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Inhibin beta A chain

Inhibin A is a dimer of alpha/INHA and beta-A/INHBA that functions as a feedback regulator in the hypothalamic-pituitary-gonadal (HPG) axis. Inhibits the secretion of FSH from the anterior pituitary gland by acting on pituitary gonadotrope cells. Antagonizes activin A by binding to the proteoglycan, betaglycan, and forming a stable complex with and, thereby, sequestering type II activin receptors while excluding type I receptor. Inhibins/activins are involved in regulating a number of diverse functions such as hypothalamic and pituitary hormone secretion, gonadal hormone secretion, germ cell development and maturation, erythroid differentiation, insulin secretion, nerve cell survival, embryonic axial development or bone growth, depending on their subunit composition.

AlphaFold DB , UniProt , Accession A0A093HLV3, Species STRCA (Struthio camelus australis), Gene n/a, Length 424 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	42.3	Very low	39	Very low	213 Å²	213	162.5 Å²	162.5	100%	1.049	83%	0.828	S	S	*	*				0	141	0	-69	179.6	93.6	0	0	107.3	L3	M1-L3 HydrophobicContact CE-CD1 3.9Å; M1-L3 HydrophobicContact CE-CG 4.42Å
2	P	48.3	Very low	38.9	Very low	120 Å²	120	160.6 Å²	160.6	78%	0.779	83%	0.83	S	S	*	*			cis	-100.5	145.2	12.4	13.7	8.5	0	0	0	111.3
3	L	34.5	Very low	39.1	Very low	116 Å²	116	159.7 Å²	159.7	61%	0.607	83%	0.826	S	S	*	*				95.4	110.8	52.1	-77.5	164.7	0	0	0	113	M1	M1-L3 HydrophobicContact CE-CD1 3.9Å; M1-L3 HydrophobicContact CE-CG 4.42Å
4	L	36.9	Very low	38.9	Very low	145 Å²	145	155.4 Å²	155.4	76%	0.759	82%	0.817	S	S	*	*			trans	66.8	139.7	137.8	-55.6	169.3	0	0	0	116.6
5	L	37.7	Very low	38.6	Very low	155 Å²	155	159.8 Å²	159.8	81%	0.812	82%	0.818	S	S	*	*			cis	-165.1	142.7	34.6	-159.5	73.5	0	0	0	108.4
6	K	39.5	Very low	38.6	Very low	200 Å²	200	159.3 Å²	159.3	87%	0.87	82%	0.816	S	S	*	*			trans	-58.3	132.7	176.9	-67.2	172.4	172.8	179	0	112.4
7	R	40.8	Very low	38.4	Very low	248 Å²	248	157.5 Å²	157.5	94%	0.936	81%	0.807	S	S	*	*			trans	-141.9	109	142.5	-95	-175.9	173	174.9	-2.7	108.3
8	G	35.8	Very low	38.3	Very low	77 Å²	77	155.8 Å²	155.8	79%	0.794	81%	0.805	S	S	*	*			trans	-72.2	134.2	176.6	0	0	0	0	0	111.1
9	F	36.2	Very low	37.8	Very low	212 Å²	212	159.7 Å²	159.7	93%	0.93	81%	0.808	S	S	*	*			trans	-123	105.3	148	-133.3	-93	0	0	0	104.8	L11	F9-L11 PolarHBondContact O-N 3.12Å
10	L	36.4	Very low	37.6	Very low	164 Å²	164	157.5 Å²	157.5	86%	0.859	81%	0.808	S	S	*	*			trans	-79	120.5	-179.5	-114	156.3	0	0	0	108.6
11	L	40.6	Very low	37.4	Very low	137 Å²	137	154.9 Å²	154.9	72%	0.717	80%	0.804	S	S	*	*			trans	-50.7	135.9	163.2	-74.3	152.4	0	0	0	111.1	F9 L13	F9-L11 PolarHBondContact O-N 3.12Å; L11-L13 HydrophobicContact CD2-CD1 4.29Å
12	V	37.9	Very low	37	Very low	140 Å²	140	150.8 Å²	150.8	85%	0.848	79%	0.793	S	S	*	*			trans	-136.6	91	145.5	-174.9	0	0	0	0	107.6	S14	V12-S14 PolarHBondContact O-N 3.29Å
13	L	40.8	Very low	36.4	Very low	149 Å²	149	151.5 Å²	151.5	78%	0.78	80%	0.795	S	S	*	*			trans	-78.1	112.3	162.1	-86.8	158.7	0	0	0	107.3	L11 W15	L11-L13 HydrophobicContact CD2-CD1 4.29Å; L13-W15 PolarHBondContact O-N 3.31Å
14	S	37.2	Very low	36.4	Very low	100 Å²	100	152 Å²	152	70%	0.699	81%	0.806	S	S	*	*			trans	-60.7	110.4	-178.6	-168.8	0	0	0	0	111.3	V12	V12-S14 PolarHBondContact O-N 3.29Å
15	W	33.5	Very low	36	Very low	221 Å²	221	148.7 Å²	148.7	84%	0.837	81%	0.806	S	S	*	*			trans	-82	110.7	157.2	-83.2	35.8	0	0	0	107.3	L13 I17	L13-W15 PolarHBondContact O-N 3.31Å; W15-I17 VanDerWaalsContact C-N 3.31Å; W15-I17 HydrophobicContact CB-CG1 4.48Å; W15-I17 PolarHBondContact O-N 2.73Å
16	I	38.3	Very low	36.1	Very low	152 Å²	152	146.7 Å²	146.7	78%	0.779	81%	0.805	S	S	*	*			trans	-73.8	91.5	170.3	-61.6	174.5	0	0	0	107.2
17	I	36.4	Very low	35.6	Very low	129 Å²	129	146.5 Å²	146.5	66%	0.662	81%	0.808	S	S	*	*			trans	-86.3	111.7	163.9	-62.6	172.8	0	0	0	106.3	W15 R19	W15-I17 VanDerWaalsContact C-N 3.31Å; W15-I17 HydrophobicContact CB-CG1 4.48Å; W15-I17 PolarHBondContact O-N 2.73Å; I17-R19 PolarHBondContact O-N 3.48Å; I17-R19 VanDerWaalsContact O-N 3.14Å
18	V	36	Very low	34.9	Very low	127 Å²	127	138.2 Å²	138.2	77%	0.77	80%	0.799	S	S	*	*			trans	-68.3	107.6	169	174.5	0	0	0	0	107.9
19	R	29.6	Very low	34.9	Very low	230 Å²	230	144.3 Å²	144.3	87%	0.868	81%	0.807	S	S	*	*			trans	-81.1	111.4	168.3	-86.7	-179.2	168.9	179.6	-3.3	109.1	I17	I17-R19 PolarHBondContact O-N 3.48Å; I17-R19 VanDerWaalsContact O-N 3.14Å
20	S	32.6	Very low	34.6	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	80%	0.801	S	S	*	*			trans	-92.8	111.8	155.4	45.2	0	0	0	0	108.5
21	S	33.3	Very low	34.6	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71	155	176.8	-59.4	0	0	0	0	111.9
22	P	34.6	Very low	34.7	Very low	126 Å²	126	137 Å²	137	82%	0.818	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83.7	139.9	-168.7	34.1	-32.4	0	0	0	111.8
23	T	34.8	Very low	34.9	Very low	135 Å²	135	136.5 Å²	136.5	83%	0.828	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-94.3	138.3	169.3	40.3	0	0	0	0	110.7
24	P	34.8	Very low	35.1	Very low	128 Å²	128	136.2 Å²	136.2	83%	0.831	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.8	165	-177.2	33.4	-29	0	0	0	111.9
25	G	29.8	Very low	35.6	Very low	75 Å²	75	134 Å²	134	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.4	169.4	-162	0	0	0	0	0	117.8
26	S	38.4	Very low	36.6	Very low	113 Å²	113	128.3 Å²	128.3	79%	0.79	77%	0.773	S	S	*	*			trans	34.8	110.3	144.8	170.1	0	0	0	0	118.3
27	E	28.8	Very low	37	Very low	196 Å²	196	124.2 Å²	124.2	92%	0.916	76%	0.758	S	S	*	*				-175.1	135.9	128.4	-102.3	167.6	-165	0	0	111.1
28	G	27.2	Very low	37.6	Very low	73 Å²	73	120.3 Å²	120.3	75%	0.753	74%	0.742	S	S	*	*			trans	97.4	81.2	157.5	0	0	0	0	0	118.3	S30	G28-S30 PolarHBondContact O-N 3.32Å
29	H	35.2	Very low	38.4	Very low	206 Å²	206	116.2 Å²	116.2	95%	0.954	72%	0.721	S	S	*	*			trans	-63.4	114.9	154	-88.3	-81.3	0	0	0	110
30	S	30.4	Very low	39.4	Very low	115 Å²	115	111.4 Å²	111.4	80%	0.804	71%	0.712	S	S	*	*			trans	-150.3	138.8	159.7	65	0	0	0	0	106.5	G28	G28-S30 PolarHBondContact O-N 3.32Å
31	S	35.6	Very low	40.1	Very low	111 Å²	111	109.4 Å²	109.4	78%	0.776	70%	0.702	S	S	*	*			cis	-147.3	142.7	9.9	39.2	0	0	0	0	107.2
32	V	43.3	Very low	40.6	Very low	132 Å²	132	110 Å²	110	80%	0.8	70%	0.702	S	S	*	*			trans	-60.6	134	169.7	171.8	0	0	0	0	107.6	D34	V32-D34 PolarHBondContact O-N 3.04Å; V32-D34 VanDerWaalsContact O-N 3.13Å
33	T	43	Very low	41	Very low	130 Å²	130	110.3 Å²	110.3	80%	0.798	70%	0.696	S	S	*	*			trans	-53.2	116.7	173.8	-32.7	0	0	0	0	109	C35	T33-C35 VanDerWaalsContact C-N 3.32Å; T33-C35 PolarHBondContact O-N 3.22Å
34	D	45.2	Very low	41.2	Very low	144 Å²	144	107.7 Å²	107.7	77%	0.77	68%	0.683	S	S	*	*			trans	-61.7	90.6	178.2	-83.4	-37	0	0	0	110.2	V32 P36	V32-D34 PolarHBondContact O-N 3.04Å; V32-D34 VanDerWaalsContact O-N 3.13Å; D34-P36 WeakPolarHBondContact O-CD 3.39Å
35	C	47.9	Very low	41.7	Very low	52 Å²	52	109.8 Å²	109.8	35%	0.351	68%	0.679	S	S	.	*			trans	-75.5	120.9	155.6	175	0	0	0	0	106.6	T33 S37 C38 A39	T33-C35 VanDerWaalsContact C-N 3.32Å; T33-C35 PolarHBondContact O-N 3.22Å; C35-S37 PolarHBondContact O-N 3.46Å; C35-S37 VanDerWaalsContact O-N 3.09Å; C35-C38 HydrophobicContact CB-CB 3.87Å; C35-C38 WeakPolarHBondContact O-CA 3.42Å; C35-C38 PolarHBondContact O-N 3.27Å; C35-A39 PolarHBondContact O-N 2.98Å
36	P	53.1	Low	42	Very low	102 Å²	102	113.3 Å²	113.3	66%	0.662	68%	0.68	S	S	*	*	H	α-helix	trans	-58.4	-25.7	-180	18.6	-28.9	0	0	0	112.8	D34	D34-P36 WeakPolarHBondContact O-CD 3.39Å
37	S	47.9	Very low	42.1	Very low	66 Å²	66	111.3 Å²	111.3	46%	0.462	66%	0.663	S	S	.	*	H	α-helix	trans	-74.8	-29.5	172.4	-51.9	0	0	0	0	113.5	C35	C35-S37 PolarHBondContact O-N 3.46Å; C35-S37 VanDerWaalsContact O-N 3.09Å
38	C	49.1	Very low	42.6	Very low	48 Å²	48	107 Å²	107	32%	0.324	65%	0.652	S	S	.	*	H	α-helix	trans	-82.7	-29.5	177.3	-62.3	0	0	0	0	112.2	C35 L40 A41 T42	C35-C38 HydrophobicContact CB-CB 3.87Å; C35-C38 WeakPolarHBondContact O-CA 3.42Å; C35-C38 PolarHBondContact O-N 3.27Å; C38-L40 PolarHBondContact O-N 3.35Å; C38-A41 WeakPolarHBondContact O-CB 3.41Å; C38-A41 PolarHBondContact O-N 2.67Å; C38-A41 VanDerWaalsContact O-N 3.09Å; C38-T42 PolarHBondContact O-N 2.78Å
39	A	51.6	Low	43.7	Very low	41 Å²	41	108.7 Å²	108.7	34%	0.339	65%	0.652	S	S	.	*	H	α-helix	trans	-65.4	-25.7	175.4	0	0	0	0	0	112.9	C35 T42	C35-A39 PolarHBondContact O-N 2.98Å; A39-T42 PolarHBondContact O-OG1 3.26Å
40	L	51.7	Low	44.7	Very low	129 Å²	129	100.5 Å²	100.5	68%	0.675	62%	0.618	S	S	*	*	H	α-helix	trans	-72.8	-32.3	170.4	-108.5	95.3	0	0	0	112.6	C38 T42 L43	C38-L40 PolarHBondContact O-N 3.35Å; L40-T42 PolarHBondContact O-N 3.3Å; L40-L43 HydrophobicContact CG-CD1 4.42Å; L40-L43 PolarHBondContact O-N 3.37Å
41	A	46	Very low	46.5	Very low	73 Å²	73	101.8 Å²	101.8	60%	0.603	61%	0.612	S	S	*	*	H	α-helix	trans	-74.6	-14.6	-179.3	0	0	0	0	0	113.1	C38	C38-A41 WeakPolarHBondContact O-CB 3.41Å; C38-A41 PolarHBondContact O-N 2.67Å; C38-A41 VanDerWaalsContact O-N 3.09Å
42	T	45.2	Very low	48.6	Very low	116 Å²	116	100.8 Å²	100.8	71%	0.712	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-4.6	176	52.4	0	0	0	0	113.6	C38 A39 L40 S44	C38-T42 PolarHBondContact O-N 2.78Å; A39-T42 PolarHBondContact O-OG1 3.26Å; L40-T42 PolarHBondContact O-N 3.3Å; T42-S44 PolarHBondContact O-N 2.83Å
43	L	42.6	Very low	50.6	Low	131 Å²	131	99.1 Å²	99.1	69%	0.686	59%	0.586	S	S	*	*	S	Bend	trans	-63.6	122.9	166.7	-73.1	165.1	0	0	0	108.4	L40	L40-L43 HydrophobicContact CG-CD1 4.42Å; L40-L43 PolarHBondContact O-N 3.37Å
44	S	38.1	Very low	52.7	Low	80 Å²	80	95.7 Å²	95.7	56%	0.559	56%	0.561	S	S	*	*			trans	-45.6	133.7	-169.2	43.7	0	0	0	0	114.9	T42 D46	T42-S44 PolarHBondContact O-N 2.83Å; S44-D46 PolarHBondContact O-N 2.96Å
45	K	46.3	Very low	54.8	Low	173 Å²	173	90.2 Å²	90.2	75%	0.752	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	4.9	175.5	-133.3	174	-175.5	178.6	0	114.8	E351	K45-E351 IonicContact NZ-OE1 2.68Å; K45-E351 PolarHBondContact NZ-OE1 3.41Å
46	D	35.9	Very low	56.9	Low	148 Å²	148	92.4 Å²	92.4	79%	0.791	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	24.6	-173.4	-68.3	-44.4	0	0	0	113.4	S44 P48	S44-D46 PolarHBondContact O-N 2.96Å; D46-P48 WeakPolarHBondContact O-CD 3.23Å
47	V	39.3	Very low	58.7	Low	72 Å²	72	90.2 Å²	90.2	44%	0.436	53%	0.528	S	S	.	.			trans	-94	111.3	170.5	179.8	0	0	0	0	107.7	S49 E53	V47-S49 PolarHBondContact O-N 3.09Å; V47-E53 WeakPolarHBondContact CG1-OE2 3.43Å
48	P	40.4	Very low	60.9	Low	104 Å²	104	87.6 Å²	87.6	68%	0.675	51%	0.51	S	S	*	.			trans	-56.8	134.9	169.6	24.6	-29.9	0	0	0	107.1	D46 S50	D46-P48 WeakPolarHBondContact O-CD 3.23Å; P48-S50 PolarHBondContact O-N 2.95Å
49	S	49.3	Very low	63	Low	109 Å²	109	87.9 Å²	87.9	76%	0.762	51%	0.506	S	S	*	.			trans	-61.9	73.8	-179.7	67.5	0	0	0	0	110.7	V47 Q51	V47-S49 PolarHBondContact O-N 3.09Å; S49-Q51 PolarHBondContact O-N 2.82Å
50	S	56.6	Low	65	Low	35 Å²	35	91.3 Å²	91.3	25%	0.245	51%	0.513	C	S	.	.			trans	-76.3	110.4	173.6	82.6	0	0	0	0	104.2	P48 E53	P48-S50 PolarHBondContact O-N 2.95Å; S50-E53 PolarHBondContact O-N 3.35Å; S50-E53 WeakPolarHBondContact OG-CG 3.42Å; S50-E53 PolarHBondContact OG-OE1 2.96Å
51	Q	67.9	Low	67	Low	142 Å²	142	88.7 Å²	88.7	66%	0.664	50%	0.497	S	S	*	.	H	α-helix	trans	-41.1	-35.1	171.4	-160	174.6	-5.1	0	0	113.7	S49 V55	S49-Q51 PolarHBondContact O-N 2.82Å; Q51-V55 WeakPolarHBondContact O-CG2 3.5Å; Q51-V55 PolarHBondContact O-N 3.24Å
52	P	80.6	Confident	69.3	Low	89 Å²	89	85.2 Å²	85.2	58%	0.578	47%	0.468	S	S	*	.	H	α-helix	trans	-63.1	-38.1	174.7	22.2	-36	0	0	0	115.6	V55 E56	P52-V55 PolarHBondContact O-N 3.48Å; P52-E56 PolarHBondContact O-N 3.19Å
53	E	84.8	Confident	71.6	Confident	97 Å²	97	80.5 Å²	80.5	45%	0.453	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-38.3	-178.5	-73.8	171.3	-129.1	0	0	111.8	V47 S50 V55 E56 A57	V47-E53 WeakPolarHBondContact CG1-OE2 3.43Å; S50-E53 PolarHBondContact O-N 3.35Å; S50-E53 WeakPolarHBondContact OG-CG 3.42Å; S50-E53 PolarHBondContact OG-OE1 2.96Å; E53-V55 VanDerWaalsContact C-N 3.33Å; E53-V55 PolarHBondContact O-N 3.24Å; E53-E56 PolarHBondContact O-N 2.03Å; E53-A57 PolarHBondContact O-N 2.78Å
54	M	86.8	Confident	74	Confident	58 Å²	58	79.7 Å²	79.7	29%	0.286	44%	0.435	S	S	.	.	H	α-helix	trans	-63.5	-39.7	173.5	-71.2	-63.3	-64.2	0	0	111.7	E56 A57 V58 F324 Y347	M54-E56 VanDerWaalsContact C-N 3.31Å; M54-E56 PolarHBondContact O-N 3.42Å; M54-A57 PolarHBondContact O-N 3.41Å; M54-V58 WeakPolarHBondContact O-CG2 3.04Å; M54-V58 PolarHBondContact O-N 3.4Å; M54-F324 HydrophobicContact CB-CE1 4.16Å; M54-F324 HydrophobicContact CB-CZ 4.07Å; M54-Y347 HydrophobicContact CE-CD1 3.67Å; M54-Y347 HydrophobicContact CE-CD2 4.45Å; M54-Y347 HydrophobicContact CE-CE1 3.35Å; M54-Y347 HydrophobicContact CE-CE2 4.18Å; M54-Y347 HydrophobicContact CE-CG 4.2Å
55	V	90.1	Very high	76.6	Confident	29 Å²	29	78.1 Å²	78.1	18%	0.176	42%	0.419	C	S	.	.	H	α-helix	trans	-62.5	-40	174	169.2	0	0	0	0	110.9	Q51 P52 E53 V58 K59 F324 I331	Q51-V55 WeakPolarHBondContact O-CG2 3.5Å; Q51-V55 PolarHBondContact O-N 3.24Å; P52-V55 PolarHBondContact O-N 3.48Å; E53-V55 VanDerWaalsContact C-N 3.33Å; E53-V55 PolarHBondContact O-N 3.24Å; V55-V58 PolarHBondContact O-N 2.91Å; V55-K59 HydrophobicContact CG1-CD 4.34Å; V55-K59 VanDerWaalsContact O-CG 3.32Å; V55-K59 WeakPolarHBondContact O-CG 3.47Å; V55-K59 PolarHBondContact O-N 2.91Å; V55-F324 HydrophobicContact CG2-CZ 4.16Å; V55-I331 HydrophobicContact CG1-CB 4.1Å; V55-I331 HydrophobicContact CG1-CG2 3.55Å; V55-I331 HydrophobicContact CG2-CG2 4.36Å
56	E	91.7	Very high	78.7	Confident	99 Å²	99	70.2 Å²	70.2	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-66	-40.7	176.7	-164.4	-174.9	151.7	0	0	112.2	P52 E53 M54 V58 K59 K60	P52-E56 PolarHBondContact O-N 3.19Å; E53-E56 PolarHBondContact O-N 2.03Å; M54-E56 VanDerWaalsContact C-N 3.31Å; M54-E56 PolarHBondContact O-N 3.42Å; E56-V58 VanDerWaalsContact C-N 3.34Å; E56-V58 PolarHBondContact O-N 3.43Å; E56-K59 WeakPolarHBondContact O-CB 3.48Å; E56-K59 PolarHBondContact O-N 2.83Å; E56-K60 WeakPolarHBondContact O-CG 3.27Å; E56-K60 PolarHBondContact O-N 2.91Å; E56-K60 VanDerWaalsContact OE1-CE 3.23Å; E56-K60 WeakPolarHBondContact OE1-CE 3.44Å; E56-K60 IonicContact OE1-NZ 2.7Å; E56-K60 PolarHBondContact OE1-NZ 2.9Å
57	A	91.6	Very high	81.3	Confident	55 Å²	55	70.7 Å²	70.7	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-60.9	-43.5	173.9	0	0	0	0	0	111.7	E53 M54 K60 H61	E53-A57 PolarHBondContact O-N 2.78Å; M54-A57 PolarHBondContact O-N 3.41Å; A57-K60 PolarHBondContact O-N 2.93Å; A57-H61 WeakPolarHBondContact O-CB 3.32Å; A57-H61 PolarHBondContact O-N 3.23Å
58	V	92.7	Very high	83.7	Confident	11 Å²	11	68 Å²	68	7%	0.067	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-45.7	174.5	165.1	0	0	0	0	111.4	M54 V55 E56 K60 H61 I62 F324 V326 Y343 A345	M54-V58 WeakPolarHBondContact O-CG2 3.04Å; M54-V58 PolarHBondContact O-N 3.4Å; V55-V58 PolarHBondContact O-N 2.91Å; E56-V58 VanDerWaalsContact C-N 3.34Å; E56-V58 PolarHBondContact O-N 3.43Å; V58-K60 PolarHBondContact O-N 2.93Å; V58-H61 WeakPolarHBondContact O-CB 3.21Å; V58-H61 PolarHBondContact O-N 2.65Å; V58-I62 HydrophobicContact CG1-CD1 3.85Å; V58-I62 HydrophobicContact CG1-CG1 4.49Å; V58-I62 WeakPolarHBondContact O-CG1 3.48Å; V58-I62 PolarHBondContact O-N 3.45Å; V58-F324 HydrophobicContact CG2-CD1 4.17Å; V58-F324 HydrophobicContact CG2-CE1 3.92Å; V58-V326 HydrophobicContact CG1-CB 4.43Å; V58-V326 HydrophobicContact CG1-CG1 4.31Å; V58-V326 HydrophobicContact CG1-CG2 4.15Å; V58-V326 HydrophobicContact CG2-CG2 4.26Å; V58-Y343 HydrophobicContact CG1-CE1 4.06Å; V58-Y343 WeakPolarHBondContact CG1-OH 3.41Å; V58-A345 HydrophobicContact CG1-CB 4.27Å; V58-A345 HydrophobicContact CG2-CB 3.61Å
59	K	94	Very high	86	Confident	55 Å²	55	74.1 Å²	74.1	24%	0.239	38%	0.375	C	S	.	.	H	α-helix	trans	-57.1	-49.6	176.1	-75.1	179.6	174.9	-179.9	0	111.5	V55 E56 H61 I62 L63 I331 W333	V55-K59 HydrophobicContact CG1-CD 4.34Å; V55-K59 VanDerWaalsContact O-CG 3.32Å; V55-K59 WeakPolarHBondContact O-CG 3.47Å; V55-K59 PolarHBondContact O-N 2.91Å; E56-K59 WeakPolarHBondContact O-CB 3.48Å; E56-K59 PolarHBondContact O-N 2.83Å; K59-H61 VanDerWaalsContact C-N 3.32Å; K59-H61 PolarHBondContact O-N 3.5Å; K59-I62 PolarHBondContact O-N 3.1Å; K59-L63 WeakPolarHBondContact O-CG 3.12Å; K59-L63 PolarHBondContact O-N 3.24Å; K59-L63 VanDerWaalsContact O-N 3.15Å; K59-I331 HydrophobicContact CG-CD1 4.15Å; K59-I331 PolarHBondContact NZ-O 3.46Å; K59-W333 VanDerWaalsContact CA-CH2 3.47Å; K59-W333 HydrophobicContact CB-CH2 3.49Å; K59-W333 VanDerWaalsContact CB-CH2 3.49Å; K59-W333 HydrophobicContact CB-CZ2 3.5Å; K59-W333 VanDerWaalsContact CB-CZ2 3.5Å; K59-W333 HydrophobicContact CB-CZ3 4.29Å; K59-W333 HydrophobicContact CD-CH2 4.49Å; K59-W333 HydrophobicContact CD-CZ2 3.73Å; K59-W333 HydrophobicContact CG-CD2 4.25Å; K59-W333 HydrophobicContact CG-CE3 4.45Å; K59-W333 HydrophobicContact CG-CH2 3.68Å; K59-W333 HydrophobicContact CG-CZ2 3.4Å; K59-W333 HydrophobicContact CG-CZ3 4.19Å; K59-W333 VanDerWaalsContact O-CH2 3.31Å; K59-W333 WeakPolarHBondContact O-CH2 3.45Å
60	K	94.1	Very high	88.1	Confident	112 Å²	112	74.6 Å²	74.6	49%	0.487	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-41.2	177.1	-72.6	175.7	-176	163.3	0	111.9	E56 A57 V58 L63 N64	E56-K60 WeakPolarHBondContact O-CG 3.27Å; E56-K60 PolarHBondContact O-N 2.91Å; E56-K60 VanDerWaalsContact OE1-CE 3.23Å; E56-K60 WeakPolarHBondContact OE1-CE 3.44Å; E56-K60 IonicContact OE1-NZ 2.7Å; E56-K60 PolarHBondContact OE1-NZ 2.9Å; A57-K60 PolarHBondContact O-N 2.93Å; V58-K60 PolarHBondContact O-N 2.93Å; K60-L63 PolarHBondContact O-N 2.86Å; K60-N64 WeakPolarHBondContact O-CB 3.45Å; K60-N64 VanDerWaalsContact O-CG 3.22Å; K60-N64 PolarHBondContact O-N 3.01Å; K60-N64 PolarHBondContact O-ND2 2.88Å
61	H	92.8	Very high	89.7	Confident	74 Å²	74	78 Å²	78	34%	0.343	38%	0.377	S	S	.	.	H	α-helix	trans	-60.2	-47.9	177.4	180	63.1	0	0	0	111.9	A57 V58 K59 L63 N64 M65	A57-H61 WeakPolarHBondContact O-CB 3.32Å; A57-H61 PolarHBondContact O-N 3.23Å; V58-H61 WeakPolarHBondContact O-CB 3.21Å; V58-H61 PolarHBondContact O-N 2.65Å; K59-H61 VanDerWaalsContact C-N 3.32Å; K59-H61 PolarHBondContact O-N 3.5Å; H61-L63 PolarHBondContact O-N 2.92Å; H61-N64 PolarHBondContact O-N 2.8Å; H61-M65 VanDerWaalsContact O-CG 3.28Å; H61-M65 WeakPolarHBondContact O-CG 3.46Å; H61-M65 PolarHBondContact O-N 3.02Å
62	I	94	Very high	90.8	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-58.9	-48.8	177.9	-64.3	157.4	0	0	0	111.1	V58 K59 N64 M65 L66 F328 W333 W336 Y343 M399 M416	V58-I62 HydrophobicContact CG1-CD1 3.85Å; V58-I62 HydrophobicContact CG1-CG1 4.49Å; V58-I62 WeakPolarHBondContact O-CG1 3.48Å; V58-I62 PolarHBondContact O-N 3.45Å; K59-I62 PolarHBondContact O-N 3.1Å; I62-N64 VanDerWaalsContact C-N 3.32Å; I62-N64 PolarHBondContact O-N 2.92Å; I62-M65 PolarHBondContact O-N 2.97Å; I62-L66 HydrophobicContact CG2-CD1 3.87Å; I62-L66 HydrophobicContact CG2-CG 4.28Å; I62-L66 WeakPolarHBondContact O-CB 3.44Å; I62-L66 WeakPolarHBondContact O-CG 3.4Å; I62-L66 PolarHBondContact O-N 2.86Å; I62-F328 HydrophobicContact CD1-CE1 3.73Å; I62-F328 HydrophobicContact CD1-CZ 4.46Å; I62-W333 HydrophobicContact CB-CZ3 3.85Å; I62-W333 HydrophobicContact CD1-CE3 4.01Å; I62-W333 HydrophobicContact CD1-CZ3 3.62Å; I62-W333 HydrophobicContact CG1-CZ3 4.38Å; I62-W333 HydrophobicContact CG2-CZ3 3.84Å; I62-W336 HydrophobicContact CG2-CH2 4.46Å; I62-Y343 HydrophobicContact CD1-CE1 3.9Å; I62-Y343 HydrophobicContact CG1-CE1 4.22Å; I62-M399 HydrophobicContact CG2-CE 4.2Å; I62-M416 HydrophobicContact CG1-CE 3.76Å
63	L	94.2	Very high	91	Very high	18 Å²	18	73.6 Å²	73.6	9%	0.094	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-44.3	179.9	-68.5	171.3	0	0	0	111.4	K59 K60 H61 M65 L66 H67 L68 W333 W336	K59-L63 WeakPolarHBondContact O-CG 3.12Å; K59-L63 PolarHBondContact O-N 3.24Å; K59-L63 VanDerWaalsContact O-N 3.15Å; K60-L63 PolarHBondContact O-N 2.86Å; H61-L63 PolarHBondContact O-N 2.92Å; L63-M65 PolarHBondContact O-N 3.09Å; L63-L66 CarbonylContact O-C 3.59Å; L63-L66 PolarHBondContact O-N 3.45Å; L63-H67 PolarHBondContact O-N 2.86Å; L63-L68 CarbonylContact C-O 3.58Å; L63-L68 HydrophobicContact CD2-CB 3.85Å; L63-L68 HydrophobicContact CD2-CD1 4.35Å; L63-L68 PolarHBondContact O-N 2.9Å; L63-W333 HydrophobicContact CD1-CH2 4.13Å; L63-W333 HydrophobicContact CD1-CZ2 4.47Å; L63-W333 HydrophobicContact CD2-CH2 4.2Å; L63-W333 HydrophobicContact CG-CH2 3.85Å; L63-W336 HydrophobicContact CD2-CH2 4.42Å
64	N	93.7	Very high	90.9	Very high	113 Å²	113	70.6 Å²	70.6	60%	0.604	34%	0.34	S	S	*	.	H	α-helix	trans	-60.2	-44.4	176.6	-72.5	-20.6	0	0	0	112.4	K60 H61 I62 L66 H67	K60-N64 WeakPolarHBondContact O-CB 3.45Å; K60-N64 VanDerWaalsContact O-CG 3.22Å; K60-N64 PolarHBondContact O-N 3.01Å; K60-N64 PolarHBondContact O-ND2 2.88Å; H61-N64 PolarHBondContact O-N 2.8Å; I62-N64 VanDerWaalsContact C-N 3.32Å; I62-N64 PolarHBondContact O-N 2.92Å; N64-L66 VanDerWaalsContact C-N 3.32Å; N64-L66 PolarHBondContact O-N 3.32Å; N64-H67 PolarHBondContact O-N 3.3Å; N64-H67 PolarHBondContact O-ND1 2.88Å
65	M	91.8	Very high	90.4	Very high	48 Å²	48	72.4 Å²	72.4	24%	0.236	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-30.1	178.9	-66.1	-57.6	-72.8	0	0	112.8	H61 I62 L63 H67 K411 I413 Q414 M416	H61-M65 VanDerWaalsContact O-CG 3.28Å; H61-M65 WeakPolarHBondContact O-CG 3.46Å; H61-M65 PolarHBondContact O-N 3.02Å; I62-M65 PolarHBondContact O-N 2.97Å; L63-M65 PolarHBondContact O-N 3.09Å; M65-H67 VanDerWaalsContact C-N 3.33Å; M65-K411 PolarHBondContact O-NZ 2.96Å; M65-I413 HydrophobicContact CB-CG2 3.79Å; M65-I413 HydrophobicContact CE-CG2 3.5Å; M65-I413 VanDerWaalsContact CE-CG2 3.5Å; M65-I413 HydrophobicContact CG-CG2 4.34Å; M65-Q414 WeakPolarHBondContact CE-O 3.15Å; M65-M416 HydrophobicContact CB-SD 4.33Å; M65-M416 HydrophobicContact CG-SD 4.02Å
66	L	90.1	Very high	89.5	Confident	7 Å²	7	78.1 Å²	78.1	4%	0.037	38%	0.379	C	S	.	.	H	α-helix	trans	-79.6	-18	172.8	-67	-179.1	0	0	0	113.5	I62 L63 N64 L68 W336 M399 Y401 K411 I413	I62-L66 HydrophobicContact CG2-CD1 3.87Å; I62-L66 HydrophobicContact CG2-CG 4.28Å; I62-L66 WeakPolarHBondContact O-CB 3.44Å; I62-L66 WeakPolarHBondContact O-CG 3.4Å; I62-L66 PolarHBondContact O-N 2.86Å; L63-L66 CarbonylContact O-C 3.59Å; L63-L66 PolarHBondContact O-N 3.45Å; N64-L66 VanDerWaalsContact C-N 3.32Å; N64-L66 PolarHBondContact O-N 3.32Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 HydrophobicContact CB-CD1 4.11Å; L66-L68 HydrophobicContact CB-CG 3.91Å; L66-L68 HydrophobicContact CD1-CD1 3.93Å; L66-W336 HydrophobicContact CD1-CH2 3.55Å; L66-W336 HydrophobicContact CD1-CZ3 3.74Å; L66-M399 HydrophobicContact CD1-CE 3.19Å; L66-M399 HydrophobicContact CD2-CE 3.82Å; L66-M399 HydrophobicContact CG-CE 3.92Å; L66-Y401 HydrophobicContact CD1-CD1 4.45Å; L66-Y401 HydrophobicContact CD1-CD2 4.34Å; L66-Y401 HydrophobicContact CD1-CE1 4.3Å; L66-Y401 HydrophobicContact CD1-CE2 4.21Å; L66-Y401 HydrophobicContact CD1-CG 4.46Å; L66-Y401 HydrophobicContact CD2-CD1 4.19Å; L66-Y401 HydrophobicContact CD2-CE1 3.53Å; L66-Y401 HydrophobicContact CG-CE1 4.47Å; L66-K411 HydrophobicContact CD2-CD 3.97Å; L66-K411 PolarHBondContact O-NZ 2.88Å; L66-K411 VanDerWaalsContact O-NZ 3.1Å; L66-I413 HydrophobicContact CD2-CD1 3.56Å; L66-I413 HydrophobicContact CD2-CG1 4.25Å; L66-I413 HydrophobicContact CG-CD1 4.44Å
67	H	91.5	Very high	88.5	Confident	157 Å²	157	77.5 Å²	77.5	73%	0.727	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	34.5	-169.5	-45.6	-46.2	0	0	0	113	L63 N64 M65 K411	L63-H67 PolarHBondContact O-N 2.86Å; N64-H67 PolarHBondContact O-N 3.3Å; N64-H67 PolarHBondContact O-ND1 2.88Å; M65-H67 VanDerWaalsContact C-N 3.33Å; H67-K411 PolarHBondContact CD2-NZ 3.21Å
68	L	89.2	Confident	87.7	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.084	38%	0.377	C	S	.	.			trans	-97	143.4	171.1	-61.6	178.9	0	0	0	109.4	L63 L66 P72 W336 Y401 D403	L63-L68 CarbonylContact C-O 3.58Å; L63-L68 HydrophobicContact CD2-CB 3.85Å; L63-L68 HydrophobicContact CD2-CD1 4.35Å; L63-L68 PolarHBondContact O-N 2.9Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 HydrophobicContact CB-CD1 4.11Å; L66-L68 HydrophobicContact CB-CG 3.91Å; L66-L68 HydrophobicContact CD1-CD1 3.93Å; L68-P72 HydrophobicContact CD1-CG 3.97Å; L68-W336 HydrophobicContact CD1-CH2 4.17Å; L68-W336 HydrophobicContact CD1-CZ3 3.88Å; L68-Y401 HydrophobicContact CD1-CE2 4.06Å; L68-D403 WeakPolarHBondContact CD2-OD1 3.44Å
69	R	89.6	Confident	87.2	Confident	232 Å²	232	81.4 Å²	81.4	88%	0.875	40%	0.403	S	S	*	.	S	Bend	trans	-77.4	-46.7	175.1	-67.9	-177.6	-179.7	-177.4	0.4	111
70	D	91.8	Very high	86.5	Confident	120 Å²	120	85.2 Å²	85.2	64%	0.642	42%	0.42	S	S	*	.	S	Bend	trans	-137.6	169.9	-177.5	-66.9	-64.6	0	0	0	109.9
71	R	91.6	Very high	85.8	Confident	106 Å²	106	83.7 Å²	83.7	40%	0.4	43%	0.428	S	S	.	.			trans	-62.5	132	172.5	169	-179.6	169.5	-179.4	4.9	110.2	G332 D335 W336	R71-G332 PolarHBondContact NH1-O 3.02Å; R71-G332 PolarHBondContact NH2-O 2.79Å; R71-D335 IonicContact CZ-OD1 2.76Å; R71-D335 IonicContact CZ-OD2 3.5Å; R71-D335 IonicContact NE-OD1 2.77Å; R71-D335 IonicContact NE-OD2 3.59Å; R71-D335 IonicContact NH2-OD1 3.84Å; R71-D335 PolarHBondContact NH2-OD1 3.37Å; R71-D335 IonicContact NH2-OD2 2.67Å; R71-D335 PolarHBondContact NH2-OD2 3.48Å; R71-W336 HydrophobicContact CG-CG 4.4Å
72	P	89.4	Confident	85.3	Confident	3 Å²	3	82.7 Å²	82.7	2%	0.019	43%	0.432	C	S	.	.			trans	-61.1	139.3	175.3	-26.8	37.2	0	0	0	113	L68 W336 Y402 D404	L68-P72 HydrophobicContact CD1-CG 3.97Å; P72-W336 HydrophobicContact CG-CE3 4.11Å; P72-W336 HydrophobicContact CG-CZ3 4.45Å; P72-Y402 WeakPolarHBondContact CG-O 3.41Å; P72-D404 WeakPolarHBondContact CA-OD1 3.37Å
73	N	86.4	Confident	84.7	Confident	136 Å²	136	83.4 Å²	83.4	73%	0.727	44%	0.436	S	S	*	.			trans	-94.3	102.4	177.9	-171.4	4.8	0	0	0	111.1	T75	N73-T75 PolarHBondContact O-N 2.83Å; N73-T75 VanDerWaalsContact O-N 3.14Å
74	I	81.9	Confident	84.1	Confident	34 Å²	34	84 Å²	84	17%	0.174	44%	0.439	C	S	.	.			trans	-83	94.3	-178.1	-55.4	177.5	0	0	0	109.7	P77 D335 W336 Y402	I74-P77 HydrophobicContact CG2-CB 3.86Å; I74-P77 HydrophobicContact CG2-CG 4.44Å; I74-D335 VanDerWaalsContact CD1-O 3.26Å; I74-D335 WeakPolarHBondContact CD1-O 3.18Å; I74-W336 VanDerWaalsContact CD1-CA 3.43Å; I74-W336 HydrophobicContact CD1-CB 3.38Å; I74-W336 HydrophobicContact CG1-CB 4.23Å; I74-Y402 HydrophobicContact CD1-CD2 3.68Å; I74-Y402 HydrophobicContact CD1-CE2 4.38Å; I74-Y402 HydrophobicContact CD1-CG 3.86Å
75	T	75.9	Confident	83.4	Confident	96 Å²	96	83 Å²	83	59%	0.589	43%	0.434	S	S	*	.	S	Bend	trans	-82.7	-30.3	178.7	56.5	0	0	0	0	113.1	N73 Q406	N73-T75 PolarHBondContact O-N 2.83Å; N73-T75 VanDerWaalsContact O-N 3.14Å; T75-Q406 PolarHBondContact OG1-NE2 3.39Å
76	Q	71.3	Confident	82.7	Confident	148 Å²	148	82.9 Å²	82.9	69%	0.692	44%	0.441	S	S	*	.	S	Bend	trans	-139.3	92.7	176.4	-66.8	-170.9	13.5	0	0	110.2
77	P	71.2	Confident	82.2	Confident	86 Å²	86	82.8 Å²	82.8	56%	0.558	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-67.5	139.7	176.6	26.9	-32	0	0	0	110.5	I74	I74-P77 HydrophobicContact CG2-CB 3.86Å; I74-P77 HydrophobicContact CG2-CG 4.44Å
78	V	75.2	Confident	81.6	Confident	54 Å²	54	82 Å²	82	33%	0.327	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-55.5	132.6	169.6	178.6	0	0	0	0	108.7	K80 A82 L83 Y402 I408	V78-K80 PolarHBondContact O-N 3.26Å; V78-A82 HydrophobicContact CG1-CB 4.08Å; V78-L83 HydrophobicContact CG1-CB 4.37Å; V78-Y402 HydrophobicContact CG2-CE1 4.34Å; V78-I408 HydrophobicContact CG2-CD1 4.47Å
79	P	82	Confident	81.2	Confident	95 Å²	95	88.5 Å²	88.5	62%	0.617	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-50.7	128.8	178.1	-28.5	34.7	0	0	0	111.3	A81 A82 L83	P79-A81 PolarHBondContact O-N 2.87Å; P79-A82 WeakPolarHBondContact O-CA 3.47Å; P79-A82 WeakPolarHBondContact O-CB 3.38Å; P79-A82 PolarHBondContact O-N 3.33Å; P79-L83 PolarHBondContact O-N 2.71Å; P79-L83 VanDerWaalsContact O-N 3.1Å
80	K	79.3	Confident	80.4	Confident	135 Å²	135	83.6 Å²	83.6	59%	0.587	45%	0.453	S	S	*	.	H	α-helix	trans	-50.9	-38.9	-172.2	-170.2	176.8	179.7	-177.1	0	112.7	V78 A82 L83 L84	V78-K80 PolarHBondContact O-N 3.26Å; K80-A82 PolarHBondContact O-N 3.14Å; K80-L83 PolarHBondContact O-N 2.75Å; K80-L84 HydrophobicContact CG-CD1 4.05Å; K80-L84 HydrophobicContact CG-CG 4.25Å; K80-L84 WeakPolarHBondContact O-CB 3.41Å; K80-L84 VanDerWaalsContact O-CG 3.25Å; K80-L84 WeakPolarHBondContact O-CG 3.03Å; K80-L84 PolarHBondContact O-N 3.02Å
81	A	78.7	Confident	79.6	Confident	80 Å²	80	84.2 Å²	84.2	66%	0.661	45%	0.451	S	S	*	.	H	α-helix	trans	-62.5	-40.6	177.1	0	0	0	0	0	113.5	P79 N85	P79-A81 PolarHBondContact O-N 2.87Å; A81-N85 WeakPolarHBondContact O-CB 3.26Å; A81-N85 PolarHBondContact O-N 3.48Å; A81-N85 VanDerWaalsContact O-N 3.14Å
82	A	82.5	Confident	78.9	Confident	52 Å²	52	81 Å²	81	43%	0.43	44%	0.443	S	S	.	.	H	α-helix	trans	-69.4	-42.4	177.5	0	0	0	0	0	111.2	V78 P79 K80 N85 A86	V78-A82 HydrophobicContact CG1-CB 4.08Å; P79-A82 WeakPolarHBondContact O-CA 3.47Å; P79-A82 WeakPolarHBondContact O-CB 3.38Å; P79-A82 PolarHBondContact O-N 3.33Å; K80-A82 PolarHBondContact O-N 3.14Å; A82-N85 PolarHBondContact O-N 2.78Å; A82-A86 WeakPolarHBondContact O-CB 3.31Å; A82-A86 PolarHBondContact O-N 3.01Å
83	L	80.8	Confident	78.2	Confident	15 Å²	15	81 Å²	81	8%	0.079	44%	0.444	C	S	.	.	H	α-helix	trans	-57	-54.7	175.1	173.7	66.9	0	0	0	111.6	V78 P79 K80 N85 A86 I87 I338 I408	V78-L83 HydrophobicContact CG1-CB 4.37Å; P79-L83 PolarHBondContact O-N 2.71Å; P79-L83 VanDerWaalsContact O-N 3.1Å; K80-L83 PolarHBondContact O-N 2.75Å; L83-N85 VanDerWaalsContact C-N 3.3Å; L83-N85 PolarHBondContact O-N 2.83Å; L83-A86 PolarHBondContact O-N 2.87Å; L83-I87 HydrophobicContact CD1-CD1 3.77Å; L83-I87 HydrophobicContact CD1-CG1 4.23Å; L83-I87 HydrophobicContact CG-CD1 3.77Å; L83-I87 VanDerWaalsContact O-CG1 3.31Å; L83-I87 WeakPolarHBondContact O-CG1 3.49Å; L83-I87 PolarHBondContact O-N 2.98Å; L83-I338 HydrophobicContact CD1-CD1 4.16Å; L83-I338 HydrophobicContact CD2-CD1 4.28Å; L83-I338 HydrophobicContact CD2-CG2 4.45Å; L83-I408 HydrophobicContact CD1-CD1 3.27Å; L83-I408 HydrophobicContact CD1-CG1 3.92Å; L83-I408 HydrophobicContact CD1-CG2 4.48Å
84	L	81.4	Confident	78.1	Confident	30 Å²	30	79.7 Å²	79.7	16%	0.157	43%	0.432	C	S	.	.	H	α-helix	trans	-62.3	-38	-177.7	-68.2	-178.7	0	0	0	112.1	K80 K88 V95 V101	K80-L84 HydrophobicContact CG-CD1 4.05Å; K80-L84 HydrophobicContact CG-CG 4.25Å; K80-L84 WeakPolarHBondContact O-CB 3.41Å; K80-L84 VanDerWaalsContact O-CG 3.25Å; K80-L84 WeakPolarHBondContact O-CG 3.03Å; K80-L84 PolarHBondContact O-N 3.02Å; L84-K88 WeakPolarHBondContact O-CB 3.42Å; L84-K88 PolarHBondContact O-N 3.24Å; L84-V95 HydrophobicContact CB-CG1 4.15Å; L84-V95 HydrophobicContact CB-CG2 4.37Å; L84-V95 HydrophobicContact CD1-CG1 4.04Å; L84-V95 HydrophobicContact CD2-CG1 3.78Å; L84-V95 HydrophobicContact CD2-CG2 4.05Å; L84-V95 HydrophobicContact CG-CG1 4.19Å; L84-V101 HydrophobicContact CD2-CG2 3.42Å; L84-V101 VanDerWaalsContact CD2-CG2 3.42Å
85	N	79.2	Confident	78.2	Confident	93 Å²	93	80 Å²	80	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-65.9	-43.4	175.7	-168.8	8.8	0	0	0	111.7	A81 A82 L83 K88 K89	A81-N85 WeakPolarHBondContact O-CB 3.26Å; A81-N85 PolarHBondContact O-N 3.48Å; A81-N85 VanDerWaalsContact O-N 3.14Å; A82-N85 PolarHBondContact O-N 2.78Å; L83-N85 VanDerWaalsContact C-N 3.3Å; L83-N85 PolarHBondContact O-N 2.83Å; N85-K88 PolarHBondContact O-N 3Å; N85-K89 WeakPolarHBondContact O-CB 3.36Å; N85-K89 WeakPolarHBondContact O-CG 3.18Å; N85-K89 PolarHBondContact O-N 2.79Å; N85-K89 WeakPolarHBondContact OD1-CG 3.1Å
86	A	78.4	Confident	78.4	Confident	45 Å²	45	77 Å²	77	37%	0.372	42%	0.423	S	S	.	.	H	α-helix	trans	-61.5	-46.4	176.6	0	0	0	0	0	111.8	A82 L83 K88 K89 L90	A82-A86 WeakPolarHBondContact O-CB 3.31Å; A82-A86 PolarHBondContact O-N 3.01Å; L83-A86 PolarHBondContact O-N 2.87Å; A86-K88 VanDerWaalsContact C-N 3.32Å; A86-K88 PolarHBondContact O-N 3.24Å; A86-K89 PolarHBondContact O-N 2.94Å; A86-L90 WeakPolarHBondContact O-CB 3.41Å; A86-L90 WeakPolarHBondContact O-CG 3.47Å; A86-L90 PolarHBondContact O-N 3.35Å
87	I	78.9	Confident	78.7	Confident	5 Å²	5	80.1 Å²	80.1	3%	0.026	44%	0.438	C	S	.	.	H	α-helix	trans	-57.4	-46.2	177.2	-68.4	167.8	0	0	0	110.8	L83 H91 V92 G93 V95 V101 I338 L400	L83-I87 HydrophobicContact CD1-CD1 3.77Å; L83-I87 HydrophobicContact CD1-CG1 4.23Å; L83-I87 HydrophobicContact CG-CD1 3.77Å; L83-I87 VanDerWaalsContact O-CG1 3.31Å; L83-I87 WeakPolarHBondContact O-CG1 3.49Å; L83-I87 PolarHBondContact O-N 2.98Å; I87-H91 PolarHBondContact O-N 3.45Å; I87-V92 HydrophobicContact CG2-CB 4.46Å; I87-V92 PolarHBondContact O-N 2.89Å; I87-V92 VanDerWaalsContact O-N 3.14Å; I87-G93 WeakPolarHBondContact CG2-O 3.48Å; I87-V95 HydrophobicContact CB-CG2 4.47Å; I87-V95 HydrophobicContact CG2-CG2 4.17Å; I87-V101 HydrophobicContact CD1-CG1 4.17Å; I87-V101 HydrophobicContact CD1-CG2 4.29Å; I87-V101 HydrophobicContact CG2-CG1 4.04Å; I87-I338 HydrophobicContact CD1-CG2 4.31Å; I87-L400 HydrophobicContact CD1-CD2 3.85Å; I87-L400 HydrophobicContact CG1-CD2 4.24Å
88	K	78.3	Confident	79.2	Confident	141 Å²	141	82 Å²	82	61%	0.613	44%	0.443	S	S	*	.	H	α-helix	trans	-66.4	-40.3	179	-173.9	174.4	-177.6	171.6	0	112.8	L84 N85 A86 V95	L84-K88 WeakPolarHBondContact O-CB 3.42Å; L84-K88 PolarHBondContact O-N 3.24Å; N85-K88 PolarHBondContact O-N 3Å; A86-K88 VanDerWaalsContact C-N 3.32Å; A86-K88 PolarHBondContact O-N 3.24Å; K88-V95 HydrophobicContact CB-CG2 4.43Å
89	K	81.5	Confident	79.1	Confident	153 Å²	153	80.3 Å²	80.3	67%	0.665	44%	0.436	S	S	*	.	H	α-helix	trans	-75.8	-34.3	-177.4	-75.8	-71	-177.7	-178.9	0	113.4	N85 A86 H91	N85-K89 WeakPolarHBondContact O-CB 3.36Å; N85-K89 WeakPolarHBondContact O-CG 3.18Å; N85-K89 PolarHBondContact O-N 2.79Å; N85-K89 WeakPolarHBondContact OD1-CG 3.1Å; A86-K89 PolarHBondContact O-N 2.94Å; K89-H91 VanDerWaalsContact C-N 3.27Å; K89-H91 PolarHBondContact O-ND1 2.87Å
90	L	72.2	Confident	79.1	Confident	128 Å²	128	80.4 Å²	80.4	67%	0.67	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	2	179.2	-64.5	174.7	0	0	0	112.9	A86 V92	A86-L90 WeakPolarHBondContact O-CB 3.41Å; A86-L90 WeakPolarHBondContact O-CG 3.47Å; A86-L90 PolarHBondContact O-N 3.35Å; L90-V92 HydrophobicContact CB-CG2 3.74Å; L90-V92 PolarHBondContact O-N 3.32Å
91	H	76.3	Confident	79.4	Confident	133 Å²	133	74.6 Å²	74.6	62%	0.616	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	33	-176.4	-54.6	83.2	0	0	0	112.6	I87 K89	I87-H91 PolarHBondContact O-N 3.45Å; K89-H91 VanDerWaalsContact C-N 3.27Å; K89-H91 PolarHBondContact O-ND1 2.87Å
92	V	76.3	Confident	79.8	Confident	39 Å²	39	73.7 Å²	73.7	24%	0.236	38%	0.382	C	S	.	.	S	Bend	trans	-80.7	-31.4	176.5	177.1	0	0	0	0	109.8	I87 L90 E104 L400 K410	I87-V92 HydrophobicContact CG2-CB 4.46Å; I87-V92 PolarHBondContact O-N 2.89Å; I87-V92 VanDerWaalsContact O-N 3.14Å; L90-V92 HydrophobicContact CB-CG2 3.74Å; L90-V92 PolarHBondContact O-N 3.32Å; V92-E104 PolarHBondContact O-N 3.01Å; V92-L400 HydrophobicContact CG1-CD1 3.83Å; V92-L400 HydrophobicContact CG1-CD2 4.42Å; V92-K410 HydrophobicContact CG1-CB 4.05Å; V92-K410 HydrophobicContact CG1-CG 4.25Å
93	G	74.8	Confident	79.9	Confident	2 Å²	2	71.7 Å²	71.7	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	157.3	178.4	0	0	0	0	0	113.9	I87 E102	I87-G93 WeakPolarHBondContact CG2-O 3.48Å; G93-E102 CarbonylContact C-O 3.52Å; G93-E102 VanDerWaalsContact C-O 3.29Å; G93-E102 WeakPolarHBondContact CA-O 3.42Å
94	K	84.3	Confident	79.8	Confident	110 Å²	110	74.8 Å²	74.8	48%	0.478	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	134.5	170.6	-63.8	179.2	-176.9	174.3	0	108.9	E102 E104	K94-E102 PolarHBondContact N-O 3.01Å; K94-E102 PolarHBondContact O-N 3.43Å; K94-E104 VanDerWaalsContact CE-OE1 3.26Å; K94-E104 WeakPolarHBondContact CE-OE1 3.34Å; K94-E104 HydrophobicContact CG-CB 4.38Å
95	V	83.6	Confident	79.6	Confident	41 Å²	41	76.1 Å²	76.1	25%	0.248	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.4	179.3	-178.3	0	0	0	0	108.9	L84 I87 K88 Y100 V101	L84-V95 HydrophobicContact CB-CG1 4.15Å; L84-V95 HydrophobicContact CB-CG2 4.37Å; L84-V95 HydrophobicContact CD1-CG1 4.04Å; L84-V95 HydrophobicContact CD2-CG1 3.78Å; L84-V95 HydrophobicContact CD2-CG2 4.05Å; L84-V95 HydrophobicContact CG-CG1 4.19Å; I87-V95 HydrophobicContact CB-CG2 4.47Å; I87-V95 HydrophobicContact CG2-CG2 4.17Å; K88-V95 HydrophobicContact CB-CG2 4.43Å; V95-Y100 CarbonylContact C-O 3.52Å; V95-Y100 WeakPolarHBondContact CA-O 3.41Å; V95-V101 HydrophobicContact CG2-CG2 4.46Å
96	G	80.7	Confident	79.9	Confident	32 Å²	32	73.3 Å²	73.3	33%	0.33	37%	0.371	S	S	.	.			trans	-71	164.5	173.5	0	0	0	0	0	112.6	D98 G99 Y100	G96-D98 PolarHBondContact O-N 3.01Å; G96-G99 PolarHBondContact O-N 3.16Å; G96-Y100 PolarHBondContact N-O 2.86Å
97	E	78.1	Confident	80.1	Confident	214 Å²	214	72.7 Å²	72.7	100%	1	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.3	179.3	-62.4	-175.7	167.2	0	0	112.8	G99	E97-G99 PolarHBondContact O-N 3.12Å
98	D	80.3	Confident	80	Confident	126 Å²	126	72.5 Å²	72.5	67%	0.674	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-3.6	173.3	62.5	-11.5	0	0	0	113.5	G96 Y100	G96-D98 PolarHBondContact O-N 3.01Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 WeakPolarHBondContact OD1-CB 3.15Å; D98-Y100 PolarHBondContact OD1-N 3.05Å
99	G	74	Confident	80	Confident	17 Å²	17	70.8 Å²	70.8	18%	0.175	35%	0.351	C	S	.	.			trans	78	16.7	-175	0	0	0	0	0	114	G96 E97	G96-G99 PolarHBondContact O-N 3.16Å; E97-G99 PolarHBondContact O-N 3.12Å
100	Y	82.1	Confident	80	Confident	98 Å²	98	69.5 Å²	69.5	38%	0.384	34%	0.342	S	S	.	.			trans	-65.8	138.4	166.6	179.6	-101.5	0	0	0	110.3	V95 G96 D98 E102 T341	V95-Y100 CarbonylContact C-O 3.52Å; V95-Y100 WeakPolarHBondContact CA-O 3.41Å; G96-Y100 PolarHBondContact N-O 2.86Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 WeakPolarHBondContact OD1-CB 3.15Å; D98-Y100 PolarHBondContact OD1-N 3.05Å; Y100-E102 HydrophobicContact CD1-CB 4.49Å; Y100-E102 HydrophobicContact CE1-CB 3.95Å; Y100-T341 HydrophobicContact CD2-CG2 4.19Å; Y100-T341 HydrophobicContact CE2-CG2 3.59Å
101	V	85.1	Confident	80.2	Confident	12 Å²	12	64.6 Å²	64.6	7%	0.073	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	121.5	-179.8	-179.6	0	0	0	0	109.1	L84 I87 V95 I338 A339 L400	L84-V101 HydrophobicContact CD2-CG2 3.42Å; L84-V101 VanDerWaalsContact CD2-CG2 3.42Å; I87-V101 HydrophobicContact CD1-CG1 4.17Å; I87-V101 HydrophobicContact CD1-CG2 4.29Å; I87-V101 HydrophobicContact CG2-CG1 4.04Å; V95-V101 HydrophobicContact CG2-CG2 4.46Å; V101-I338 HydrophobicContact CB-CG2 4.44Å; V101-I338 HydrophobicContact CG2-CG2 4.32Å; V101-A339 HydrophobicContact CB-CB 4.44Å; V101-A339 HydrophobicContact CG1-CB 4.21Å; V101-L400 HydrophobicContact CG1-CD2 4.2Å
102	E	86.3	Confident	80.2	Confident	61 Å²	61	62.5 Å²	62.5	29%	0.285	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.3	171.9	-167.2	179.3	-122.9	0	0	109.9	G93 K94 Y100 E104 R109	G93-E102 CarbonylContact C-O 3.52Å; G93-E102 VanDerWaalsContact C-O 3.29Å; G93-E102 WeakPolarHBondContact CA-O 3.42Å; K94-E102 PolarHBondContact N-O 3.01Å; K94-E102 PolarHBondContact O-N 3.43Å; Y100-E102 HydrophobicContact CD1-CB 4.49Å; Y100-E102 HydrophobicContact CE1-CB 3.95Å; E102-E104 PolarHBondContact O-N 2.8Å; E102-R109 VanDerWaalsContact CD-NH1 3.27Å; E102-R109 IonicContact OE1-CZ 3.83Å; E102-R109 IonicContact OE1-NH1 3.72Å; E102-R109 IonicContact OE1-NH2 3.12Å; E102-R109 PolarHBondContact OE1-NH2 2.88Å; E102-R109 IonicContact OE2-CZ 2.59Å; E102-R109 IonicContact OE2-NH1 3.31Å; E102-R109 PolarHBondContact OE2-NH1 2.92Å; E102-R109 IonicContact OE2-NH2 3.53Å; E102-R109 PolarHBondContact OE2-NH2 3.17Å
103	I	85.9	Confident	80.1	Confident	11 Å²	11	66.1 Å²	66.1	6%	0.056	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.5	178.7	-57.9	174.2	0	0	0	108.5	D106 A339 S398 L400	I103-D106 HydrophobicContact CB-CB 4.41Å; I103-D106 HydrophobicContact CG2-CB 4.37Å; I103-A339 HydrophobicContact CD1-CB 4.2Å; I103-A339 HydrophobicContact CG1-CB 3.94Å; I103-S398 WeakPolarHBondContact CD1-O 3.49Å; I103-L400 HydrophobicContact CD1-CB 4.27Å
104	E	78.5	Confident	80.1	Confident	79 Å²	79	70.5 Å²	70.5	37%	0.369	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-45.1	-175.3	-178.7	159.4	-146.3	0	0	111.1	V92 K94 E102 D106	V92-E104 PolarHBondContact O-N 3.01Å; K94-E104 VanDerWaalsContact CE-OE1 3.26Å; K94-E104 WeakPolarHBondContact CE-OE1 3.34Å; K94-E104 HydrophobicContact CG-CB 4.38Å; E102-E104 PolarHBondContact O-N 2.8Å; E104-D106 PolarHBondContact O-N 2.86Å
105	D	78.1	Confident	79.5	Confident	59 Å²	59	68 Å²	68	32%	0.316	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	64	175.3	-166.3	28.3	0	0	0	112.6	R110 K410	D105-R110 IonicContact OD1-CZ 2.73Å; D105-R110 IonicContact OD1-NE 2.86Å; D105-R110 PolarHBondContact OD1-NE 3.23Å; D105-R110 IonicContact OD1-NH2 2.75Å; D105-R110 PolarHBondContact OD1-NH2 3.17Å; D105-R110 IonicContact OD2-CZ 2.96Å; D105-R110 IonicContact OD2-NH2 2.71Å; D105-R110 PolarHBondContact OD2-NH2 3.27Å; D105-K410 WeakPolarHBondContact O-CE 3.49Å; D105-K410 PolarHBondContact O-NZ 3.38Å
106	D	83.6	Confident	78.8	Confident	33 Å²	33	69.5 Å²	69.5	18%	0.176	35%	0.348	C	S	.	.			trans	-79.7	121.1	178.1	177	33.5	0	0	0	111.4	I103 E104 G108 R109 R110 S398	I103-D106 HydrophobicContact CB-CB 4.41Å; I103-D106 HydrophobicContact CG2-CB 4.37Å; E104-D106 PolarHBondContact O-N 2.86Å; D106-G108 PolarHBondContact O-N 2.76Å; D106-G108 PolarHBondContact OD1-N 3.29Å; D106-R109 HydrophobicContact CB-CB 4.37Å; D106-R109 HydrophobicContact CB-CG 4.32Å; D106-R109 PolarHBondContact O-N 3.4Å; D106-R109 PolarHBondContact OD2-N 3.41Å; D106-R109 VanDerWaalsContact OD2-N 3.16Å; D106-R110 PolarHBondContact O-N 3.13Å; D106-S398 WeakPolarHBondContact OD1-CB 3.4Å; D106-S398 PolarHBondContact OD1-N 3.16Å; D106-S398 PolarHBondContact OD1-OG 3.21Å
107	V	82.8	Confident	78.2	Confident	33 Å²	33	72.1 Å²	72.1	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-69.3	-24.7	178	-175.8	0	0	0	0	111	R110 A111 P396 S398 D412	V107-R110 PolarHBondContact O-N 2.71Å; V107-A111 WeakPolarHBondContact O-CB 3.4Å; V107-A111 PolarHBondContact O-N 2.86Å; V107-P396 HydrophobicContact CB-CB 4.48Å; V107-P396 HydrophobicContact CB-CG 4.49Å; V107-P396 HydrophobicContact CG1-CB 3.82Å; V107-P396 HydrophobicContact CG1-CG 3.61Å; V107-S398 PolarHBondContact N-OG 3.31Å; V107-D412 HydrophobicContact CB-CB 4.38Å; V107-D412 HydrophobicContact CG2-CB 3.66Å; V107-D412 WeakPolarHBondContact CG2-OD2 3.45Å
108	G	77	Confident	77.7	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-48.8	171.4	0	0	0	0	0	112.1	D106 A111 E112 R395 P396	D106-G108 PolarHBondContact O-N 2.76Å; D106-G108 PolarHBondContact OD1-N 3.29Å; G108-A111 PolarHBondContact O-N 2.71Å; G108-E112 WeakPolarHBondContact O-CG 3.5Å; G108-E112 PolarHBondContact O-N 2.87Å; G108-R395 PolarHBondContact O-NH1 3.22Å; G108-P396 WeakPolarHBondContact CA-O 3.41Å
109	R	79.8	Confident	77.2	Confident	105 Å²	105	65.6 Å²	65.6	40%	0.396	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-40.2	173.3	-76	178.5	170.2	165.4	-3.1	113.5	E102 D106 A111 E112 M113	E102-R109 VanDerWaalsContact CD-NH1 3.27Å; E102-R109 IonicContact OE1-CZ 3.83Å; E102-R109 IonicContact OE1-NH1 3.72Å; E102-R109 IonicContact OE1-NH2 3.12Å; E102-R109 PolarHBondContact OE1-NH2 2.88Å; E102-R109 IonicContact OE2-CZ 2.59Å; E102-R109 IonicContact OE2-NH1 3.31Å; E102-R109 PolarHBondContact OE2-NH1 2.92Å; E102-R109 IonicContact OE2-NH2 3.53Å; E102-R109 PolarHBondContact OE2-NH2 3.17Å; D106-R109 HydrophobicContact CB-CB 4.37Å; D106-R109 HydrophobicContact CB-CG 4.32Å; D106-R109 PolarHBondContact O-N 3.4Å; D106-R109 PolarHBondContact OD2-N 3.41Å; D106-R109 VanDerWaalsContact OD2-N 3.16Å; R109-A111 VanDerWaalsContact C-N 3.32Å; R109-E112 PolarHBondContact O-N 2.82Å; R109-M113 WeakPolarHBondContact O-CB 3.46Å; R109-M113 PolarHBondContact O-N 3.23Å
110	R	80.7	Confident	77.2	Confident	125 Å²	125	66.2 Å²	66.2	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-39.2	175.2	-68.6	-178.1	179.6	-168.2	-2.5	111.7	D105 D106 V107 M113 N114	D105-R110 IonicContact OD1-CZ 2.73Å; D105-R110 IonicContact OD1-NE 2.86Å; D105-R110 PolarHBondContact OD1-NE 3.23Å; D105-R110 IonicContact OD1-NH2 2.75Å; D105-R110 PolarHBondContact OD1-NH2 3.17Å; D105-R110 IonicContact OD2-CZ 2.96Å; D105-R110 IonicContact OD2-NH2 2.71Å; D105-R110 PolarHBondContact OD2-NH2 3.27Å; D106-R110 PolarHBondContact O-N 3.13Å; V107-R110 PolarHBondContact O-N 2.71Å; R110-M113 PolarHBondContact O-N 3.41Å; R110-N114 WeakPolarHBondContact O-CB 3.29Å; R110-N114 VanDerWaalsContact O-CG 3.27Å; R110-N114 PolarHBondContact O-N 2.8Å
111	A	76.6	Confident	77.2	Confident	25 Å²	25	63.3 Å²	63.3	21%	0.207	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-41.7	176.2	0	0	0	0	0	111.8	V107 G108 R109 N114 E115 R395 P396	V107-A111 WeakPolarHBondContact O-CB 3.4Å; V107-A111 PolarHBondContact O-N 2.86Å; G108-A111 PolarHBondContact O-N 2.71Å; R109-A111 VanDerWaalsContact C-N 3.32Å; A111-N114 PolarHBondContact O-N 2.89Å; A111-E115 PolarHBondContact O-N 3.19Å; A111-R395 HydrophobicContact CB-CG 3.85Å; A111-P396 HydrophobicContact CB-CG 3.89Å
112	E	76.9	Confident	77.1	Confident	89 Å²	89	68.9 Å²	68.9	42%	0.416	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-44.4	172	-71.1	170.6	-174.7	0	0	111.4	G108 R109 N114 E115 V116 R395	G108-E112 WeakPolarHBondContact O-CG 3.5Å; G108-E112 PolarHBondContact O-N 2.87Å; R109-E112 PolarHBondContact O-N 2.82Å; E112-N114 PolarHBondContact O-N 3.07Å; E112-E115 WeakPolarHBondContact O-CB 3.38Å; E112-E115 PolarHBondContact O-N 2.87Å; E112-V116 WeakPolarHBondContact O-CG2 3.4Å; E112-V116 PolarHBondContact O-N 3.44Å; E112-R395 IonicContact OE1-CZ 2.82Å; E112-R395 IonicContact OE1-NH1 2.59Å; E112-R395 PolarHBondContact OE1-NH1 3.28Å; E112-R395 IonicContact OE1-NH2 2.91Å; E112-R395 PolarHBondContact OE1-NH2 2.84Å
113	M	73.4	Confident	77	Confident	116 Å²	116	66.8 Å²	66.8	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-63.1	-41.9	176.2	-175.4	176.4	68.1	0	0	112.2	R109 R110 E115 V116 V117	R109-M113 WeakPolarHBondContact O-CB 3.46Å; R109-M113 PolarHBondContact O-N 3.23Å; R110-M113 PolarHBondContact O-N 3.41Å; M113-E115 VanDerWaalsContact C-N 3.29Å; M113-E115 PolarHBondContact O-N 2.94Å; M113-V116 WeakPolarHBondContact O-CB 3.45Å; M113-V116 PolarHBondContact O-N 2.79Å; M113-V117 WeakPolarHBondContact O-CG2 3.3Å; M113-V117 PolarHBondContact O-N 3.22Å
114	N	74.8	Confident	77.1	Confident	93 Å²	93	70.5 Å²	70.5	50%	0.497	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.5	-73.7	-12.7	0	0	0	111.6	R110 A111 E112 V117 E118	R110-N114 WeakPolarHBondContact O-CB 3.29Å; R110-N114 VanDerWaalsContact O-CG 3.27Å; R110-N114 PolarHBondContact O-N 2.8Å; A111-N114 PolarHBondContact O-N 2.89Å; E112-N114 PolarHBondContact O-N 3.07Å; N114-V117 PolarHBondContact O-N 2.98Å; N114-E118 WeakPolarHBondContact O-CG 3.23Å; N114-E118 PolarHBondContact O-N 2.88Å
115	E	71.4	Confident	77.6	Confident	58 Å²	58	67.4 Å²	67.4	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-39.8	173.5	175.3	165.1	-156.4	0	0	112	A111 E112 M113 V117 E118 Q119 K393	A111-E115 PolarHBondContact O-N 3.19Å; E112-E115 WeakPolarHBondContact O-CB 3.38Å; E112-E115 PolarHBondContact O-N 2.87Å; M113-E115 VanDerWaalsContact C-N 3.29Å; M113-E115 PolarHBondContact O-N 2.94Å; E115-V117 VanDerWaalsContact C-N 3.31Å; E115-V117 PolarHBondContact O-N 2.92Å; E115-E118 PolarHBondContact O-N 2.78Å; E115-Q119 WeakPolarHBondContact O-CB 3.25Å; E115-Q119 WeakPolarHBondContact O-CG 3.39Å; E115-Q119 PolarHBondContact O-N 2.77Å; E115-Q119 PolarHBondContact OE1-NE2 2.74Å; E115-K393 IonicContact OE1-NZ 3.13Å; E115-K393 PolarHBondContact OE1-NZ 2.98Å; E115-K393 IonicContact OE2-NZ 3.23Å; E115-K393 PolarHBondContact OE2-NZ 3.42Å
116	V	68.3	Low	78.1	Confident	72 Å²	72	69.7 Å²	69.7	44%	0.436	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-43.5	172.1	175.7	0	0	0	0	110.4	E112 M113 E118 Q119 T120	E112-V116 WeakPolarHBondContact O-CG2 3.4Å; E112-V116 PolarHBondContact O-N 3.44Å; M113-V116 WeakPolarHBondContact O-CB 3.45Å; M113-V116 PolarHBondContact O-N 2.79Å; V116-E118 VanDerWaalsContact C-N 3.35Å; V116-E118 PolarHBondContact O-N 2.94Å; V116-Q119 CarbonylContact O-C 3.58Å; V116-Q119 WeakPolarHBondContact O-CA 3.35Å; V116-Q119 WeakPolarHBondContact O-CB 3.29Å; V116-Q119 PolarHBondContact O-N 2.82Å; V116-T120 HydrophobicContact CG1-CG2 4.28Å; V116-T120 WeakPolarHBondContact O-CG2 3.38Å; V116-T120 PolarHBondContact O-N 2.75Å; V116-T120 PolarHBondContact O-OG1 2.85Å
117	V	68.9	Low	78.4	Confident	88 Å²	88	68.1 Å²	68.1	53%	0.533	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.9	174.2	0	0	0	0	111.6	M113 N114 E115 Q119 T120	M113-V117 WeakPolarHBondContact O-CG2 3.3Å; M113-V117 PolarHBondContact O-N 3.22Å; N114-V117 PolarHBondContact O-N 2.98Å; E115-V117 VanDerWaalsContact C-N 3.31Å; E115-V117 PolarHBondContact O-N 2.92Å; V117-Q119 PolarHBondContact O-N 3.28Å; V117-T120 WeakPolarHBondContact CA-OG1 3.43Å; V117-T120 PolarHBondContact O-N 2.98Å; V117-T120 PolarHBondContact O-OG1 3.11Å
118	E	68.3	Low	78.6	Confident	141 Å²	141	71.7 Å²	71.7	66%	0.659	35%	0.353	S	S	*	.	H	α-helix	trans	-64.5	-24.6	173.8	-74	-179.2	-174.8	0	0	113.2	N114 E115 V116	N114-E118 WeakPolarHBondContact O-CG 3.23Å; N114-E118 PolarHBondContact O-N 2.88Å; E115-E118 PolarHBondContact O-N 2.78Å; V116-E118 VanDerWaalsContact C-N 3.35Å; V116-E118 PolarHBondContact O-N 2.94Å
119	Q	69.4	Low	78.8	Confident	62 Å²	62	76.3 Å²	76.3	29%	0.29	39%	0.385	S	S	.	.	H	α-helix	trans	-90.1	-19	177.2	-69.6	174.9	11.5	0	0	113.3	E115 V116 V117	E115-Q119 WeakPolarHBondContact O-CB 3.25Å; E115-Q119 WeakPolarHBondContact O-CG 3.39Å; E115-Q119 PolarHBondContact O-N 2.77Å; E115-Q119 PolarHBondContact OE1-NE2 2.74Å; V116-Q119 CarbonylContact O-C 3.58Å; V116-Q119 WeakPolarHBondContact O-CA 3.35Å; V116-Q119 WeakPolarHBondContact O-CB 3.29Å; V116-Q119 PolarHBondContact O-N 2.82Å; V117-Q119 PolarHBondContact O-N 3.28Å
120	T	73.9	Confident	78.5	Confident	30 Å²	30	71.7 Å²	71.7	18%	0.184	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.2	174.4	55.5	0	0	0	0	110.7	V116 V117 A295 R296	V116-T120 HydrophobicContact CG1-CG2 4.28Å; V116-T120 WeakPolarHBondContact O-CG2 3.38Å; V116-T120 PolarHBondContact O-N 2.75Å; V116-T120 PolarHBondContact O-OG1 2.85Å; V117-T120 WeakPolarHBondContact CA-OG1 3.43Å; V117-T120 PolarHBondContact O-N 2.98Å; V117-T120 PolarHBondContact O-OG1 3.11Å; T120-A295 WeakPolarHBondContact CA-O 3.38Å; T120-R296 HydrophobicContact CG2-CB 4.18Å
121	S	81.2	Confident	78.2	Confident	36 Å²	36	70.6 Å²	70.6	25%	0.252	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.2	172.5	-61.6	0	0	0	0	109.7	A295	S121-A295 PolarHBondContact N-O 2.92Å; S121-A295 PolarHBondContact O-N 3.23Å; S121-A295 VanDerWaalsContact O-N 3.15Å
122	E	84.4	Confident	77.9	Confident	130 Å²	130	72.3 Å²	72.3	61%	0.607	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	117	167.3	-171.2	176.8	171.1	0	0	109.2	M292 M293 L294	E122-M292 HydrophobicContact CG-CG 4.35Å; E122-M293 WeakPolarHBondContact CA-O 3.08Å; E122-L294 HydrophobicContact CB-CD2 3.67Å; E122-L294 HydrophobicContact CG-CD2 3.78Å
123	I	84.2	Confident	77.6	Confident	17 Å²	17	77.5 Å²	77.5	9%	0.087	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.7	-178	-57.7	172.3	0	0	0	108.4	E143 L147 M292 M293	I123-E143 HydrophobicContact CD1-CB 4.48Å; I123-L147 HydrophobicContact CD1-CD1 3.65Å; I123-M292 CarbonylContact O-C 3.51Å; I123-M292 WeakPolarHBondContact O-CA 3.28Å; I123-M293 HydrophobicContact CB-CG 3.81Å; I123-M293 HydrophobicContact CG2-CG 4.48Å; I123-M293 PolarHBondContact N-O 2.99Å; I123-M293 PolarHBondContact O-N 2.78Å
124	I	87.9	Confident	77.8	Confident	89 Å²	89	79.2 Å²	79.2	46%	0.456	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.7	173.6	-58.6	173.7	0	0	0	108.5	F126 F290 L291 M292	I124-F126 HydrophobicContact CG2-CE2 4.09Å; I124-F126 HydrophobicContact CG2-CZ 4.27Å; I124-F290 HydrophobicContact CG2-CB 4.02Å; I124-F290 HydrophobicContact CG2-CD2 3.8Å; I124-F290 HydrophobicContact CG2-CG 4.1Å; I124-L291 CarbonylContact C-O 3.5Å; I124-L291 WeakPolarHBondContact CA-O 3.32Å; I124-M292 HydrophobicContact CG1-CG 4.39Å
125	T	87.9	Confident	78.4	Confident	14 Å²	14	75 Å²	75	9%	0.086	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	112.5	179.2	-57.1	0	0	0	0	109.7	F138 E139 F290 L291	T125-F138 HydrophobicContact CG2-CB 4.05Å; T125-F138 HydrophobicContact CG2-CD1 4.27Å; T125-F138 WeakPolarHBondContact O-CD1 3.42Å; T125-E139 VanDerWaalsContact CG2-O 3.24Å; T125-E139 WeakPolarHBondContact CG2-O 3.36Å; T125-F290 CarbonylContact O-C 3.58Å; T125-F290 VanDerWaalsContact O-CA 3.27Å; T125-F290 WeakPolarHBondContact O-CA 3.37Å; T125-L291 PolarHBondContact N-O 2.84Å; T125-L291 PolarHBondContact O-N 2.86Å
126	F	89.5	Confident	79.4	Confident	107 Å²	107	72.3 Å²	72.3	47%	0.469	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.8	176.1	-71.8	-82.9	0	0	0	111.6	I124 R288 F290	I124-F126 HydrophobicContact CG2-CE2 4.09Å; I124-F126 HydrophobicContact CG2-CZ 4.27Å; F126-R288 HydrophobicContact CD1-CB 4.41Å; F126-R288 HydrophobicContact CD1-CG 4.17Å; F126-F290 HydrophobicContact CD1-CB 3.82Å; F126-F290 HydrophobicContact CE1-CB 4.05Å; F126-F290 HydrophobicContact CE1-CD1 4.25Å; F126-F290 HydrophobicContact CE1-CG 4.42Å; F126-F290 HydrophobicContact CG-CB 4.33Å
127	A	89.6	Confident	80.5	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.365	C	S	.	.			trans	-69.4	139.2	178.7	0	0	0	0	0	112.3	L136 H137 F138 R288 P289	A127-L136 HydrophobicContact CB-CB 3.93Å; A127-L136 HydrophobicContact CB-CD1 4.01Å; A127-L136 HydrophobicContact CB-CD2 3.89Å; A127-L136 HydrophobicContact CB-CG 4.16Å; A127-H137 CarbonylContact C-O 3.6Å; A127-H137 WeakPolarHBondContact CA-O 3.23Å; A127-F138 HydrophobicContact CB-CD1 4.17Å; A127-F138 HydrophobicContact CB-CE1 3.53Å; A127-F138 HydrophobicContact CB-CZ 3.76Å; A127-R288 VanDerWaalsContact O-CZ 3.23Å; A127-R288 PolarHBondContact O-NE 3.13Å; A127-R288 PolarHBondContact O-NH2 2.7Å; A127-P289 HydrophobicContact CB-CB 3.95Å; A127-P289 WeakPolarHBondContact CB-O 3.23Å; A127-P289 PolarHBondContact N-O 2.82Å
128	E	87.2	Confident	81.6	Confident	108 Å²	108	66.7 Å²	66.7	51%	0.505	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	166.3	165.9	-61.2	-170.6	171.4	0	0	111.4	G130 H137 L257	E128-G130 PolarHBondContact O-N 3.43Å; E128-G130 VanDerWaalsContact O-N 3.17Å; E128-H137 HydrophobicContact CB-CB 4.22Å; E128-H137 PolarHBondContact N-O 3.46Å; E128-H137 PolarHBondContact O-N 2.96Å; E128-L257 WeakPolarHBondContact O-CD1 3.41Å
129	S	81.3	Confident	82.7	Confident	98 Å²	98	64.1 Å²	64.1	69%	0.685	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	107.5	-176.7	-179.5	0	0	0	0	109.6	L257	S129-L257 VanDerWaalsContact CA-CD1 3.49Å
130	G	73.3	Confident	83.5	Confident	8 Å²	8	61.2 Å²	61.2	8%	0.082	31%	0.314	C	S	.	.			trans	-75.1	166.5	174.5	0	0	0	0	0	113.2	E128 T135	E128-G130 PolarHBondContact O-N 3.43Å; E128-G130 VanDerWaalsContact O-N 3.17Å; G130-T135 WeakPolarHBondContact CA-O 3.28Å; G130-T135 PolarHBondContact N-O 3.47Å
131	T	73.1	Confident	83.7	Confident	101 Å²	101	62.7 Å²	62.7	62%	0.62	33%	0.326	S	S	*	.	S	Bend	trans	-120.5	113.5	171.1	53.4	0	0	0	0	109.2	R201	T131-R201 PolarHBondContact O-NH1 3.48Å
132	P	70.9	Confident	83	Confident	61 Å²	61	69 Å²	69	40%	0.396	35%	0.349	S	S	.	.	S	Bend	cis	-89.1	177	24.7	36.1	-39.9	0	0	0	116	T135	P132-T135 WeakPolarHBondContact O-CB 3.09Å; P132-T135 PolarHBondContact O-N 3.31Å; P132-T135 PolarHBondContact O-OG1 3.27Å
133	K	70.1	Confident	81.9	Confident	199 Å²	199	68.4 Å²	68.4	87%	0.865	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	142.3	175.6	-69.6	179.8	178.8	174.4	0	111.5	T135	K133-T135 VanDerWaalsContact C-N 3.35Å
134	K	78.4	Confident	80.6	Confident	151 Å²	151	67.6 Å²	67.6	66%	0.657	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	23.4	-173.8	-52.6	-176.5	178.9	-177.7	0	115.4	I242 L256	K134-I242 PolarHBondContact O-N 2.83Å; K134-L256 HydrophobicContact CB-CD1 4Å; K134-L256 HydrophobicContact CG-CD1 4.24Å
135	T	88.1	Confident	79.1	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.4	172.7	-46	0	0	0	0	109.2	G130 P132 K133 D239 V240	G130-T135 WeakPolarHBondContact CA-O 3.28Å; G130-T135 PolarHBondContact N-O 3.47Å; P132-T135 WeakPolarHBondContact O-CB 3.09Å; P132-T135 PolarHBondContact O-N 3.31Å; P132-T135 PolarHBondContact O-OG1 3.27Å; K133-T135 VanDerWaalsContact C-N 3.35Å; T135-D239 HydrophobicContact CG2-CB 4.17Å; T135-V240 CarbonylContact C-O 3.47Å; T135-V240 WeakPolarHBondContact CA-O 3.31Å
136	L	91.1	Very high	77.9	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.6	171.6	-61.8	-174.9	0	0	0	108.6	A127 F138 L157 V240 I242 L256 L257 P289	A127-L136 HydrophobicContact CB-CB 3.93Å; A127-L136 HydrophobicContact CB-CD1 4.01Å; A127-L136 HydrophobicContact CB-CD2 3.89Å; A127-L136 HydrophobicContact CB-CG 4.16Å; L136-F138 HydrophobicContact CB-CD2 4.44Å; L136-F138 HydrophobicContact CB-CE2 3.7Å; L136-F138 HydrophobicContact CB-CZ 4.01Å; L136-F138 HydrophobicContact CD1-CE2 4.29Å; L136-F138 HydrophobicContact CD1-CZ 3.94Å; L136-L157 HydrophobicContact CD1-CD2 3.89Å; L136-V240 PolarHBondContact N-O 2.53Å; L136-V240 PolarHBondContact O-N 2.83Å; L136-I242 HydrophobicContact CD1-CD1 3.43Å; L136-I242 VanDerWaalsContact CD1-CD1 3.43Å; L136-I242 HydrophobicContact CG-CD1 3.84Å; L136-L256 HydrophobicContact CD1-CD2 4.35Å; L136-L256 HydrophobicContact CD2-CB 4.09Å; L136-L256 HydrophobicContact CD2-CD2 4.23Å; L136-L256 HydrophobicContact CG-CD2 4.42Å; L136-L257 HydrophobicContact CD2-CG 4.48Å; L136-P289 HydrophobicContact CD1-CB 3.61Å; L136-P289 HydrophobicContact CD1-CG 3.88Å; L136-P289 HydrophobicContact CD2-CG 4.47Å
137	H	92.8	Very high	76.7	Confident	41 Å²	41	64 Å²	64	19%	0.19	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.9	175.2	-178.9	73.5	0	0	0	109.3	A127 E128 E139 S237 D239	A127-H137 CarbonylContact C-O 3.6Å; A127-H137 WeakPolarHBondContact CA-O 3.23Å; E128-H137 HydrophobicContact CB-CB 4.22Å; E128-H137 PolarHBondContact N-O 3.46Å; E128-H137 PolarHBondContact O-N 2.96Å; H137-E139 IonicContact NE2-OE2 3.29Å; H137-S237 PolarHBondContact CE1-OG 3.43Å; H137-D239 IonicContact CE1-OD1 3Å; H137-D239 IonicContact CG-OD1 3.46Å; H137-D239 IonicContact ND1-OD1 3.41Å; H137-D239 PolarHBondContact ND1-OD1 3.14Å
138	F	91.3	Very high	75.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	117.3	174.6	-58.7	-85.7	0	0	0	109	T125 A127 L136 V155 L238 V240 L291	T125-F138 HydrophobicContact CG2-CB 4.05Å; T125-F138 HydrophobicContact CG2-CD1 4.27Å; T125-F138 WeakPolarHBondContact O-CD1 3.42Å; A127-F138 HydrophobicContact CB-CD1 4.17Å; A127-F138 HydrophobicContact CB-CE1 3.53Å; A127-F138 HydrophobicContact CB-CZ 3.76Å; L136-F138 HydrophobicContact CB-CD2 4.44Å; L136-F138 HydrophobicContact CB-CE2 3.7Å; L136-F138 HydrophobicContact CB-CZ 4.01Å; L136-F138 HydrophobicContact CD1-CE2 4.29Å; L136-F138 HydrophobicContact CD1-CZ 3.94Å; F138-V155 HydrophobicContact CZ-CG1 4.2Å; F138-L238 HydrophobicContact CB-CB 4.28Å; F138-L238 HydrophobicContact CD2-CD2 4.46Å; F138-L238 PolarHBondContact N-O 3.18Å; F138-L238 PolarHBondContact O-N 2.95Å; F138-V240 HydrophobicContact CD2-CG2 3.97Å; F138-V240 HydrophobicContact CE2-CB 4.18Å; F138-V240 HydrophobicContact CE2-CG2 3.85Å; F138-L291 HydrophobicContact CD1-CB 3.78Å; F138-L291 HydrophobicContact CE1-CB 3.96Å; F138-L291 HydrophobicContact CG-CB 4.29Å
139	E	90.6	Very high	75.5	Confident	88 Å²	88	62 Å²	62	41%	0.411	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	100.6	171.5	-168.9	60.3	-147.9	0	0	108.5	T125 H137 S141 S236 S237	T125-E139 VanDerWaalsContact CG2-O 3.24Å; T125-E139 WeakPolarHBondContact CG2-O 3.36Å; H137-E139 IonicContact NE2-OE2 3.29Å; E139-S141 PolarHBondContact O-N 3.28Å; E139-S236 PolarHBondContact OE1-OG 3.39Å; E139-S237 WeakPolarHBondContact OE2-CB 3.49Å; E139-S237 PolarHBondContact OE2-OG 3.22Å
140	I	86.5	Confident	75.8	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.297	C	S	.	.			trans	-68.8	130.3	-179.3	-57.8	171	0	0	0	107.9	V227 L230 L231 S236 L291 M293	I140-V227 HydrophobicContact CD1-CG1 4.14Å; I140-L230 HydrophobicContact CD1-CD2 4.04Å; I140-L231 HydrophobicContact CD1-CD2 4.39Å; I140-S236 VanDerWaalsContact CB-O 3.32Å; I140-S236 WeakPolarHBondContact CB-O 3.44Å; I140-S236 WeakPolarHBondContact CG1-O 3.27Å; I140-S236 PolarHBondContact N-O 3.1Å; I140-S236 WeakPolarHBondContact O-CB 3.42Å; I140-L291 HydrophobicContact CD1-CD2 4.1Å; I140-L291 HydrophobicContact CG1-CD2 4.06Å; I140-M293 HydrophobicContact CD1-SD 4.5Å; I140-M293 HydrophobicContact CG2-SD 3.86Å
141	S	78.6	Confident	76.5	Confident	61 Å²	61	62.1 Å²	62.1	43%	0.427	31%	0.314	S	S	.	.			trans	-52.6	147.1	179.3	179.7	0	0	0	0	111.1	E139 E143 G144 S145	E139-S141 PolarHBondContact O-N 3.28Å; S141-E143 PolarHBondContact O-N 3.04Å; S141-E143 VanDerWaalsContact O-N 3.11Å; S141-E143 PolarHBondContact OG-N 2.89Å; S141-G144 WeakPolarHBondContact O-CA 3.41Å; S141-G144 PolarHBondContact O-N 3.3Å; S141-S145 PolarHBondContact O-N 3.24Å
142	K	66.3	Low	77.3	Confident	169 Å²	169	60.2 Å²	60.2	74%	0.735	30%	0.298	S	S	*	.	H	α-helix	trans	-56.7	-26.1	173.1	-69.6	-176.8	179.9	179.8	0	112.4	G144 S145 E146	K142-G144 PolarHBondContact O-N 3.27Å; K142-S145 WeakPolarHBondContact CA-OG 3.47Å; K142-S145 PolarHBondContact O-N 3.28Å; K142-S145 PolarHBondContact O-OG 3.47Å; K142-E146 PolarHBondContact O-N 3.04Å
143	E	62.1	Low	78.4	Confident	116 Å²	116	57.3 Å²	57.3	54%	0.542	28%	0.279	S	S	.	.	H	α-helix	trans	-50.2	-46.3	167.6	-157.2	93.1	-137.7	0	0	110.4	I123 S141 S145 E146 L147	I123-E143 HydrophobicContact CD1-CB 4.48Å; S141-E143 PolarHBondContact O-N 3.04Å; S141-E143 VanDerWaalsContact O-N 3.11Å; S141-E143 PolarHBondContact OG-N 2.89Å; E143-S145 PolarHBondContact O-N 3.34Å; E143-E146 PolarHBondContact O-N 2.87Å; E143-L147 VanDerWaalsContact O-CG 3.29Å; E143-L147 WeakPolarHBondContact O-CG 3.38Å
144	G	55.1	Low	79.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-70.3	-25.4	177.5	0	0	0	0	0	115.1	S141 K142 E146 L147	S141-G144 WeakPolarHBondContact O-CA 3.41Å; S141-G144 PolarHBondContact O-N 3.3Å; K142-G144 PolarHBondContact O-N 3.27Å; G144-E146 VanDerWaalsContact C-N 3.28Å; G144-E146 PolarHBondContact O-N 3.15Å; G144-L147 PolarHBondContact O-N 2.79Å
145	S	58.2	Low	80.5	Confident	51 Å²	51	42.1 Å²	42.1	36%	0.357	21%	0.214	S	C	.	.	H	α-helix	trans	-72.8	-20.2	176.3	69.7	0	0	0	0	113.7	S141 K142 E143	S141-S145 PolarHBondContact O-N 3.24Å; K142-S145 WeakPolarHBondContact CA-OG 3.47Å; K142-S145 PolarHBondContact O-N 3.28Å; K142-S145 PolarHBondContact O-OG 3.47Å; E143-S145 PolarHBondContact O-N 3.34Å
146	E	61.4	Low	80.8	Confident	78 Å²	78	44.9 Å²	44.9	36%	0.364	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-7.4	174.4	-63.1	-171.6	-170.7	0	0	113.1	K142 E143 G144 S148 R304	K142-E146 PolarHBondContact O-N 3.04Å; E143-E146 PolarHBondContact O-N 2.87Å; G144-E146 VanDerWaalsContact C-N 3.28Å; G144-E146 PolarHBondContact O-N 3.15Å; E146-S148 PolarHBondContact O-N 2.89Å; E146-R304 IonicContact OE1-CZ 2.73Å; E146-R304 VanDerWaalsContact OE1-CZ 3.31Å; E146-R304 IonicContact OE1-NE 3.43Å; E146-R304 IonicContact OE1-NH1 2.84Å; E146-R304 PolarHBondContact OE1-NH1 2.87Å; E146-R304 VanDerWaalsContact OE1-NH1 3.12Å; E146-R304 IonicContact OE1-NH2 2.83Å; E146-R304 WeakPolarHBondContact OE2-CD 3.48Å; E146-R304 IonicContact OE2-CZ 3.4Å; E146-R304 VanDerWaalsContact OE2-CZ 3.29Å; E146-R304 IonicContact OE2-NE 3.76Å; E146-R304 IonicContact OE2-NH1 2.64Å; E146-R304 PolarHBondContact OE2-NH1 2.89Å
147	L	64	Low	81	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	22%	0.223	C	C	.	.			trans	-87.3	111.7	-178.6	-52.3	176.6	0	0	0	109.6	I123 E143 G144 A295 R296 Q297	I123-L147 HydrophobicContact CD1-CD1 3.65Å; E143-L147 VanDerWaalsContact O-CG 3.29Å; E143-L147 WeakPolarHBondContact O-CG 3.38Å; G144-L147 PolarHBondContact O-N 2.79Å; L147-A295 HydrophobicContact CB-CB 3.64Å; L147-A295 HydrophobicContact CD1-CB 3.49Å; L147-A295 VanDerWaalsContact CD1-CB 3.49Å; L147-A295 HydrophobicContact CG-CB 4.15Å; L147-R296 CarbonylContact C-O 3.53Å; L147-Q297 HydrophobicContact CD2-CG 3.71Å
148	S	67.7	Low	81	Confident	28 Å²	28	43.8 Å²	43.8	20%	0.196	22%	0.218	C	C	.	.			trans	-94.2	5.2	-167.3	-63.6	0	0	0	0	113.7	E146 R296	E146-S148 PolarHBondContact O-N 2.89Å; S148-R296 PolarHBondContact N-O 2.87Å; S148-R296 VanDerWaalsContact N-O 3.15Å
149	V	83.9	Confident	81	Confident	39 Å²	39	43.8 Å²	43.8	24%	0.236	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	124.1	162.4	-176	0	0	0	0	110.6	A295 R296 A298	V149-A295 CarbonylContact O-C 3.48Å; V149-A295 VanDerWaalsContact O-CA 3.32Å; V149-A295 WeakPolarHBondContact O-CA 3.45Å; V149-A295 WeakPolarHBondContact O-CB 3.42Å; V149-R296 HydrophobicContact CB-CG 3.74Å; V149-R296 HydrophobicContact CG1-CG 4.42Å; V149-R296 HydrophobicContact CG2-CG 4.48Å; V149-R296 PolarHBondContact N-O 2.84Å; V149-R296 VanDerWaalsContact N-O 3.13Å; V149-R296 PolarHBondContact O-N 3.02Å; V149-A298 HydrophobicContact CG2-CB 4.01Å
150	V	88.8	Confident	81	Confident	13 Å²	13	43.5 Å²	43.5	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	111.7	168.6	-177.3	0	0	0	0	108	A153 V227 Q228 L231 M293	V150-A153 HydrophobicContact CG1-CB 4.04Å; V150-V227 HydrophobicContact CG2-CG1 4.28Å; V150-Q228 HydrophobicContact CB-CB 4.22Å; V150-Q228 HydrophobicContact CG2-CB 4.2Å; V150-L231 HydrophobicContact CG2-CD1 3.64Å; V150-M293 HydrophobicContact CG2-CE 4.12Å
151	E	87.2	Confident	81.2	Confident	94 Å²	94	44.4 Å²	44.4	44%	0.439	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-39	174.6	-64	-169	155.5	0	0	110.6	L294 R296	E151-L294 PolarHBondContact N-O 3.13Å; E151-R296 HydrophobicContact CG-CG 4.34Å; E151-R296 WeakPolarHBondContact OE1-CD 3.49Å; E151-R296 IonicContact OE1-NE 2.86Å
152	H	89.9	Confident	81.4	Confident	62 Å²	62	46 Å²	46	29%	0.287	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	137.2	-172.8	-172.2	-110.9	0	0	0	111.2	E154 M293 L294	H152-E154 WeakPolarHBondContact CE1-CG 3.32Å; H152-E154 IonicContact CE1-OE1 3.54Å; H152-E154 PolarHBondContact CE1-OE1 3.39Å; H152-E154 IonicContact CE1-OE2 3.96Å; H152-E154 IonicContact NE2-OE1 2.64Å; H152-E154 PolarHBondContact NE2-OE1 3.42Å; H152-M293 CarbonylContact O-C 3.52Å; H152-M293 VanDerWaalsContact O-CA 3.23Å; H152-M293 WeakPolarHBondContact O-CA 3.21Å; H152-L294 HydrophobicContact CB-CB 4.13Å; H152-L294 HydrophobicContact CB-CD1 4.2Å; H152-L294 HydrophobicContact CB-CG 4.45Å; H152-L294 PolarHBondContact N-O 3.15Å; H152-L294 PolarHBondContact O-N 3.33Å
153	A	94.1	Very high	81.7	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	139.4	169.6	0	0	0	0	0	112.5	V150 V223 S224 V227 L291 M292 M293	V150-A153 HydrophobicContact CG1-CB 4.04Å; A153-V223 HydrophobicContact CB-CG2 4.13Å; A153-V223 PolarHBondContact O-N 2.89Å; A153-S224 PolarHBondContact N-OG 3.2Å; A153-S224 PolarHBondContact O-N 3.03Å; A153-S224 PolarHBondContact O-OG 3.46Å; A153-V227 HydrophobicContact CB-CB 4.09Å; A153-V227 HydrophobicContact CB-CG1 4.41Å; A153-V227 HydrophobicContact CB-CG2 3.92Å; A153-L291 HydrophobicContact CB-CD1 4.42Å; A153-M292 CarbonylContact C-O 3.58Å; A153-M292 VanDerWaalsContact CA-O 3.28Å; A153-M292 WeakPolarHBondContact CA-O 3.45Å; A153-M293 HydrophobicContact CB-CB 3.78Å
154	E	96.2	Very high	81.7	Confident	30 Å²	30	44.5 Å²	44.5	14%	0.14	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	136.1	-173.5	-64.8	-179.2	148.6	0	0	112.2	H152 W156 I220 F221 L291 M292	H152-E154 WeakPolarHBondContact CE1-CG 3.32Å; H152-E154 IonicContact CE1-OE1 3.54Å; H152-E154 PolarHBondContact CE1-OE1 3.39Å; H152-E154 IonicContact CE1-OE2 3.96Å; H152-E154 IonicContact NE2-OE1 2.64Å; H152-E154 PolarHBondContact NE2-OE1 3.42Å; E154-W156 PolarHBondContact OE2-NE1 3.49Å; E154-I220 HydrophobicContact CB-CG2 3.77Å; E154-I220 HydrophobicContact CG-CG2 3.73Å; E154-I220 VanDerWaalsContact OE1-CG2 3.23Å; E154-I220 WeakPolarHBondContact OE1-CG2 3.46Å; E154-I220 VanDerWaalsContact OE2-CG2 3.25Å; E154-I220 WeakPolarHBondContact OE2-CG2 3.39Å; E154-F221 CarbonylContact C-O 3.6Å; E154-F221 WeakPolarHBondContact CA-O 3.47Å; E154-L291 CarbonylContact O-C 3.56Å; E154-L291 WeakPolarHBondContact O-CA 3.3Å; E154-M292 PolarHBondContact N-O 3.31Å; E154-M292 PolarHBondContact O-N 3.46Å; E154-M292 WeakPolarHBondContact OE2-CE 3.5Å
155	V	96.3	Very high	82.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.7	167.5	179	0	0	0	0	109.3	F138 L157 L175 F221 V223 L291	F138-V155 HydrophobicContact CZ-CG1 4.2Å; V155-L157 HydrophobicContact CG1-CD2 3.87Å; V155-L157 HydrophobicContact CG1-CG 4.07Å; V155-L175 HydrophobicContact CB-CD2 3.84Å; V155-L175 HydrophobicContact CG1-CD2 3.97Å; V155-L175 HydrophobicContact CG2-CD2 4.11Å; V155-F221 HydrophobicContact CB-CB 4.38Å; V155-F221 PolarHBondContact N-O 2.64Å; V155-F221 PolarHBondContact O-N 3.4Å; V155-V223 HydrophobicContact CG2-CG1 4.07Å; V155-V223 HydrophobicContact CG2-CG2 3.9Å; V155-L291 HydrophobicContact CG2-CD1 3.98Å
156	W	95.3	Very high	82.4	Confident	63 Å²	63	57.1 Å²	57.1	24%	0.239	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.2	178.8	-73.1	65.3	0	0	0	109.8	E154 W218 I220 P289 F290	E154-W156 PolarHBondContact OE2-NE1 3.49Å; W156-W218 HydrophobicContact CB-CE3 4.02Å; W156-W218 HydrophobicContact CB-CZ3 4.08Å; W156-W218 HydrophobicContact CE3-CB 4.13Å; W156-W218 HydrophobicContact CE3-CD2 4.39Å; W156-W218 HydrophobicContact CE3-CE3 4.31Å; W156-W218 HydrophobicContact CE3-CG 4.34Å; W156-W218 HydrophobicContact CZ3-CB 4.32Å; W156-I220 HydrophobicContact CD2-CG1 3.95Å; W156-I220 HydrophobicContact CE3-CG1 4.04Å; W156-I220 HydrophobicContact CH2-CD1 3.47Å; W156-I220 VanDerWaalsContact CH2-CD1 3.47Å; W156-I220 HydrophobicContact CH2-CG1 3.9Å; W156-I220 HydrophobicContact CZ2-CD1 3.46Å; W156-I220 VanDerWaalsContact CZ2-CD1 3.46Å; W156-I220 HydrophobicContact CZ2-CG1 3.78Å; W156-I220 HydrophobicContact CZ3-CD1 4.03Å; W156-I220 HydrophobicContact CZ3-CG1 4.02Å; W156-P289 WeakPolarHBondContact O-CA 3.48Å; W156-F290 HydrophobicContact CB-CD1 4.02Å; W156-F290 HydrophobicContact CB-CD2 4.05Å; W156-F290 HydrophobicContact CB-CE1 3.64Å; W156-F290 HydrophobicContact CB-CE2 3.69Å; W156-F290 HydrophobicContact CB-CG 4.21Å; W156-F290 HydrophobicContact CB-CZ 3.47Å; W156-F290 VanDerWaalsContact CB-CZ 3.47Å; W156-F290 AromaticContact CD1-CE2 3.55Å; W156-F290 HydrophobicContact CD2-CE1 4.43Å; W156-F290 AromaticContact CD2-CE2 3.83Å; W156-F290 HydrophobicContact CD2-CE2 3.83Å; W156-F290 AromaticContact CD2-CZ 3.53Å; W156-F290 HydrophobicContact CD2-CZ 3.53Å; W156-F290 AromaticContact CE3-CZ 3.82Å; W156-F290 HydrophobicContact CE3-CZ 3.82Å; W156-F290 HydrophobicContact CG-CD2 4.11Å; W156-F290 HydrophobicContact CG-CE1 4.09Å; W156-F290 AromaticContact CG-CE2 3.4Å; W156-F290 HydrophobicContact CG-CE2 3.4Å; W156-F290 AromaticContact CG-CZ 3.39Å; W156-F290 HydrophobicContact CG-CZ 3.39Å; W156-F290 PolarHBondContact N-O 3.05Å; W156-F290 PolarHBondContact O-N 3.41Å
157	L	94.7	Very high	82.7	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.9	178.4	-58.4	-178.9	0	0	0	110.5	L136 V155 I173 L175 H219 F221 I242 L254 P289	L136-L157 HydrophobicContact CD1-CD2 3.89Å; V155-L157 HydrophobicContact CG1-CD2 3.87Å; V155-L157 HydrophobicContact CG1-CG 4.07Å; L157-I173 HydrophobicContact CD1-CG2 4.45Å; L157-L175 HydrophobicContact CD1-CD1 3.95Å; L157-H219 PolarHBondContact N-O 3.29Å; L157-H219 PolarHBondContact O-N 3.2Å; L157-F221 HydrophobicContact CB-CD2 4.47Å; L157-F221 HydrophobicContact CB-CE2 4.06Å; L157-F221 HydrophobicContact CD1-CD2 4.05Å; L157-F221 HydrophobicContact CD1-CE2 3.77Å; L157-F221 HydrophobicContact CD1-CZ 4.35Å; L157-F221 HydrophobicContact CG-CD2 4.14Å; L157-F221 HydrophobicContact CG-CE2 4.07Å; L157-I242 HydrophobicContact CD1-CD1 3.74Å; L157-I242 HydrophobicContact CD1-CG1 4.25Å; L157-I242 HydrophobicContact CD1-CG2 4.27Å; L157-I242 HydrophobicContact CD2-CD1 3.73Å; L157-I242 HydrophobicContact CG-CD1 4.43Å; L157-L254 HydrophobicContact CB-CD2 4.29Å; L157-P289 HydrophobicContact CD2-CB 3.84Å; L157-P289 HydrophobicContact CD2-CG 4.04Å
158	F	92.6	Very high	82.7	Confident	18 Å²	18	65.9 Å²	65.9	8%	0.079	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.2	174	-169.1	-97.7	0	0	0	111.1	K160 W218 V255 H287	F158-K160 HydrophobicContact CD1-CB 4.43Å; F158-K160 HydrophobicContact CE1-CB 4.24Å; F158-W218 HydrophobicContact CB-CD2 4.12Å; F158-W218 HydrophobicContact CB-CE3 3.96Å; F158-W218 HydrophobicContact CB-CH2 4.12Å; F158-W218 HydrophobicContact CB-CZ2 4.26Å; F158-W218 HydrophobicContact CB-CZ3 3.96Å; F158-W218 AromaticContact CD2-CD1 3.84Å; F158-W218 AromaticContact CD2-CD2 3.85Å; F158-W218 HydrophobicContact CD2-CD2 3.85Å; F158-W218 AromaticContact CD2-CE2 3.74Å; F158-W218 AromaticContact CD2-CG 3.93Å; F158-W218 HydrophobicContact CD2-CG 3.93Å; F158-W218 HydrophobicContact CD2-CZ2 4.35Å; F158-W218 AromaticContact CD2-NE1 3.7Å; F158-W218 HydrophobicContact CG-CD2 4.49Å; F158-V255 HydrophobicContact CB-CB 4.38Å; F158-V255 HydrophobicContact CD1-CG2 3.78Å; F158-V255 PolarHBondContact O-N 2.77Å; F158-H287 HydrophobicContact CB-CB 3.82Å; F158-H287 HydrophobicContact CD1-CB 3.83Å; F158-H287 AromaticContact CD1-CD2 3.65Å; F158-H287 AromaticContact CD1-CG 3.54Å; F158-H287 AromaticContact CD2-CD2 3.29Å; F158-H287 WeakPolarHBondContact CD2-CD2 3.35Å; F158-H287 AromaticContact CD2-NE2 3.88Å; F158-H287 AromaticContact CE1-CD2 3.7Å; F158-H287 AromaticContact CE1-CE1 3.81Å; F158-H287 AromaticContact CE1-CG 3.78Å; F158-H287 AromaticContact CE1-ND1 3.84Å; F158-H287 AromaticContact CE1-NE2 3.72Å; F158-H287 AromaticContact CE2-CD2 3.35Å; F158-H287 WeakPolarHBondContact CE2-CD2 3.43Å; F158-H287 AromaticContact CE2-NE2 3.39Å; F158-H287 WeakPolarHBondContact CE2-NE2 3.48Å; F158-H287 HydrophobicContact CG-CB 3.8Å; F158-H287 AromaticContact CG-CD2 3.43Å; F158-H287 VanDerWaalsContact CG-CD2 3.43Å; F158-H287 WeakPolarHBondContact CG-CD2 3.42Å; F158-H287 AromaticContact CG-CG 3.64Å; F158-H287 AromaticContact CZ-CD2 3.55Å; F158-H287 AromaticContact CZ-CE1 3.75Å; F158-H287 AromaticContact CZ-NE2 3.29Å; F158-H287 VanDerWaalsContact CZ-NE2 3.29Å; F158-H287 WeakPolarHBondContact CZ-NE2 3.41Å
159	L	92	Very high	83.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.4	173.6	-173.6	69.5	0	0	0	108.9	V211 T213 S216 T217 A252 L254	L159-V211 HydrophobicContact CD2-CG2 4.02Å; L159-T213 HydrophobicContact CD2-CG2 4.34Å; L159-S216 CarbonylContact O-C 3.57Å; L159-S216 WeakPolarHBondContact O-CA 3.38Å; L159-S216 WeakPolarHBondContact O-CB 3.39Å; L159-T217 PolarHBondContact N-O 3.34Å; L159-T217 PolarHBondContact O-N 3.32Å; L159-T217 VanDerWaalsContact O-N 3.14Å; L159-A252 HydrophobicContact CD1-CB 3.87Å; L159-A252 HydrophobicContact CD2-CB 4.35Å; L159-A252 HydrophobicContact CG-CB 4.16Å; L159-L254 HydrophobicContact CB-CD2 4.38Å; L159-L254 HydrophobicContact CD1-CD2 3.79Å; L159-L254 HydrophobicContact CD1-CG 4.01Å
160	K	90.8	Very high	83.4	Confident	83 Å²	83	71.5 Å²	71.5	36%	0.361	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.2	175.3	-174.9	179.9	-175	180	0	109.3	F158 A252 S253 V255 E284	F158-K160 HydrophobicContact CD1-CB 4.43Å; F158-K160 HydrophobicContact CE1-CB 4.24Å; K160-A252 CarbonylContact O-C 3.53Å; K160-A252 WeakPolarHBondContact O-CA 3.37Å; K160-S253 WeakPolarHBondContact CB-O 3.36Å; K160-S253 PolarHBondContact N-O 3.19Å; K160-S253 PolarHBondContact O-N 3.11Å; K160-V255 HydrophobicContact CB-CG2 4.15Å; K160-E284 IonicContact NZ-OE1 3.83Å; K160-E284 PolarHBondContact NZ-OE1 3.49Å
161	V	89.3	Confident	83.5	Confident	19 Å²	19	70.9 Å²	70.9	12%	0.115	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.8	176.2	-178.1	0	0	0	0	108.6	K163 T213 S216 A252	V161-K163 WeakPolarHBondContact CG1-O 3.41Å; V161-T213 WeakPolarHBondContact CG1-O 3.48Å; V161-T213 WeakPolarHBondContact CG2-O 3.41Å; V161-S216 PolarHBondContact N-OG 3.38Å; V161-S216 PolarHBondContact O-OG 3.45Å; V161-A252 HydrophobicContact CG2-CB 4.28Å
162	S	82.8	Confident	83.9	Confident	94 Å²	94	68.7 Å²	68.7	66%	0.657	33%	0.332	S	S	*	.	S	Bend	trans	-81.6	-30	-175.4	60.2	0	0	0	0	113.3	G251	S162-G251 PolarHBondContact N-O 3.48Å; S162-G251 PolarHBondContact OG-O 3.16Å
163	K	73.4	Confident	84.2	Confident	169 Å²	169	65.7 Å²	65.7	74%	0.735	32%	0.318	S	S	*	.	S	Bend	trans	-133.4	116.6	176.5	-68	-178.9	-179.7	177	0	108.1	V161 N165	V161-K163 WeakPolarHBondContact CG1-O 3.41Å; K163-N165 PolarHBondContact O-N 3.46Å
164	A	63	Low	84.3	Confident	86 Å²	86	69.1 Å²	69.1	71%	0.711	33%	0.331	S	S	*	.			trans	-63.4	108.1	178.5	0	0	0	0	0	109.5
165	N	62.7	Low	84.3	Confident	61 Å²	61	67.7 Å²	67.7	33%	0.326	32%	0.324	S	S	.	.			trans	-81.8	127.7	175.9	-163.3	-10.1	0	0	0	109.3	K163 S167	K163-N165 PolarHBondContact O-N 3.46Å; N165-S167 VanDerWaalsContact C-N 3.31Å; N165-S167 PolarHBondContact ND2-OG 3.11Å; N165-S167 VanDerWaalsContact ND2-OG 3.09Å; N165-S167 PolarHBondContact OD1-N 3.09Å; N165-S167 PolarHBondContact OD1-OG 2.99Å
166	R	64.2	Low	84.2	Confident	254 Å²	254	69.3 Å²	69.3	96%	0.958	33%	0.331	S	S	*	.	S	Bend	trans	-78.1	-16.4	179.8	-70.1	-175.6	178.9	177.8	-0	112.5
167	S	67.6	Low	84.1	Confident	55 Å²	55	67 Å²	67	39%	0.385	32%	0.323	S	S	.	.	S	Bend	trans	-74	143.3	172.6	57.7	0	0	0	0	111.3	N165 T169	N165-S167 VanDerWaalsContact C-N 3.31Å; N165-S167 PolarHBondContact ND2-OG 3.11Å; N165-S167 VanDerWaalsContact ND2-OG 3.09Å; N165-S167 PolarHBondContact OD1-N 3.09Å; N165-S167 PolarHBondContact OD1-OG 2.99Å; S167-T169 PolarHBondContact O-N 2.85Å; S167-T169 PolarHBondContact O-OG1 3Å; S167-T169 WeakPolarHBondContact OG-CG2 3.5Å
168	R	63.5	Low	83.9	Confident	213 Å²	213	67.8 Å²	67.8	80%	0.804	33%	0.327	S	S	*	.			trans	-68.8	60.1	172.8	-94.5	178.9	170.5	160.1	3.5	111.6	K170	R168-K170 PolarHBondContact O-N 3.42Å
169	T	77.9	Confident	83.3	Confident	35 Å²	35	70.2 Å²	70.2	22%	0.215	34%	0.339	C	S	.	.			trans	-81.7	110.5	178.6	38.4	0	0	0	0	109.8	S167 T213 T250	S167-T169 PolarHBondContact O-N 2.85Å; S167-T169 PolarHBondContact O-OG1 3Å; S167-T169 WeakPolarHBondContact OG-CG2 3.5Å; T169-T213 PolarHBondContact O-N 2.98Å; T169-T213 PolarHBondContact O-OG1 3.41Å; T169-T213 PolarHBondContact OG1-OG1 2.64Å; T169-T250 HydrophobicContact CG2-CG2 4.26Å
170	K	88.6	Confident	82.1	Confident	151 Å²	151	78.7 Å²	78.7	66%	0.657	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	138	164.9	-67.4	-176.4	178.4	-177.4	0	108.4	R168 V211	R168-K170 PolarHBondContact O-N 3.42Å; K170-V211 CarbonylContact C-O 3.49Å; K170-V211 VanDerWaalsContact CA-O 3.23Å; K170-V211 WeakPolarHBondContact CA-O 3.32Å
171	V	92	Very high	80.4	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.3	171.2	-60.8	0	0	0	0	109.1	A210 V211 T213 L246 T250	V171-A210 CarbonylContact O-C 3.48Å; V171-A210 WeakPolarHBondContact O-CA 3.47Å; V171-V211 HydrophobicContact CG2-CG2 3.53Å; V171-V211 PolarHBondContact N-O 3.21Å; V171-V211 WeakPolarHBondContact O-CG2 3.29Å; V171-V211 PolarHBondContact O-N 3.35Å; V171-T213 HydrophobicContact CB-CG2 4.27Å; V171-T213 HydrophobicContact CG1-CG2 3.72Å; V171-T213 HydrophobicContact CG2-CG2 3.61Å; V171-L246 HydrophobicContact CB-CB 4.31Å; V171-L246 HydrophobicContact CG1-CB 3.79Å; V171-T250 HydrophobicContact CG1-CG2 3.79Å
172	T	95.5	Very high	78.5	Confident	47 Å²	47	86.1 Å²	86.1	29%	0.288	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.2	177.6	-56.1	0	0	0	0	109.4	R174 E208	T172-R174 HydrophobicContact CG2-CG 4.33Å; T172-E208 HydrophobicContact CG2-CG 3.58Å; T172-E208 WeakPolarHBondContact CG2-OE1 3.24Å
173	I	95.7	Very high	76.6	Confident	0 Å²	0	91 Å²	91	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.7	173.4	-61.7	171.5	0	0	0	108.1	L157 L175 E208 K209 V211 F221 I242 A243 C244 L254	L157-I173 HydrophobicContact CD1-CG2 4.45Å; I173-L175 HydrophobicContact CG2-CD1 3.91Å; I173-E208 WeakPolarHBondContact O-CA 3.37Å; I173-K209 PolarHBondContact N-O 3.1Å; I173-K209 PolarHBondContact O-N 3.14Å; I173-V211 HydrophobicContact CD1-CB 4.49Å; I173-V211 HydrophobicContact CD1-CG1 4.19Å; I173-V211 HydrophobicContact CD1-CG2 3.51Å; I173-V211 HydrophobicContact CG1-CG2 4.01Å; I173-F221 HydrophobicContact CB-CE1 3.82Å; I173-F221 HydrophobicContact CB-CZ 3.71Å; I173-F221 HydrophobicContact CD1-CZ 3.98Å; I173-F221 HydrophobicContact CG1-CZ 4.45Å; I173-F221 HydrophobicContact CG2-CE1 3.76Å; I173-F221 HydrophobicContact CG2-CZ 3.6Å; I173-I242 HydrophobicContact CG2-CG2 3.95Å; I173-A243 WeakPolarHBondContact CA-O 3.45Å; I173-C244 HydrophobicContact CG1-CB 4.05Å; I173-L254 HydrophobicContact CD1-CD1 4.26Å; I173-L254 HydrophobicContact CD1-CD2 3.91Å; I173-L254 HydrophobicContact CD1-CG 4.5Å; I173-L254 HydrophobicContact CG2-CD1 4.36Å
174	R	96.3	Very high	75	Confident	71 Å²	71	90 Å²	90	27%	0.268	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.1	178.1	-61.9	179.1	-169.3	103.2	3.2	110.6	T172 F176 L205 S207 E208 A243 D245	T172-R174 HydrophobicContact CG2-CG 4.33Å; R174-F176 HydrophobicContact CB-CD2 4.25Å; R174-F176 HydrophobicContact CB-CE2 3.47Å; R174-F176 VanDerWaalsContact CB-CE2 3.47Å; R174-F176 HydrophobicContact CB-CZ 3.84Å; R174-F176 HydrophobicContact CG-CE2 4.5Å; R174-F176 HydrophobicContact CG-CZ 4.5Å; R174-L205 HydrophobicContact CB-CD1 3.92Å; R174-L205 HydrophobicContact CG-CD1 4.27Å; R174-S207 WeakPolarHBondContact CA-O 3.35Å; R174-E208 HydrophobicContact CG-CB 4.32Å; R174-E208 HydrophobicContact CG-CG 3.96Å; R174-E208 IonicContact CZ-OE1 3.76Å; R174-E208 IonicContact NE-OE1 3.67Å; R174-E208 PolarHBondContact NE-OE1 3.07Å; R174-E208 IonicContact NH2-OE1 3.94Å; R174-E208 PolarHBondContact NH2-OE1 3.4Å; R174-A243 HydrophobicContact CB-CB 4.44Å; R174-A243 PolarHBondContact N-O 3.16Å; R174-A243 PolarHBondContact O-N 2.84Å; R174-D245 IonicContact NH1-OD2 3.46Å; R174-D245 PolarHBondContact NH1-OD2 3.32Å
175	L	95.9	Very high	74.2	Confident	0 Å²	0	93.4 Å²	93.4	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.7	174.1	-81.5	61.2	0	0	0	108.4	V155 L157 I173 I206 S207 F221 V240 I242	V155-L175 HydrophobicContact CB-CD2 3.84Å; V155-L175 HydrophobicContact CG1-CD2 3.97Å; V155-L175 HydrophobicContact CG2-CD2 4.11Å; L157-L175 HydrophobicContact CD1-CD1 3.95Å; I173-L175 HydrophobicContact CG2-CD1 3.91Å; L175-I206 HydrophobicContact CB-CD1 4.12Å; L175-I206 HydrophobicContact CB-CG1 3.69Å; L175-I206 VanDerWaalsContact O-CG1 3.26Å; L175-I206 WeakPolarHBondContact O-CG1 3.2Å; L175-I206 PolarHBondContact O-N 3.36Å; L175-S207 PolarHBondContact N-O 3.36Å; L175-S207 PolarHBondContact O-N 2.96Å; L175-F221 HydrophobicContact CD1-CD1 3.67Å; L175-F221 HydrophobicContact CD1-CD2 4.42Å; L175-F221 HydrophobicContact CD1-CE1 3.89Å; L175-F221 HydrophobicContact CD1-CG 3.96Å; L175-F221 HydrophobicContact CD1-CZ 4.39Å; L175-F221 HydrophobicContact CD2-CB 3.84Å; L175-F221 HydrophobicContact CD2-CD1 4.48Å; L175-F221 HydrophobicContact CD2-CG 4.1Å; L175-V240 HydrophobicContact CB-CG1 3.84Å; L175-V240 HydrophobicContact CD2-CG1 4.13Å; L175-V240 HydrophobicContact CG-CG1 3.82Å; L175-I242 HydrophobicContact CG-CG1 4.36Å
176	F	95.1	Very high	73.2	Confident	36 Å²	36	95.6 Å²	95.6	16%	0.158	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.4	178	-62	-87.6	0	0	0	110	R174 E203 T204 L205 V240 R241 A243	R174-F176 HydrophobicContact CB-CD2 4.25Å; R174-F176 HydrophobicContact CB-CE2 3.47Å; R174-F176 VanDerWaalsContact CB-CE2 3.47Å; R174-F176 HydrophobicContact CB-CZ 3.84Å; R174-F176 HydrophobicContact CG-CE2 4.5Å; R174-F176 HydrophobicContact CG-CZ 4.5Å; F176-E203 HydrophobicContact CB-CB 4.41Å; F176-T204 CarbonylContact C-O 3.51Å; F176-T204 VanDerWaalsContact CA-O 3.27Å; F176-T204 WeakPolarHBondContact CA-O 3.35Å; F176-L205 HydrophobicContact CD1-CB 4.13Å; F176-L205 HydrophobicContact CD1-CD1 4.1Å; F176-L205 HydrophobicContact CE1-CB 4.02Å; F176-L205 HydrophobicContact CE1-CD1 3.69Å; F176-L205 HydrophobicContact CE1-CG 4.44Å; F176-L205 HydrophobicContact CE2-CD1 4.49Å; F176-L205 HydrophobicContact CZ-CD1 3.91Å; F176-V240 CarbonylContact O-C 3.11Å; F176-V240 WeakPolarHBondContact O-CA 3.38Å; F176-R241 HydrophobicContact CB-CB 4.37Å; F176-R241 VanDerWaalsContact CD2-NH2 3.27Å; F176-R241 PolarHBondContact N-O 2.91Å; F176-R241 PolarHBondContact O-N 2.89Å; F176-A243 HydrophobicContact CD2-CB 4.39Å; F176-A243 HydrophobicContact CE2-CB 3.86Å
177	Q	93.4	Very high	72.2	Confident	13 Å²	13	92.9 Å²	92.9	6%	0.061	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.7	168.7	177	177.1	15	0	0	109.4	E203 T204 I206 L238 D239	Q177-E203 WeakPolarHBondContact O-CA 3.26Å; Q177-T204 PolarHBondContact N-O 2.91Å; Q177-T204 PolarHBondContact O-N 3.19Å; Q177-I206 HydrophobicContact CB-CD1 4.35Å; Q177-I206 HydrophobicContact CB-CG2 3.5Å; Q177-L238 HydrophobicContact CB-CD1 4.37Å; Q177-L238 HydrophobicContact CG-CD1 3.73Å; Q177-D239 WeakPolarHBondContact CA-O 3.43Å
178	Q	89.6	Confident	70.9	Confident	18 Å²	18	94 Å²	94	8%	0.084	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.5	172.5	-59.6	-158	-33.7	0	0	109.8	E203 D239 R241	Q178-E203 PolarHBondContact NE2-OE1 2.97Å; Q178-D239 HydrophobicContact CB-CB 4.05Å; Q178-D239 PolarHBondContact N-O 3.37Å; Q178-R241 HydrophobicContact CG-CB 4.32Å
179	Q	79.7	Confident	69.4	Low	70 Å²	70	88.5 Å²	88.5	33%	0.327	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.4	170.8	-69.8	-180	7	0	0	109.2	Q181 G202	Q179-Q181 PolarHBondContact O-N 3.26Å; Q179-G202 PolarHBondContact N-O 3.14Å
180	R	67	Low	67.4	Low	177 Å²	177	95.8 Å²	95.8	67%	0.668	50%	0.503	S	S	*	.			trans	-80.5	115.3	163.7	-70.4	-173.2	-175.2	177.7	3.4	107.5
181	Q	55.3	Low	65	Low	146 Å²	146	98.3 Å²	98.3	68%	0.682	52%	0.517	S	S	*	.			trans	-65.8	136.6	164.5	-74	-171.2	-5.1	0	0	108.6	Q179 K183	Q179-Q181 PolarHBondContact O-N 3.26Å; Q181-K183 PolarHBondContact O-N 3.45Å
182	P	48.5	Very low	62.2	Low	112 Å²	112	103.6 Å²	103.6	73%	0.727	55%	0.554	S	S	*	*			trans	-61.7	133.4	163.4	24.5	-25.8	0	0	0	107.9	D184	P182-D184 PolarHBondContact O-N 3.03Å; P182-D184 VanDerWaalsContact O-N 3.1Å
183	K	44.4	Very low	59.6	Low	198 Å²	198	111.1 Å²	111.1	86%	0.861	59%	0.586	S	S	*	*			trans	-62.2	112.1	167	-79.7	-177.8	170.6	-172.2	0	106.7	Q181 N185	Q181-K183 PolarHBondContact O-N 3.45Å; K183-N185 PolarHBondContact O-N 2.88Å
184	D	39.3	Very low	56.8	Low	148 Å²	148	118.9 Å²	118.9	79%	0.791	63%	0.627	S	S	*	*			trans	-62.2	119.3	164	-89.4	-31.9	0	0	0	107.8	P182 S186	P182-D184 PolarHBondContact O-N 3.03Å; P182-D184 VanDerWaalsContact O-N 3.1Å; D184-S186 PolarHBondContact O-N 2.86Å
185	N	45.7	Very low	54.2	Low	157 Å²	157	118.9 Å²	118.9	84%	0.84	65%	0.649	S	S	*	*			trans	-73.9	79	164.9	-83.6	-4.1	0	0	0	107.7	K183	K183-N185 PolarHBondContact O-N 2.88Å
186	S	41.1	Very low	51.6	Low	106 Å²	106	122.2 Å²	122.2	74%	0.741	68%	0.684	S	S	*	*			trans	-88.1	97.1	154.4	58.2	0	0	0	0	107.3	D184 G188	D184-S186 PolarHBondContact O-N 2.86Å; S186-G188 PolarHBondContact O-N 2.93Å
187	E	43.8	Very low	48.9	Very low	198 Å²	198	129.1 Å²	129.1	93%	0.925	72%	0.722	S	S	*	*			trans	-58.8	128.8	165.2	-72.6	177.7	151.3	0	0	109.4
188	G	40.1	Very low	46.6	Very low	77 Å²	77	138.4 Å²	138.4	79%	0.794	76%	0.762	S	S	*	*			trans	123.6	85.2	164	0	0	0	0	0	114.5	S186	S186-G188 PolarHBondContact O-N 2.93Å
189	A	33.6	Very low	44.4	Very low	98 Å²	98	140.9 Å²	140.9	81%	0.81	79%	0.792	S	S	*	*			trans	-179.1	104.1	135.6	0	0	0	0	0	109.8
190	E	34	Very low	42.9	Very low	189 Å²	189	146 Å²	146	88%	0.883	82%	0.816	S	S	*	*			trans	25.4	124.7	143.5	-61.2	178	179	0	0	119.8	S192	E190-S192 PolarHBondContact O-N 3.34Å
191	E	39.9	Very low	42.8	Very low	204 Å²	204	143 Å²	143	95%	0.953	81%	0.805	S	S	*	*			trans	-50.2	119.9	169.7	-63.5	175.3	157.9	0	0	111.6
192	S	32.8	Very low	43.9	Very low	111 Å²	111	137.3 Å²	137.3	78%	0.776	79%	0.785	S	S	*	*			trans	-131.5	118.2	159	36.7	0	0	0	0	108.7	E190 D194	E190-S192 PolarHBondContact O-N 3.34Å; S192-D194 PolarHBondContact O-N 2.67Å; S192-D194 VanDerWaalsContact O-N 3.12Å
193	E	41.3	Very low	45.8	Very low	204 Å²	204	135.6 Å²	135.6	95%	0.953	77%	0.768	S	S	*	*			trans	-71.6	91.2	173.8	-64	-175	144	0	0	109.5
194	D	36.1	Very low	48.1	Very low	163 Å²	163	128.8 Å²	128.8	87%	0.872	74%	0.743	S	S	*	*			trans	-156.9	150.5	153.5	-159.7	12.6	0	0	0	111.5	S192	S192-D194 PolarHBondContact O-N 2.67Å; S192-D194 VanDerWaalsContact O-N 3.12Å
195	G	41.9	Very low	50.8	Low	71 Å²	71	125.7 Å²	125.7	73%	0.732	73%	0.726	S	S	*	*			trans	-64.8	141.2	-162.4	0	0	0	0	0	116.9
196	G	41.3	Very low	53.2	Low	71 Å²	71	119 Å²	119	73%	0.732	69%	0.69	S	S	*	*			trans	92.8	86	134.9	0	0	0	0	0	118
197	L	38.4	Very low	55.9	Low	180 Å²	180	114.5 Å²	114.5	94%	0.942	66%	0.658	S	S	*	*			trans	-140	95.1	153.9	-75.8	169.9	0	0	0	110.4	G199	L197-G199 PolarHBondContact O-N 3.24Å
198	K	44	Very low	58.4	Low	208 Å²	208	110.1 Å²	110.1	90%	0.904	64%	0.638	S	S	*	*			trans	-63.3	117.1	161.1	-87.6	176.9	175.1	170.4	0	106.8	E200	K198-E200 PolarHBondContact O-N 2.59Å
199	G	43.1	Very low	61	Low	70 Å²	70	110.1 Å²	110.1	72%	0.722	62%	0.616	S	S	*	*			trans	-46.3	126.5	173.9	0	0	0	0	0	111.1	L197 R201	L197-G199 PolarHBondContact O-N 3.24Å; G199-R201 PolarHBondContact O-N 3.12Å
200	E	50	Low	63.9	Low	179 Å²	179	108.2 Å²	108.2	84%	0.836	60%	0.601	S	S	*	*			trans	-59.9	110.1	-178.9	-73.7	-174.9	144.5	0	0	109	K198 G202	K198-E200 PolarHBondContact O-N 2.59Å; E200-G202 PolarHBondContact O-N 3.03Å
201	R	63.6	Low	66.7	Low	113 Å²	113	99.4 Å²	99.4	43%	0.426	56%	0.559	S	S	.	*			trans	-70	114.5	167.7	-69.9	-173.5	-169	-166.4	3.5	106.9	T131 G199 E203	T131-R201 PolarHBondContact O-NH1 3.48Å; G199-R201 PolarHBondContact O-N 3.12Å; R201-E203 PolarHBondContact O-N 2.85Å
202	G	78.7	Confident	69	Low	26 Å²	26	92.2 Å²	92.2	27%	0.268	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	124.6	170.3	0	0	0	0	0	109.7	Q179 E200	Q179-G202 PolarHBondContact N-O 3.14Å; E200-G202 PolarHBondContact O-N 3.03Å
203	E	89	Confident	71.7	Confident	77 Å²	77	86.9 Å²	86.9	36%	0.36	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.9	174	-64.5	-165.5	151.8	0	0	109.7	F176 Q177 Q178 R201 R241	F176-E203 HydrophobicContact CB-CB 4.41Å; Q177-E203 WeakPolarHBondContact O-CA 3.26Å; Q178-E203 PolarHBondContact NE2-OE1 2.97Å; R201-E203 PolarHBondContact O-N 2.85Å; E203-R241 WeakPolarHBondContact OE1-CD 3.35Å; E203-R241 IonicContact OE1-CZ 2.73Å; E203-R241 IonicContact OE1-NE 3.85Å; E203-R241 PolarHBondContact OE1-NE 3.3Å; E203-R241 IonicContact OE2-CZ 3.31Å; E203-R241 IonicContact OE2-NE 3.18Å; E203-R241 PolarHBondContact OE2-NE 3.01Å; E203-R241 IonicContact OE2-NH2 3.48Å; E203-R241 PolarHBondContact OE2-NH2 2.9Å
204	T	93	Very high	73.8	Confident	54 Å²	54	82.8 Å²	82.8	33%	0.331	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.5	177.5	-54.4	0	0	0	0	109.2	F176 Q177 I206	F176-T204 CarbonylContact C-O 3.51Å; F176-T204 VanDerWaalsContact CA-O 3.27Å; F176-T204 WeakPolarHBondContact CA-O 3.35Å; Q177-T204 PolarHBondContact N-O 2.91Å; Q177-T204 PolarHBondContact O-N 3.19Å; T204-I206 PolarHBondContact O-N 3.3Å
205	L	95.4	Very high	76.2	Confident	84 Å²	84	82 Å²	82	44%	0.44	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	122	172.9	-178.9	70.9	0	0	0	109.4	R174 F176 E208	R174-L205 HydrophobicContact CB-CD1 3.92Å; R174-L205 HydrophobicContact CG-CD1 4.27Å; F176-L205 HydrophobicContact CD1-CB 4.13Å; F176-L205 HydrophobicContact CD1-CD1 4.1Å; F176-L205 HydrophobicContact CE1-CB 4.02Å; F176-L205 HydrophobicContact CE1-CD1 3.69Å; F176-L205 HydrophobicContact CE1-CG 4.44Å; F176-L205 HydrophobicContact CE2-CD1 4.49Å; F176-L205 HydrophobicContact CZ-CD1 3.91Å; L205-E208 HydrophobicContact CD2-CB 4.48Å
206	I	96.1	Very high	78.5	Confident	16 Å²	16	81.1 Å²	81.1	8%	0.082	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-21.8	-179.2	58.9	169.8	0	0	0	113.5	L175 Q177 T204 V223 S226 V240	L175-I206 HydrophobicContact CB-CD1 4.12Å; L175-I206 HydrophobicContact CB-CG1 3.69Å; L175-I206 VanDerWaalsContact O-CG1 3.26Å; L175-I206 WeakPolarHBondContact O-CG1 3.2Å; L175-I206 PolarHBondContact O-N 3.36Å; Q177-I206 HydrophobicContact CB-CD1 4.35Å; Q177-I206 HydrophobicContact CB-CG2 3.5Å; T204-I206 PolarHBondContact O-N 3.3Å; I206-V223 HydrophobicContact CD1-CG1 3.95Å; I206-V223 HydrophobicContact CG1-CG1 4.27Å; I206-S226 WeakPolarHBondContact CB-OG 3.37Å; I206-S226 VanDerWaalsContact CG2-OG 3.31Å; I206-S226 WeakPolarHBondContact CG2-OG 3.49Å; I206-V240 HydrophobicContact CD1-CG1 4.09Å; I206-V240 HydrophobicContact CD1-CG2 4.03Å
207	S	97	Very high	80.9	Confident	12 Å²	12	80 Å²	80	8%	0.084	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	141.3	175.4	-154.2	0	0	0	0	110.6	R174 L175 P222	R174-S207 WeakPolarHBondContact CA-O 3.35Å; L175-S207 PolarHBondContact N-O 3.36Å; L175-S207 PolarHBondContact O-N 2.96Å; S207-P222 PolarHBondContact OG-O 3.27Å; S207-P222 VanDerWaalsContact OG-O 3.09Å
208	E	96.5	Very high	83.5	Confident	106 Å²	106	74.8 Å²	74.8	50%	0.495	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.5	172.5	177.8	173.3	-130.4	0	0	108.9	T172 I173 R174 L205	T172-E208 HydrophobicContact CG2-CG 3.58Å; T172-E208 WeakPolarHBondContact CG2-OE1 3.24Å; I173-E208 WeakPolarHBondContact O-CA 3.37Å; R174-E208 HydrophobicContact CG-CB 4.32Å; R174-E208 HydrophobicContact CG-CG 3.96Å; R174-E208 IonicContact CZ-OE1 3.76Å; R174-E208 IonicContact NE-OE1 3.67Å; R174-E208 PolarHBondContact NE-OE1 3.07Å; R174-E208 IonicContact NH2-OE1 3.94Å; R174-E208 PolarHBondContact NH2-OE1 3.4Å; L205-E208 HydrophobicContact CD2-CB 4.48Å
209	K	95.5	Very high	86	Confident	76 Å²	76	66 Å²	66	33%	0.33	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	133.2	-179.7	-164.7	177.5	-173.8	178.4	0	111.6	I173 V211 I220 F221	I173-K209 PolarHBondContact N-O 3.1Å; I173-K209 PolarHBondContact O-N 3.14Å; K209-V211 HydrophobicContact CD-CG1 4.33Å; K209-V211 HydrophobicContact CG-CG1 4.25Å; K209-I220 WeakPolarHBondContact CD-O 3.45Å; K209-I220 PolarHBondContact NZ-O 3.16Å; K209-F221 HydrophobicContact CB-CD1 3.9Å; K209-F221 HydrophobicContact CB-CE1 3.52Å; K209-F221 HydrophobicContact CB-CZ 4.34Å; K209-F221 HydrophobicContact CD-CD1 4.5Å; K209-F221 HydrophobicContact CD-CE1 4.37Å
210	A	94.9	Very high	88.4	Confident	59 Å²	59	65 Å²	65	49%	0.488	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.4	166.8	0	0	0	0	0	109.9	V171	V171-A210 CarbonylContact O-C 3.48Å; V171-A210 WeakPolarHBondContact O-CA 3.47Å
211	V	92.4	Very high	90.7	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	149	-177.2	-58.2	0	0	0	0	111.5	L159 K170 V171 I173 K209 H219 F221	L159-V211 HydrophobicContact CD2-CG2 4.02Å; K170-V211 CarbonylContact C-O 3.49Å; K170-V211 VanDerWaalsContact CA-O 3.23Å; K170-V211 WeakPolarHBondContact CA-O 3.32Å; V171-V211 HydrophobicContact CG2-CG2 3.53Å; V171-V211 PolarHBondContact N-O 3.21Å; V171-V211 WeakPolarHBondContact O-CG2 3.29Å; V171-V211 PolarHBondContact O-N 3.35Å; I173-V211 HydrophobicContact CD1-CB 4.49Å; I173-V211 HydrophobicContact CD1-CG1 4.19Å; I173-V211 HydrophobicContact CD1-CG2 3.51Å; I173-V211 HydrophobicContact CG1-CG2 4.01Å; K209-V211 HydrophobicContact CD-CG1 4.33Å; K209-V211 HydrophobicContact CG-CG1 4.25Å; V211-H219 HydrophobicContact CG1-CB 4.09Å; V211-F221 HydrophobicContact CG1-CZ 4.35Å
212	D	88.6	Confident	92.3	Very high	53 Å²	53	54.7 Å²	54.7	28%	0.283	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.9	178	-166.2	-29.4	0	0	0	110.4	R214	D212-R214 WeakPolarHBondContact OD1-CB 3.16Å; D212-R214 WeakPolarHBondContact OD1-CD 3.5Å; D212-R214 WeakPolarHBondContact OD1-CG 3.35Å; D212-R214 PolarHBondContact OD1-N 2.94Å; D212-R214 IonicContact OD1-NE 2.83Å; D212-R214 WeakPolarHBondContact OD2-CD 3.34Å; D212-R214 IonicContact OD2-CZ 2.65Å; D212-R214 IonicContact OD2-NE 2.91Å; D212-R214 PolarHBondContact OD2-NE 2.88Å
213	T	88.6	Confident	93.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.			trans	-96.6	12.7	-178.8	55.7	0	0	0	0	113.9	L159 V161 T169 V171 A252	L159-T213 HydrophobicContact CD2-CG2 4.34Å; V161-T213 WeakPolarHBondContact CG1-O 3.48Å; V161-T213 WeakPolarHBondContact CG2-O 3.41Å; T169-T213 PolarHBondContact O-N 2.98Å; T169-T213 PolarHBondContact O-OG1 3.41Å; T169-T213 PolarHBondContact OG1-OG1 2.64Å; V171-T213 HydrophobicContact CB-CG2 4.27Å; V171-T213 HydrophobicContact CG1-CG2 3.72Å; V171-T213 HydrophobicContact CG2-CG2 3.61Å; T213-A252 HydrophobicContact CG2-CB 4.14Å
214	R	85	Confident	93.4	Very high	118 Å²	118	51.5 Å²	51.5	45%	0.445	27%	0.269	S	S	.	.	S	Bend	trans	-61.9	-41.5	179.2	-79.9	166	-163.2	-105	-4.4	115	D212	D212-R214 WeakPolarHBondContact OD1-CB 3.16Å; D212-R214 WeakPolarHBondContact OD1-CD 3.5Å; D212-R214 WeakPolarHBondContact OD1-CG 3.35Å; D212-R214 PolarHBondContact OD1-N 2.94Å; D212-R214 IonicContact OD1-NE 2.83Å; D212-R214 WeakPolarHBondContact OD2-CD 3.34Å; D212-R214 IonicContact OD2-CZ 2.65Å; D212-R214 IonicContact OD2-NE 2.91Å; D212-R214 PolarHBondContact OD2-NE 2.88Å
215	K	87.6	Confident	93.4	Very high	146 Å²	146	52.9 Å²	52.9	64%	0.635	28%	0.281	S	S	*	.	S	Bend	trans	-144.4	149.1	-171	67	177.2	-176.3	175.6	0	110.7	T217	K215-T217 PolarHBondContact O-N 2.73Å
216	S	90.8	Very high	93.3	Very high	53 Å²	53	49.6 Å²	49.6	37%	0.371	27%	0.265	S	S	.	.			trans	-64.9	123.1	172.5	-53	0	0	0	0	110.1	L159 V161	L159-S216 CarbonylContact O-C 3.57Å; L159-S216 WeakPolarHBondContact O-CA 3.38Å; L159-S216 WeakPolarHBondContact O-CB 3.39Å; V161-S216 PolarHBondContact N-OG 3.38Å; V161-S216 PolarHBondContact O-OG 3.45Å
217	T	91.7	Very high	93.1	Very high	47 Å²	47	48.8 Å²	48.8	29%	0.288	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	165.5	-176	-160.4	0	0	0	0	112.1	L159 K215	L159-T217 PolarHBondContact N-O 3.34Å; L159-T217 PolarHBondContact O-N 3.32Å; L159-T217 VanDerWaalsContact O-N 3.14Å; K215-T217 PolarHBondContact O-N 2.73Å
218	W	92.8	Very high	92.8	Very high	71 Å²	71	50 Å²	50	27%	0.269	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.5	173.4	-72.6	100.2	0	0	0	110.8	W156 F158 H287 F290	W156-W218 HydrophobicContact CB-CE3 4.02Å; W156-W218 HydrophobicContact CB-CZ3 4.08Å; W156-W218 HydrophobicContact CE3-CB 4.13Å; W156-W218 HydrophobicContact CE3-CD2 4.39Å; W156-W218 HydrophobicContact CE3-CE3 4.31Å; W156-W218 HydrophobicContact CE3-CG 4.34Å; W156-W218 HydrophobicContact CZ3-CB 4.32Å; F158-W218 HydrophobicContact CB-CD2 4.12Å; F158-W218 HydrophobicContact CB-CE3 3.96Å; F158-W218 HydrophobicContact CB-CH2 4.12Å; F158-W218 HydrophobicContact CB-CZ2 4.26Å; F158-W218 HydrophobicContact CB-CZ3 3.96Å; F158-W218 AromaticContact CD2-CD1 3.84Å; F158-W218 AromaticContact CD2-CD2 3.85Å; F158-W218 HydrophobicContact CD2-CD2 3.85Å; F158-W218 AromaticContact CD2-CE2 3.74Å; F158-W218 AromaticContact CD2-CG 3.93Å; F158-W218 HydrophobicContact CD2-CG 3.93Å; F158-W218 HydrophobicContact CD2-CZ2 4.35Å; F158-W218 AromaticContact CD2-NE1 3.7Å; F158-W218 HydrophobicContact CG-CD2 4.49Å; W218-H287 HydrophobicContact CZ2-CB 4.49Å; W218-F290 HydrophobicContact CH2-CD1 4.3Å; W218-F290 AromaticContact CH2-CE1 3.94Å; W218-F290 HydrophobicContact CH2-CE1 3.94Å; W218-F290 HydrophobicContact CZ3-CD1 4.36Å; W218-F290 AromaticContact CZ3-CE1 3.97Å; W218-F290 HydrophobicContact CZ3-CE1 3.97Å
219	H	94.9	Very high	92.6	Very high	23 Å²	23	51.7 Å²	51.7	11%	0.106	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.8	171.5	-67	-63.8	0	0	0	110.1	L157 V211 F221	L157-H219 PolarHBondContact N-O 3.29Å; L157-H219 PolarHBondContact O-N 3.2Å; V211-H219 HydrophobicContact CG1-CB 4.09Å; H219-F221 HydrophobicContact CB-CE2 3.68Å; H219-F221 HydrophobicContact CB-CZ 4.21Å; H219-F221 WeakPolarHBondContact O-CD2 3.25Å
220	I	95.4	Very high	92.3	Very high	50 Å²	50	48.2 Å²	48.2	26%	0.256	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	129	-175.9	-53.2	173.5	0	0	0	109.1	E154 W156 K209	E154-I220 HydrophobicContact CB-CG2 3.77Å; E154-I220 HydrophobicContact CG-CG2 3.73Å; E154-I220 VanDerWaalsContact OE1-CG2 3.23Å; E154-I220 WeakPolarHBondContact OE1-CG2 3.46Å; E154-I220 VanDerWaalsContact OE2-CG2 3.25Å; E154-I220 WeakPolarHBondContact OE2-CG2 3.39Å; W156-I220 HydrophobicContact CD2-CG1 3.95Å; W156-I220 HydrophobicContact CE3-CG1 4.04Å; W156-I220 HydrophobicContact CH2-CD1 3.47Å; W156-I220 VanDerWaalsContact CH2-CD1 3.47Å; W156-I220 HydrophobicContact CH2-CG1 3.9Å; W156-I220 HydrophobicContact CZ2-CD1 3.46Å; W156-I220 VanDerWaalsContact CZ2-CD1 3.46Å; W156-I220 HydrophobicContact CZ2-CG1 3.78Å; W156-I220 HydrophobicContact CZ3-CD1 4.03Å; W156-I220 HydrophobicContact CZ3-CG1 4.02Å; K209-I220 WeakPolarHBondContact CD-O 3.45Å; K209-I220 PolarHBondContact NZ-O 3.16Å
221	F	97	Very high	92	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	110.6	-178.6	-66.8	-95.6	0	0	0	109.8	E154 V155 L157 I173 L175 K209 V211 H219 V223	E154-F221 CarbonylContact C-O 3.6Å; E154-F221 WeakPolarHBondContact CA-O 3.47Å; V155-F221 HydrophobicContact CB-CB 4.38Å; V155-F221 PolarHBondContact N-O 2.64Å; V155-F221 PolarHBondContact O-N 3.4Å; L157-F221 HydrophobicContact CB-CD2 4.47Å; L157-F221 HydrophobicContact CB-CE2 4.06Å; L157-F221 HydrophobicContact CD1-CD2 4.05Å; L157-F221 HydrophobicContact CD1-CE2 3.77Å; L157-F221 HydrophobicContact CD1-CZ 4.35Å; L157-F221 HydrophobicContact CG-CD2 4.14Å; L157-F221 HydrophobicContact CG-CE2 4.07Å; I173-F221 HydrophobicContact CB-CE1 3.82Å; I173-F221 HydrophobicContact CB-CZ 3.71Å; I173-F221 HydrophobicContact CD1-CZ 3.98Å; I173-F221 HydrophobicContact CG1-CZ 4.45Å; I173-F221 HydrophobicContact CG2-CE1 3.76Å; I173-F221 HydrophobicContact CG2-CZ 3.6Å; L175-F221 HydrophobicContact CD1-CD1 3.67Å; L175-F221 HydrophobicContact CD1-CD2 4.42Å; L175-F221 HydrophobicContact CD1-CE1 3.89Å; L175-F221 HydrophobicContact CD1-CG 3.96Å; L175-F221 HydrophobicContact CD1-CZ 4.39Å; L175-F221 HydrophobicContact CD2-CB 3.84Å; L175-F221 HydrophobicContact CD2-CD1 4.48Å; L175-F221 HydrophobicContact CD2-CG 4.1Å; K209-F221 HydrophobicContact CB-CD1 3.9Å; K209-F221 HydrophobicContact CB-CE1 3.52Å; K209-F221 HydrophobicContact CB-CZ 4.34Å; K209-F221 HydrophobicContact CD-CD1 4.5Å; K209-F221 HydrophobicContact CD-CE1 4.37Å; V211-F221 HydrophobicContact CG1-CZ 4.35Å; H219-F221 HydrophobicContact CB-CE2 3.68Å; H219-F221 HydrophobicContact CB-CZ 4.21Å; H219-F221 WeakPolarHBondContact O-CD2 3.25Å; F221-V223 PolarHBondContact O-N 3.38Å
222	P	96.6	Very high	91.7	Very high	75 Å²	75	50.3 Å²	50.3	49%	0.487	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	132.7	179.3	28.4	-33.8	0	0	0	110	S207	S207-P222 PolarHBondContact OG-O 3.27Å; S207-P222 VanDerWaalsContact OG-O 3.09Å
223	V	96.5	Very high	91.6	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	26%	0.262	C	S	.	.			trans	-138.4	13.3	-178.7	-65.8	0	0	0	0	113.1	A153 V155 I206 F221 S225 S226 V227 L291	A153-V223 HydrophobicContact CB-CG2 4.13Å; A153-V223 PolarHBondContact O-N 2.89Å; V155-V223 HydrophobicContact CG2-CG1 4.07Å; V155-V223 HydrophobicContact CG2-CG2 3.9Å; I206-V223 HydrophobicContact CD1-CG1 3.95Å; I206-V223 HydrophobicContact CG1-CG1 4.27Å; F221-V223 PolarHBondContact O-N 3.38Å; V223-S225 PolarHBondContact O-N 3.45Å; V223-S226 WeakPolarHBondContact O-CB 2.96Å; V223-S226 PolarHBondContact O-N 3.01Å; V223-V227 HydrophobicContact CB-CG2 4.37Å; V223-V227 HydrophobicContact CG2-CG2 3.83Å; V223-V227 PolarHBondContact O-N 2.92Å; V223-L291 HydrophobicContact CG2-CD1 3.81Å
224	S	94.4	Very high	91.4	Very high	33 Å²	33	55.4 Å²	55.4	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-46.5	-52.3	-175	-46.3	0	0	0	0	114.1	A153 S226 V227 Q228	A153-S224 PolarHBondContact N-OG 3.2Å; A153-S224 PolarHBondContact O-N 3.03Å; A153-S224 PolarHBondContact O-OG 3.46Å; S224-S226 VanDerWaalsContact C-N 3.28Å; S224-S226 PolarHBondContact O-N 3.49Å; S224-V227 PolarHBondContact O-N 3.32Å; S224-Q228 WeakPolarHBondContact O-CB 3.44Å; S224-Q228 PolarHBondContact O-N 2.88Å
225	S	93.3	Very high	91.6	Very high	83 Å²	83	54.7 Å²	54.7	58%	0.58	30%	0.295	S	S	*	.	H	α-helix	trans	-64.3	-31.9	-178.2	54.9	0	0	0	0	113.6	V223 R229	V223-S225 PolarHBondContact O-N 3.45Å; S225-R229 WeakPolarHBondContact O-CB 3.49Å; S225-R229 PolarHBondContact O-N 3.27Å; S225-R229 VanDerWaalsContact O-N 3.12Å
226	S	93.7	Very high	91.6	Very high	15 Å²	15	49.2 Å²	49.2	11%	0.105	28%	0.276	C	S	.	.	H	α-helix	trans	-77.5	-39.6	-179.1	-55	0	0	0	0	110.7	I206 V223 S224 L230	I206-S226 WeakPolarHBondContact CB-OG 3.37Å; I206-S226 VanDerWaalsContact CG2-OG 3.31Å; I206-S226 WeakPolarHBondContact CG2-OG 3.49Å; V223-S226 WeakPolarHBondContact O-CB 2.96Å; V223-S226 PolarHBondContact O-N 3.01Å; S224-S226 VanDerWaalsContact C-N 3.28Å; S224-S226 PolarHBondContact O-N 3.49Å; S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 PolarHBondContact O-N 2.91Å
227	V	92.1	Very high	91.6	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-43.9	173.6	178.3	0	0	0	0	110.7	I140 V150 A153 V223 S224 R229 L230 L231 L238 L291 M293	I140-V227 HydrophobicContact CD1-CG1 4.14Å; V150-V227 HydrophobicContact CG2-CG1 4.28Å; A153-V227 HydrophobicContact CB-CB 4.09Å; A153-V227 HydrophobicContact CB-CG1 4.41Å; A153-V227 HydrophobicContact CB-CG2 3.92Å; V223-V227 HydrophobicContact CB-CG2 4.37Å; V223-V227 HydrophobicContact CG2-CG2 3.83Å; V223-V227 PolarHBondContact O-N 2.92Å; S224-V227 PolarHBondContact O-N 3.32Å; V227-R229 PolarHBondContact O-N 3.48Å; V227-L230 WeakPolarHBondContact O-CB 3.43Å; V227-L230 PolarHBondContact O-N 3.35Å; V227-L230 VanDerWaalsContact O-N 3.16Å; V227-L231 HydrophobicContact CG1-CD1 4.11Å; V227-L231 HydrophobicContact CG1-CG 4.44Å; V227-L231 WeakPolarHBondContact O-CG 3.34Å; V227-L231 PolarHBondContact O-N 2.98Å; V227-L238 HydrophobicContact CG2-CD2 4.45Å; V227-L291 HydrophobicContact CG2-CD1 4.26Å; V227-L291 HydrophobicContact CG2-CD2 4.49Å; V227-M293 HydrophobicContact CG1-CE 4.25Å; V227-M293 HydrophobicContact CG1-SD 4.16Å
228	Q	91.3	Very high	91.6	Very high	36 Å²	36	46.8 Å²	46.8	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-54.4	-52.2	173.4	-178.9	67.6	63	0	0	111	V150 S224 L230 L231 D232	V150-Q228 HydrophobicContact CB-CB 4.22Å; V150-Q228 HydrophobicContact CG2-CB 4.2Å; S224-Q228 WeakPolarHBondContact O-CB 3.44Å; S224-Q228 PolarHBondContact O-N 2.88Å; Q228-L230 VanDerWaalsContact C-N 3.26Å; Q228-L230 PolarHBondContact O-N 2.86Å; Q228-L231 PolarHBondContact O-N 3.24Å; Q228-L231 VanDerWaalsContact O-N 3.16Å; Q228-D232 PolarHBondContact NE2-OD1 2.98Å; Q228-D232 WeakPolarHBondContact O-CB 3.39Å; Q228-D232 PolarHBondContact O-N 2.7Å
229	R	90.8	Very high	91.6	Very high	142 Å²	142	44.8 Å²	44.8	54%	0.536	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-35.6	179.2	-170.5	-173.1	-53.3	-159.4	1.8	112.9	S225 V227 Q233	S225-R229 WeakPolarHBondContact O-CB 3.49Å; S225-R229 PolarHBondContact O-N 3.27Å; S225-R229 VanDerWaalsContact O-N 3.12Å; V227-R229 PolarHBondContact O-N 3.48Å; R229-Q233 VanDerWaalsContact O-CG 3.3Å; R229-Q233 WeakPolarHBondContact O-CG 3.21Å; R229-Q233 PolarHBondContact O-N 3.33Å
230	L	90.3	Very high	91.6	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-65.3	-47	176.8	-178.6	74.4	0	0	0	111.2	I140 S226 V227 Q228 Q233 K235 L238	I140-L230 HydrophobicContact CD1-CD2 4.04Å; S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 PolarHBondContact O-N 2.91Å; V227-L230 WeakPolarHBondContact O-CB 3.43Å; V227-L230 PolarHBondContact O-N 3.35Å; V227-L230 VanDerWaalsContact O-N 3.16Å; Q228-L230 VanDerWaalsContact C-N 3.26Å; Q228-L230 PolarHBondContact O-N 2.86Å; L230-Q233 WeakPolarHBondContact O-CB 3.47Å; L230-Q233 PolarHBondContact O-N 3.24Å; L230-K235 HydrophobicContact CD1-CB 3.58Å; L230-K235 HydrophobicContact CD1-CD 4.1Å; L230-K235 HydrophobicContact CD1-CG 4.5Å; L230-K235 HydrophobicContact CG-CB 4Å; L230-K235 PolarHBondContact O-N 3.06Å; L230-K235 VanDerWaalsContact O-N 3.17Å; L230-L238 HydrophobicContact CD2-CB 3.76Å; L230-L238 HydrophobicContact CD2-CD1 4.2Å; L230-L238 HydrophobicContact CD2-CG 4.45Å
231	L	88.1	Confident	91.5	Very high	11 Å²	11	44.3 Å²	44.3	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-68.9	-35.5	179.2	-63.2	176	0	0	0	112	I140 V150 V227 Q228 Q233 G234 M293	I140-L231 HydrophobicContact CD1-CD2 4.39Å; V150-L231 HydrophobicContact CG2-CD1 3.64Å; V227-L231 HydrophobicContact CG1-CD1 4.11Å; V227-L231 HydrophobicContact CG1-CG 4.44Å; V227-L231 WeakPolarHBondContact O-CG 3.34Å; V227-L231 PolarHBondContact O-N 2.98Å; Q228-L231 PolarHBondContact O-N 3.24Å; Q228-L231 VanDerWaalsContact O-N 3.16Å; L231-Q233 PolarHBondContact O-N 3.19Å; L231-G234 WeakPolarHBondContact O-CA 3.41Å; L231-G234 PolarHBondContact O-N 3.47Å; L231-M293 HydrophobicContact CD1-CE 3.85Å
232	D	86.9	Confident	91.3	Very high	94 Å²	94	44.8 Å²	44.8	50%	0.503	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-31.8	173.4	-66.8	-21.5	0	0	0	111.9	Q228 G234	Q228-D232 PolarHBondContact NE2-OD1 2.98Å; Q228-D232 WeakPolarHBondContact O-CB 3.39Å; Q228-D232 PolarHBondContact O-N 2.7Å; D232-G234 PolarHBondContact O-N 3.11Å
233	Q	86.9	Confident	91.2	Very high	93 Å²	93	41.8 Å²	41.8	44%	0.435	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	0.9	173.7	-67.8	175.1	15.4	0	0	113.5	R229 L230 L231 K235	R229-Q233 VanDerWaalsContact O-CG 3.3Å; R229-Q233 WeakPolarHBondContact O-CG 3.21Å; R229-Q233 PolarHBondContact O-N 3.33Å; L230-Q233 WeakPolarHBondContact O-CB 3.47Å; L230-Q233 PolarHBondContact O-N 3.24Å; L231-Q233 PolarHBondContact O-N 3.19Å; Q233-K235 VanDerWaalsContact C-N 3.26Å; Q233-K235 HydrophobicContact CB-CD 4.23Å; Q233-K235 HydrophobicContact CB-CG 4.28Å; Q233-K235 PolarHBondContact O-N 2.73Å
234	G	84.4	Confident	91	Very high	67 Å²	67	42.9 Å²	42.9	69%	0.691	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	20.4	-176.2	0	0	0	0	0	113.9	L231 D232	L231-G234 WeakPolarHBondContact O-CA 3.41Å; L231-G234 PolarHBondContact O-N 3.47Å; D232-G234 PolarHBondContact O-N 3.11Å
235	K	87.8	Confident	90.7	Very high	103 Å²	103	46.8 Å²	46.8	45%	0.448	26%	0.259	S	S	.	.			trans	-100.6	140.1	178.7	-64.3	173.2	-175.4	164.2	0	109.8	L230 Q233	L230-K235 HydrophobicContact CD1-CB 3.58Å; L230-K235 HydrophobicContact CD1-CD 4.1Å; L230-K235 HydrophobicContact CD1-CG 4.5Å; L230-K235 HydrophobicContact CG-CB 4Å; L230-K235 PolarHBondContact O-N 3.06Å; L230-K235 VanDerWaalsContact O-N 3.17Å; Q233-K235 VanDerWaalsContact C-N 3.26Å; Q233-K235 HydrophobicContact CB-CD 4.23Å; Q233-K235 HydrophobicContact CB-CG 4.28Å; Q233-K235 PolarHBondContact O-N 2.73Å
236	S	88.4	Confident	90.5	Very high	32 Å²	32	46.7 Å²	46.7	22%	0.224	25%	0.252	C	S	.	.			trans	-105.8	-9.1	174.4	51.2	0	0	0	0	113.5	E139 I140	E139-S236 PolarHBondContact OE1-OG 3.39Å; I140-S236 VanDerWaalsContact CB-O 3.32Å; I140-S236 WeakPolarHBondContact CB-O 3.44Å; I140-S236 WeakPolarHBondContact CG1-O 3.27Å; I140-S236 PolarHBondContact N-O 3.1Å; I140-S236 WeakPolarHBondContact O-CB 3.42Å
237	S	91.4	Very high	90.3	Very high	48 Å²	48	46.4 Å²	46.4	34%	0.336	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.4	-167.8	-151.7	0	0	0	0	111.3	H137 E139	H137-S237 PolarHBondContact CE1-OG 3.43Å; E139-S237 WeakPolarHBondContact OE2-CB 3.49Å; E139-S237 PolarHBondContact OE2-OG 3.22Å
238	L	91.4	Very high	90	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	110	-176.5	-179.5	66.8	0	0	0	111	F138 Q177 V227 L230 V240 L291	F138-L238 HydrophobicContact CB-CB 4.28Å; F138-L238 HydrophobicContact CD2-CD2 4.46Å; F138-L238 PolarHBondContact N-O 3.18Å; F138-L238 PolarHBondContact O-N 2.95Å; Q177-L238 HydrophobicContact CB-CD1 4.37Å; Q177-L238 HydrophobicContact CG-CD1 3.73Å; V227-L238 HydrophobicContact CG2-CD2 4.45Å; L230-L238 HydrophobicContact CD2-CB 3.76Å; L230-L238 HydrophobicContact CD2-CD1 4.2Å; L230-L238 HydrophobicContact CD2-CG 4.45Å; L238-V240 HydrophobicContact CD1-CG2 4.31Å; L238-V240 HydrophobicContact CD2-CG2 3.91Å; L238-V240 HydrophobicContact CG-CG2 3.74Å; L238-L291 HydrophobicContact CD2-CD2 4.39Å
239	D	93.1	Very high	89.7	Confident	29 Å²	29	60.5 Å²	60.5	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.7	171.5	-74.8	-37.6	0	0	0	110.5	T135 H137 Q177 Q178	T135-D239 HydrophobicContact CG2-CB 4.17Å; H137-D239 IonicContact CE1-OD1 3Å; H137-D239 IonicContact CG-OD1 3.46Å; H137-D239 IonicContact ND1-OD1 3.41Å; H137-D239 PolarHBondContact ND1-OD1 3.14Å; Q177-D239 WeakPolarHBondContact CA-O 3.43Å; Q178-D239 HydrophobicContact CB-CB 4.05Å; Q178-D239 PolarHBondContact N-O 3.37Å
240	V	93.9	Very high	89.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	113.1	-178.8	-173.7	0	0	0	0	110.8	T135 L136 F138 L175 F176 I206 L238 I242	T135-V240 CarbonylContact C-O 3.47Å; T135-V240 WeakPolarHBondContact CA-O 3.31Å; L136-V240 PolarHBondContact N-O 2.53Å; L136-V240 PolarHBondContact O-N 2.83Å; F138-V240 HydrophobicContact CD2-CG2 3.97Å; F138-V240 HydrophobicContact CE2-CB 4.18Å; F138-V240 HydrophobicContact CE2-CG2 3.85Å; L175-V240 HydrophobicContact CB-CG1 3.84Å; L175-V240 HydrophobicContact CD2-CG1 4.13Å; L175-V240 HydrophobicContact CG-CG1 3.82Å; F176-V240 CarbonylContact O-C 3.11Å; F176-V240 WeakPolarHBondContact O-CA 3.38Å; I206-V240 HydrophobicContact CD1-CG1 4.09Å; I206-V240 HydrophobicContact CD1-CG2 4.03Å; L238-V240 HydrophobicContact CD1-CG2 4.31Å; L238-V240 HydrophobicContact CD2-CG2 3.91Å; L238-V240 HydrophobicContact CG-CG2 3.74Å; V240-I242 HydrophobicContact CG1-CG1 4.38Å
241	R	93.5	Very high	89.3	Confident	63 Å²	63	55.5 Å²	55.5	24%	0.238	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.4	168.7	-174.6	-179.4	68.9	76.4	-1.7	109.7	F176 Q178 E203	F176-R241 HydrophobicContact CB-CB 4.37Å; F176-R241 VanDerWaalsContact CD2-NH2 3.27Å; F176-R241 PolarHBondContact N-O 2.91Å; F176-R241 PolarHBondContact O-N 2.89Å; Q178-R241 HydrophobicContact CG-CB 4.32Å; E203-R241 WeakPolarHBondContact OE1-CD 3.35Å; E203-R241 IonicContact OE1-CZ 2.73Å; E203-R241 IonicContact OE1-NE 3.85Å; E203-R241 PolarHBondContact OE1-NE 3.3Å; E203-R241 IonicContact OE2-CZ 3.31Å; E203-R241 IonicContact OE2-NE 3.18Å; E203-R241 PolarHBondContact OE2-NE 3.01Å; E203-R241 IonicContact OE2-NH2 3.48Å; E203-R241 PolarHBondContact OE2-NH2 2.9Å
242	I	92.9	Very high	89.3	Confident	9 Å²	9	55.2 Å²	55.2	5%	0.046	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.6	179.5	-59.8	162.1	0	0	0	110.3	K134 L136 L157 I173 L175 V240 L254 L256	K134-I242 PolarHBondContact O-N 2.83Å; L136-I242 HydrophobicContact CD1-CD1 3.43Å; L136-I242 VanDerWaalsContact CD1-CD1 3.43Å; L136-I242 HydrophobicContact CG-CD1 3.84Å; L157-I242 HydrophobicContact CD1-CD1 3.74Å; L157-I242 HydrophobicContact CD1-CG1 4.25Å; L157-I242 HydrophobicContact CD1-CG2 4.27Å; L157-I242 HydrophobicContact CD2-CD1 3.73Å; L157-I242 HydrophobicContact CG-CD1 4.43Å; I173-I242 HydrophobicContact CG2-CG2 3.95Å; L175-I242 HydrophobicContact CG-CG1 4.36Å; V240-I242 HydrophobicContact CG1-CG1 4.38Å; I242-L254 HydrophobicContact CG2-CD1 3.56Å; I242-L256 HydrophobicContact CD1-CD2 3.43Å; I242-L256 VanDerWaalsContact CD1-CD2 3.43Å
243	A	93.4	Very high	89.5	Confident	13 Å²	13	54.2 Å²	54.2	11%	0.107	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.8	175.9	0	0	0	0	0	111.1	I173 R174 F176	I173-A243 WeakPolarHBondContact CA-O 3.45Å; R174-A243 HydrophobicContact CB-CB 4.44Å; R174-A243 PolarHBondContact N-O 3.16Å; R174-A243 PolarHBondContact O-N 2.84Å; F176-A243 HydrophobicContact CD2-CB 4.39Å; F176-A243 HydrophobicContact CE2-CB 3.86Å
244	C	92.4	Very high	89.6	Confident	25 Å²	25	51.1 Å²	51.1	17%	0.169	29%	0.291	C	S	.	.			trans	-152.9	97.3	170.4	-177.1	0	0	0	0	108.4	I173 C247 L254	I173-C244 HydrophobicContact CG1-CB 4.05Å; C244-C247 HydrophobicContact CB-CB 3.81Å; C244-C247 WeakPolarHBondContact CB-SG 3.36Å; C244-C247 WeakPolarHBondContact SG-CB 3.5Å; C244-C247 PolarHBondContact SG-N 2.82Å; C244-C247 VanDerWaalsContact SG-N 3.42Å; C244-C247 CovalentContact SG-SG 2.03Å; C244-C247 PolarHBondContact SG-SG 2.59Å; C244-L254 HydrophobicContact CB-CD1 4.24Å
245	D	89.8	Confident	89.7	Confident	114 Å²	114	48.8 Å²	48.8	61%	0.61	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-34.7	-170.5	-50.9	-42.3	0	0	0	111.2	R174	R174-D245 IonicContact NH1-OD2 3.46Å; R174-D245 PolarHBondContact NH1-OD2 3.32Å
246	L	88.9	Confident	89.5	Confident	82 Å²	82	45.6 Å²	45.6	43%	0.429	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	0.9	-176.1	-58.5	176.7	0	0	0	114.4	V171 E249 T250	V171-L246 HydrophobicContact CB-CB 4.31Å; V171-L246 HydrophobicContact CG1-CB 3.79Å; L246-E249 WeakPolarHBondContact CD2-OE2 3.44Å; L246-T250 WeakPolarHBondContact O-CG2 3.19Å; L246-T250 PolarHBondContact O-N 3.16Å; L246-T250 PolarHBondContact O-OG1 3.32Å
247	C	88.5	Confident	88.8	Confident	9 Å²	9	47 Å²	47	6%	0.061	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-47.6	-176.8	-84.3	0	0	0	0	111.5	C244 E249 T250 G251 A252	C244-C247 HydrophobicContact CB-CB 3.81Å; C244-C247 WeakPolarHBondContact CB-SG 3.36Å; C244-C247 WeakPolarHBondContact SG-CB 3.5Å; C244-C247 PolarHBondContact SG-N 2.82Å; C244-C247 VanDerWaalsContact SG-N 3.42Å; C244-C247 CovalentContact SG-SG 2.03Å; C244-C247 PolarHBondContact SG-SG 2.59Å; C247-E249 PolarHBondContact O-N 2.76Å; C247-T250 PolarHBondContact O-N 3.4Å; C247-T250 PolarHBondContact O-OG1 3.38Å; C247-G251 PolarHBondContact O-N 3.02Å; C247-A252 CarbonylContact C-O 3.52Å; C247-A252 CarbonylContact O-C 3.57Å; C247-A252 WeakPolarHBondContact O-CA 3.28Å; C247-A252 PolarHBondContact O-N 3.32Å
248	Q	85.9	Confident	87.2	Confident	177 Å²	177	47.8 Å²	47.8	83%	0.827	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.7	-176.7	-173.9	171.4	-12.7	0	0	112.1	T250 G251	Q248-T250 VanDerWaalsContact C-N 3.27Å; Q248-T250 PolarHBondContact O-N 2.88Å; Q248-G251 PolarHBondContact O-N 3.38Å
249	E	85.3	Confident	85.3	Confident	154 Å²	154	57.7 Å²	57.7	72%	0.72	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-33.3	177.5	-62.9	-179.8	-174.8	0	0	112.4	L246 C247 G251	L246-E249 WeakPolarHBondContact CD2-OE2 3.44Å; C247-E249 PolarHBondContact O-N 2.76Å; E249-G251 VanDerWaalsContact C-N 3.29Å; E249-G251 PolarHBondContact O-N 2.9Å
250	T	84.9	Confident	83.2	Confident	18 Å²	18	66 Å²	66	11%	0.11	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	4.9	179.1	53	0	0	0	0	113.4	T169 V171 L246 C247 Q248 A252	T169-T250 HydrophobicContact CG2-CG2 4.26Å; V171-T250 HydrophobicContact CG1-CG2 3.79Å; L246-T250 WeakPolarHBondContact O-CG2 3.19Å; L246-T250 PolarHBondContact O-N 3.16Å; L246-T250 PolarHBondContact O-OG1 3.32Å; C247-T250 PolarHBondContact O-N 3.4Å; C247-T250 PolarHBondContact O-OG1 3.38Å; Q248-T250 VanDerWaalsContact C-N 3.27Å; Q248-T250 PolarHBondContact O-N 2.88Å; T250-A252 PolarHBondContact O-N 3.37Å
251	G	86.8	Confident	80.6	Confident	23 Å²	23	75.6 Å²	75.6	24%	0.237	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	16.1	-178	0	0	0	0	0	113.9	S162 C247 Q248 E249	S162-G251 PolarHBondContact N-O 3.48Å; S162-G251 PolarHBondContact OG-O 3.16Å; C247-G251 PolarHBondContact O-N 3.02Å; Q248-G251 PolarHBondContact O-N 3.38Å; E249-G251 VanDerWaalsContact C-N 3.29Å; E249-G251 PolarHBondContact O-N 2.9Å
252	A	89.4	Confident	77.9	Confident	6 Å²	6	81.1 Å²	81.1	5%	0.05	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.4	178.1	0	0	0	0	0	111.2	L159 K160 V161 T213 C247 T250	L159-A252 HydrophobicContact CD1-CB 3.87Å; L159-A252 HydrophobicContact CD2-CB 4.35Å; L159-A252 HydrophobicContact CG-CB 4.16Å; K160-A252 CarbonylContact O-C 3.53Å; K160-A252 WeakPolarHBondContact O-CA 3.37Å; V161-A252 HydrophobicContact CG2-CB 4.28Å; T213-A252 HydrophobicContact CG2-CB 4.14Å; C247-A252 CarbonylContact C-O 3.52Å; C247-A252 CarbonylContact O-C 3.57Å; C247-A252 WeakPolarHBondContact O-CA 3.28Å; C247-A252 PolarHBondContact O-N 3.32Å; T250-A252 PolarHBondContact O-N 3.37Å
253	S	90.3	Very high	75.3	Confident	73 Å²	73	90.2 Å²	90.2	51%	0.51	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.5	178.4	-175	0	0	0	0	109.8	K160	K160-S253 WeakPolarHBondContact CB-O 3.36Å; K160-S253 PolarHBondContact N-O 3.19Å; K160-S253 PolarHBondContact O-N 3.11Å
254	L	88.9	Confident	72.8	Confident	28 Å²	28	96.9 Å²	96.9	15%	0.147	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.8	174.6	-73.1	165.1	0	0	0	109.9	L157 L159 I173 I242 C244 L256	L157-L254 HydrophobicContact CB-CD2 4.29Å; L159-L254 HydrophobicContact CB-CD2 4.38Å; L159-L254 HydrophobicContact CD1-CD2 3.79Å; L159-L254 HydrophobicContact CD1-CG 4.01Å; I173-L254 HydrophobicContact CD1-CD1 4.26Å; I173-L254 HydrophobicContact CD1-CD2 3.91Å; I173-L254 HydrophobicContact CD1-CG 4.5Å; I173-L254 HydrophobicContact CG2-CD1 4.36Å; I242-L254 HydrophobicContact CG2-CD1 3.56Å; C244-L254 HydrophobicContact CB-CD1 4.24Å; L254-L256 HydrophobicContact CB-CD2 4.16Å; L254-L256 HydrophobicContact CB-CG 4.43Å; L254-L256 PolarHBondContact O-N 3.27Å
255	V	87.3	Confident	70.6	Confident	18 Å²	18	102.8 Å²	102.8	11%	0.109	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	106.7	171	-177.5	0	0	0	0	107.3	F158 K160 H287 P289	F158-V255 HydrophobicContact CB-CB 4.38Å; F158-V255 HydrophobicContact CD1-CG2 3.78Å; F158-V255 PolarHBondContact O-N 2.77Å; K160-V255 HydrophobicContact CB-CG2 4.15Å; V255-H287 HydrophobicContact CB-CB 4.21Å; V255-H287 HydrophobicContact CG1-CB 3.94Å; V255-H287 HydrophobicContact CG2-CB 4.22Å; V255-P289 WeakPolarHBondContact O-CG 3.23Å
256	L	82.3	Confident	68.3	Low	36 Å²	36	104.2 Å²	104.2	19%	0.188	52%	0.523	C	S	.	.			trans	-98.5	-90.6	177.1	-59.5	-174.9	0	0	0	108.8	K134 L136 I242 L254 P289	K134-L256 HydrophobicContact CB-CD1 4Å; K134-L256 HydrophobicContact CG-CD1 4.24Å; L136-L256 HydrophobicContact CD1-CD2 4.35Å; L136-L256 HydrophobicContact CD2-CB 4.09Å; L136-L256 HydrophobicContact CD2-CD2 4.23Å; L136-L256 HydrophobicContact CG-CD2 4.42Å; I242-L256 HydrophobicContact CD1-CD2 3.43Å; I242-L256 VanDerWaalsContact CD1-CD2 3.43Å; L254-L256 HydrophobicContact CB-CD2 4.16Å; L254-L256 HydrophobicContact CB-CG 4.43Å; L254-L256 PolarHBondContact O-N 3.27Å; L256-P289 WeakPolarHBondContact O-CD 3.46Å
257	L	74.2	Confident	66.5	Low	60 Å²	60	103.4 Å²	103.4	31%	0.314	53%	0.534	S	S	.	.			trans	-146.2	138.5	171.1	-67.4	170.6	0	0	0	108.4	E128 S129 L136 R288	E128-L257 WeakPolarHBondContact O-CD1 3.41Å; S129-L257 VanDerWaalsContact CA-CD1 3.49Å; L136-L257 HydrophobicContact CD2-CG 4.48Å; L257-R288 HydrophobicContact CD2-CG 3.85Å
258	G	58.6	Low	64.3	Low	65 Å²	65	112 Å²	112	67%	0.67	57%	0.573	S	S	*	*			trans	-58.5	151.2	-178.1	0	0	0	0	0	112.3	K260	G258-K260 PolarHBondContact O-N 3.29Å; G258-K260 VanDerWaalsContact O-N 3.07Å
259	K	52.1	Low	62.4	Low	209 Å²	209	107.6 Å²	107.6	91%	0.909	58%	0.576	S	S	*	*			trans	-59.7	115.8	169.9	-68.6	178.6	-179.3	174.1	0	107.4	K261	K259-K261 PolarHBondContact O-N 2.88Å
260	K	47.5	Very low	60	Low	205 Å²	205	108.9 Å²	108.9	89%	0.891	58%	0.579	S	S	*	*			trans	-53.9	111	159.6	-111	-179.8	177.7	174.9	0	105.7	G258 K262	G258-K260 PolarHBondContact O-N 3.29Å; G258-K260 VanDerWaalsContact O-N 3.07Å; K260-K262 PolarHBondContact O-N 2.98Å
261	K	39.1	Very low	58	Low	201 Å²	201	117.7 Å²	117.7	87%	0.874	62%	0.619	S	S	*	*			trans	-56.2	111.8	173.6	-157.8	173.7	-174.2	173.4	0	105.2	K259 K263	K259-K261 PolarHBondContact O-N 2.88Å; K261-K263 PolarHBondContact O-N 3.44Å
262	K	37.5	Very low	55.5	Low	179 Å²	179	125.8 Å²	125.8	78%	0.778	65%	0.647	S	S	*	*			trans	-57.1	113.5	171.9	-162.9	-178.3	-178.3	-169	0	103.8	K260 E264	K260-K262 PolarHBondContact O-N 2.98Å; K262-E264 PolarHBondContact O-N 2.96Å
263	K	38.9	Very low	53	Low	200 Å²	200	134.2 Å²	134.2	87%	0.87	69%	0.686	S	S	*	*			trans	-64.3	92.7	169.4	-162.7	179.8	-177.3	-175.3	0	103.6	K261 D265	K261-K263 PolarHBondContact O-N 3.44Å; K263-D265 PolarHBondContact O-N 2.96Å; K263-D265 VanDerWaalsContact O-N 3.11Å
264	E	39.9	Very low	50.6	Low	153 Å²	153	135.9 Å²	135.9	72%	0.715	70%	0.704	S	S	*	*			trans	-61.1	112.9	164.9	-84	176.2	164.2	0	0	104.6	K262 D266	K262-E264 PolarHBondContact O-N 2.96Å; E264-D266 PolarHBondContact O-N 3.28Å
265	D	46	Very low	48.2	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	73%	0.728	S	S	*	*			trans	-72.2	71.9	174.1	-173.4	39	0	0	0	107.4	K263 G267	K263-D265 PolarHBondContact O-N 2.96Å; K263-D265 VanDerWaalsContact O-N 3.11Å; D265-G267 PolarHBondContact O-N 2.73Å
266	D	42.3	Very low	46	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	77%	0.766	S	S	*	*			trans	-86.7	97.2	159.2	-77.6	-22.3	0	0	0	105.8	E264 E268	E264-D266 PolarHBondContact O-N 3.28Å; D266-E268 PolarHBondContact O-N 2.71Å; D266-E268 VanDerWaalsContact O-N 3.09Å
267	G	51.2	Low	44.1	Very low	64 Å²	64	150.1 Å²	150.1	66%	0.66	78%	0.783	S	S	*	*			trans	-55.6	112.1	173.2	0	0	0	0	0	110.3	D265	D265-G267 PolarHBondContact O-N 2.73Å
268	E	41.1	Very low	43	Very low	189 Å²	189	151.1 Å²	151.1	88%	0.883	79%	0.792	S	S	*	*			trans	-168.8	129.1	130.3	-108.3	176.8	168.5	0	0	109	D266 K270	D266-E268 PolarHBondContact O-N 2.71Å; D266-E268 VanDerWaalsContact O-N 3.09Å; E268-K270 PolarHBondContact O-N 2.75Å; E268-K270 VanDerWaalsContact O-N 3.11Å
269	G	46.3	Very low	42.7	Very low	86 Å²	86	150.1 Å²	150.1	89%	0.887	78%	0.782	S	S	*	*			trans	-61	112.3	-174.9	0	0	0	0	0	112.1
270	K	36	Very low	42.6	Very low	181 Å²	181	147.2 Å²	147.2	79%	0.787	77%	0.771	S	S	*	*			trans	-135.7	116.3	149	-93.6	-176.6	175.1	173.7	0	107.9	E268 K272	E268-K270 PolarHBondContact O-N 2.75Å; E268-K270 VanDerWaalsContact O-N 3.11Å; K270-K272 PolarHBondContact O-N 3.29Å
271	E	41.7	Very low	42.7	Very low	203 Å²	203	142.3 Å²	142.3	95%	0.949	75%	0.751	S	S	*	*			trans	-50.2	105.3	162.7	-70.3	177	152.6	0	0	107.6
272	K	34.3	Very low	43.4	Very low	192 Å²	192	138.7 Å²	138.7	84%	0.835	74%	0.737	S	S	*	*			trans	-97.3	111.3	166	-74.1	-171.8	178.5	178.4	0	106.1	K270	K270-K272 PolarHBondContact O-N 3.29Å
273	E	37	Very low	44.3	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	73%	0.731	S	S	*	*			trans	-41.7	147.1	166.2	-65.5	178.1	145.7	0	0	110.8	G275	E273-G275 PolarHBondContact O-N 3.02Å
274	A	40.3	Very low	45.3	Very low	108 Å²	108	131.4 Å²	131.4	89%	0.893	71%	0.707	S	S	*	*			trans	-37.5	102.4	-178.2	0	0	0	0	0	111.8	E276	A274-E276 PolarHBondContact O-N 3.04Å; A274-E276 VanDerWaalsContact O-N 3.16Å
275	G	39.4	Very low	46.6	Very low	64 Å²	64	129.9 Å²	129.9	66%	0.66	70%	0.7	S	S	*	*			trans	-59.9	118.8	177.9	0	0	0	0	0	109.6	E273 F277	E273-G275 PolarHBondContact O-N 3.02Å; G275-F277 PolarHBondContact O-N 2.86Å; G275-F277 VanDerWaalsContact O-N 3.1Å
276	E	40	Very low	48.2	Very low	190 Å²	190	126.5 Å²	126.5	89%	0.888	69%	0.688	S	S	*	*			trans	-44.7	111.2	169	-159.8	170.1	-175.1	0	0	109.3	A274 T278	A274-E276 PolarHBondContact O-N 3.04Å; A274-E276 VanDerWaalsContact O-N 3.16Å; E276-T278 PolarHBondContact O-N 3.43Å
277	F	42.8	Very low	50.3	Low	126 Å²	126	121.9 Å²	121.9	55%	0.553	66%	0.661	S	S	*	*			trans	-58.9	122.4	172.3	-90.8	-91.3	0	0	0	107.5	G275 G279 E281 E282	G275-F277 PolarHBondContact O-N 2.86Å; G275-F277 VanDerWaalsContact O-N 3.1Å; F277-G279 PolarHBondContact O-N 2.96Å; F277-E281 HydrophobicContact CD1-CB 4.3Å; F277-E282 HydrophobicContact CB-CG 4.39Å
278	T	50.4	Low	52	Low	82 Å²	82	123.3 Å²	123.3	50%	0.503	65%	0.647	S	S	.	*			trans	-62.5	136.3	174.9	61.1	0	0	0	0	108.9	E276 E280 E281	E276-T278 PolarHBondContact O-N 3.43Å; T278-E280 PolarHBondContact O-N 2.79Å; T278-E281 PolarHBondContact O-N 3.36Å
279	G	51.8	Low	54.5	Low	44 Å²	44	114.3 Å²	114.3	45%	0.454	61%	0.605	S	S	.	*	H	α-helix	trans	-61.1	-6.5	-176.8	0	0	0	0	0	115.6	F277 K283	F277-G279 PolarHBondContact O-N 2.96Å; G279-K283 WeakPolarHBondContact O-CD 3.04Å; G279-K283 VanDerWaalsContact O-CG 3.3Å; G279-K283 WeakPolarHBondContact O-CG 3.41Å
280	E	51	Low	56.7	Low	148 Å²	148	112 Å²	112	69%	0.692	57%	0.57	S	S	*	*	H	α-helix	trans	-80.4	-32.6	169.4	-66.5	-166.4	148	0	0	112.7	T278 K283 E284	T278-E280 PolarHBondContact O-N 2.79Å; E280-K283 PolarHBondContact O-N 3.38Å; E280-E284 WeakPolarHBondContact O-CG 3.21Å; E280-E284 PolarHBondContact O-N 2.75Å
281	E	50.2	Low	59.4	Low	101 Å²	101	103.3 Å²	103.3	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-73.4	-38.3	177.7	-71.5	-179.6	163.8	0	0	111.7	F277 T278 K283 E284 Q285	F277-E281 HydrophobicContact CD1-CB 4.3Å; T278-E281 PolarHBondContact O-N 3.36Å; E281-K283 VanDerWaalsContact C-N 3.35Å; E281-E284 PolarHBondContact O-N 2.95Å; E281-Q285 WeakPolarHBondContact O-CG 3.04Å; E281-Q285 PolarHBondContact O-N 3.48Å
282	E	54.1	Low	61.8	Low	125 Å²	125	94.7 Å²	94.7	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-39.8	171.4	-72.7	-170.6	149.8	0	0	112	F277 E284 Q285 S286	F277-E282 HydrophobicContact CB-CG 4.39Å; E282-E284 VanDerWaalsContact C-N 3.32Å; E282-E284 PolarHBondContact O-N 3.15Å; E282-Q285 PolarHBondContact O-N 3.49Å; E282-S286 PolarHBondContact O-N 2.91Å
283	K	54.8	Low	64.4	Low	148 Å²	148	85.6 Å²	85.6	64%	0.643	45%	0.453	S	S	*	.	H	α-helix	trans	-69.6	-25.5	175.7	-78.2	177.1	-177	172.9	0	113.1	G279 E280 E281 S286 H287	G279-K283 WeakPolarHBondContact O-CD 3.04Å; G279-K283 VanDerWaalsContact O-CG 3.3Å; G279-K283 WeakPolarHBondContact O-CG 3.41Å; E280-K283 PolarHBondContact O-N 3.38Å; E281-K283 VanDerWaalsContact C-N 3.35Å; K283-S286 PolarHBondContact O-OG 2.84Å; K283-H287 PolarHBondContact O-CE1 3.37Å; K283-H287 VanDerWaalsContact O-CE1 3.27Å; K283-H287 PolarHBondContact O-ND1 2.99Å
284	E	60.5	Low	66.8	Low	79 Å²	79	79.3 Å²	79.3	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-82.8	-27.4	173.8	-75.8	-172.3	171.7	0	0	112.2	K160 E280 E281 E282 H287	K160-E284 IonicContact NZ-OE1 3.83Å; K160-E284 PolarHBondContact NZ-OE1 3.49Å; E280-E284 WeakPolarHBondContact O-CG 3.21Å; E280-E284 PolarHBondContact O-N 2.75Å; E281-E284 PolarHBondContact O-N 2.95Å; E282-E284 VanDerWaalsContact C-N 3.32Å; E282-E284 PolarHBondContact O-N 3.15Å; E284-H287 PolarHBondContact O-N 3Å
285	Q	67.7	Low	68.8	Low	121 Å²	121	74.2 Å²	74.2	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-65.4	-35.5	171.8	-72.7	177	24.1	0	0	112.8	E281 E282 H287 R288	E281-Q285 WeakPolarHBondContact O-CG 3.04Å; E281-Q285 PolarHBondContact O-N 3.48Å; E282-Q285 PolarHBondContact O-N 3.49Å; Q285-H287 PolarHBondContact O-N 2.76Å; Q285-R288 WeakPolarHBondContact O-CB 3.43Å; Q285-R288 PolarHBondContact O-N 3.21Å
286	S	78.4	Confident	70.8	Confident	77 Å²	77	76.6 Å²	76.6	54%	0.538	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.4	175.7	66	0	0	0	0	113.9	E282 K283	E282-S286 PolarHBondContact O-N 2.91Å; K283-S286 PolarHBondContact O-OG 2.84Å
287	H	86.7	Confident	72.4	Confident	47 Å²	47	71.9 Å²	71.9	22%	0.218	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	16.7	178.4	-62.7	123.9	0	0	0	113.2	F158 W218 V255 K283 E284 Q285	F158-H287 HydrophobicContact CB-CB 3.82Å; F158-H287 HydrophobicContact CD1-CB 3.83Å; F158-H287 AromaticContact CD1-CD2 3.65Å; F158-H287 AromaticContact CD1-CG 3.54Å; F158-H287 AromaticContact CD2-CD2 3.29Å; F158-H287 WeakPolarHBondContact CD2-CD2 3.35Å; F158-H287 AromaticContact CD2-NE2 3.88Å; F158-H287 AromaticContact CE1-CD2 3.7Å; F158-H287 AromaticContact CE1-CE1 3.81Å; F158-H287 AromaticContact CE1-CG 3.78Å; F158-H287 AromaticContact CE1-ND1 3.84Å; F158-H287 AromaticContact CE1-NE2 3.72Å; F158-H287 AromaticContact CE2-CD2 3.35Å; F158-H287 WeakPolarHBondContact CE2-CD2 3.43Å; F158-H287 AromaticContact CE2-NE2 3.39Å; F158-H287 WeakPolarHBondContact CE2-NE2 3.48Å; F158-H287 HydrophobicContact CG-CB 3.8Å; F158-H287 AromaticContact CG-CD2 3.43Å; F158-H287 VanDerWaalsContact CG-CD2 3.43Å; F158-H287 WeakPolarHBondContact CG-CD2 3.42Å; F158-H287 AromaticContact CG-CG 3.64Å; F158-H287 AromaticContact CZ-CD2 3.55Å; F158-H287 AromaticContact CZ-CE1 3.75Å; F158-H287 AromaticContact CZ-NE2 3.29Å; F158-H287 VanDerWaalsContact CZ-NE2 3.29Å; F158-H287 WeakPolarHBondContact CZ-NE2 3.41Å; W218-H287 HydrophobicContact CZ2-CB 4.49Å; V255-H287 HydrophobicContact CB-CB 4.21Å; V255-H287 HydrophobicContact CG1-CB 3.94Å; V255-H287 HydrophobicContact CG2-CB 4.22Å; K283-H287 PolarHBondContact O-CE1 3.37Å; K283-H287 VanDerWaalsContact O-CE1 3.27Å; K283-H287 PolarHBondContact O-ND1 2.99Å; E284-H287 PolarHBondContact O-N 3Å; Q285-H287 PolarHBondContact O-N 2.76Å
288	R	87.8	Confident	73.4	Confident	94 Å²	94	67.5 Å²	67.5	36%	0.355	34%	0.337	S	S	.	.			trans	-60.7	127.2	177.6	-174.7	174.4	-177.3	-174.5	-2.4	110.6	F126 A127 L257 Q285	F126-R288 HydrophobicContact CD1-CB 4.41Å; F126-R288 HydrophobicContact CD1-CG 4.17Å; A127-R288 VanDerWaalsContact O-CZ 3.23Å; A127-R288 PolarHBondContact O-NE 3.13Å; A127-R288 PolarHBondContact O-NH2 2.7Å; L257-R288 HydrophobicContact CD2-CG 3.85Å; Q285-R288 WeakPolarHBondContact O-CB 3.43Å; Q285-R288 PolarHBondContact O-N 3.21Å
289	P	92.3	Very high	73.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.346	C	S	.	.			trans	-58	145.8	175.3	-29.2	37.7	0	0	0	113.4	A127 L136 W156 L157 V255 L256	A127-P289 HydrophobicContact CB-CB 3.95Å; A127-P289 WeakPolarHBondContact CB-O 3.23Å; A127-P289 PolarHBondContact N-O 2.82Å; L136-P289 HydrophobicContact CD1-CB 3.61Å; L136-P289 HydrophobicContact CD1-CG 3.88Å; L136-P289 HydrophobicContact CD2-CG 4.47Å; W156-P289 WeakPolarHBondContact O-CA 3.48Å; L157-P289 HydrophobicContact CD2-CB 3.84Å; L157-P289 HydrophobicContact CD2-CG 4.04Å; V255-P289 WeakPolarHBondContact O-CG 3.23Å; L256-P289 WeakPolarHBondContact O-CD 3.46Å
290	F	93.6	Very high	73.7	Confident	37 Å²	37	75 Å²	75	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.5	174.9	61.3	-88.4	0	0	0	111.4	I124 T125 F126 W156 W218 M292	I124-F290 HydrophobicContact CG2-CB 4.02Å; I124-F290 HydrophobicContact CG2-CD2 3.8Å; I124-F290 HydrophobicContact CG2-CG 4.1Å; T125-F290 CarbonylContact O-C 3.58Å; T125-F290 VanDerWaalsContact O-CA 3.27Å; T125-F290 WeakPolarHBondContact O-CA 3.37Å; F126-F290 HydrophobicContact CD1-CB 3.82Å; F126-F290 HydrophobicContact CE1-CB 4.05Å; F126-F290 HydrophobicContact CE1-CD1 4.25Å; F126-F290 HydrophobicContact CE1-CG 4.42Å; F126-F290 HydrophobicContact CG-CB 4.33Å; W156-F290 HydrophobicContact CB-CD1 4.02Å; W156-F290 HydrophobicContact CB-CD2 4.05Å; W156-F290 HydrophobicContact CB-CE1 3.64Å; W156-F290 HydrophobicContact CB-CE2 3.69Å; W156-F290 HydrophobicContact CB-CG 4.21Å; W156-F290 HydrophobicContact CB-CZ 3.47Å; W156-F290 VanDerWaalsContact CB-CZ 3.47Å; W156-F290 AromaticContact CD1-CE2 3.55Å; W156-F290 HydrophobicContact CD2-CE1 4.43Å; W156-F290 AromaticContact CD2-CE2 3.83Å; W156-F290 HydrophobicContact CD2-CE2 3.83Å; W156-F290 AromaticContact CD2-CZ 3.53Å; W156-F290 HydrophobicContact CD2-CZ 3.53Å; W156-F290 AromaticContact CE3-CZ 3.82Å; W156-F290 HydrophobicContact CE3-CZ 3.82Å; W156-F290 HydrophobicContact CG-CD2 4.11Å; W156-F290 HydrophobicContact CG-CE1 4.09Å; W156-F290 AromaticContact CG-CE2 3.4Å; W156-F290 HydrophobicContact CG-CE2 3.4Å; W156-F290 AromaticContact CG-CZ 3.39Å; W156-F290 HydrophobicContact CG-CZ 3.39Å; W156-F290 PolarHBondContact N-O 3.05Å; W156-F290 PolarHBondContact O-N 3.41Å; W218-F290 HydrophobicContact CH2-CD1 4.3Å; W218-F290 AromaticContact CH2-CE1 3.94Å; W218-F290 HydrophobicContact CH2-CE1 3.94Å; W218-F290 HydrophobicContact CZ3-CD1 4.36Å; W218-F290 AromaticContact CZ3-CE1 3.97Å; W218-F290 HydrophobicContact CZ3-CE1 3.97Å; F290-M292 HydrophobicContact CD2-CB 4.38Å; F290-M292 HydrophobicContact CE2-CB 4.32Å
291	L	92.6	Very high	73.5	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.6	167.1	170	67.1	0	0	0	107.1	I124 T125 F138 I140 A153 E154 V155 V223 V227 L238	I124-L291 CarbonylContact C-O 3.5Å; I124-L291 WeakPolarHBondContact CA-O 3.32Å; T125-L291 PolarHBondContact N-O 2.84Å; T125-L291 PolarHBondContact O-N 2.86Å; F138-L291 HydrophobicContact CD1-CB 3.78Å; F138-L291 HydrophobicContact CE1-CB 3.96Å; F138-L291 HydrophobicContact CG-CB 4.29Å; I140-L291 HydrophobicContact CD1-CD2 4.1Å; I140-L291 HydrophobicContact CG1-CD2 4.06Å; A153-L291 HydrophobicContact CB-CD1 4.42Å; E154-L291 CarbonylContact O-C 3.56Å; E154-L291 WeakPolarHBondContact O-CA 3.3Å; V155-L291 HydrophobicContact CG2-CD1 3.98Å; V223-L291 HydrophobicContact CG2-CD1 3.81Å; V227-L291 HydrophobicContact CG2-CD1 4.26Å; V227-L291 HydrophobicContact CG2-CD2 4.49Å; L238-L291 HydrophobicContact CD2-CD2 4.39Å
292	M	92.9	Very high	73.5	Confident	22 Å²	22	78.8 Å²	78.8	11%	0.108	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.6	167.1	178.2	-83.8	-74.9	0	0	108.3	E122 I123 I124 A153 E154 F290 L294	E122-M292 HydrophobicContact CG-CG 4.35Å; I123-M292 CarbonylContact O-C 3.51Å; I123-M292 WeakPolarHBondContact O-CA 3.28Å; I124-M292 HydrophobicContact CG1-CG 4.39Å; A153-M292 CarbonylContact C-O 3.58Å; A153-M292 VanDerWaalsContact CA-O 3.28Å; A153-M292 WeakPolarHBondContact CA-O 3.45Å; E154-M292 PolarHBondContact N-O 3.31Å; E154-M292 PolarHBondContact O-N 3.46Å; E154-M292 WeakPolarHBondContact OE2-CE 3.5Å; F290-M292 HydrophobicContact CD2-CB 4.38Å; F290-M292 HydrophobicContact CE2-CB 4.32Å; M292-L294 HydrophobicContact SD-CG 4.27Å
293	M	88.1	Confident	73	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	141.6	171.7	60.8	177.8	-69.9	0	0	111.9	E122 I123 I140 V150 H152 A153 V227 L231 A295	E122-M293 WeakPolarHBondContact CA-O 3.08Å; I123-M293 HydrophobicContact CB-CG 3.81Å; I123-M293 HydrophobicContact CG2-CG 4.48Å; I123-M293 PolarHBondContact N-O 2.99Å; I123-M293 PolarHBondContact O-N 2.78Å; I140-M293 HydrophobicContact CD1-SD 4.5Å; I140-M293 HydrophobicContact CG2-SD 3.86Å; V150-M293 HydrophobicContact CG2-CE 4.12Å; H152-M293 CarbonylContact O-C 3.52Å; H152-M293 VanDerWaalsContact O-CA 3.23Å; H152-M293 WeakPolarHBondContact O-CA 3.21Å; A153-M293 HydrophobicContact CB-CB 3.78Å; V227-M293 HydrophobicContact CG1-CE 4.25Å; V227-M293 HydrophobicContact CG1-SD 4.16Å; L231-M293 HydrophobicContact CD1-CE 3.85Å; M293-A295 HydrophobicContact CE-CB 3.62Å
294	L	86.8	Confident	72.5	Confident	53 Å²	53	83 Å²	83	28%	0.277	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122	166.3	-62.7	172	0	0	0	107.7	E122 E151 H152 M292	E122-L294 HydrophobicContact CB-CD2 3.67Å; E122-L294 HydrophobicContact CG-CD2 3.78Å; E151-L294 PolarHBondContact N-O 3.13Å; H152-L294 HydrophobicContact CB-CB 4.13Å; H152-L294 HydrophobicContact CB-CD1 4.2Å; H152-L294 HydrophobicContact CB-CG 4.45Å; H152-L294 PolarHBondContact N-O 3.15Å; H152-L294 PolarHBondContact O-N 3.33Å; M292-L294 HydrophobicContact SD-CG 4.27Å
295	A	83.8	Confident	72	Confident	0 Å²	0	88.1 Å²	88.1	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.2	178.3	0	0	0	0	0	111.2	T120 S121 L147 V149 M293	T120-A295 WeakPolarHBondContact CA-O 3.38Å; S121-A295 PolarHBondContact N-O 2.92Å; S121-A295 PolarHBondContact O-N 3.23Å; S121-A295 VanDerWaalsContact O-N 3.15Å; L147-A295 HydrophobicContact CB-CB 3.64Å; L147-A295 HydrophobicContact CD1-CB 3.49Å; L147-A295 VanDerWaalsContact CD1-CB 3.49Å; L147-A295 HydrophobicContact CG-CB 4.15Å; V149-A295 CarbonylContact O-C 3.48Å; V149-A295 VanDerWaalsContact O-CA 3.32Å; V149-A295 WeakPolarHBondContact O-CA 3.45Å; V149-A295 WeakPolarHBondContact O-CB 3.42Å; M293-A295 HydrophobicContact CE-CB 3.62Å
296	R	81.4	Confident	71.1	Confident	115 Å²	115	89.8 Å²	89.8	43%	0.434	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.9	178.8	62.2	176.5	-177.4	154.2	3.3	109.9	T120 L147 S148 V149 E151 A298	T120-R296 HydrophobicContact CG2-CB 4.18Å; L147-R296 CarbonylContact C-O 3.53Å; S148-R296 PolarHBondContact N-O 2.87Å; S148-R296 VanDerWaalsContact N-O 3.15Å; V149-R296 HydrophobicContact CB-CG 3.74Å; V149-R296 HydrophobicContact CG1-CG 4.42Å; V149-R296 HydrophobicContact CG2-CG 4.48Å; V149-R296 PolarHBondContact N-O 2.84Å; V149-R296 VanDerWaalsContact N-O 3.13Å; V149-R296 PolarHBondContact O-N 3.02Å; E151-R296 HydrophobicContact CG-CG 4.34Å; E151-R296 WeakPolarHBondContact OE1-CD 3.49Å; E151-R296 IonicContact OE1-NE 2.86Å; R296-A298 PolarHBondContact O-N 3.18Å
297	Q	72.5	Confident	69.9	Low	91 Å²	91	92.4 Å²	92.4	43%	0.425	40%	0.398	S	S	.	.			trans	-66.2	123.9	167.6	-71.7	179.4	4.3	0	0	108.5	L147	L147-Q297 HydrophobicContact CD2-CG 3.71Å
298	A	64.1	Low	68.6	Low	34 Å²	34	97.5 Å²	97.5	28%	0.281	42%	0.416	S	S	.	.			trans	-72.2	142.2	168.6	0	0	0	0	0	108.3	V149 R296 D300	V149-A298 HydrophobicContact CG2-CB 4.01Å; R296-A298 PolarHBondContact O-N 3.18Å; A298-D300 PolarHBondContact O-N 3Å
299	E	59	Low	67.5	Low	147 Å²	147	93.8 Å²	93.8	69%	0.687	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-4.4	-176.1	-62.1	-164.9	133.8	0	0	114.1	R308	E299-R308 IonicContact OE1-NH2 3.2Å
300	D	50.3	Low	66.9	Low	137 Å²	137	96.1 Å²	96.1	73%	0.733	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	32.6	-162.3	-153.3	21.8	0	0	0	116.3	A298	A298-D300 PolarHBondContact O-N 3Å
301	R	46	Very low	66.5	Low	164 Å²	164	99.3 Å²	99.3	62%	0.619	43%	0.434	S	S	*	.			trans	-111.4	91	158.4	-74.5	-173.2	177.2	167.1	2.1	109.9	H303	R301-H303 PolarHBondContact O-N 2.79Å
302	Q	49.2	Very low	66.2	Low	163 Å²	163	101.2 Å²	101.2	76%	0.762	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-36.3	124.4	159	-64.3	177.3	-14.9	0	0	109
303	H	44.7	Very low	65.5	Low	178 Å²	178	105.6 Å²	105.6	82%	0.824	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.1	6.9	169	-52.8	-69.4	0	0	0	121	R301	R301-H303 PolarHBondContact O-N 2.79Å
304	R	44.9	Very low	64.7	Low	184 Å²	184	109.3 Å²	109.3	69%	0.694	51%	0.51	S	S	*	.	S	Bend	trans	-112.1	77.8	144.5	-133.8	177	-168.2	-160	5	107.8	E146 R306	E146-R304 IonicContact OE1-CZ 2.73Å; E146-R304 VanDerWaalsContact OE1-CZ 3.31Å; E146-R304 IonicContact OE1-NE 3.43Å; E146-R304 IonicContact OE1-NH1 2.84Å; E146-R304 PolarHBondContact OE1-NH1 2.87Å; E146-R304 VanDerWaalsContact OE1-NH1 3.12Å; E146-R304 IonicContact OE1-NH2 2.83Å; E146-R304 WeakPolarHBondContact OE2-CD 3.48Å; E146-R304 IonicContact OE2-CZ 3.4Å; E146-R304 VanDerWaalsContact OE2-CZ 3.29Å; E146-R304 IonicContact OE2-NE 3.76Å; E146-R304 IonicContact OE2-NH1 2.64Å; E146-R304 PolarHBondContact OE2-NH1 2.89Å; R304-R306 PolarHBondContact O-N 3.13Å
305	R	48.6	Very low	64	Low	186 Å²	186	114.8 Å²	114.8	70%	0.702	53%	0.531	S	S	*	.			trans	-57.6	84.3	175.5	-96.2	-177.3	174.1	178.5	-3.5	108.8	R307 S360	R305-R307 PolarHBondContact O-N 2.91Å; R305-R307 VanDerWaalsContact O-N 3.11Å; R305-S360 PolarHBondContact NH1-OG 2.81Å
306	R	48.8	Very low	63.3	Low	157 Å²	157	119.7 Å²	119.7	59%	0.592	56%	0.561	S	S	*	*			trans	-57.7	114.5	144.4	-155.2	176.3	-175.8	-172.5	-0.3	103.4	R304 R308	R304-R306 PolarHBondContact O-N 3.13Å; R306-R308 PolarHBondContact O-N 2.89Å
307	R	54.8	Low	63.2	Low	131 Å²	131	118.6 Å²	118.6	49%	0.494	56%	0.564	S	S	.	*			trans	-68.5	80.7	-169.5	-65.9	-179.3	-179	-176.9	2.9	108.4	R305 G309	R305-R307 PolarHBondContact O-N 2.91Å; R305-R307 VanDerWaalsContact O-N 3.11Å; R307-G309 PolarHBondContact O-N 3.35Å
308	R	58.5	Low	63.7	Low	155 Å²	155	116.2 Å²	116.2	59%	0.585	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-54.4	132.7	168.9	-64.8	-176.5	-174.8	178.6	-0.8	107.3	E299 R306 L310	E299-R308 IonicContact OE1-NH2 3.2Å; R306-R308 PolarHBondContact O-N 2.89Å; R308-L310 PolarHBondContact O-N 3.34Å
309	G	65.4	Low	64.8	Low	15 Å²	15	114.6 Å²	114.6	16%	0.155	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-53.1	138.6	176.8	0	0	0	0	0	110.9	R307 E420	R307-G309 PolarHBondContact O-N 3.35Å; G309-E420 PolarHBondContact N-OE1 3.33Å
310	L	79.5	Confident	66.1	Low	50 Å²	50	108 Å²	108	26%	0.262	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-63.2	138.4	177.2	-67.8	170.7	0	0	0	110.7	R308 I318 C320 K321 G361	R308-L310 PolarHBondContact O-N 3.34Å; L310-I318 HydrophobicContact CD1-CG2 3.68Å; L310-C320 HydrophobicContact CB-CB 3.87Å; L310-C320 CarbonylContact O-C 3.58Å; L310-C320 VanDerWaalsContact O-CA 3.29Å; L310-C320 WeakPolarHBondContact O-CA 3.4Å; L310-C320 WeakPolarHBondContact O-CB 3.39Å; L310-K321 PolarHBondContact O-N 2.93Å; L310-G361 PolarHBondContact N-O 3.26Å
311	E	85.2	Confident	68	Low	103 Å²	103	102.7 Å²	102.7	48%	0.481	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-99.8	142.1	166.9	-58.4	-160.2	146.6	0	0	110	D313 K321 Q323	E311-D313 PolarHBondContact O-N 3.37Å; E311-D313 VanDerWaalsContact O-N 3.15Å; E311-K321 WeakPolarHBondContact CA-O 3.43Å; E311-K321 WeakPolarHBondContact OE1-CE 3.45Å; E311-K321 IonicContact OE1-NZ 2.71Å; E311-K321 PolarHBondContact OE1-NZ 2.98Å; E311-Q323 PolarHBondContact OE1-NE2 3.14Å; E311-Q323 PolarHBondContact OE2-NE2 2.86Å
312	C	85.1	Confident	70	Confident	40 Å²	40	98.2 Å²	98.2	27%	0.27	47%	0.465	S	S	.	.			trans	-74.7	104.5	-175.3	-56.2	0	0	0	0	111.5	G314 C320 K321 K322	C312-G314 VanDerWaalsContact C-N 3.31Å; C312-C320 WeakPolarHBondContact CA-SG 3.29Å; C312-C320 HydrophobicContact CB-CB 4.09Å; C312-C320 WeakPolarHBondContact CB-SG 3.43Å; C312-C320 WeakPolarHBondContact SG-CB 3.26Å; C312-C320 PolarHBondContact SG-O 3.28Å; C312-C320 CovalentContact SG-SG 2.03Å; C312-C320 PolarHBondContact SG-SG 3.1Å; C312-K321 PolarHBondContact N-O 3.21Å; C312-K321 VanDerWaalsContact SG-C 3.52Å; C312-K321 PolarHBondContact SG-O 3.26Å; C312-K322 HydrophobicContact CB-CB 4.45Å
313	D	79.1	Confident	72	Confident	114 Å²	114	96 Å²	96	61%	0.61	46%	0.455	S	S	*	.			trans	-90	12.2	175.1	-172.6	27.8	0	0	0	112.8	E311 K315	E311-D313 PolarHBondContact O-N 3.37Å; E311-D313 VanDerWaalsContact O-N 3.15Å; D313-K315 PolarHBondContact O-N 2.77Å; D313-K315 IonicContact OD1-NZ 2.76Å; D313-K315 WeakPolarHBondContact OD2-CD 3.39Å; D313-K315 WeakPolarHBondContact OD2-CE 3.45Å; D313-K315 IonicContact OD2-NZ 3.67Å; D313-K315 PolarHBondContact OD2-NZ 3.22Å
314	G	71.9	Confident	74.3	Confident	79 Å²	79	89.1 Å²	89.1	81%	0.814	42%	0.423	S	S	*	.	S	Bend	trans	69.1	-6.2	179.2	0	0	0	0	0	116.2	C312	C312-G314 VanDerWaalsContact C-N 3.31Å
315	K	71.7	Confident	76.6	Confident	167 Å²	167	85.7 Å²	85.7	73%	0.726	41%	0.413	S	S	*	.	S	Bend	trans	-90.5	-20.5	-177.8	-65.8	169.5	-168.2	147.8	0	114.4	D313	D313-K315 PolarHBondContact O-N 2.77Å; D313-K315 IonicContact OD1-NZ 2.76Å; D313-K315 WeakPolarHBondContact OD2-CD 3.39Å; D313-K315 WeakPolarHBondContact OD2-CE 3.45Å; D313-K315 IonicContact OD2-NZ 3.67Å; D313-K315 PolarHBondContact OD2-NZ 3.22Å
316	V	69	Low	78.7	Confident	103 Å²	103	77 Å²	77	62%	0.624	38%	0.381	S	S	*	.			trans	-137.2	132.6	-172.7	-169.5	0	0	0	0	109.9	I318	V316-I318 HydrophobicContact CB-CG2 4.23Å; V316-I318 HydrophobicContact CG1-CB 3.93Å; V316-I318 HydrophobicContact CG1-CG2 3.62Å; V316-I318 PolarHBondContact O-N 2.95Å
317	N	78.9	Confident	80.8	Confident	93 Å²	93	70.6 Å²	70.6	50%	0.497	36%	0.36	S	S	.	.			trans	-88.2	33.2	178.5	-168.9	23.3	0	0	0	112.8	G350 E351	N317-G350 WeakPolarHBondContact OD1-CA 3.45Å; N317-E351 PolarHBondContact ND2-OE1 2.81Å; N317-E351 PolarHBondContact O-N 3.12Å
318	I	83.6	Confident	82.7	Confident	41 Å²	41	64.4 Å²	64.4	21%	0.21	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-91.1	148.3	176.2	-166.7	160.3	0	0	0	109.2	L310 V316 C320	L310-I318 HydrophobicContact CD1-CG2 3.68Å; V316-I318 HydrophobicContact CB-CG2 4.23Å; V316-I318 HydrophobicContact CG1-CB 3.93Å; V316-I318 HydrophobicContact CG1-CG2 3.62Å; V316-I318 PolarHBondContact O-N 2.95Å; I318-C320 PolarHBondContact O-N 2.03Å; I318-C320 VanDerWaalsContact O-N 3.1Å; I318-C320 PolarHBondContact O-SG 2.86Å
319	C	85.8	Confident	84.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	-47.7	117.8	178.4	178.9	0	0	0	0	112.8	E349 E351 C352 C389 G422	C319-E349 CarbonylContact C-O 3.57Å; C319-E349 WeakPolarHBondContact CA-O 3.03Å; C319-E351 PolarHBondContact N-O 3.47Å; C319-C352 VanDerWaalsContact CB-SG 3.59Å; C319-C389 WeakPolarHBondContact CA-SG 3.5Å; C319-C389 HydrophobicContact CB-CB 3.67Å; C319-C389 WeakPolarHBondContact CB-SG 3.37Å; C319-C389 WeakPolarHBondContact SG-CA 3.44Å; C319-C389 WeakPolarHBondContact SG-CB 3.3Å; C319-C389 CovalentContact SG-SG 2.04Å; C319-C389 PolarHBondContact SG-SG 2.68Å; C319-G422 VanDerWaalsContact SG-C 3.59Å; C319-G422 PolarHBondContact SG-O 3.25Å; C319-G422 VanDerWaalsContact SG-O 3.39Å
320	C	86.8	Confident	85.6	Confident	8 Å²	8	70.1 Å²	70.1	5%	0.054	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	161.7	-176	56.4	0	0	0	0	111.1	L310 C312 I318 C348 E349	L310-C320 HydrophobicContact CB-CB 3.87Å; L310-C320 CarbonylContact O-C 3.58Å; L310-C320 VanDerWaalsContact O-CA 3.29Å; L310-C320 WeakPolarHBondContact O-CA 3.4Å; L310-C320 WeakPolarHBondContact O-CB 3.39Å; C312-C320 WeakPolarHBondContact CA-SG 3.29Å; C312-C320 HydrophobicContact CB-CB 4.09Å; C312-C320 WeakPolarHBondContact CB-SG 3.43Å; C312-C320 WeakPolarHBondContact SG-CB 3.26Å; C312-C320 PolarHBondContact SG-O 3.28Å; C312-C320 CovalentContact SG-SG 2.03Å; C312-C320 PolarHBondContact SG-SG 3.1Å; I318-C320 PolarHBondContact O-N 2.03Å; I318-C320 VanDerWaalsContact O-N 3.1Å; I318-C320 PolarHBondContact O-SG 2.86Å; C320-C348 WeakPolarHBondContact O-CA 3.35Å; C320-E349 PolarHBondContact N-O 2.96Å; C320-E349 PolarHBondContact O-N 2.03Å
321	K	89.6	Confident	86.2	Confident	26 Å²	26	68.8 Å²	68.8	11%	0.113	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.4	171.8	179.9	-172.4	66.8	-173	0	109.8	L310 E311 C312 N346 V418 E419 C421	L310-K321 PolarHBondContact O-N 2.93Å; E311-K321 WeakPolarHBondContact CA-O 3.43Å; E311-K321 WeakPolarHBondContact OE1-CE 3.45Å; E311-K321 IonicContact OE1-NZ 2.71Å; E311-K321 PolarHBondContact OE1-NZ 2.98Å; C312-K321 PolarHBondContact N-O 3.21Å; C312-K321 VanDerWaalsContact SG-C 3.52Å; C312-K321 PolarHBondContact SG-O 3.26Å; K321-N346 HydrophobicContact CD-CB 4.25Å; K321-N346 HydrophobicContact CG-CB 4.12Å; K321-V418 WeakPolarHBondContact CD-O 3.49Å; K321-V418 HydrophobicContact CG-CG1 4.4Å; K321-E419 VanDerWaalsContact CD-O 3.28Å; K321-E419 WeakPolarHBondContact CD-O 3.16Å; K321-E419 PolarHBondContact NZ-O 3.48Å; K321-C421 VanDerWaalsContact CA-SG 3.55Å; K321-C421 HydrophobicContact CB-CB 4.46Å
322	K	90	Very high	86.5	Confident	70 Å²	70	65.4 Å²	65.4	30%	0.304	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.1	171.3	-168.9	153.2	163.8	-174.6	0	110.2	C312 N346 Y347 E349	C312-K322 HydrophobicContact CB-CB 4.45Å; K322-N346 VanDerWaalsContact O-CA 3.31Å; K322-N346 WeakPolarHBondContact O-CA 3.47Å; K322-Y347 HydrophobicContact CB-CD1 4.38Å; K322-Y347 HydrophobicContact CB-CD2 4.45Å; K322-Y347 HydrophobicContact CB-CE1 4.02Å; K322-Y347 HydrophobicContact CB-CE2 4.11Å; K322-Y347 HydrophobicContact CD-CE1 4.25Å; K322-Y347 HydrophobicContact CD-CE2 4.09Å; K322-Y347 WeakPolarHBondContact CD-OH 3.19Å; K322-Y347 WeakPolarHBondContact CE-OH 3.45Å; K322-Y347 HydrophobicContact CG-CE1 4Å; K322-Y347 HydrophobicContact CG-CE2 4.47Å; K322-Y347 PolarHBondContact N-O 3.46Å; K322-Y347 PolarHBondContact NZ-OH 2.03Å; K322-Y347 PolarHBondContact O-N 2.89Å; K322-Y347 VanDerWaalsContact O-N 3.13Å; K322-E349 WeakPolarHBondContact CD-OE2 3.36Å; K322-E349 IonicContact NZ-OE1 3.55Å; K322-E349 IonicContact NZ-OE2 3.8Å; K322-E349 PolarHBondContact NZ-OE2 2.04Å
323	Q	90.6	Very high	87	Confident	115 Å²	115	64 Å²	64	54%	0.537	34%	0.343	S	S	.	.			trans	-82.3	128.4	179.8	-63.2	-175.7	4.5	0	0	110.1	E311 N346	E311-Q323 PolarHBondContact OE1-NE2 3.14Å; E311-Q323 PolarHBondContact OE2-NE2 2.86Å; Q323-N346 WeakPolarHBondContact CA-OD1 3.19Å
324	F	91.9	Very high	87.5	Confident	35 Å²	35	61.8 Å²	61.8	15%	0.154	34%	0.336	C	S	.	.			trans	-142.7	102.4	178.3	-176.2	-119	0	0	0	109.7	M54 V55 V58 V326 H344 A345 N346 Y347	M54-F324 HydrophobicContact CB-CE1 4.16Å; M54-F324 HydrophobicContact CB-CZ 4.07Å; V55-F324 HydrophobicContact CG2-CZ 4.16Å; V58-F324 HydrophobicContact CG2-CD1 4.17Å; V58-F324 HydrophobicContact CG2-CE1 3.92Å; F324-V326 HydrophobicContact CD1-CG2 3.65Å; F324-V326 HydrophobicContact CE1-CG2 3.28Å; F324-V326 HydrophobicContact CZ-CG2 3.89Å; F324-H344 CarbonylContact O-C 3.57Å; F324-A345 HydrophobicContact CD1-CB 4.17Å; F324-A345 CarbonylContact O-C 3.6Å; F324-A345 WeakPolarHBondContact O-CA 3.31Å; F324-A345 PolarHBondContact O-N 3.31Å; F324-N346 PolarHBondContact N-OD1 2.87Å; F324-Y347 HydrophobicContact CB-CD1 4.24Å; F324-Y347 HydrophobicContact CB-CE1 4.07Å
325	F	93	Very high	88.4	Confident	111 Å²	111	61.4 Å²	61.4	49%	0.487	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.3	177.8	-178.8	-98.4	0	0	0	110.6	Y343 H344	F325-Y343 WeakPolarHBondContact CD2-O 3.47Å; F325-H344 AromaticContact CD2-CD2 3.95Å; F325-H344 AromaticContact CD2-CE1 3.71Å; F325-H344 AromaticContact CD2-ND1 3.9Å; F325-H344 AromaticContact CD2-NE2 3.73Å
326	V	93	Very high	89.3	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	114.9	177.7	-177.7	0	0	0	0	109.4	V58 F324 I331 G342 Y343 A345	V58-V326 HydrophobicContact CG1-CB 4.43Å; V58-V326 HydrophobicContact CG1-CG1 4.31Å; V58-V326 HydrophobicContact CG1-CG2 4.15Å; V58-V326 HydrophobicContact CG2-CG2 4.26Å; F324-V326 HydrophobicContact CD1-CG2 3.65Å; F324-V326 HydrophobicContact CE1-CG2 3.28Å; F324-V326 HydrophobicContact CZ-CG2 3.89Å; V326-I331 HydrophobicContact CG1-CD1 3.88Å; V326-I331 HydrophobicContact CG1-CG1 4.46Å; V326-I331 HydrophobicContact CG1-CG2 3.6Å; V326-G342 CarbonylContact O-C 3.52Å; V326-G342 WeakPolarHBondContact O-CA 3.2Å; V326-Y343 PolarHBondContact N-O 3.38Å; V326-Y343 PolarHBondContact O-N 2.72Å; V326-A345 HydrophobicContact CG2-CB 4.21Å
327	S	93.8	Very high	90.4	Very high	21 Å²	21	48.8 Å²	48.8	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126	168.8	166.4	0	0	0	0	109.5	K329 D330 I331	S327-K329 PolarHBondContact O-N 2.84Å; S327-K329 PolarHBondContact OG-N 2.67Å; S327-D330 VanDerWaalsContact CB-CG 3.41Å; S327-D330 WeakPolarHBondContact CB-OD2 3.41Å; S327-D330 PolarHBondContact O-N 2.94Å; S327-D330 VanDerWaalsContact OG-CG 3.27Å; S327-D330 PolarHBondContact OG-N 2.98Å; S327-D330 PolarHBondContact OG-OD1 3.34Å; S327-D330 PolarHBondContact OG-OD2 3.21Å; S327-I331 PolarHBondContact O-N 3.16Å
328	F	94.6	Very high	91	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.4	176.3	-63.4	-48.8	0	0	0	112.2	I62 I331 G332 W333 S334 I337 P340 T341 Y343 M399	I62-F328 HydrophobicContact CD1-CE1 3.73Å; I62-F328 HydrophobicContact CD1-CZ 4.46Å; F328-I331 HydrophobicContact CD1-CD1 3.94Å; F328-G332 PolarHBondContact O-N 3.27Å; F328-W333 HydrophobicContact CB-CB 4.31Å; F328-W333 HydrophobicContact CD1-CB 4.5Å; F328-W333 PolarHBondContact O-N 3.3Å; F328-S334 PolarHBondContact O-N 3.47Å; F328-S334 VanDerWaalsContact O-N 3.13Å; F328-I337 HydrophobicContact CD1-CD1 3.77Å; F328-I337 HydrophobicContact CD2-CB 4.27Å; F328-I337 HydrophobicContact CD2-CD1 4.18Å; F328-I337 HydrophobicContact CD2-CG2 3.68Å; F328-I337 HydrophobicContact CE1-CD1 3.8Å; F328-I337 HydrophobicContact CE2-CD1 4.2Å; F328-I337 HydrophobicContact CE2-CG2 3.8Å; F328-I337 HydrophobicContact CG-CB 4.46Å; F328-I337 HydrophobicContact CG-CD1 3.97Å; F328-I337 HydrophobicContact CG-CG2 4.34Å; F328-I337 HydrophobicContact CZ-CD1 4Å; F328-P340 VanDerWaalsContact CD2-O 3.23Å; F328-P340 WeakPolarHBondContact CD2-O 3.3Å; F328-P340 HydrophobicContact CE2-CG 4.38Å; F328-T341 PolarHBondContact N-O 3.18Å; F328-Y343 AromaticContact CE1-CD1 3.77Å; F328-Y343 HydrophobicContact CE1-CD1 3.77Å; F328-Y343 AromaticContact CE1-CE1 3.8Å; F328-Y343 HydrophobicContact CE1-CE1 3.8Å; F328-Y343 HydrophobicContact CE2-CD1 4.3Å; F328-Y343 AromaticContact CZ-CD1 3.41Å; F328-Y343 HydrophobicContact CZ-CD1 3.41Å; F328-Y343 VanDerWaalsContact CZ-CD1 3.41Å; F328-Y343 AromaticContact CZ-CE1 3.81Å; F328-Y343 HydrophobicContact CZ-CE1 3.81Å; F328-Y343 HydrophobicContact CZ-CG 4.44Å; F328-M399 HydrophobicContact CZ-SD 4.38Å
329	K	92.7	Very high	91.2	Very high	159 Å²	159	44 Å²	44	69%	0.691	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-45.2	172.9	-172.3	-178.1	178.8	-175.9	0	111.1	S327 I331 G332	S327-K329 PolarHBondContact O-N 2.84Å; S327-K329 PolarHBondContact OG-N 2.67Å; K329-I331 VanDerWaalsContact C-N 3.3Å; K329-I331 PolarHBondContact O-N 2.96Å; K329-G332 PolarHBondContact O-N 3.28Å; K329-G332 VanDerWaalsContact O-N 3.16Å
330	D	91.3	Very high	91.6	Very high	132 Å²	132	45.6 Å²	45.6	71%	0.706	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-29.7	-173.6	-58	-4.5	0	0	0	111.5	S327	S327-D330 VanDerWaalsContact CB-CG 3.41Å; S327-D330 WeakPolarHBondContact CB-OD2 3.41Å; S327-D330 PolarHBondContact O-N 2.94Å; S327-D330 VanDerWaalsContact OG-CG 3.27Å; S327-D330 PolarHBondContact OG-N 2.98Å; S327-D330 PolarHBondContact OG-OD1 3.34Å; S327-D330 PolarHBondContact OG-OD2 3.21Å
331	I	92.5	Very high	91.8	Very high	21 Å²	21	49 Å²	49	11%	0.108	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	0.4	176.4	74.4	172.5	0	0	0	113.8	V55 K59 V326 S327 F328 K329 W333	V55-I331 HydrophobicContact CG1-CB 4.1Å; V55-I331 HydrophobicContact CG1-CG2 3.55Å; V55-I331 HydrophobicContact CG2-CG2 4.36Å; K59-I331 HydrophobicContact CG-CD1 4.15Å; K59-I331 PolarHBondContact NZ-O 3.46Å; V326-I331 HydrophobicContact CG1-CD1 3.88Å; V326-I331 HydrophobicContact CG1-CG1 4.46Å; V326-I331 HydrophobicContact CG1-CG2 3.6Å; S327-I331 PolarHBondContact O-N 3.16Å; F328-I331 HydrophobicContact CD1-CD1 3.94Å; K329-I331 VanDerWaalsContact C-N 3.3Å; K329-I331 PolarHBondContact O-N 2.96Å; I331-W333 HydrophobicContact CD1-CB 4.12Å; I331-W333 HydrophobicContact CD1-CD2 3.94Å; I331-W333 HydrophobicContact CD1-CE3 4.1Å; I331-W333 HydrophobicContact CD1-CG 3.92Å; I331-W333 HydrophobicContact CG1-CB 3.93Å; I331-W333 HydrophobicContact CG1-CD2 4.48Å; I331-W333 HydrophobicContact CG1-CG 3.95Å
332	G	92.4	Very high	92	Very high	32 Å²	32	48.3 Å²	48.3	33%	0.33	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	30.2	177.3	0	0	0	0	0	115.3	R71 F328 K329	R71-G332 PolarHBondContact NH1-O 3.02Å; R71-G332 PolarHBondContact NH2-O 2.79Å; F328-G332 PolarHBondContact O-N 3.27Å; K329-G332 PolarHBondContact O-N 3.28Å; K329-G332 VanDerWaalsContact O-N 3.16Å
333	W	94.6	Very high	92.1	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.045	24%	0.244	C	C	.	.			trans	-110.9	0.4	-179.1	-78.1	20.2	0	0	0	113.8	K59 I62 L63 F328 I331 D335 W336 I337	K59-W333 VanDerWaalsContact CA-CH2 3.47Å; K59-W333 HydrophobicContact CB-CH2 3.49Å; K59-W333 VanDerWaalsContact CB-CH2 3.49Å; K59-W333 HydrophobicContact CB-CZ2 3.5Å; K59-W333 VanDerWaalsContact CB-CZ2 3.5Å; K59-W333 HydrophobicContact CB-CZ3 4.29Å; K59-W333 HydrophobicContact CD-CH2 4.49Å; K59-W333 HydrophobicContact CD-CZ2 3.73Å; K59-W333 HydrophobicContact CG-CD2 4.25Å; K59-W333 HydrophobicContact CG-CE3 4.45Å; K59-W333 HydrophobicContact CG-CH2 3.68Å; K59-W333 HydrophobicContact CG-CZ2 3.4Å; K59-W333 HydrophobicContact CG-CZ3 4.19Å; K59-W333 VanDerWaalsContact O-CH2 3.31Å; K59-W333 WeakPolarHBondContact O-CH2 3.45Å; I62-W333 HydrophobicContact CB-CZ3 3.85Å; I62-W333 HydrophobicContact CD1-CE3 4.01Å; I62-W333 HydrophobicContact CD1-CZ3 3.62Å; I62-W333 HydrophobicContact CG1-CZ3 4.38Å; I62-W333 HydrophobicContact CG2-CZ3 3.84Å; L63-W333 HydrophobicContact CD1-CH2 4.13Å; L63-W333 HydrophobicContact CD1-CZ2 4.47Å; L63-W333 HydrophobicContact CD2-CH2 4.2Å; L63-W333 HydrophobicContact CG-CH2 3.85Å; F328-W333 HydrophobicContact CB-CB 4.31Å; F328-W333 HydrophobicContact CD1-CB 4.5Å; F328-W333 PolarHBondContact O-N 3.3Å; I331-W333 HydrophobicContact CD1-CB 4.12Å; I331-W333 HydrophobicContact CD1-CD2 3.94Å; I331-W333 HydrophobicContact CD1-CE3 4.1Å; I331-W333 HydrophobicContact CD1-CG 3.92Å; I331-W333 HydrophobicContact CG1-CB 3.93Å; I331-W333 HydrophobicContact CG1-CD2 4.48Å; I331-W333 HydrophobicContact CG1-CG 3.95Å; W333-D335 VanDerWaalsContact C-OD1 3.29Å; W333-D335 WeakPolarHBondContact CA-OD1 3.45Å; W333-D335 PolarHBondContact O-N 3.18Å; W333-W336 AromaticContact CD1-NE1 3.98Å; W333-W336 AromaticContact CD2-CZ2 3.98Å; W333-W336 HydrophobicContact CD2-CZ2 3.98Å; W333-W336 AromaticContact CD2-NE1 3.6Å; W333-W336 AromaticContact CE3-CZ2 3.5Å; W333-W336 HydrophobicContact CE3-CZ2 3.5Å; W333-W336 VanDerWaalsContact CE3-CZ2 3.5Å; W333-W336 AromaticContact CE3-NE1 3.97Å; W333-W336 AromaticContact CG-NE1 3.44Å; W333-W336 HydrophobicContact CH2-CZ2 4.18Å; W333-W336 HydrophobicContact CZ3-CH2 4.43Å; W333-W336 AromaticContact CZ3-CZ2 3.61Å; W333-W336 HydrophobicContact CZ3-CZ2 3.61Å; W333-W336 VanDerWaalsContact O-CD1 3.29Å; W333-W336 PolarHBondContact O-N 3.22Å; W333-I337 HydrophobicContact CB-CD1 4.25Å; W333-I337 HydrophobicContact CE3-CD1 3.81Å; W333-I337 WeakPolarHBondContact O-CB 3.33Å; W333-I337 PolarHBondContact O-N 3.33Å
334	S	90.7	Very high	92.2	Very high	67 Å²	67	43.9 Å²	43.9	47%	0.469	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-3.9	177.9	61.1	0	0	0	0	114.7	F328	F328-S334 PolarHBondContact O-N 3.47Å; F328-S334 VanDerWaalsContact O-N 3.13Å
335	D	89.2	Confident	92.2	Very high	71 Å²	71	42.8 Å²	42.8	38%	0.38	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-35.7	173.9	61.8	-53.4	0	0	0	111.9	R71 I74 W333	R71-D335 IonicContact CZ-OD1 2.76Å; R71-D335 IonicContact CZ-OD2 3.5Å; R71-D335 IonicContact NE-OD1 2.77Å; R71-D335 IonicContact NE-OD2 3.59Å; R71-D335 IonicContact NH2-OD1 3.84Å; R71-D335 PolarHBondContact NH2-OD1 3.37Å; R71-D335 IonicContact NH2-OD2 2.67Å; R71-D335 PolarHBondContact NH2-OD2 3.48Å; I74-D335 VanDerWaalsContact CD1-O 3.26Å; I74-D335 WeakPolarHBondContact CD1-O 3.18Å; W333-D335 VanDerWaalsContact C-OD1 3.29Å; W333-D335 WeakPolarHBondContact CA-OD1 3.45Å; W333-D335 PolarHBondContact O-N 3.18Å
336	W	91.7	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-27.2	-177.8	76	-82.4	0	0	0	113.4	I62 L63 L66 L68 R71 P72 I74 W333 M399 Y401 Y402	I62-W336 HydrophobicContact CG2-CH2 4.46Å; L63-W336 HydrophobicContact CD2-CH2 4.42Å; L66-W336 HydrophobicContact CD1-CH2 3.55Å; L66-W336 HydrophobicContact CD1-CZ3 3.74Å; L68-W336 HydrophobicContact CD1-CH2 4.17Å; L68-W336 HydrophobicContact CD1-CZ3 3.88Å; R71-W336 HydrophobicContact CG-CG 4.4Å; P72-W336 HydrophobicContact CG-CE3 4.11Å; P72-W336 HydrophobicContact CG-CZ3 4.45Å; I74-W336 VanDerWaalsContact CD1-CA 3.43Å; I74-W336 HydrophobicContact CD1-CB 3.38Å; I74-W336 HydrophobicContact CG1-CB 4.23Å; W333-W336 AromaticContact CD1-NE1 3.98Å; W333-W336 AromaticContact CD2-CZ2 3.98Å; W333-W336 HydrophobicContact CD2-CZ2 3.98Å; W333-W336 AromaticContact CD2-NE1 3.6Å; W333-W336 AromaticContact CE3-CZ2 3.5Å; W333-W336 HydrophobicContact CE3-CZ2 3.5Å; W333-W336 VanDerWaalsContact CE3-CZ2 3.5Å; W333-W336 AromaticContact CE3-NE1 3.97Å; W333-W336 AromaticContact CG-NE1 3.44Å; W333-W336 HydrophobicContact CH2-CZ2 4.18Å; W333-W336 HydrophobicContact CZ3-CH2 4.43Å; W333-W336 AromaticContact CZ3-CZ2 3.61Å; W333-W336 HydrophobicContact CZ3-CZ2 3.61Å; W333-W336 VanDerWaalsContact O-CD1 3.29Å; W333-W336 PolarHBondContact O-N 3.22Å; W336-M399 HydrophobicContact CH2-CE 4.3Å; W336-M399 HydrophobicContact CZ3-CE 4.33Å; W336-Y401 AromaticContact CE3-CD2 3.92Å; W336-Y401 HydrophobicContact CE3-CD2 3.92Å; W336-Y401 HydrophobicContact CE3-CG 4.29Å; W336-Y401 AromaticContact CZ3-CD2 3.56Å; W336-Y401 HydrophobicContact CZ3-CD2 3.56Å; W336-Y401 HydrophobicContact CZ3-CE2 4.36Å; W336-Y401 AromaticContact CZ3-CG 3.95Å; W336-Y401 HydrophobicContact CZ3-CG 3.95Å; W336-Y401 CarbonylContact O-C 3.6Å; W336-Y401 WeakPolarHBondContact O-CA 2.98Å; W336-Y401 WeakPolarHBondContact O-CB 3.42Å; W336-Y402 PolarHBondContact O-N 3.09Å
337	I	92.7	Very high	92.2	Very high	4 Å²	4	41 Å²	41	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112.2	168.5	-56.9	176.8	0	0	0	108.2	F328 W333 M399	F328-I337 HydrophobicContact CD1-CD1 3.77Å; F328-I337 HydrophobicContact CD2-CB 4.27Å; F328-I337 HydrophobicContact CD2-CD1 4.18Å; F328-I337 HydrophobicContact CD2-CG2 3.68Å; F328-I337 HydrophobicContact CE1-CD1 3.8Å; F328-I337 HydrophobicContact CE2-CD1 4.2Å; F328-I337 HydrophobicContact CE2-CG2 3.8Å; F328-I337 HydrophobicContact CG-CB 4.46Å; F328-I337 HydrophobicContact CG-CD1 3.97Å; F328-I337 HydrophobicContact CG-CG2 4.34Å; F328-I337 HydrophobicContact CZ-CD1 4Å; W333-I337 HydrophobicContact CB-CD1 4.25Å; W333-I337 HydrophobicContact CE3-CD1 3.81Å; W333-I337 WeakPolarHBondContact O-CB 3.33Å; W333-I337 PolarHBondContact O-N 3.33Å; I337-M399 HydrophobicContact CD1-CE 4.06Å; I337-M399 HydrophobicContact CD1-SD 3.92Å; I337-M399 HydrophobicContact CG1-CE 4.08Å; I337-M399 HydrophobicContact CG1-SD 4.24Å; I337-M399 HydrophobicContact CG2-CG 3.95Å; I337-M399 HydrophobicContact CG2-SD 3.88Å
338	I	89.8	Confident	92	Very high	33 Å²	33	41.4 Å²	41.4	17%	0.169	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-43.4	-177.4	-58.5	159.9	0	0	0	110.1	L83 I87 V101 L400 Y402 I408	L83-I338 HydrophobicContact CD1-CD1 4.16Å; L83-I338 HydrophobicContact CD2-CD1 4.28Å; L83-I338 HydrophobicContact CD2-CG2 4.45Å; I87-I338 HydrophobicContact CD1-CG2 4.31Å; V101-I338 HydrophobicContact CB-CG2 4.44Å; V101-I338 HydrophobicContact CG2-CG2 4.32Å; I338-L400 WeakPolarHBondContact CA-O 3.37Å; I338-L400 HydrophobicContact CB-CB 4.45Å; I338-L400 HydrophobicContact CB-CD2 4.16Å; I338-L400 HydrophobicContact CB-CG 4.14Å; I338-L400 WeakPolarHBondContact CB-O 3.35Å; I338-L400 HydrophobicContact CD1-CD2 4.48Å; I338-L400 HydrophobicContact CD1-CG 4.17Å; I338-L400 HydrophobicContact CG2-CD2 3.91Å; I338-L400 HydrophobicContact CG2-CG 4.44Å; I338-L400 PolarHBondContact N-O 3.24Å; I338-Y402 HydrophobicContact CD1-CD2 3.93Å; I338-Y402 HydrophobicContact CD1-CE2 3.65Å; I338-Y402 HydrophobicContact CG1-CD2 4.03Å; I338-Y402 HydrophobicContact CG1-CE2 3.77Å; I338-I408 HydrophobicContact CD1-CG1 4.17Å; I338-I408 HydrophobicContact CD1-CG2 3.81Å
339	A	88.7	Confident	91.7	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	147.2	176.7	0	0	0	0	0	111.3	V101 I103 M399 L400	V101-A339 HydrophobicContact CB-CB 4.44Å; V101-A339 HydrophobicContact CG1-CB 4.21Å; I103-A339 HydrophobicContact CD1-CB 4.2Å; I103-A339 HydrophobicContact CG1-CB 3.94Å; A339-M399 WeakPolarHBondContact O-CG 3.45Å; A339-L400 HydrophobicContact CB-CB 4.14Å; A339-L400 PolarHBondContact N-O 2.95Å; A339-L400 VanDerWaalsContact N-O 3.14Å; A339-L400 PolarHBondContact O-N 2.98Å
340	P	93.8	Very high	91.4	Very high	33 Å²	33	38.7 Å²	38.7	21%	0.214	23%	0.225	C	C	.	.			cis	-76	-177.9	-4.7	30.5	-30.7	0	0	0	112.1	F328 G342 M397	F328-P340 VanDerWaalsContact CD2-O 3.23Å; F328-P340 WeakPolarHBondContact CD2-O 3.3Å; F328-P340 HydrophobicContact CE2-CG 4.38Å; P340-G342 VanDerWaalsContact C-N 3.3Å; P340-M397 HydrophobicContact CG-CE 3.1Å
341	T	91.7	Very high	90.9	Very high	81 Å²	81	36.8 Å²	36.8	50%	0.497	21%	0.212	S	C	.	.	S	Bend	trans	-75.6	-18.9	178.6	49.6	0	0	0	0	114	Y100 F328	Y100-T341 HydrophobicContact CD2-CG2 4.19Å; Y100-T341 HydrophobicContact CE2-CG2 3.59Å; F328-T341 PolarHBondContact N-O 3.18Å
342	G	93.1	Very high	90.3	Very high	10 Å²	10	36.6 Å²	36.6	10%	0.103	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.3	176.1	-179	0	0	0	0	0	109.8	V326 P340	V326-G342 CarbonylContact O-C 3.52Å; V326-G342 WeakPolarHBondContact O-CA 3.2Å; P340-G342 VanDerWaalsContact C-N 3.3Å
343	Y	93.1	Very high	89.4	Confident	8 Å²	8	38.1 Å²	38.1	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.3	178.7	80.8	-70.6	0	0	0	112.8	V58 I62 F325 V326 F328 A345 M397 M416 I417	V58-Y343 HydrophobicContact CG1-CE1 4.06Å; V58-Y343 WeakPolarHBondContact CG1-OH 3.41Å; I62-Y343 HydrophobicContact CD1-CE1 3.9Å; I62-Y343 HydrophobicContact CG1-CE1 4.22Å; F325-Y343 WeakPolarHBondContact CD2-O 3.47Å; V326-Y343 PolarHBondContact N-O 3.38Å; V326-Y343 PolarHBondContact O-N 2.72Å; F328-Y343 AromaticContact CE1-CD1 3.77Å; F328-Y343 HydrophobicContact CE1-CD1 3.77Å; F328-Y343 AromaticContact CE1-CE1 3.8Å; F328-Y343 HydrophobicContact CE1-CE1 3.8Å; F328-Y343 HydrophobicContact CE2-CD1 4.3Å; F328-Y343 AromaticContact CZ-CD1 3.41Å; F328-Y343 HydrophobicContact CZ-CD1 3.41Å; F328-Y343 VanDerWaalsContact CZ-CD1 3.41Å; F328-Y343 AromaticContact CZ-CE1 3.81Å; F328-Y343 HydrophobicContact CZ-CE1 3.81Å; F328-Y343 HydrophobicContact CZ-CG 4.44Å; Y343-A345 HydrophobicContact CD2-CB 4.39Å; Y343-A345 HydrophobicContact CE1-CB 4.33Å; Y343-A345 HydrophobicContact CE2-CB 3.66Å; Y343-A345 PolarHBondContact O-N 2.6Å; Y343-M397 VanDerWaalsContact CB-CE 3.46Å; Y343-M397 HydrophobicContact CD1-CE 4.47Å; Y343-M397 HydrophobicContact CD2-SD 3.91Å; Y343-M397 HydrophobicContact CG-CE 3.95Å; Y343-M397 HydrophobicContact CG-SD 3.9Å; Y343-M416 HydrophobicContact CE1-CE 4.41Å; Y343-M416 HydrophobicContact CE2-CE 3.77Å; Y343-M416 HydrophobicContact CE2-CG 4.44Å; Y343-I417 HydrophobicContact CD2-CG1 4.32Å
344	H	92.1	Very high	87.7	Confident	85 Å²	85	40 Å²	40	39%	0.394	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	91.8	176	-68	-84.8	0	0	0	110.2	F324 F325 N346	F324-H344 CarbonylContact O-C 3.57Å; F325-H344 AromaticContact CD2-CD2 3.95Å; F325-H344 AromaticContact CD2-CE1 3.71Å; F325-H344 AromaticContact CD2-ND1 3.9Å; F325-H344 AromaticContact CD2-NE2 3.73Å; H344-N346 PolarHBondContact O-N 2.88Å
345	A	92.8	Very high	86	Confident	12 Å²	12	43.9 Å²	43.9	10%	0.099	24%	0.242	C	C	.	.			trans	-76.7	54.2	171.8	0	0	0	0	0	111.2	V58 F324 V326 Y343	V58-A345 HydrophobicContact CG1-CB 4.27Å; V58-A345 HydrophobicContact CG2-CB 3.61Å; F324-A345 HydrophobicContact CD1-CB 4.17Å; F324-A345 CarbonylContact O-C 3.6Å; F324-A345 WeakPolarHBondContact O-CA 3.31Å; F324-A345 PolarHBondContact O-N 3.31Å; V326-A345 HydrophobicContact CG2-CB 4.21Å; Y343-A345 HydrophobicContact CD2-CB 4.39Å; Y343-A345 HydrophobicContact CE1-CB 4.33Å; Y343-A345 HydrophobicContact CE2-CB 3.66Å; Y343-A345 PolarHBondContact O-N 2.6Å
346	N	93.1	Very high	84.3	Confident	21 Å²	21	44.4 Å²	44.4	11%	0.112	24%	0.244	C	C	.	.			trans	-61.1	148	179.8	-59.8	-24.1	0	0	0	110.4	K321 K322 Q323 F324 H344 V418	K321-N346 HydrophobicContact CD-CB 4.25Å; K321-N346 HydrophobicContact CG-CB 4.12Å; K322-N346 VanDerWaalsContact O-CA 3.31Å; K322-N346 WeakPolarHBondContact O-CA 3.47Å; Q323-N346 WeakPolarHBondContact CA-OD1 3.19Å; F324-N346 PolarHBondContact N-OD1 2.87Å; H344-N346 PolarHBondContact O-N 2.88Å; N346-V418 HydrophobicContact CB-CB 3.98Å; N346-V418 WeakPolarHBondContact CB-O 3.1Å; N346-V418 PolarHBondContact ND2-O 3.39Å; N346-V418 WeakPolarHBondContact O-CB 3.42Å; N346-V418 WeakPolarHBondContact O-CG2 3.04Å
347	Y	91.4	Very high	82.1	Confident	58 Å²	58	47.4 Å²	47.4	23%	0.227	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	162.1	179.9	65.5	-85.7	0	0	0	111.4	M54 K322 F324 E349	M54-Y347 HydrophobicContact CE-CD1 3.67Å; M54-Y347 HydrophobicContact CE-CD2 4.45Å; M54-Y347 HydrophobicContact CE-CE1 3.35Å; M54-Y347 HydrophobicContact CE-CE2 4.18Å; M54-Y347 HydrophobicContact CE-CG 4.2Å; K322-Y347 HydrophobicContact CB-CD1 4.38Å; K322-Y347 HydrophobicContact CB-CD2 4.45Å; K322-Y347 HydrophobicContact CB-CE1 4.02Å; K322-Y347 HydrophobicContact CB-CE2 4.11Å; K322-Y347 HydrophobicContact CD-CE1 4.25Å; K322-Y347 HydrophobicContact CD-CE2 4.09Å; K322-Y347 WeakPolarHBondContact CD-OH 3.19Å; K322-Y347 WeakPolarHBondContact CE-OH 3.45Å; K322-Y347 HydrophobicContact CG-CE1 4Å; K322-Y347 HydrophobicContact CG-CE2 4.47Å; K322-Y347 PolarHBondContact N-O 3.46Å; K322-Y347 PolarHBondContact NZ-OH 2.03Å; K322-Y347 PolarHBondContact O-N 2.89Å; K322-Y347 VanDerWaalsContact O-N 3.13Å; F324-Y347 HydrophobicContact CB-CD1 4.24Å; F324-Y347 HydrophobicContact CB-CE1 4.07Å; Y347-E349 HydrophobicContact CD2-CB 4.4Å; Y347-E349 HydrophobicContact CE2-CB 4.08Å; Y347-E349 WeakPolarHBondContact CE2-OE2 3.03Å; Y347-E349 PolarHBondContact OH-OE2 3.04Å
348	C	89.9	Confident	80	Confident	28 Å²	28	49.2 Å²	49.2	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.9	179.4	-58.4	0	0	0	0	110.5	C320 V390 P391 C421	C320-C348 WeakPolarHBondContact O-CA 3.35Å; C348-V390 VanDerWaalsContact SG-C 3.55Å; C348-P391 VanDerWaalsContact SG-N 3.38Å; C348-C421 WeakPolarHBondContact CA-SG 3.29Å; C348-C421 HydrophobicContact CB-CB 3.77Å; C348-C421 WeakPolarHBondContact CB-SG 3.24Å; C348-C421 WeakPolarHBondContact SG-CB 3.42Å; C348-C421 CovalentContact SG-SG 2.03Å; C348-C421 PolarHBondContact SG-SG 3Å
349	E	87.9	Confident	77.8	Confident	80 Å²	80	51.9 Å²	51.9	37%	0.374	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.5	179.2	-166.9	177.4	157.9	0	0	109.5	C319 C320 K322 Y347	C319-E349 CarbonylContact C-O 3.57Å; C319-E349 WeakPolarHBondContact CA-O 3.03Å; C320-E349 PolarHBondContact N-O 2.96Å; C320-E349 PolarHBondContact O-N 2.03Å; K322-E349 WeakPolarHBondContact CD-OE2 3.36Å; K322-E349 IonicContact NZ-OE1 3.55Å; K322-E349 IonicContact NZ-OE2 3.8Å; K322-E349 PolarHBondContact NZ-OE2 2.04Å; Y347-E349 HydrophobicContact CD2-CB 4.4Å; Y347-E349 HydrophobicContact CE2-CB 4.08Å; Y347-E349 WeakPolarHBondContact CE2-OE2 3.03Å; Y347-E349 PolarHBondContact OH-OE2 3.04Å
350	G	86.1	Confident	75.7	Confident	24 Å²	24	54.5 Å²	54.5	25%	0.247	32%	0.324	C	S	.	.	S	Bend	trans	109.7	174.1	176	0	0	0	0	0	114.1	N317	N317-G350 WeakPolarHBondContact OD1-CA 3.45Å
351	E	82.6	Confident	73.7	Confident	92 Å²	92	53.5 Å²	53.5	43%	0.43	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-100	148.5	-174.9	-65	-177.9	-172.7	0	0	112.1	K45 N317 C319 P353	K45-E351 IonicContact NZ-OE1 2.68Å; K45-E351 PolarHBondContact NZ-OE1 3.41Å; N317-E351 PolarHBondContact ND2-OE1 2.81Å; N317-E351 PolarHBondContact O-N 3.12Å; C319-E351 PolarHBondContact N-O 3.47Å; E351-P353 WeakPolarHBondContact O-CD 3.05Å
352	C	78.5	Confident	71.8	Confident	17 Å²	17	50.3 Å²	50.3	12%	0.115	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-108.9	97.5	176.4	-75.8	0	0	0	0	109.8	C319 S354 S387 C388 C423	C319-C352 VanDerWaalsContact CB-SG 3.59Å; C352-S354 PolarHBondContact O-N 3.01Å; C352-S387 WeakPolarHBondContact CB-O 3.21Å; C352-C388 VanDerWaalsContact SG-C 3.59Å; C352-C423 VanDerWaalsContact CA-SG 3.52Å; C352-C423 HydrophobicContact CB-CB 3.7Å; C352-C423 WeakPolarHBondContact CB-SG 3.49Å; C352-C423 WeakPolarHBondContact SG-CA 3.37Å; C352-C423 WeakPolarHBondContact SG-CB 3.46Å; C352-C423 CovalentContact SG-SG 2.03Å; C352-C423 PolarHBondContact SG-SG 2.97Å
353	P	74	Confident	69.9	Low	64 Å²	64	51 Å²	51	42%	0.416	30%	0.304	S	S	.	.			trans	-66.2	133.9	-177.9	24.3	-31.5	0	0	0	111.5	E351 H355 I356	E351-P353 WeakPolarHBondContact O-CD 3.05Å; P353-H355 VanDerWaalsContact C-N 3.26Å; P353-H355 PolarHBondContact O-N 3.08Å; P353-I356 HydrophobicContact CB-CD1 4.15Å; P353-I356 HydrophobicContact CB-CG1 4.22Å; P353-I356 HydrophobicContact CG-CB 4.3Å; P353-I356 HydrophobicContact CG-CD1 3.84Å; P353-I356 HydrophobicContact CG-CG1 4.13Å
354	S	59.9	Low	68.2	Low	52 Å²	52	53.2 Å²	53.2	36%	0.364	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.3	-173.8	46.5	0	0	0	0	115.3	C352	C352-S354 PolarHBondContact O-N 3.01Å
355	H	54.2	Low	66.5	Low	148 Å²	148	51.2 Å²	51.2	69%	0.685	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	5.3	-166.9	-61.7	-61.5	0	0	0	115	P353 A357	P353-H355 VanDerWaalsContact C-N 3.26Å; P353-H355 PolarHBondContact O-N 3.08Å; H355-A357 PolarHBondContact O-N 3.19Å
356	I	52.4	Low	64.9	Low	82 Å²	82	59.9 Å²	59.9	42%	0.421	35%	0.347	S	S	.	.			trans	-102.5	87.3	-176.7	-56.6	-174	0	0	0	109.6	P353 G358 T359	P353-I356 HydrophobicContact CB-CD1 4.15Å; P353-I356 HydrophobicContact CB-CG1 4.22Å; P353-I356 HydrophobicContact CG-CB 4.3Å; P353-I356 HydrophobicContact CG-CD1 3.84Å; P353-I356 HydrophobicContact CG-CG1 4.13Å; I356-G358 PolarHBondContact O-N 3.26Å; I356-T359 VanDerWaalsContact CG2-CB 3.44Å; I356-T359 WeakPolarHBondContact CG2-OG1 3.08Å
357	A	45.8	Very low	63.3	Low	63 Å²	63	65.9 Å²	65.9	52%	0.521	37%	0.374	S	S	.	.	S	Bend	trans	-61.5	99.4	159.4	0	0	0	0	0	109	H355	H355-A357 PolarHBondContact O-N 3.19Å
358	G	50.2	Low	61.9	Low	42 Å²	42	63.3 Å²	63.3	43%	0.433	37%	0.365	S	S	.	.	S	Bend	trans	84	23.6	155.9	0	0	0	0	0	118.6	I356 S360	I356-G358 PolarHBondContact O-N 3.26Å; G358-S360 PolarHBondContact O-N 2.85Å
359	T	42.8	Very low	60.8	Low	88 Å²	88	65.5 Å²	65.5	54%	0.54	38%	0.378	S	S	.	.			trans	-87	114.7	169.8	-37.1	0	0	0	0	111.6	I356	I356-T359 VanDerWaalsContact CG2-CB 3.44Å; I356-T359 WeakPolarHBondContact CG2-OG1 3.08Å
360	S	45.4	Very low	59.8	Low	57 Å²	57	65.5 Å²	65.5	40%	0.399	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	32.9	85.6	156.8	-55.2	0	0	0	0	118.6	R305 G358	R305-S360 PolarHBondContact NH1-OG 2.81Å; G358-S360 PolarHBondContact O-N 2.85Å
361	G	50	Low	58.8	Low	11 Å²	11	66.3 Å²	66.3	11%	0.113	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	115.8	-11.1	148.3	0	0	0	0	0	117.2	L310	L310-G361 PolarHBondContact N-O 3.26Å
362	S	52.2	Low	57.9	Low	14 Å²	14	63 Å²	63	10%	0.098	37%	0.367	C	S	.	.			trans	-87.6	118.1	171.5	-48.1	0	0	0	0	110.1	L364	S362-L364 PolarHBondContact O-N 3.41Å
363	S	52.5	Low	57.3	Low	25 Å²	25	66.3 Å²	66.3	18%	0.175	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	112.1	167.4	58.3	0	0	0	0	108	T392 G422 C423	S363-T392 WeakPolarHBondContact OG-CB 2.85Å; S363-T392 WeakPolarHBondContact OG-CG2 3.36Å; S363-T392 PolarHBondContact OG-OG1 3.1Å; S363-G422 VanDerWaalsContact O-CA 3.3Å; S363-G422 WeakPolarHBondContact O-CA 3.46Å; S363-C423 PolarHBondContact O-N 3.28Å
364	L	58.4	Low	56.8	Low	54 Å²	54	69.1 Å²	69.1	28%	0.283	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.8	171.2	-68.5	172.1	0	0	0	107.6	S362 C423	S362-L364 PolarHBondContact O-N 3.41Å; L364-C423 HydrophobicContact CD2-CB 3.92Å
365	S	56.6	Low	57	Low	43 Å²	43	68.8 Å²	68.8	30%	0.301	37%	0.374	S	S	.	.			trans	-61.5	159.5	171.6	82.5	0	0	0	0	110.3	H367 S368 T369	S365-H367 PolarHBondContact O-N 3.37Å; S365-H367 PolarHBondContact OG-N 3.11Å; S365-S368 WeakPolarHBondContact O-CB 3.47Å; S365-S368 PolarHBondContact O-N 3.33Å; S365-S368 VanDerWaalsContact O-N 3.08Å; S365-S368 PolarHBondContact OG-N 2.93Å; S365-S368 VanDerWaalsContact OG-N 3.1Å; S365-S368 PolarHBondContact OG-OG 3.1Å; S365-T369 PolarHBondContact O-N 2.86Å; S365-T369 PolarHBondContact O-OG1 3.43Å
366	F	59.8	Low	57.4	Low	194 Å²	194	67.5 Å²	67.5	85%	0.851	37%	0.37	S	S	*	.	H	α-helix	trans	-55.1	-41	174.5	-77.1	-78.1	0	0	0	111.5	S368 T369 V370	F366-S368 PolarHBondContact O-N 3.15Å; F366-T369 PolarHBondContact O-N 3.17Å; F366-V370 WeakPolarHBondContact O-CG2 3.49Å; F366-V370 PolarHBondContact O-N 3.49Å
367	H	59.1	Low	58.1	Low	147 Å²	147	71.5 Å²	71.5	68%	0.681	38%	0.38	S	S	*	.	H	α-helix	trans	-61	-44.2	175	-75.4	-75.6	0	0	0	112.2	S365 T369 V370 I371	S365-H367 PolarHBondContact O-N 3.37Å; S365-H367 PolarHBondContact OG-N 3.11Å; H367-T369 VanDerWaalsContact C-N 3.3Å; H367-T369 PolarHBondContact O-N 2.89Å; H367-V370 PolarHBondContact O-N 3.05Å; H367-I371 WeakPolarHBondContact O-CB 3.37Å; H367-I371 VanDerWaalsContact O-CG1 3.24Å; H367-I371 WeakPolarHBondContact O-CG1 3.31Å; H367-I371 PolarHBondContact O-N 3.42Å
368	S	61.6	Low	58.7	Low	5 Å²	5	71.5 Å²	71.5	4%	0.035	39%	0.385	C	S	.	.	H	α-helix	trans	-63.2	-37.4	178.9	-44.3	0	0	0	0	112.2	S365 F366 N372 C423 S424	S365-S368 WeakPolarHBondContact O-CB 3.47Å; S365-S368 PolarHBondContact O-N 3.33Å; S365-S368 VanDerWaalsContact O-N 3.08Å; S365-S368 PolarHBondContact OG-N 2.93Å; S365-S368 VanDerWaalsContact OG-N 3.1Å; S365-S368 PolarHBondContact OG-OG 3.1Å; F366-S368 PolarHBondContact O-N 3.15Å; S368-N372 WeakPolarHBondContact O-CB 3.33Å; S368-N372 PolarHBondContact O-N 3.46Å; S368-C423 PolarHBondContact OG-O 3.14Å; S368-C423 VanDerWaalsContact OG-O 3.12Å; S368-S424 VanDerWaalsContact CB-OXT 3.27Å; S368-S424 WeakPolarHBondContact CB-OXT 3.26Å; S368-S424 WeakPolarHBondContact OG-CA 3.47Å; S368-S424 PolarHBondContact OG-OXT 3.48Å
369	T	66.9	Low	59.1	Low	74 Å²	74	74.6 Å²	74.6	45%	0.454	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-46.4	176	-56.8	0	0	0	0	111.3	S365 F366 H367 H373	S365-T369 PolarHBondContact O-N 2.86Å; S365-T369 PolarHBondContact O-OG1 3.43Å; F366-T369 PolarHBondContact O-N 3.17Å; H367-T369 VanDerWaalsContact C-N 3.3Å; H367-T369 PolarHBondContact O-N 2.89Å; T369-H373 WeakPolarHBondContact O-CB 3.48Å; T369-H373 PolarHBondContact O-N 3.39Å
370	V	66.3	Low	59.7	Low	80 Å²	80	75.4 Å²	75.4	49%	0.485	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-49.9	177.3	175.3	0	0	0	0	110.4	F366 H367 N372 H373 Y374	F366-V370 WeakPolarHBondContact O-CG2 3.49Å; F366-V370 PolarHBondContact O-N 3.49Å; H367-V370 PolarHBondContact O-N 3.05Å; V370-N372 PolarHBondContact O-N 3.2Å; V370-H373 VanDerWaalsContact O-CB 3.32Å; V370-H373 WeakPolarHBondContact O-CB 3.41Å; V370-H373 PolarHBondContact O-N 3.3Å; V370-H373 VanDerWaalsContact O-N 3.1Å; V370-Y374 HydrophobicContact CG1-CD2 3.84Å; V370-Y374 HydrophobicContact CG1-CE2 3.75Å; V370-Y374 VanDerWaalsContact O-CD2 3.29Å; V370-Y374 WeakPolarHBondContact O-CD2 3.32Å; V370-Y374 PolarHBondContact O-N 3.24Å
371	I	65.4	Low	60.3	Low	40 Å²	40	77 Å²	77	21%	0.205	41%	0.407	C	S	.	.	H	α-helix	trans	-61.1	-44	-179.4	-66.8	165.5	0	0	0	111	H367 H373 Y374 R375 F382	H367-I371 WeakPolarHBondContact O-CB 3.37Å; H367-I371 VanDerWaalsContact O-CG1 3.24Å; H367-I371 WeakPolarHBondContact O-CG1 3.31Å; H367-I371 PolarHBondContact O-N 3.42Å; I371-H373 VanDerWaalsContact C-N 3.3Å; I371-H373 PolarHBondContact O-N 3.02Å; I371-Y374 PolarHBondContact O-N 2.91Å; I371-R375 VanDerWaalsContact CG2-CZ 3.45Å; I371-R375 WeakPolarHBondContact O-CG 3.28Å; I371-R375 PolarHBondContact O-N 3.44Å; I371-F382 HydrophobicContact CG2-CB 4.4Å
372	N	62.9	Low	60.5	Low	24 Å²	24	80.3 Å²	80.3	13%	0.128	42%	0.418	C	S	.	.	H	α-helix	trans	-61.7	-39.8	175.8	-170.3	42.3	0	0	0	111.5	S368 V370 Y374 R375 M376	S368-N372 WeakPolarHBondContact O-CB 3.33Å; S368-N372 PolarHBondContact O-N 3.46Å; V370-N372 PolarHBondContact O-N 3.2Å; N372-Y374 VanDerWaalsContact C-N 3.35Å; N372-Y374 PolarHBondContact O-N 3.43Å; N372-R375 PolarHBondContact O-N 2.99Å; N372-M376 WeakPolarHBondContact O-CB 3.34Å; N372-M376 VanDerWaalsContact O-CG 3.24Å; N372-M376 WeakPolarHBondContact O-CG 2.96Å; N372-M376 PolarHBondContact O-N 3.05Å
373	H	66.3	Low	60.7	Low	85 Å²	85	83.2 Å²	83.2	39%	0.394	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-43.5	175	-163.2	-28.6	0	0	0	112	T369 V370 I371 R377	T369-H373 WeakPolarHBondContact O-CB 3.48Å; T369-H373 PolarHBondContact O-N 3.39Å; V370-H373 VanDerWaalsContact O-CB 3.32Å; V370-H373 WeakPolarHBondContact O-CB 3.41Å; V370-H373 PolarHBondContact O-N 3.3Å; V370-H373 VanDerWaalsContact O-N 3.1Å; I371-H373 VanDerWaalsContact C-N 3.3Å; I371-H373 PolarHBondContact O-N 3.02Å; H373-R377 PolarHBondContact CE1-NE 2.64Å; H373-R377 PolarHBondContact CE1-NH1 3.1Å; H373-R377 PolarHBondContact CE1-NH2 3.29Å; H373-R377 PolarHBondContact ND1-NH1 2.96Å; H373-R377 PolarHBondContact NE2-NH1 3.47Å; H373-R377 PolarHBondContact NE2-NH2 3.04Å; H373-R377 PolarHBondContact O-N 3.49Å
374	Y	64.3	Low	60.9	Low	124 Å²	124	89.4 Å²	89.4	49%	0.486	47%	0.474	S	S	.	.	H	α-helix	trans	-67.4	-38.7	177.4	-84.3	-84.6	0	0	0	112.5	V370 I371 N372 R377 G378 H379	V370-Y374 HydrophobicContact CG1-CD2 3.84Å; V370-Y374 HydrophobicContact CG1-CE2 3.75Å; V370-Y374 VanDerWaalsContact O-CD2 3.29Å; V370-Y374 WeakPolarHBondContact O-CD2 3.32Å; V370-Y374 PolarHBondContact O-N 3.24Å; I371-Y374 PolarHBondContact O-N 2.91Å; N372-Y374 VanDerWaalsContact C-N 3.35Å; N372-Y374 PolarHBondContact O-N 3.43Å; Y374-R377 PolarHBondContact O-N 3.44Å; Y374-G378 PolarHBondContact O-N 2.88Å; Y374-H379 HydrophobicContact CD1-CB 4.23Å; Y374-H379 PolarHBondContact O-N 3.31Å
375	R	64.1	Low	61.2	Low	45 Å²	45	90.9 Å²	90.9	17%	0.17	48%	0.482	C	S	.	.	H	α-helix	trans	-62.8	-46.4	174.3	-71.9	-178.4	-170.6	137.6	4.4	112.2	I371 N372 R377 G378 F382 L385	I371-R375 VanDerWaalsContact CG2-CZ 3.45Å; I371-R375 WeakPolarHBondContact O-CG 3.28Å; I371-R375 PolarHBondContact O-N 3.44Å; N372-R375 PolarHBondContact O-N 2.99Å; R375-R377 PolarHBondContact O-N 3.35Å; R375-G378 PolarHBondContact O-N 2.7Å; R375-F382 HydrophobicContact CG-CB 4.3Å; R375-F382 PolarHBondContact NE-O 2.94Å; R375-L385 PolarHBondContact NH2-O 3.49Å
376	M	62.2	Low	61.8	Low	120 Å²	120	97.9 Å²	97.9	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-63	-28.3	178.8	-70.2	-66.6	-72.2	0	0	112.6	N372 G378	N372-M376 WeakPolarHBondContact O-CB 3.34Å; N372-M376 VanDerWaalsContact O-CG 3.24Å; N372-M376 WeakPolarHBondContact O-CG 2.96Å; N372-M376 PolarHBondContact O-N 3.05Å; M376-G378 VanDerWaalsContact C-N 3.27Å; M376-G378 PolarHBondContact O-N 2.98Å
377	R	67.9	Low	62.5	Low	167 Å²	167	89.7 Å²	89.7	63%	0.63	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	10.2	173.7	-73.9	-170.6	171.7	130.3	3.6	113.7	H373 Y374 R375 H379	H373-R377 PolarHBondContact CE1-NE 2.64Å; H373-R377 PolarHBondContact CE1-NH1 3.1Å; H373-R377 PolarHBondContact CE1-NH2 3.29Å; H373-R377 PolarHBondContact ND1-NH1 2.96Å; H373-R377 PolarHBondContact NE2-NH1 3.47Å; H373-R377 PolarHBondContact NE2-NH2 3.04Å; H373-R377 PolarHBondContact O-N 3.49Å; Y374-R377 PolarHBondContact O-N 3.44Å; R375-R377 PolarHBondContact O-N 3.35Å; R377-H379 VanDerWaalsContact C-N 3.25Å; R377-H379 PolarHBondContact O-N 3.32Å; R377-H379 PolarHBondContact O-ND1 2.55Å
378	G	57	Low	63.5	Low	62 Å²	62	83.8 Å²	83.8	64%	0.639	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	15.4	175.3	0	0	0	0	0	115.1	Y374 R375 M376 S380	Y374-G378 PolarHBondContact O-N 2.88Å; R375-G378 PolarHBondContact O-N 2.7Å; M376-G378 VanDerWaalsContact C-N 3.27Å; M376-G378 PolarHBondContact O-N 2.98Å; G378-S380 PolarHBondContact O-N 2.94Å
379	H	59.6	Low	64.7	Low	107 Å²	107	85 Å²	85	50%	0.495	46%	0.456	S	S	.	.			trans	-78.3	114.2	175.9	-70	58.1	0	0	0	108.6	Y374 R377 P381	Y374-H379 HydrophobicContact CD1-CB 4.23Å; Y374-H379 PolarHBondContact O-N 3.31Å; R377-H379 VanDerWaalsContact C-N 3.25Å; R377-H379 PolarHBondContact O-N 3.32Å; R377-H379 PolarHBondContact O-ND1 2.55Å; H379-P381 VanDerWaalsContact O-CD 3.26Å; H379-P381 WeakPolarHBondContact O-CD 3.38Å
380	S	54.4	Low	65.6	Low	105 Å²	105	82.5 Å²	82.5	73%	0.734	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	11.7	-160.2	62.8	0	0	0	0	119.7	G378 F382	G378-S380 PolarHBondContact O-N 2.94Å; S380-F382 VanDerWaalsContact C-N 3.27Å; S380-F382 PolarHBondContact O-N 3.4Å
381	P	58	Low	66.7	Low	92 Å²	92	81.4 Å²	81.4	60%	0.597	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-11.6	171.6	14.7	-7.7	0	0	0	113.9	H379	H379-P381 VanDerWaalsContact O-CD 3.26Å; H379-P381 WeakPolarHBondContact O-CD 3.38Å
382	F	55.4	Low	67.6	Low	80 Å²	80	82.4 Å²	82.4	35%	0.351	44%	0.444	S	S	.	.	S	Bend	trans	-124	12.4	-170.6	-54.5	-69	0	0	0	116.1	I371 R375 S380 N384 L385	I371-F382 HydrophobicContact CG2-CB 4.4Å; R375-F382 HydrophobicContact CG-CB 4.3Å; R375-F382 PolarHBondContact NE-O 2.94Å; S380-F382 VanDerWaalsContact C-N 3.27Å; S380-F382 PolarHBondContact O-N 3.4Å; F382-N384 VanDerWaalsContact C-N 3.25Å; F382-N384 PolarHBondContact O-N 3.33Å; F382-L385 HydrophobicContact CD1-CD1 4.14Å; F382-L385 HydrophobicContact CD1-CD2 4.06Å; F382-L385 PolarHBondContact O-N 2.87Å
383	A	55.3	Low	68.7	Low	75 Å²	75	83.9 Å²	83.9	62%	0.62	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-27	-177.4	0	0	0	0	0	113.6
384	N	58	Low	69.8	Low	154 Å²	154	82.8 Å²	82.8	82%	0.824	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	1.3	-177.5	-61.1	-24.3	0	0	0	113.9	F382 K386	F382-N384 VanDerWaalsContact C-N 3.25Å; F382-N384 PolarHBondContact O-N 3.33Å; N384-K386 PolarHBondContact O-N 2.9Å
385	L	64.6	Low	71.1	Confident	86 Å²	86	78.9 Å²	78.9	45%	0.45	43%	0.43	S	S	.	.			trans	-81.9	112.9	177.9	-89	76	0	0	0	109.4	R375 F382	R375-L385 PolarHBondContact NH2-O 3.49Å; F382-L385 HydrophobicContact CD1-CD1 4.14Å; F382-L385 HydrophobicContact CD1-CD2 4.06Å; F382-L385 PolarHBondContact O-N 2.87Å
386	K	68.3	Low	72.4	Confident	190 Å²	190	77.9 Å²	77.9	83%	0.826	43%	0.43	S	S	*	.			trans	-75.7	136.5	171.2	-67.3	-175.7	178.5	-179.4	0	109.8	N384	N384-K386 PolarHBondContact O-N 2.9Å
387	S	75	Confident	73.8	Confident	22 Å²	22	72.7 Å²	72.7	15%	0.154	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-76.1	142.3	169.3	-78.2	0	0	0	0	110.4	C352 S424	C352-S387 WeakPolarHBondContact CB-O 3.21Å; S387-S424 WeakPolarHBondContact CA-O 3.48Å; S387-S424 WeakPolarHBondContact CB-O 3.45Å; S387-S424 PolarHBondContact OG-O 3.21Å
388	C	81.1	Confident	74.9	Confident	22 Å²	22	64.8 Å²	64.8	15%	0.149	37%	0.374	C	S	.	.			trans	-108.2	146.1	-179.6	-64.5	0	0	0	0	110.2	C352 V390 C423 S424	C352-C388 VanDerWaalsContact SG-C 3.59Å; C388-V390 HydrophobicContact CB-CG1 4.04Å; C388-V390 PolarHBondContact O-N 3.48Å; C388-C423 WeakPolarHBondContact O-CA 3.23Å; C388-S424 PolarHBondContact N-O 3.26Å; C388-S424 PolarHBondContact O-N 3.19Å; C388-S424 PolarHBondContact O-OG 3.47Å
389	C	85.4	Confident	76.6	Confident	30 Å²	30	61.9 Å²	61.9	20%	0.203	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112	171.8	-171.7	0	0	0	0	108.7	C319	C319-C389 WeakPolarHBondContact CA-SG 3.5Å; C319-C389 HydrophobicContact CB-CB 3.67Å; C319-C389 WeakPolarHBondContact CB-SG 3.37Å; C319-C389 WeakPolarHBondContact SG-CA 3.44Å; C319-C389 WeakPolarHBondContact SG-CB 3.3Å; C319-C389 CovalentContact SG-SG 2.04Å; C319-C389 PolarHBondContact SG-SG 2.68Å
390	V	86.3	Confident	78	Confident	23 Å²	23	56.9 Å²	56.9	14%	0.139	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	154.7	-173.7	-60.5	0	0	0	0	111.3	C348 C388 T392 C421 G422	C348-V390 VanDerWaalsContact SG-C 3.55Å; C388-V390 HydrophobicContact CB-CG1 4.04Å; C388-V390 PolarHBondContact O-N 3.48Å; V390-T392 PolarHBondContact O-N 3.41Å; V390-C421 WeakPolarHBondContact O-CA 3.32Å; V390-G422 PolarHBondContact N-O 3.13Å; V390-G422 PolarHBondContact O-N 3.23Å
391	P	89.3	Confident	79.8	Confident	57 Å²	57	52.3 Å²	52.3	37%	0.37	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	129.6	170.6	-22.3	33.6	0	0	0	111	C348 L394 V418 E420	C348-P391 VanDerWaalsContact SG-N 3.38Å; P391-L394 HydrophobicContact CB-CD1 4.23Å; P391-L394 HydrophobicContact CB-CD2 3.72Å; P391-L394 HydrophobicContact CB-CG 3.94Å; P391-L394 HydrophobicContact CG-CD2 4.33Å; P391-V418 HydrophobicContact CB-CG1 4.09Å; P391-V418 HydrophobicContact CB-CG2 4.13Å; P391-V418 HydrophobicContact CG-CG1 4.38Å; P391-V418 HydrophobicContact CG-CG2 3.9Å; P391-E420 WeakPolarHBondContact CA-O 3.47Å
392	T	84.5	Confident	81.2	Confident	60 Å²	60	48.4 Å²	48.4	37%	0.368	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-25.8	176.5	49.2	0	0	0	0	112.4	S363 V390 E420	S363-T392 WeakPolarHBondContact OG-CB 2.85Å; S363-T392 WeakPolarHBondContact OG-CG2 3.36Å; S363-T392 PolarHBondContact OG-OG1 3.1Å; V390-T392 PolarHBondContact O-N 3.41Å; T392-E420 PolarHBondContact N-O 3.36Å; T392-E420 PolarHBondContact OG1-O 3.31Å
393	K	85.9	Confident	82.5	Confident	56 Å²	56	46.7 Å²	46.7	24%	0.243	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.2	172.1	-164.3	-178.8	-178.7	-132.8	0	109.8	E115 E419 E420	E115-K393 IonicContact OE1-NZ 3.13Å; E115-K393 PolarHBondContact OE1-NZ 2.98Å; E115-K393 IonicContact OE2-NZ 3.23Å; E115-K393 PolarHBondContact OE2-NZ 3.42Å; K393-E419 HydrophobicContact CB-CB 4.23Å; K393-E419 HydrophobicContact CD-CB 4.26Å; K393-E419 WeakPolarHBondContact CD-OE2 3.24Å; K393-E419 VanDerWaalsContact CE-OE2 3.23Å; K393-E419 WeakPolarHBondContact CE-OE2 3.47Å; K393-E419 HydrophobicContact CG-CB 4.22Å; K393-E419 IonicContact NZ-OE2 3.5Å; K393-E419 PolarHBondContact NZ-OE2 3.48Å; K393-E419 PolarHBondContact O-N 3.17Å; K393-E420 HydrophobicContact CB-CB 3.75Å; K393-E420 HydrophobicContact CB-CG 3.94Å; K393-E420 HydrophobicContact CD-CG 4.25Å; K393-E420 PolarHBondContact N-O 3.44Å; K393-E420 PolarHBondContact O-N 2.82Å
394	L	89.6	Confident	83.6	Confident	62 Å²	62	48.1 Å²	48.1	33%	0.325	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.1	-179	-67.3	159.2	0	0	0	109.3	P391 N415 I417 V418	P391-L394 HydrophobicContact CB-CD1 4.23Å; P391-L394 HydrophobicContact CB-CD2 3.72Å; P391-L394 HydrophobicContact CB-CG 3.94Å; P391-L394 HydrophobicContact CG-CD2 4.33Å; L394-N415 HydrophobicContact CB-CB 4.31Å; L394-N415 HydrophobicContact CD1-CB 3.91Å; L394-I417 CarbonylContact C-O 3.5Å; L394-I417 VanDerWaalsContact CA-O 3.3Å; L394-I417 WeakPolarHBondContact CA-O 3.12Å; L394-V418 HydrophobicContact CD2-CB 4.37Å; L394-V418 HydrophobicContact CD2-CG2 3.73Å
395	R	90.8	Very high	84.5	Confident	41 Å²	41	43 Å²	43	16%	0.155	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.1	177.2	-170.8	168.6	55.4	116.4	-7	111.4	G108 A111 E112 M416 I417 E419	G108-R395 PolarHBondContact O-NH1 3.22Å; A111-R395 HydrophobicContact CB-CG 3.85Å; E112-R395 IonicContact OE1-CZ 2.82Å; E112-R395 IonicContact OE1-NH1 2.59Å; E112-R395 PolarHBondContact OE1-NH1 3.28Å; E112-R395 IonicContact OE1-NH2 2.91Å; E112-R395 PolarHBondContact OE1-NH2 2.84Å; R395-M416 PolarHBondContact O-N 3.02Å; R395-I417 HydrophobicContact CB-CB 4.36Å; R395-I417 PolarHBondContact N-O 3.35Å; R395-I417 PolarHBondContact O-N 2.92Å; R395-E419 HydrophobicContact CB-CG 3.88Å; R395-E419 WeakPolarHBondContact CB-OE1 3.16Å; R395-E419 WeakPolarHBondContact CD-OE1 2.97Å; R395-E419 IonicContact NE-OE1 3.56Å; R395-E419 PolarHBondContact NE-OE1 3.31Å
396	P	92.5	Very high	84.9	Confident	25 Å²	25	42.5 Å²	42.5	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	161.2	171.6	29.9	-38.1	0	0	0	112.1	V107 G108 A111 I413	V107-P396 HydrophobicContact CB-CB 4.48Å; V107-P396 HydrophobicContact CB-CG 4.49Å; V107-P396 HydrophobicContact CG1-CB 3.82Å; V107-P396 HydrophobicContact CG1-CG 3.61Å; G108-P396 WeakPolarHBondContact CA-O 3.41Å; A111-P396 HydrophobicContact CB-CG 3.89Å; P396-I413 CarbonylContact C-O 3.56Å; P396-I413 WeakPolarHBondContact CA-O 3.43Å; P396-I413 WeakPolarHBondContact CB-O 3.27Å
397	M	91.8	Very high	85.5	Confident	10 Å²	10	38.3 Å²	38.3	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	134.7	178.4	178.8	-171.7	170.7	0	0	109.9	P340 Y343 I413 M416 I417	P340-M397 HydrophobicContact CG-CE 3.1Å; Y343-M397 VanDerWaalsContact CB-CE 3.46Å; Y343-M397 HydrophobicContact CD1-CE 4.47Å; Y343-M397 HydrophobicContact CD2-SD 3.91Å; Y343-M397 HydrophobicContact CG-CE 3.95Å; Y343-M397 HydrophobicContact CG-SD 3.9Å; M397-I413 PolarHBondContact N-O 2.97Å; M397-I413 WeakPolarHBondContact O-CB 3.03Å; M397-I413 PolarHBondContact O-N 3.44Å; M397-M416 HydrophobicContact CB-CB 3.91Å; M397-M416 HydrophobicContact CB-CG 3.98Å; M397-M416 HydrophobicContact SD-CG 3.91Å; M397-I417 HydrophobicContact CB-CD1 4.18Å; M397-I417 HydrophobicContact CB-CG1 4.48Å; M397-I417 HydrophobicContact CG-CD1 4.39Å; M397-I417 HydrophobicContact SD-CD1 4.28Å; M397-I417 HydrophobicContact SD-CG1 4.49Å
398	S	90.9	Very high	86	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	140.2	171.8	-61.1	0	0	0	0	111	I103 D106 V107 K411 D412	I103-S398 WeakPolarHBondContact CD1-O 3.49Å; D106-S398 WeakPolarHBondContact OD1-CB 3.4Å; D106-S398 PolarHBondContact OD1-N 3.16Å; D106-S398 PolarHBondContact OD1-OG 3.21Å; V107-S398 PolarHBondContact N-OG 3.31Å; S398-K411 CarbonylContact C-O 3.56Å; S398-K411 WeakPolarHBondContact CA-O 3.01Å; S398-D412 VanDerWaalsContact CB-OD1 3.28Å; S398-D412 WeakPolarHBondContact CB-OD1 3.05Å; S398-D412 PolarHBondContact OG-OD1 3.09Å
399	M	91.6	Very high	86.3	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.6	174.8	-157.3	169	82.2	0	0	111.5	I62 L66 F328 W336 I337 A339 Y401 K410 K411 I413	I62-M399 HydrophobicContact CG2-CE 4.2Å; L66-M399 HydrophobicContact CD1-CE 3.19Å; L66-M399 HydrophobicContact CD2-CE 3.82Å; L66-M399 HydrophobicContact CG-CE 3.92Å; F328-M399 HydrophobicContact CZ-SD 4.38Å; W336-M399 HydrophobicContact CH2-CE 4.3Å; W336-M399 HydrophobicContact CZ3-CE 4.33Å; I337-M399 HydrophobicContact CD1-CE 4.06Å; I337-M399 HydrophobicContact CD1-SD 3.92Å; I337-M399 HydrophobicContact CG1-CE 4.08Å; I337-M399 HydrophobicContact CG1-SD 4.24Å; I337-M399 HydrophobicContact CG2-CG 3.95Å; I337-M399 HydrophobicContact CG2-SD 3.88Å; A339-M399 WeakPolarHBondContact O-CG 3.45Å; M399-Y401 HydrophobicContact CE-CD1 3.73Å; M399-Y401 HydrophobicContact CE-CE1 4.42Å; M399-Y401 HydrophobicContact CE-CG 3.92Å; M399-K410 WeakPolarHBondContact O-CA 3.49Å; M399-K411 PolarHBondContact N-O 3.36Å; M399-K411 PolarHBondContact O-N 2.92Å; M399-I413 HydrophobicContact CB-CD1 4.09Å
400	L	90.1	Very high	86.3	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.1	175.3	-174.4	67.6	0	0	0	108.6	I87 V92 V101 I103 I338 A339 I408 I409 K410	I87-L400 HydrophobicContact CD1-CD2 3.85Å; I87-L400 HydrophobicContact CG1-CD2 4.24Å; V92-L400 HydrophobicContact CG1-CD1 3.83Å; V92-L400 HydrophobicContact CG1-CD2 4.42Å; V101-L400 HydrophobicContact CG1-CD2 4.2Å; I103-L400 HydrophobicContact CD1-CB 4.27Å; I338-L400 WeakPolarHBondContact CA-O 3.37Å; I338-L400 HydrophobicContact CB-CB 4.45Å; I338-L400 HydrophobicContact CB-CD2 4.16Å; I338-L400 HydrophobicContact CB-CG 4.14Å; I338-L400 WeakPolarHBondContact CB-O 3.35Å; I338-L400 HydrophobicContact CD1-CD2 4.48Å; I338-L400 HydrophobicContact CD1-CG 4.17Å; I338-L400 HydrophobicContact CG2-CD2 3.91Å; I338-L400 HydrophobicContact CG2-CG 4.44Å; I338-L400 PolarHBondContact N-O 3.24Å; A339-L400 HydrophobicContact CB-CB 4.14Å; A339-L400 PolarHBondContact N-O 2.95Å; A339-L400 VanDerWaalsContact N-O 3.14Å; A339-L400 PolarHBondContact O-N 2.98Å; L400-I408 HydrophobicContact CD1-CG2 3.61Å; L400-I408 HydrophobicContact CG-CG2 4.13Å; L400-I409 WeakPolarHBondContact CA-O 3.48Å; L400-K410 HydrophobicContact CD1-CB 3.97Å
401	Y	90.8	Very high	86.4	Confident	8 Å²	8	44.9 Å²	44.9	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	164.2	-172	68.7	-83.1	0	0	0	113	L66 L68 W336 M399 D403 I408 I409 K411	L66-Y401 HydrophobicContact CD1-CD1 4.45Å; L66-Y401 HydrophobicContact CD1-CD2 4.34Å; L66-Y401 HydrophobicContact CD1-CE1 4.3Å; L66-Y401 HydrophobicContact CD1-CE2 4.21Å; L66-Y401 HydrophobicContact CD1-CG 4.46Å; L66-Y401 HydrophobicContact CD2-CD1 4.19Å; L66-Y401 HydrophobicContact CD2-CE1 3.53Å; L66-Y401 HydrophobicContact CG-CE1 4.47Å; L68-Y401 HydrophobicContact CD1-CE2 4.06Å; W336-Y401 AromaticContact CE3-CD2 3.92Å; W336-Y401 HydrophobicContact CE3-CD2 3.92Å; W336-Y401 HydrophobicContact CE3-CG 4.29Å; W336-Y401 AromaticContact CZ3-CD2 3.56Å; W336-Y401 HydrophobicContact CZ3-CD2 3.56Å; W336-Y401 HydrophobicContact CZ3-CE2 4.36Å; W336-Y401 AromaticContact CZ3-CG 3.95Å; W336-Y401 HydrophobicContact CZ3-CG 3.95Å; W336-Y401 CarbonylContact O-C 3.6Å; W336-Y401 WeakPolarHBondContact O-CA 2.98Å; W336-Y401 WeakPolarHBondContact O-CB 3.42Å; M399-Y401 HydrophobicContact CE-CD1 3.73Å; M399-Y401 HydrophobicContact CE-CE1 4.42Å; M399-Y401 HydrophobicContact CE-CG 3.92Å; Y401-D403 HydrophobicContact CE2-CB 4.49Å; Y401-I408 WeakPolarHBondContact O-CA 3.39Å; Y401-I409 HydrophobicContact CE1-CB 4.17Å; Y401-I409 HydrophobicContact CE1-CG2 4.18Å; Y401-I409 PolarHBondContact N-O 2.95Å; Y401-I409 PolarHBondContact O-N 3.38Å; Y401-K411 HydrophobicContact CE1-CB 4Å
402	Y	87.4	Confident	86.4	Confident	11 Å²	11	45.3 Å²	45.3	4%	0.043	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130	170	-74.1	-82.9	0	0	0	111.1	P72 I74 V78 W336 I338 N407 I408	P72-Y402 WeakPolarHBondContact CG-O 3.41Å; I74-Y402 HydrophobicContact CD1-CD2 3.68Å; I74-Y402 HydrophobicContact CD1-CE2 4.38Å; I74-Y402 HydrophobicContact CD1-CG 3.86Å; V78-Y402 HydrophobicContact CG2-CE1 4.34Å; W336-Y402 PolarHBondContact O-N 3.09Å; I338-Y402 HydrophobicContact CD1-CD2 3.93Å; I338-Y402 HydrophobicContact CD1-CE2 3.65Å; I338-Y402 HydrophobicContact CG1-CD2 4.03Å; I338-Y402 HydrophobicContact CG1-CE2 3.77Å; Y402-N407 CarbonylContact C-O 3.29Å; Y402-N407 WeakPolarHBondContact CA-O 3.47Å; Y402-I408 HydrophobicContact CD1-CG1 3.9Å; Y402-I408 HydrophobicContact CE1-CD1 4.09Å; Y402-I408 HydrophobicContact CE1-CG1 3.53Å
403	D	83.4	Confident	86.7	Confident	44 Å²	44	42.7 Å²	42.7	24%	0.235	22%	0.224	C	C	.	.			trans	-87.9	171.6	173.6	-171	34.3	0	0	0	112.3	L68 Y401 G405 Q406 N407 I409	L68-D403 WeakPolarHBondContact CD2-OD1 3.44Å; Y401-D403 HydrophobicContact CE2-CB 4.49Å; D403-G405 PolarHBondContact O-N 2.98Å; D403-G405 VanDerWaalsContact O-N 3.11Å; D403-Q406 WeakPolarHBondContact O-CA 3.37Å; D403-Q406 PolarHBondContact O-N 3.37Å; D403-N407 PolarHBondContact N-O 3.09Å; D403-I409 HydrophobicContact CB-CD1 3.56Å; D403-I409 HydrophobicContact CB-CG1 4.13Å
404	D	78.4	Confident	86.9	Confident	105 Å²	105	47 Å²	47	56%	0.561	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.8	178.1	-71.4	-25.9	0	0	0	112.7	P72 Q406	P72-D404 WeakPolarHBondContact CA-OD1 3.37Å; D404-Q406 PolarHBondContact O-N 2.85Å
405	G	76.1	Confident	86.8	Confident	47 Å²	47	48.5 Å²	48.5	49%	0.485	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	10.5	174.3	0	0	0	0	0	115.4	D403 N407	D403-G405 PolarHBondContact O-N 2.98Å; D403-G405 VanDerWaalsContact O-N 3.11Å; G405-N407 PolarHBondContact O-N 3.42Å; G405-N407 VanDerWaalsContact O-N 3.16Å; G405-N407 PolarHBondContact O-ND2 3.28Å
406	Q	73.4	Confident	86.9	Confident	75 Å²	75	46.9 Å²	46.9	35%	0.35	25%	0.248	S	C	.	.	S	Bend	trans	59.8	17.8	-173.2	-56.3	-175.5	-11.2	0	0	114.5	T75 D403 D404	T75-Q406 PolarHBondContact OG1-NE2 3.39Å; D403-Q406 WeakPolarHBondContact O-CA 3.37Å; D403-Q406 PolarHBondContact O-N 3.37Å; D404-Q406 PolarHBondContact O-N 2.85Å
407	N	81.9	Confident	86.9	Confident	102 Å²	102	46.4 Å²	46.4	55%	0.545	24%	0.244	S	C	.	.			trans	-85.4	145.8	176	-63.1	-56.3	0	0	0	110.3	Y402 D403 G405	Y402-N407 CarbonylContact C-O 3.29Å; Y402-N407 WeakPolarHBondContact CA-O 3.47Å; D403-N407 PolarHBondContact N-O 3.09Å; G405-N407 PolarHBondContact O-N 3.42Å; G405-N407 VanDerWaalsContact O-N 3.16Å; G405-N407 PolarHBondContact O-ND2 3.28Å
408	I	85.6	Confident	86.9	Confident	66 Å²	66	46.5 Å²	46.5	34%	0.338	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.9	175.6	-61.7	140.1	0	0	0	108.5	V78 L83 I338 L400 Y401 Y402	V78-I408 HydrophobicContact CG2-CD1 4.47Å; L83-I408 HydrophobicContact CD1-CD1 3.27Å; L83-I408 HydrophobicContact CD1-CG1 3.92Å; L83-I408 HydrophobicContact CD1-CG2 4.48Å; I338-I408 HydrophobicContact CD1-CG1 4.17Å; I338-I408 HydrophobicContact CD1-CG2 3.81Å; L400-I408 HydrophobicContact CD1-CG2 3.61Å; L400-I408 HydrophobicContact CG-CG2 4.13Å; Y401-I408 WeakPolarHBondContact O-CA 3.39Å; Y402-I408 HydrophobicContact CD1-CG1 3.9Å; Y402-I408 HydrophobicContact CE1-CD1 4.09Å; Y402-I408 HydrophobicContact CE1-CG1 3.53Å
409	I	86.1	Confident	86.8	Confident	53 Å²	53	48.2 Å²	48.2	27%	0.272	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.9	-176.4	-57.3	-173.9	0	0	0	109.8	L400 Y401 D403 K411	L400-I409 WeakPolarHBondContact CA-O 3.48Å; Y401-I409 HydrophobicContact CE1-CB 4.17Å; Y401-I409 HydrophobicContact CE1-CG2 4.18Å; Y401-I409 PolarHBondContact N-O 2.95Å; Y401-I409 PolarHBondContact O-N 3.38Å; D403-I409 HydrophobicContact CB-CD1 3.56Å; D403-I409 HydrophobicContact CB-CG1 4.13Å; I409-K411 HydrophobicContact CG2-CB 4.38Å
410	K	86.8	Confident	86.6	Confident	63 Å²	63	50.8 Å²	50.8	27%	0.274	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.1	162.7	-173.7	-102.5	-172.9	-176.5	0	108.2	V92 D105 M399 L400 D412	V92-K410 HydrophobicContact CG1-CB 4.05Å; V92-K410 HydrophobicContact CG1-CG 4.25Å; D105-K410 WeakPolarHBondContact O-CE 3.49Å; D105-K410 PolarHBondContact O-NZ 3.38Å; M399-K410 WeakPolarHBondContact O-CA 3.49Å; L400-K410 HydrophobicContact CD1-CB 3.97Å; K410-D412 WeakPolarHBondContact CE-OD1 3.45Å; K410-D412 IonicContact NZ-OD1 3.83Å; K410-D412 PolarHBondContact NZ-OD1 2.92Å; K410-D412 IonicContact NZ-OD2 2.76Å; K410-D412 PolarHBondContact NZ-OD2 2.91Å
411	K	88.1	Confident	86.4	Confident	52 Å²	52	50.6 Å²	50.6	23%	0.226	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.3	178.9	-166.2	179	-174.3	-170.3	0	110.3	M65 L66 H67 S398 M399 Y401 I409 I413	M65-K411 PolarHBondContact O-NZ 2.96Å; L66-K411 HydrophobicContact CD2-CD 3.97Å; L66-K411 PolarHBondContact O-NZ 2.88Å; L66-K411 VanDerWaalsContact O-NZ 3.1Å; H67-K411 PolarHBondContact CD2-NZ 3.21Å; S398-K411 CarbonylContact C-O 3.56Å; S398-K411 WeakPolarHBondContact CA-O 3.01Å; M399-K411 PolarHBondContact N-O 3.36Å; M399-K411 PolarHBondContact O-N 2.92Å; Y401-K411 HydrophobicContact CE1-CB 4Å; I409-K411 HydrophobicContact CG2-CB 4.38Å; K411-I413 HydrophobicContact CD-CG1 4.45Å; K411-I413 HydrophobicContact CG-CG1 4.35Å
412	D	88.4	Confident	86	Confident	67 Å²	67	50.2 Å²	50.2	36%	0.358	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.3	173	-60.6	-32	0	0	0	108.7	V107 S398 K410	V107-D412 HydrophobicContact CB-CB 4.38Å; V107-D412 HydrophobicContact CG2-CB 3.66Å; V107-D412 WeakPolarHBondContact CG2-OD2 3.45Å; S398-D412 VanDerWaalsContact CB-OD1 3.28Å; S398-D412 WeakPolarHBondContact CB-OD1 3.05Å; S398-D412 PolarHBondContact OG-OD1 3.09Å; K410-D412 WeakPolarHBondContact CE-OD1 3.45Å; K410-D412 IonicContact NZ-OD1 3.83Å; K410-D412 PolarHBondContact NZ-OD1 2.92Å; K410-D412 IonicContact NZ-OD2 2.76Å; K410-D412 PolarHBondContact NZ-OD2 2.91Å
413	I	90.2	Very high	85.6	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.9	-172.6	-52.9	169.6	0	0	0	107.9	M65 L66 P396 M397 M399 K411 M416	M65-I413 HydrophobicContact CB-CG2 3.79Å; M65-I413 HydrophobicContact CE-CG2 3.5Å; M65-I413 VanDerWaalsContact CE-CG2 3.5Å; M65-I413 HydrophobicContact CG-CG2 4.34Å; L66-I413 HydrophobicContact CD2-CD1 3.56Å; L66-I413 HydrophobicContact CD2-CG1 4.25Å; L66-I413 HydrophobicContact CG-CD1 4.44Å; P396-I413 CarbonylContact C-O 3.56Å; P396-I413 WeakPolarHBondContact CA-O 3.43Å; P396-I413 WeakPolarHBondContact CB-O 3.27Å; M397-I413 PolarHBondContact N-O 2.97Å; M397-I413 WeakPolarHBondContact O-CB 3.03Å; M397-I413 PolarHBondContact O-N 3.44Å; M399-I413 HydrophobicContact CB-CD1 4.09Å; K411-I413 HydrophobicContact CD-CG1 4.45Å; K411-I413 HydrophobicContact CG-CG1 4.35Å; I413-M416 HydrophobicContact CG2-CB 4.19Å; I413-M416 HydrophobicContact CG2-CG 4.4Å; I413-M416 HydrophobicContact CG2-SD 3.99Å
414	Q	90.5	Very high	84.9	Confident	145 Å²	145	50.4 Å²	50.4	68%	0.678	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	155.7	174.7	-64.7	-175.8	-2.4	0	0	110.9	M65 M416	M65-Q414 WeakPolarHBondContact CE-O 3.15Å; Q414-M416 VanDerWaalsContact C-N 3.3Å; Q414-M416 PolarHBondContact O-N 3.28Å
415	N	88.8	Confident	85.3	Confident	94 Å²	94	47.7 Å²	47.7	50%	0.503	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.4	35.5	170.7	-61.8	-20.8	0	0	0	115	L394	L394-N415 HydrophobicContact CB-CB 4.31Å; L394-N415 HydrophobicContact CD1-CB 3.91Å
416	M	91.8	Very high	85.7	Confident	8 Å²	8	47.7 Å²	47.7	4%	0.039	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-38.5	-171.9	-170	64.2	-179.9	0	0	113.4	I62 M65 Y343 R395 M397 I413 Q414	I62-M416 HydrophobicContact CG1-CE 3.76Å; M65-M416 HydrophobicContact CB-SD 4.33Å; M65-M416 HydrophobicContact CG-SD 4.02Å; Y343-M416 HydrophobicContact CE1-CE 4.41Å; Y343-M416 HydrophobicContact CE2-CE 3.77Å; Y343-M416 HydrophobicContact CE2-CG 4.44Å; R395-M416 PolarHBondContact O-N 3.02Å; M397-M416 HydrophobicContact CB-CB 3.91Å; M397-M416 HydrophobicContact CB-CG 3.98Å; M397-M416 HydrophobicContact SD-CG 3.91Å; I413-M416 HydrophobicContact CG2-CB 4.19Å; I413-M416 HydrophobicContact CG2-CG 4.4Å; I413-M416 HydrophobicContact CG2-SD 3.99Å; Q414-M416 VanDerWaalsContact C-N 3.3Å; Q414-M416 PolarHBondContact O-N 3.28Å
417	I	92.9	Very high	86.4	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126	-175.4	-60.8	172.3	0	0	0	109.5	Y343 L394 R395 M397	Y343-I417 HydrophobicContact CD2-CG1 4.32Å; L394-I417 CarbonylContact C-O 3.5Å; L394-I417 VanDerWaalsContact CA-O 3.3Å; L394-I417 WeakPolarHBondContact CA-O 3.12Å; R395-I417 HydrophobicContact CB-CB 4.36Å; R395-I417 PolarHBondContact N-O 3.35Å; R395-I417 PolarHBondContact O-N 2.92Å; M397-I417 HydrophobicContact CB-CD1 4.18Å; M397-I417 HydrophobicContact CB-CG1 4.48Å; M397-I417 HydrophobicContact CG-CD1 4.39Å; M397-I417 HydrophobicContact SD-CD1 4.28Å; M397-I417 HydrophobicContact SD-CG1 4.49Å
418	V	91.3	Very high	86.7	Confident	12 Å²	12	42.9 Å²	42.9	7%	0.073	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.6	173	-178.4	0	0	0	0	110.3	K321 N346 P391 L394	K321-V418 WeakPolarHBondContact CD-O 3.49Å; K321-V418 HydrophobicContact CG-CG1 4.4Å; N346-V418 HydrophobicContact CB-CB 3.98Å; N346-V418 WeakPolarHBondContact CB-O 3.1Å; N346-V418 PolarHBondContact ND2-O 3.39Å; N346-V418 WeakPolarHBondContact O-CB 3.42Å; N346-V418 WeakPolarHBondContact O-CG2 3.04Å; P391-V418 HydrophobicContact CB-CG1 4.09Å; P391-V418 HydrophobicContact CB-CG2 4.13Å; P391-V418 HydrophobicContact CG-CG1 4.38Å; P391-V418 HydrophobicContact CG-CG2 3.9Å; L394-V418 HydrophobicContact CD2-CB 4.37Å; L394-V418 HydrophobicContact CD2-CG2 3.73Å
419	E	88.6	Confident	86.8	Confident	37 Å²	37	41.5 Å²	41.5	17%	0.173	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-38.4	176.5	-63.1	-159.9	147.2	0	0	112.6	K321 K393 R395	K321-E419 VanDerWaalsContact CD-O 3.28Å; K321-E419 WeakPolarHBondContact CD-O 3.16Å; K321-E419 PolarHBondContact NZ-O 3.48Å; K393-E419 HydrophobicContact CB-CB 4.23Å; K393-E419 HydrophobicContact CD-CB 4.26Å; K393-E419 WeakPolarHBondContact CD-OE2 3.24Å; K393-E419 VanDerWaalsContact CE-OE2 3.23Å; K393-E419 WeakPolarHBondContact CE-OE2 3.47Å; K393-E419 HydrophobicContact CG-CB 4.22Å; K393-E419 IonicContact NZ-OE2 3.5Å; K393-E419 PolarHBondContact NZ-OE2 3.48Å; K393-E419 PolarHBondContact O-N 3.17Å; R395-E419 HydrophobicContact CB-CG 3.88Å; R395-E419 WeakPolarHBondContact CB-OE1 3.16Å; R395-E419 WeakPolarHBondContact CD-OE1 2.97Å; R395-E419 IonicContact NE-OE1 3.56Å; R395-E419 PolarHBondContact NE-OE1 3.31Å
420	E	87.4	Confident	86.8	Confident	55 Å²	55	40.7 Å²	40.7	26%	0.257	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.2	178.9	-58	-168.3	145.7	0	0	111.7	G309 P391 T392 K393	G309-E420 PolarHBondContact N-OE1 3.33Å; P391-E420 WeakPolarHBondContact CA-O 3.47Å; T392-E420 PolarHBondContact N-O 3.36Å; T392-E420 PolarHBondContact OG1-O 3.31Å; K393-E420 HydrophobicContact CB-CB 3.75Å; K393-E420 HydrophobicContact CB-CG 3.94Å; K393-E420 HydrophobicContact CD-CG 4.25Å; K393-E420 PolarHBondContact N-O 3.44Å; K393-E420 PolarHBondContact O-N 2.82Å
421	C	86.7	Confident	86.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	151	176	-63.5	0	0	0	0	110.3	K321 C348 V390	K321-C421 VanDerWaalsContact CA-SG 3.55Å; K321-C421 HydrophobicContact CB-CB 4.46Å; C348-C421 WeakPolarHBondContact CA-SG 3.29Å; C348-C421 HydrophobicContact CB-CB 3.77Å; C348-C421 WeakPolarHBondContact CB-SG 3.24Å; C348-C421 WeakPolarHBondContact SG-CB 3.42Å; C348-C421 CovalentContact SG-SG 2.03Å; C348-C421 PolarHBondContact SG-SG 3Å; V390-C421 WeakPolarHBondContact O-CA 3.32Å
422	G	81.5	Confident	86.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	174.1	179.7	0	0	0	0	0	113.1	C319 S363 V390	C319-G422 VanDerWaalsContact SG-C 3.59Å; C319-G422 PolarHBondContact SG-O 3.25Å; C319-G422 VanDerWaalsContact SG-O 3.39Å; S363-G422 VanDerWaalsContact O-CA 3.3Å; S363-G422 WeakPolarHBondContact O-CA 3.46Å; V390-G422 PolarHBondContact N-O 3.13Å; V390-G422 PolarHBondContact O-N 3.23Å
423	C	78.6	Confident	86.6	Confident	8 Å²	8	35.8 Å²	35.8	5%	0.054	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.3	-179.7	-67.3	0	0	0	0	110.3	C352 S363 L364 S368 C388	C352-C423 VanDerWaalsContact CA-SG 3.52Å; C352-C423 HydrophobicContact CB-CB 3.7Å; C352-C423 WeakPolarHBondContact CB-SG 3.49Å; C352-C423 WeakPolarHBondContact SG-CA 3.37Å; C352-C423 WeakPolarHBondContact SG-CB 3.46Å; C352-C423 CovalentContact SG-SG 2.03Å; C352-C423 PolarHBondContact SG-SG 2.97Å; S363-C423 PolarHBondContact O-N 3.28Å; L364-C423 HydrophobicContact CD2-CB 3.92Å; S368-C423 PolarHBondContact OG-O 3.14Å; S368-C423 VanDerWaalsContact OG-O 3.12Å; C388-C423 WeakPolarHBondContact O-CA 3.23Å
424	S	70.5	Confident	86.2	Confident	51 Å²	51	38.5 Å²	38.5	36%	0.357	20%	0.2	S	C	.	.			trans	-95.6	0	176.1	66.7	0	0	0	0	113	S368 S387 C388	S368-S424 VanDerWaalsContact CB-OXT 3.27Å; S368-S424 WeakPolarHBondContact CB-OXT 3.26Å; S368-S424 WeakPolarHBondContact OG-CA 3.47Å; S368-S424 PolarHBondContact OG-OXT 3.48Å; S387-S424 WeakPolarHBondContact CA-O 3.48Å; S387-S424 WeakPolarHBondContact CB-O 3.45Å; S387-S424 PolarHBondContact OG-O 3.21Å; C388-S424 PolarHBondContact N-O 3.26Å; C388-S424 PolarHBondContact O-N 3.19Å; C388-S424 PolarHBondContact O-OG 3.47Å

Retrieved 424 of 424 residues in 68.3 ms (Link to these results)

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