95.4	20	111.4	D370 W373 A559	D370-R556 PolarHBondContact O-NH1 3.06Å; D370-R556 PolarHBondContact O-NH2 3.07Å; D370-R556 IonicContact OD2-NE 2.95Å; W373-R556 WeakPolarHBondContact O-CD 3.22Å; W373-R556 WeakPolarHBondContact O-CG 3.32Å; W373-R556 PolarHBondContact O-NH1 3.26Å; R556-A559 HydrophobicContact CB-CB 3.81Å; R556-A559 PolarHBondContact O-N 3.37Å
557	W	67.2	Low	76.6	Confident	17 Å²	17	45.4 Å²	45.4	6%	0.064	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	136.5	173.3	176.2	19.2	0	0	0	110.8	A393 T394 H398 L442 L490 R493 L536 A559	A393-W557 PolarHBondContact O-N 3.33Å; A393-W557 VanDerWaalsContact O-N 3.14Å; T394-W557 HydrophobicContact CG2-CE3 3.75Å; T394-W557 HydrophobicContact CG2-CZ3 4.4Å; H398-W557 AromaticContact CE1-CZ3 3.89Å; H398-W557 AromaticContact NE2-CH2 3.83Å; H398-W557 AromaticContact NE2-CZ3 3.65Å; L442-W557 HydrophobicContact CD1-CE3 3.67Å; L442-W557 HydrophobicContact CD1-CZ3 3.84Å; L490-W557 HydrophobicContact CB-CH2 4.37Å; L490-W557 HydrophobicContact CB-CZ2 4.25Å; L490-W557 HydrophobicContact CD2-CD2 3.52Å; L490-W557 HydrophobicContact CD2-CE3 3.61Å; L490-W557 HydrophobicContact CD2-CG 3.95Å; L490-W557 HydrophobicContact CD2-CH2 4.4Å; L490-W557 HydrophobicContact CD2-CZ2 4.29Å; L490-W557 HydrophobicContact CD2-CZ3 4.06Å; L490-W557 HydrophobicContact CG-CD2 4.18Å; L490-W557 HydrophobicContact CG-CE3 3.93Å; L490-W557 HydrophobicContact CG-CH2 3.98Å; L490-W557 HydrophobicContact CG-CZ2 4.16Å; L490-W557 HydrophobicContact CG-CZ3 3.85Å; R493-W557 HydrophobicContact CG-CZ2 4.44Å; L536-W557 HydrophobicContact CD2-CZ2 3.83Å; W557-A559 PolarHBondContact O-N 2.98Å; W557-A559 VanDerWaalsContact O-N 3.15Å
558	D	61	Low	77.6	Confident	62 Å²	62	41.2 Å²	41.2	33%	0.332	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	11.6	179.6	-76.1	-8.3	0	0	0	111.6	R493	R493-D558 IonicContact NH1-OD2 2.66Å; R493-D558 PolarHBondContact NH1-OD2 3.3Å
559	A	65.5	Low	78.6	Confident	33 Å²	33	40.3 Å²	40.3	27%	0.273	22%	0.218	S	C	.	.			trans	-97.6	115.9	163.9	0	0	0	0	0	107.7	I555 R556 W557	I555-A559 HydrophobicContact CD1-CB 4.27Å; I555-A559 WeakPolarHBondContact CD1-O 3.21Å; I555-A559 WeakPolarHBondContact CG1-O 3.29Å; R556-A559 HydrophobicContact CB-CB 3.81Å; R556-A559 PolarHBondContact O-N 3.37Å; W557-A559 PolarHBondContact O-N 2.98Å; W557-A559 VanDerWaalsContact O-N 3.15Å
560	H	75.9	Confident	79.4	Confident	71 Å²	71	40.2 Å²	40.2	33%	0.329	22%	0.218	S	C	.	.			trans	-162	154.6	176.5	62.3	86.2	0	0	0	108.4	I535 D538 C562	I535-H560 HydrophobicContact CG2-CB 4.46Å; I535-H560 PolarHBondContact O-CD2 2.64Å; D538-H560 HydrophobicContact CB-CB 3.65Å; H560-C562 HydrophobicContact CB-CB 4.5Å; H560-C562 PolarHBondContact CE1-O 3.06Å; H560-C562 PolarHBondContact ND1-N 2.88Å; H560-C562 PolarHBondContact ND1-O 2.66Å
561	N	73.7	Confident	80.5	Confident	124 Å²	124	42.3 Å²	42.3	66%	0.663	23%	0.229	S	C	*	.	S	Bend	trans	-97.1	1.7	166.5	60.8	-20.7	0	0	0	112.2
562	C	80.5	Confident	81.8	Confident	8 Å²	8	39.9 Å²	39.9	5%	0.054	22%	0.216	C	C	.	.			trans	-82.6	155.2	-171.2	-46.9	0	0	0	0	113.9	C498 I535 H560 E566	C498-C562 HydrophobicContact CB-CB 3.73Å; C498-C562 WeakPolarHBondContact CB-SG 3.4Å; C498-C562 WeakPolarHBondContact SG-CB 3.43Å; C498-C562 CovalentContact SG-SG 2.01Å; C498-C562 PolarHBondContact SG-SG 3.22Å; I535-C562 HydrophobicContact CD1-CB 4.18Å; I535-C562 WeakPolarHBondContact CD1-O 3.34Å; H560-C562 HydrophobicContact CB-CB 4.5Å; H560-C562 PolarHBondContact CE1-O 3.06Å; H560-C562 PolarHBondContact ND1-N 2.88Å; H560-C562 PolarHBondContact ND1-O 2.66Å; C562-E566 WeakPolarHBondContact CA-OE2 3.09Å; C562-E566 HydrophobicContact CB-CB 4.03Å; C562-E566 WeakPolarHBondContact CB-OE2 3.02Å
563	D	84.3	Confident	82.6	Confident	91 Å²	91	44.7 Å²	44.7	49%	0.487	24%	0.239	S	C	.	.			trans	-109.6	179.2	161	77.1	28.6	0	0	0	112	S565 E566	D563-S565 PolarHBondContact O-N 3.14Å; D563-S565 WeakPolarHBondContact OD1-CA 3.01Å; D563-S565 WeakPolarHBondContact OD1-CB 3.44Å; D563-S565 PolarHBondContact OD1-N 2.97Å; D563-S565 PolarHBondContact OD1-OG 2.88Å; D563-E566 PolarHBondContact N-OE2 2.98Å; D563-E566 WeakPolarHBondContact O-CB 3.41Å; D563-E566 PolarHBondContact O-N 2.89Å
564	H	93.1	Very high	82.7	Confident	44 Å²	44	44.6 Å²	44.6	20%	0.204	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-70.9	-6.6	-177.9	-77.8	-48.9	0	0	0	114.5	T496 A526 P530 G531 R532 G533 D567	T496-H564 PolarHBondContact OG1-CE1 2.69Å; T496-H564 PolarHBondContact OG1-ND1 3Å; A526-H564 VanDerWaalsContact CB-O 3.26Å; A526-H564 WeakPolarHBondContact CB-O 3.48Å; P530-H564 WeakPolarHBondContact CA-O 3.42Å; P530-H564 HydrophobicContact CB-CB 3.8Å; P530-H564 VanDerWaalsContact CB-O 3.29Å; P530-H564 WeakPolarHBondContact CB-O 3.46Å; G531-H564 PolarHBondContact O-CD2 3.07Å; R532-H564 WeakPolarHBondContact CA-NE2 3.41Å; G533-H564 PolarHBondContact N-NE2 2.93Å; G533-H564 PolarHBondContact O-NE2 2.94Å; H564-D567 IonicContact CE1-OD1 3.18Å; H564-D567 IonicContact CG-OD2 3.48Å; H564-D567 IonicContact ND1-OD1 3.12Å; H564-D567 PolarHBondContact ND1-OD1 2.9Å; H564-D567 VanDerWaalsContact ND1-OD1 3.07Å; H564-D567 IonicContact ND1-OD2 3.11Å; H564-D567 PolarHBondContact ND1-OD2 3.47Å
565	S	88.8	Confident	82	Confident	66 Å²	66	51.4 Å²	51.4	46%	0.462	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-72.5	-13.8	167.3	77	0	0	0	0	112.3	E525 A526 D563	E525-S565 CarbonylContact C-O 3.58Å; E525-S565 WeakPolarHBondContact CA-O 3.24Å; A526-S565 WeakPolarHBondContact CB-O 3.34Å; A526-S565 PolarHBondContact N-O 3.07Å; D563-S565 PolarHBondContact O-N 3.14Å; D563-S565 WeakPolarHBondContact OD1-CA 3.01Å; D563-S565 WeakPolarHBondContact OD1-CB 3.44Å; D563-S565 PolarHBondContact OD1-N 2.97Å; D563-S565 PolarHBondContact OD1-OG 2.88Å
566	E	94.1	Very high	82.9	Confident	60 Å²	60	50.9 Å²	50.9	28%	0.28	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-106.3	17.3	179	-68.8	169.5	127.1	0	0	111.8	C498 D499 C562 D563 A568	C498-E566 CarbonylContact C-O 3.55Å; D499-E566 WeakPolarHBondContact CB-O 3.37Å; D499-E566 VanDerWaalsContact CG-O 3.27Å; D499-E566 PolarHBondContact N-O 3.1Å; D499-E566 WeakPolarHBondContact OD1-CB 3.4Å; D499-E566 VanDerWaalsContact OD1-O 3.13Å; C562-E566 WeakPolarHBondContact CA-OE2 3.09Å; C562-E566 HydrophobicContact CB-CB 4.03Å; C562-E566 WeakPolarHBondContact CB-OE2 3.02Å; D563-E566 PolarHBondContact N-OE2 2.98Å; D563-E566 WeakPolarHBondContact O-CB 3.41Å; D563-E566 PolarHBondContact O-N 2.89Å; E566-A568 PolarHBondContact O-N 3.04Å
567	D	96.3	Very high	83.7	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-67	123.7	178	-78.1	-21.9	0	0	0	111.7	R485 T496 A526 G531 H564	R485-D567 WeakPolarHBondContact CD-OD2 3.08Å; R485-D567 HydrophobicContact CG-CB 4.13Å; T496-D567 WeakPolarHBondContact CB-OD1 3.15Å; T496-D567 WeakPolarHBondContact CG2-OD2 3.32Å; T496-D567 PolarHBondContact OG1-OD1 2.81Å; A526-D567 WeakPolarHBondContact CA-O 3.46Å; A526-D567 HydrophobicContact CB-CB 4.41Å; A526-D567 PolarHBondContact N-O 3.16Å; G531-D567 WeakPolarHBondContact CA-OD2 3.2Å; G531-D567 PolarHBondContact N-OD2 3.13Å; H564-D567 IonicContact CE1-OD1 3.18Å; H564-D567 IonicContact CG-OD2 3.48Å; H564-D567 IonicContact ND1-OD1 3.12Å; H564-D567 PolarHBondContact ND1-OD1 2.9Å; H564-D567 VanDerWaalsContact ND1-OD1 3.07Å; H564-D567 IonicContact ND1-OD2 3.11Å; H564-D567 PolarHBondContact ND1-OD2 3.47Å
568	A	98	Very high	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.298	C	S	.	.			trans	-64.2	141.7	176.3	0	0	0	0	0	112.9	V486 V497 D499 W502 E566	V486-A568 PolarHBondContact N-O 3.26Å; V497-A568 HydrophobicContact CB-CB 4.28Å; V497-A568 HydrophobicContact CG1-CB 4.27Å; V497-A568 VanDerWaalsContact O-CB 3.29Å; V497-A568 WeakPolarHBondContact O-CB 3.43Å; V497-A568 PolarHBondContact O-N 2.97Å; D499-A568 HydrophobicContact CB-CB 4.19Å; W502-A568 HydrophobicContact CB-CB 4.45Å; W502-A568 HydrophobicContact CD2-CB 3.82Å; W502-A568 HydrophobicContact CE3-CB 4.38Å; W502-A568 HydrophobicContact CG-CB 3.81Å; E566-A568 PolarHBondContact O-N 3.04Å
569	G	97.9	Very high	86	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	171.1	171.4	0	0	0	0	0	112.7	G484 W502 P523	G484-G569 CarbonylContact O-C 3.46Å; G484-G569 WeakPolarHBondContact O-CA 3.36Å; W502-G569 PolarHBondContact NE1-O 2.6Å; P523-G569 VanDerWaalsContact CD-O 3.31Å; P523-G569 WeakPolarHBondContact CD-O 3.33Å; P523-G569 WeakPolarHBondContact O-CA 3.37Å; P523-G569 PolarHBondContact O-N 3.46Å
570	V	97.9	Very high	87.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	146.5	176.4	72.5	0	0	0	0	111.6	L475 E483 G484 V486 A507 L510	L475-V570 HydrophobicContact CD1-CG1 3.53Å; L475-V570 HydrophobicContact CD2-CG1 3.44Å; L475-V570 VanDerWaalsContact CD2-CG1 3.44Å; L475-V570 HydrophobicContact CG-CG1 4.13Å; E483-V570 CarbonylContact C-O 3.46Å; E483-V570 VanDerWaalsContact CA-O 3.23Å; E483-V570 WeakPolarHBondContact CA-O 3.11Å; G484-V570 PolarHBondContact N-O 3.25Å; G484-V570 PolarHBondContact O-N 3.04Å; V486-V570 HydrophobicContact CG2-CB 4.2Å; V486-V570 HydrophobicContact CG2-CG1 4.17Å; A507-V570 HydrophobicContact CB-CG2 3.7Å; L510-V570 HydrophobicContact CD1-CG1 4.45Å; L510-V570 HydrophobicContact CD2-CB 4.27Å; L510-V570 HydrophobicContact CD2-CG1 3.65Å; L510-V570 HydrophobicContact CD2-CG2 4.16Å
571	L	97	Very high	88.1	Confident	48 Å²	48	51.4 Å²	51.4	25%	0.251	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119	164.2	-72	82.4	0	0	0	108.2	E483 L520 A521 P523 F528	E483-L571 HydrophobicContact CB-CG 4.21Å; L520-L571 WeakPolarHBondContact CA-O 3.07Å; L520-L571 HydrophobicContact CB-CB 4.41Å; L520-L571 WeakPolarHBondContact CB-O 3.31Å; L520-L571 PolarHBondContact N-O 3.2Å; A521-L571 HydrophobicContact CB-CB 4.17Å; A521-L571 HydrophobicContact CB-CD1 4.11Å; A521-L571 PolarHBondContact N-O 3.26Å; A521-L571 PolarHBondContact O-N 2.99Å; P523-L571 HydrophobicContact CG-CD1 3.62Å; F528-L571 HydrophobicContact CE2-CD1 3.8Å; F528-L571 HydrophobicContact CZ-CD1 3.57Å; F528-L571 HydrophobicContact CZ-CG 4.03Å
572	C	96.3	Very high	89.1	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.02	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	154.8	174	-47.3	0	0	0	0	110.4	C482 C511 C516 Q518 P574	C482-C572 HydrophobicContact CB-CB 4.18Å; C482-C572 VanDerWaalsContact O-CB 3.3Å; C482-C572 WeakPolarHBondContact O-CB 3.23Å; C482-C572 PolarHBondContact O-N 3.44Å; C511-C572 VanDerWaalsContact CA-SG 3.51Å; C511-C572 HydrophobicContact CB-CB 3.73Å; C511-C572 WeakPolarHBondContact CB-SG 3.46Å; C511-C572 WeakPolarHBondContact SG-CB 3.35Å; C511-C572 CovalentContact SG-SG 2.03Å; C511-C572 PolarHBondContact SG-SG 3.14Å; C516-C572 HydrophobicContact CB-CB 3.76Å; C516-C572 VanDerWaalsContact O-CB 3.28Å; C516-C572 WeakPolarHBondContact O-CB 3.42Å; Q518-C572 CarbonylContact O-C 3.56Å; Q518-C572 WeakPolarHBondContact O-CA 3.07Å; C572-P574 VanDerWaalsContact O-CD 3.28Å; C572-P574 WeakPolarHBondContact O-CD 3.25Å
573	Q	89	Confident	89.8	Confident	102 Å²	102	49.2 Å²	49.2	48%	0.477	29%	0.286	S	S	.	.			trans	-83.4	109.4	171.8	-172.4	176.7	-56.5	0	0	109.8	C516 Q518 L520 S575	C516-Q573 CarbonylContact C-O 3.59Å; C516-Q573 CarbonylContact O-C 3.49Å; Q518-Q573 PolarHBondContact O-N 3.09Å; L520-Q573 HydrophobicContact CD1-CB 3.89Å; L520-Q573 HydrophobicContact CD1-CG 4.48Å; L520-Q573 HydrophobicContact CD2-CB 4.02Å; L520-Q573 HydrophobicContact CG-CB 3.9Å; Q573-S575 PolarHBondContact O-N 3.14Å
574	P	74.4	Confident	90.2	Very high	71 Å²	71	45.7 Å²	45.7	46%	0.461	27%	0.269	S	S	.	.			trans	-54.1	131.5	178.2	-19.7	31.6	0	0	0	110.2	C482 C572	C482-P574 HydrophobicContact CB-CG 4.46Å; C572-P574 VanDerWaalsContact O-CD 3.28Å; C572-P574 WeakPolarHBondContact O-CD 3.25Å
575	S	60.1	Low	90	Very high	152 Å²	152	45.8 Å²	45.8	100%	1.063	28%	0.275	S	S	*	.			trans	-76	0	-179.2	-47.8	0	0	0	0	112.4	G517 Q573	G517-S575 WeakPolarHBondContact CA-OG 3.37Å; G517-S575 PolarHBondContact N-OG 2.86Å; Q573-S575 PolarHBondContact O-N 3.14Å

Retrieved 575 of 575 residues in 417.5 ms (Link to these results)

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