A0A5K4F128_SCHMA Loading...

Caspase-7

AlphaFold DB , UniProt , Accession A0A5K4F128, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 328 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	33.8	Very low	240 Å²	240	144.9 Å²	144.9	100%	1.182	80%	0.797	S	S	*	*				0	72.4	0	-87	179.9	159.1	0	0	108.5
2	V	37.2	Very low	34	Very low	144 Å²	144	144.9 Å²	144.9	87%	0.873	79%	0.793	S	S	*	*			trans	-152.6	74.2	159.4	-143.7	0	0	0	0	105
3	D	30.3	Very low	34.8	Very low	148 Å²	148	135.2 Å²	135.2	79%	0.791	74%	0.743	S	S	*	*			trans	-125.1	150.2	167	-67.7	-53.7	0	0	0	105.6
4	D	31	Very low	35.3	Very low	156 Å²	156	132.8 Å²	132.8	83%	0.834	73%	0.733	S	S	*	*			trans	92.6	87.6	179.2	-52.3	-31	0	0	0	116.9
5	V	34	Very low	36.3	Very low	136 Å²	136	124.3 Å²	124.3	82%	0.824	69%	0.687	S	S	*	*				-139.3	88.6	129	-174.4	0	0	0	0	107.5	S7	V5-S7 PolarHBondContact O-N 3.39Å; V5-S7 VanDerWaalsContact O-N 3.13Å
6	D	31.4	Very low	37.3	Very low	162 Å²	162	120.6 Å²	120.6	87%	0.866	66%	0.663	S	S	*	*			trans	-70.4	98.8	160.4	-175.8	11.4	0	0	0	107.6	S8	D6-S8 VanDerWaalsContact C-N 3.32Å; D6-S8 PolarHBondContact O-N 3.49Å
7	S	31.9	Very low	38.1	Very low	94 Å²	94	119.2 Å²	119.2	66%	0.657	65%	0.65	S	S	*	*			trans	-70.5	90.4	178.9	47.8	0	0	0	0	110	V5	V5-S7 PolarHBondContact O-N 3.39Å; V5-S7 VanDerWaalsContact O-N 3.13Å
8	S	33.4	Very low	39	Very low	90 Å²	90	114.4 Å²	114.4	63%	0.629	62%	0.623	S	S	*	*			trans	12.4	113.2	146.6	40	0	0	0	0	116	D6 K10	D6-S8 VanDerWaalsContact C-N 3.32Å; D6-S8 PolarHBondContact O-N 3.49Å; S8-K10 VanDerWaalsContact C-N 3.25Å; S8-K10 PolarHBondContact O-N 2.72Å
9	N	30	Very low	39	Very low	160 Å²	160	113.6 Å²	113.6	86%	0.856	63%	0.626	S	S	*	*			trans	-57.9	79.6	169.2	-160	19.5	0	0	0	110.8	N11	N9-N11 PolarHBondContact O-N 2.9Å
10	K	38.1	Very low	38.8	Very low	163 Å²	163	112.7 Å²	112.7	71%	0.709	63%	0.628	S	S	*	*			trans	-62.6	128.2	173.3	-74.7	-176.4	175.5	-175	0	108.2	S8 L12	S8-K10 VanDerWaalsContact C-N 3.25Å; S8-K10 PolarHBondContact O-N 2.72Å; K10-L12 PolarHBondContact O-N 3.05Å
11	N	39	Very low	38.3	Very low	101 Å²	101	111.8 Å²	111.8	54%	0.54	63%	0.626	S	S	.	*			trans	-62.5	80.2	175.1	-82.3	-55.4	0	0	0	110.1	N9 S13	N9-N11 PolarHBondContact O-N 2.9Å; N11-S13 PolarHBondContact O-N 2.82Å
12	L	36.1	Very low	38	Very low	145 Å²	145	109.2 Å²	109.2	76%	0.759	61%	0.611	S	S	*	*			trans	-66.8	121.8	173.6	-77	137.6	0	0	0	108.7	K10	K10-L12 PolarHBondContact O-N 3.05Å
13	S	44.4	Very low	37.6	Very low	19 Å²	19	108.5 Å²	108.5	13%	0.133	60%	0.601	C	S	.	*			trans	-149.7	129	-174.9	95.1	0	0	0	0	112.6	N11 N249 T291	N11-S13 PolarHBondContact O-N 2.82Å; S13-N249 WeakPolarHBondContact CB-ND2 3.13Å; S13-N249 PolarHBondContact OG-ND2 3.28Å; S13-T291 WeakPolarHBondContact O-CB 3.11Å
14	V	41.9	Very low	37.3	Very low	101 Å²	101	112.9 Å²	112.9	61%	0.612	61%	0.606	S	S	*	*	B	Isolated β-bridge	trans	-75.9	122.8	179.2	-179.3	0	0	0	0	109.9	N249 T291	V14-N249 PolarHBondContact O-ND2 2.74Å; V14-T291 WeakPolarHBondContact CA-O 3.26Å
15	V	49.5	Very low	37.3	Very low	6 Å²	6	110.8 Å²	110.8	4%	0.036	60%	0.604	C	S	.	*	B	Isolated β-bridge	trans	-93.7	137.8	176.4	-176.2	0	0	0	0	109.7	F247 W255 T291	V15-F247 HydrophobicContact CG1-CD1 3.65Å; V15-F247 HydrophobicContact CG1-CE1 4.18Å; V15-F247 HydrophobicContact CG2-CD1 4.19Å; V15-W255 HydrophobicContact CG2-CZ2 4.34Å; V15-T291 PolarHBondContact N-O 2.87Å
16	E	52	Low	36.9	Very low	65 Å²	65	109.6 Å²	109.6	30%	0.304	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-78.4	138.9	170.2	-86.7	174	158.2	0	0	111.8	N98 R248	E16-N98 PolarHBondContact OE1-ND2 2.91Å; E16-R248 IonicContact OE2-CZ 3.94Å; E16-R248 IonicContact OE2-NH1 2.88Å; E16-R248 PolarHBondContact OE2-NH1 3.04Å; E16-R248 VanDerWaalsContact OE2-NH1 3.09Å; E16-R248 IonicContact OE2-NH2 3.44Å; E16-R248 PolarHBondContact OE2-NH2 3.49Å
17	E	50.9	Low	36.7	Very low	96 Å²	96	109.6 Å²	109.6	45%	0.449	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-82.8	141.9	174.1	-66	168.1	-152.4	0	0	110.9	S294 F297	E17-S294 WeakPolarHBondContact OE1-CA 3.11Å; E17-S294 WeakPolarHBondContact OE1-CB 3.16Å; E17-S294 PolarHBondContact OE1-N 2.98Å; E17-F297 HydrophobicContact CG-CD2 3.94Å; E17-F297 HydrophobicContact CG-CE2 4.25Å; E17-F297 HydrophobicContact CG-CG 4.27Å
18	H	54.1	Low	36.4	Very low	33 Å²	33	111 Å²	111	15%	0.153	61%	0.61	C	S	.	*	P	Polyproline II helix	trans	-100.8	118.1	173.6	-72.7	-99.3	0	0	0	109.3	S20 P95 H154 Y245	H18-S20 PolarHBondContact O-N 3.14Å; H18-S20 VanDerWaalsContact O-N 3.17Å; H18-P95 VanDerWaalsContact CE1-CG 3.46Å; H18-P95 WeakPolarHBondContact CE1-CG 3.38Å; H18-P95 WeakPolarHBondContact ND1-CG 3.47Å; H18-H154 AromaticContact CE1-CE1 3.19Å; H18-H154 PolarHBondContact CE1-CE1 3.16Å; H18-H154 AromaticContact CE1-ND1 3.89Å; H18-H154 AromaticContact CE1-NE2 3.97Å; H18-H154 AromaticContact ND1-CE1 3.75Å; H18-Y245 HydrophobicContact CB-CE2 4.43Å; H18-Y245 AromaticContact CD2-CE2 3.84Å; H18-Y245 AromaticContact CD2-CZ 3.62Å; H18-Y245 PolarHBondContact CD2-OH 3.48Å; H18-Y245 PolarHBondContact NE2-OH 3.24Å
19	S	39.8	Very low	36.1	Very low	99 Å²	99	112.1 Å²	112.1	69%	0.692	62%	0.617	S	S	*	*			trans	-62	113.5	175.6	176.5	0	0	0	0	110.7	T21	S19-T21 PolarHBondContact O-N 3.1Å
20	S	34.3	Very low	35.9	Very low	95 Å²	95	112.5 Å²	112.5	66%	0.664	62%	0.619	S	S	*	*			trans	-72	101.4	176.6	-41.4	0	0	0	0	110.2	H18	H18-S20 PolarHBondContact O-N 3.14Å; H18-S20 VanDerWaalsContact O-N 3.17Å
21	T	29.6	Very low	35.5	Very low	95 Å²	95	110 Å²	110	58%	0.583	62%	0.622	S	S	*	*			trans	-111.3	114.5	168.4	-44.1	0	0	0	0	109.4	S19 I23	S19-T21 PolarHBondContact O-N 3.1Å; T21-I23 PolarHBondContact O-N 2.66Å
22	Q	29.3	Very low	35.1	Very low	185 Å²	185	111.1 Å²	111.1	86%	0.864	64%	0.635	S	S	*	*			trans	-63.4	115.2	-177.9	-74.2	178.5	-17.4	0	0	111.5
23	I	28.2	Very low	34.8	Very low	129 Å²	129	114.2 Å²	114.2	66%	0.662	64%	0.642	S	S	*	*			trans	-87.2	113.2	168	-61.8	174.7	0	0	0	108.2	T21 S25	T21-I23 PolarHBondContact O-N 2.66Å; I23-S25 PolarHBondContact O-N 3.35Å
24	R	24.6	Very low	34.1	Very low	241 Å²	241	121 Å²	121	91%	0.909	68%	0.677	S	S	*	*			trans	-72.9	108.8	170.7	-77.9	-178.8	172.1	-175.7	-2.1	109.3
25	S	30.3	Very low	33.4	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	69%	0.69	S	S	*	*			trans	-98.5	117	166.5	57.9	0	0	0	0	109.8	I23	I23-S25 PolarHBondContact O-N 3.35Å
26	S	26.1	Very low	32.5	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	73%	0.731	S	S	*	*			trans	-113.3	91.5	173	55.2	0	0	0	0	108.9
27	L	27.8	Very low	31.4	Very low	162 Å²	162	138.1 Å²	138.1	85%	0.848	76%	0.757	S	S	*	*			trans	-138.6	103.2	170	-78.2	163.8	0	0	0	108.9
28	S	25.5	Very low	30.2	Very low	122 Å²	122	140.9 Å²	140.9	85%	0.853	77%	0.774	S	S	*	*			trans	-83.8	121.5	169.9	57.8	0	0	0	0	109.4
29	C	26.2	Very low	29.2	Very low	114 Å²	114	148.2 Å²	148.2	77%	0.77	81%	0.806	S	S	*	*			trans	-113.5	112.4	175.1	-63.3	0	0	0	0	109.7
30	D	26.7	Very low	28.6	Very low	169 Å²	169	150.1 Å²	150.1	90%	0.904	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.3	131.9	171.2	-89.2	-34.7	0	0	0	111
31	S	29.3	Very low	28.2	Very low	109 Å²	109	156.3 Å²	156.3	76%	0.762	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-99.4	126.1	179.8	-64.3	0	0	0	0	111.5
32	P	31.1	Very low	28.2	Very low	126 Å²	126	157 Å²	157	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-84.8	127.8	171.3	3.8	13	0	0	0	111.5
33	K	29.9	Very low	28.4	Very low	210 Å²	210	154.9 Å²	154.9	91%	0.913	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-74.5	118.7	170.9	-66.8	175.3	178.9	174.8	0	109.5
34	N	29.1	Very low	28.7	Very low	162 Å²	162	153.7 Å²	153.7	87%	0.866	83%	0.829	S	S	*	*			trans	-118.9	115.9	168.5	-146.8	2.6	0	0	0	110.8
35	K	27.8	Very low	29.2	Very low	203 Å²	203	150 Å²	150	88%	0.883	83%	0.827	S	S	*	*			trans	-84.8	123.1	173.2	-78.2	176.7	172.4	178.5	0	107.8
36	L	31	Very low	29.3	Very low	172 Å²	172	154.2 Å²	154.2	90%	0.901	83%	0.831	S	S	*	*			trans	-126.5	132	167.5	-160.2	65.8	0	0	0	111.5
37	N	28.3	Very low	29.3	Very low	156 Å²	156	154.4 Å²	154.4	83%	0.834	83%	0.831	S	S	*	*			trans	-77.5	145.8	-163.4	-114.9	-18.3	0	0	0	113.9
38	N	25.4	Very low	29.6	Very low	153 Å²	153	152.2 Å²	152.2	82%	0.818	83%	0.829	S	S	*	*			trans	-62.6	130.9	168.4	-67.8	-26.9	0	0	0	111.6
39	K	32.2	Very low	30.1	Very low	187 Å²	187	152.2 Å²	152.2	81%	0.813	82%	0.824	S	S	*	*			trans	-129.8	102.6	159.2	-80.6	-173.2	177.5	179.3	0	109.3
40	T	27	Very low	30.5	Very low	140 Å²	140	152.5 Å²	152.5	86%	0.859	83%	0.827	S	S	*	*			trans	-68.5	130.3	168.1	32.8	0	0	0	0	109.8
41	W	26.1	Very low	30.7	Very low	224 Å²	224	149.4 Å²	149.4	85%	0.848	82%	0.818	S	S	*	*			trans	-113.4	111.9	170.6	-85.7	48.6	0	0	0	108.3
42	S	30.5	Very low	30.8	Very low	111 Å²	111	150 Å²	150	78%	0.776	82%	0.822	S	S	*	*			trans	-104.2	114.3	168.6	59	0	0	0	0	108.4
43	N	33.2	Very low	31.2	Very low	140 Å²	140	148 Å²	148	75%	0.749	81%	0.811	S	S	*	*			trans	-124.6	108.7	164.7	-89.7	-18.3	0	0	0	109.4
44	S	34.2	Very low	31.5	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	81%	0.808	S	S	*	*			trans	-77.7	115.6	170.6	160.5	0	0	0	0	108.7
45	L	36	Very low	31.8	Very low	164 Å²	164	146.4 Å²	146.4	86%	0.859	81%	0.81	S	S	*	*			trans	-119.4	100	166.3	-88.1	140	0	0	0	107.8	C47	L45-C47 PolarHBondContact O-N 3.26Å
46	K	32.8	Very low	32.3	Very low	199 Å²	199	140.9 Å²	140.9	87%	0.865	80%	0.795	S	S	*	*			trans	-72.7	115.8	166.4	-72	177.6	175.6	178.1	0	107.8
47	C	26.1	Very low	32.7	Very low	116 Å²	116	139.2 Å²	139.2	78%	0.784	79%	0.792	S	S	*	*			trans	-119.2	105.6	166.9	-165.2	0	0	0	0	108.2	L45	L45-C47 PolarHBondContact O-N 3.26Å
48	S	32.4	Very low	33.2	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	79%	0.787	S	S	*	*			trans	-96	109.5	174.3	52.8	0	0	0	0	108.7
49	V	37.4	Very low	33.7	Very low	121 Å²	121	137.5 Å²	137.5	73%	0.733	78%	0.783	S	S	*	*			trans	-129.1	105.4	165.4	-176.1	0	0	0	0	107.3
50	S	33.1	Very low	34.1	Very low	120 Å²	120	135.8 Å²	135.8	84%	0.839	78%	0.781	S	S	*	*			trans	-84.2	120	164.9	64	0	0	0	0	108.3
51	C	31.8	Very low	34.6	Very low	105 Å²	105	134.2 Å²	134.2	71%	0.709	77%	0.773	S	S	*	*			trans	-146.4	92.8	158.9	-164.7	0	0	0	0	108.5	S53	C51-S53 PolarHBondContact O-N 3.29Å
52	S	32.3	Very low	35.5	Very low	122 Å²	122	128.7 Å²	128.7	85%	0.853	77%	0.769	S	S	*	*			trans	-79	95	167.8	46.4	0	0	0	0	109
53	S	38.4	Very low	36.3	Very low	83 Å²	83	132 Å²	132	58%	0.58	77%	0.772	S	S	*	*			trans	-163.1	120.2	160.3	57.4	0	0	0	0	111.5	C51	C51-S53 PolarHBondContact O-N 3.29Å
54	L	37	Very low	37.4	Very low	164 Å²	164	134 Å²	134	86%	0.859	77%	0.774	S	S	*	*			trans	68.3	92.5	152.1	-55.8	165.4	0	0	0	115.4	P56	L54-P56 WeakPolarHBondContact O-CD 3.45Å
55	L	34.4	Very low	38.5	Very low	174 Å²	174	133.3 Å²	133.3	91%	0.911	77%	0.77	S	S	*	*			trans	-64.7	109.2	167.8	-59.5	172.1	0	0	0	109
56	P	39	Very low	39.9	Very low	87 Å²	87	128.2 Å²	128.2	57%	0.565	75%	0.746	S	S	*	*			trans	-70.1	133.4	158.3	-1.1	21.6	0	0	0	105.4	L54 F58	L54-P56 WeakPolarHBondContact O-CD 3.45Å; P56-F58 HydrophobicContact CB-CD2 4.42Å; P56-F58 HydrophobicContact CG-CD2 4.32Å; P56-F58 HydrophobicContact CG-CE2 4Å; P56-F58 PolarHBondContact O-N 2.72Å
57	V	38.4	Very low	42.1	Very low	137 Å²	137	119.3 Å²	119.3	83%	0.83	71%	0.709	S	S	*	*			trans	-59.2	92.6	162.7	176.9	0	0	0	0	105.4	S59	V57-S59 VanDerWaalsContact C-N 3.3Å; V57-S59 PolarHBondContact O-N 3.14Å
58	F	38.9	Very low	45	Very low	169 Å²	169	120.6 Å²	120.6	74%	0.741	70%	0.698	S	S	*	*			trans	-64.5	101.6	172.9	-95.3	-90.3	0	0	0	105	P56 I60	P56-F58 HydrophobicContact CB-CD2 4.42Å; P56-F58 HydrophobicContact CG-CD2 4.32Å; P56-F58 HydrophobicContact CG-CE2 4Å; P56-F58 PolarHBondContact O-N 2.72Å; F58-I60 VanDerWaalsContact C-N 3.26Å; F58-I60 PolarHBondContact O-N 3.27Å
59	S	35.9	Very low	47.8	Very low	105 Å²	105	117 Å²	117	73%	0.734	67%	0.672	S	S	*	*			trans	-54	99.5	163.2	-55.8	0	0	0	0	106	V57 P61	V57-S59 VanDerWaalsContact C-N 3.3Å; V57-S59 PolarHBondContact O-N 3.14Å; S59-P61 WeakPolarHBondContact O-CD 3.5Å
60	I	41.5	Very low	50.4	Low	150 Å²	150	111.6 Å²	111.6	77%	0.769	64%	0.638	S	S	*	*			trans	-57.9	113.3	178.3	-62.3	169.2	0	0	0	104.9	F58 S62	F58-I60 VanDerWaalsContact C-N 3.26Å; F58-I60 PolarHBondContact O-N 3.27Å; I60-S62 PolarHBondContact O-N 3.17Å
61	P	37.7	Very low	53	Low	107 Å²	107	113.9 Å²	113.9	70%	0.695	63%	0.628	S	S	*	*			trans	-56	123.2	174.1	-19.7	32.5	0	0	0	105.7	S59 E63	S59-P61 WeakPolarHBondContact O-CD 3.5Å; P61-E63 VanDerWaalsContact C-N 3.31Å; P61-E63 PolarHBondContact O-N 3.43Å
62	S	45.3	Very low	55.6	Low	108 Å²	108	109.5 Å²	109.5	76%	0.755	60%	0.598	S	S	*	*			trans	-47.7	101.4	172.3	161	0	0	0	0	107.4	I60 K64	I60-S62 PolarHBondContact O-N 3.17Å; S62-K64 VanDerWaalsContact C-N 3.34Å; S62-K64 PolarHBondContact O-N 3.11Å
63	E	47	Very low	58	Low	182 Å²	182	108.8 Å²	108.8	85%	0.85	59%	0.585	S	S	*	*			trans	-63.1	102.8	176	-86	-170.3	154.8	0	0	105.4	P61 S65	P61-E63 VanDerWaalsContact C-N 3.31Å; P61-E63 PolarHBondContact O-N 3.43Å; E63-S65 PolarHBondContact O-N 2.69Å
64	K	55.4	Low	60.2	Low	181 Å²	181	105.7 Å²	105.7	79%	0.787	57%	0.566	S	S	*	*			trans	-58.3	112.8	175.2	-70.4	-176.1	178.4	-178.7	0	106.5	S62	S62-K64 VanDerWaalsContact C-N 3.34Å; S62-K64 PolarHBondContact O-N 3.11Å
65	S	57.6	Low	62.6	Low	90 Å²	90	102 Å²	102	63%	0.629	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-54.8	140.9	-176.3	45.7	0	0	0	0	110.2	E63	E63-S65 PolarHBondContact O-N 2.69Å
66	P	64.5	Low	65.4	Low	57 Å²	57	98.1 Å²	98.1	37%	0.37	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-62.6	141.3	177.3	27.1	-33.8	0	0	0	110	Y68	P66-Y68 HydrophobicContact CG-CE1 4.33Å; P66-Y68 PolarHBondContact O-N 3.15Å
67	S	79.2	Confident	68	Low	11 Å²	11	94.1 Å²	94.1	8%	0.077	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-69.5	133	167.8	-165.1	0	0	0	0	110.7	V69 D220 A221 K312	S67-V69 VanDerWaalsContact C-N 3.31Å; S67-V69 PolarHBondContact OG-N 3.16Å; S67-V69 VanDerWaalsContact OG-N 3.15Å; S67-D220 WeakPolarHBondContact CB-O 3.21Å; S67-D220 PolarHBondContact OG-O 3.48Å; S67-A221 VanDerWaalsContact CB-CA 3.49Å; S67-A221 WeakPolarHBondContact OG-CB 3.36Å; S67-K312 WeakPolarHBondContact O-CE 3.45Å
68	Y	88.5	Confident	70.8	Confident	143 Å²	143	87.7 Å²	87.7	56%	0.561	47%	0.471	S	S	*	.			trans	-93.8	19	169.6	-59.4	-69.4	0	0	0	112.1	P66 K312 H313	P66-Y68 HydrophobicContact CG-CE1 4.33Å; P66-Y68 PolarHBondContact O-N 3.15Å; Y68-K312 CarbonylContact O-C 3.55Å; Y68-K312 WeakPolarHBondContact O-CA 3.48Å; Y68-K312 WeakPolarHBondContact O-CB 3.42Å; Y68-H313 WeakPolarHBondContact O-CB 3.34Å; Y68-H313 PolarHBondContact O-CD2 3.44Å; Y68-H313 PolarHBondContact O-N 3.41Å
69	V	89.3	Confident	73.6	Confident	42 Å²	42	79.8 Å²	79.8	26%	0.255	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-122.1	135.4	176	-171.5	0	0	0	0	110.3	S67 K312 H313 I315	S67-V69 VanDerWaalsContact C-N 3.31Å; S67-V69 PolarHBondContact OG-N 3.16Å; S67-V69 VanDerWaalsContact OG-N 3.15Å; V69-K312 WeakPolarHBondContact O-CD 3.26Å; V69-H313 WeakPolarHBondContact CA-O 2.84Å; V69-H313 HydrophobicContact CG2-CB 4.4Å; V69-I315 HydrophobicContact CG1-CD1 4.02Å; V69-I315 HydrophobicContact CG1-CG1 4.31Å; V69-I315 HydrophobicContact CG2-CD1 4.41Å
70	Y	92.5	Very high	76.6	Confident	7 Å²	7	74.8 Å²	74.8	3%	0.027	40%	0.402	C	S	.	.			trans	-67.4	148.1	173.2	-75.6	-78.3	0	0	0	111.2	T72 G187 P189 D233 L310 T311 K312 H313 V314	Y70-T72 PolarHBondContact O-N 2.87Å; Y70-G187 WeakPolarHBondContact CD1-O 3.18Å; Y70-G187 WeakPolarHBondContact CE1-O 3.45Å; Y70-P189 HydrophobicContact CD1-CG 3.79Å; Y70-P189 HydrophobicContact CD2-CG 3.57Å; Y70-P189 HydrophobicContact CE1-CG 4.16Å; Y70-P189 HydrophobicContact CE2-CG 3.91Å; Y70-P189 HydrophobicContact CG-CG 3.49Å; Y70-P189 VanDerWaalsContact CG-CG 3.49Å; Y70-D233 HydrophobicContact CE1-CB 4.31Å; Y70-D233 WeakPolarHBondContact CE1-OD1 3.2Å; Y70-D233 WeakPolarHBondContact OH-CB 3.34Å; Y70-D233 VanDerWaalsContact OH-CG 3.29Å; Y70-D233 PolarHBondContact OH-OD1 2.9Å; Y70-L310 HydrophobicContact CE2-CB 4.19Å; Y70-L310 HydrophobicContact CE2-CD2 3.92Å; Y70-T311 PolarHBondContact OH-N 2.55Å; Y70-T311 PolarHBondContact OH-OG1 2.56Å; Y70-K312 HydrophobicContact CD1-CB 4.29Å; Y70-K312 HydrophobicContact CD1-CD 4.2Å; Y70-K312 HydrophobicContact CD2-CB 3.54Å; Y70-K312 WeakPolarHBondContact CD2-O 3.16Å; Y70-K312 HydrophobicContact CE1-CB 4.31Å; Y70-K312 HydrophobicContact CE1-CD 4.43Å; Y70-K312 HydrophobicContact CE2-CB 3.61Å; Y70-K312 WeakPolarHBondContact CE2-O 3.1Å; Y70-K312 HydrophobicContact CG-CB 3.91Å; Y70-K312 HydrophobicContact CG-CD 4.4Å; Y70-H313 PolarHBondContact N-O 2.84Å; Y70-V314 HydrophobicContact CD2-CB 4.48Å; Y70-V314 HydrophobicContact CD2-CG2 3.46Å; Y70-V314 VanDerWaalsContact CD2-CG2 3.46Å; Y70-V314 HydrophobicContact CE2-CG2 3.78Å; Y70-V314 HydrophobicContact CG-CG2 4.47Å
71	R	88.6	Confident	79.3	Confident	167 Å²	167	67.6 Å²	67.6	63%	0.63	37%	0.365	S	S	*	.			trans	-69.9	120.8	173.6	-174.9	-179	167.1	135.4	10.6	109.1	D73	R71-D73 WeakPolarHBondContact CD-OD1 3.45Å; R71-D73 WeakPolarHBondContact CG-OD1 3.37Å; R71-D73 IonicContact CZ-OD1 3.24Å; R71-D73 IonicContact NE-OD1 3.18Å; R71-D73 PolarHBondContact NE-OD1 3.47Å; R71-D73 IonicContact NH2-OD1 2.69Å; R71-D73 PolarHBondContact NH2-OD1 3.25Å; R71-D73 VanDerWaalsContact NH2-OD1 3.11Å; R71-D73 IonicContact NH2-OD2 3.98Å
72	T	86.8	Confident	82.2	Confident	13 Å²	13	62.5 Å²	62.5	8%	0.08	33%	0.332	C	S	.	.			trans	-132.2	20.8	-177.4	55.1	0	0	0	0	112.2	Y70 R77 I315 P317 K319	Y70-T72 PolarHBondContact O-N 2.87Å; T72-R77 VanDerWaalsContact CB-NH1 3.32Å; T72-R77 PolarHBondContact O-NH1 3.07Å; T72-I315 WeakPolarHBondContact CB-O 3.1Å; T72-I315 VanDerWaalsContact CG2-O 3.31Å; T72-I315 WeakPolarHBondContact CG2-O 3.42Å; T72-I315 PolarHBondContact OG1-O 2.72Å; T72-P317 WeakPolarHBondContact OG1-CD 3.48Å; T72-K319 PolarHBondContact O-NZ 2.96Å
73	D	82.6	Confident	84.8	Confident	108 Å²	108	57.4 Å²	57.4	58%	0.578	30%	0.296	S	S	*	.			trans	-109.9	9.9	-177.5	71.7	-16.1	0	0	0	113	R71	R71-D73 WeakPolarHBondContact CD-OD1 3.45Å; R71-D73 WeakPolarHBondContact CG-OD1 3.37Å; R71-D73 IonicContact CZ-OD1 3.24Å; R71-D73 IonicContact NE-OD1 3.18Å; R71-D73 PolarHBondContact NE-OD1 3.47Å; R71-D73 IonicContact NH2-OD1 2.69Å; R71-D73 PolarHBondContact NH2-OD1 3.25Å; R71-D73 VanDerWaalsContact NH2-OD1 3.11Å; R71-D73 IonicContact NH2-OD2 3.98Å
74	G	83.7	Confident	87.2	Confident	18 Å²	18	48.8 Å²	48.8	19%	0.186	26%	0.256	C	S	.	.	S	Bend	trans	-65.8	179.9	176.8	0	0	0	0	0	112.8	D145 K319	G74-D145 WeakPolarHBondContact CA-OD1 3.3Å; G74-D145 PolarHBondContact N-OD1 2.89Å; G74-D145 PolarHBondContact N-OD2 3.15Å; G74-K319 PolarHBondContact O-NZ 3.14Å
75	A	87	Confident	89.2	Confident	86 Å²	86	40.3 Å²	40.3	71%	0.711	22%	0.219	S	C	*	.	S	Bend	trans	-63.1	-45.7	-178.1	0	0	0	0	0	111.6
76	E	93	Very high	91.1	Very high	93 Å²	93	37.7 Å²	37.7	44%	0.435	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-118.3	138.3	-178.6	-60.7	-169	176.5	0	0	111	G78 D143 H144 D145	E76-G78 VanDerWaalsContact C-N 3.32Å; E76-D143 PolarHBondContact N-O 2.89Å; E76-H144 CarbonylContact O-C 3.58Å; E76-H144 WeakPolarHBondContact O-CA 3.44Å; E76-H144 IonicContact OE2-CE1 3.11Å; E76-H144 PolarHBondContact OE2-CE1 2.77Å; E76-H144 IonicContact OE2-ND1 3.2Å; E76-H144 PolarHBondContact OE2-ND1 2.86Å; E76-H144 IonicContact OE2-NE2 3.75Å; E76-D145 PolarHBondContact O-N 3.09Å
77	R	94.9	Very high	92.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.008	21%	0.21	C	C	.	.			trans	-64.6	-45.7	177.9	173.7	67.1	69.6	-141.5	-0.2	109.8	T72 L114 D115 F116 D145 C146 P317 K319	T72-R77 VanDerWaalsContact CB-NH1 3.32Å; T72-R77 PolarHBondContact O-NH1 3.07Å; R77-L114 WeakPolarHBondContact CG-O 3.47Å; R77-L114 PolarHBondContact NE-O 2.93Å; R77-D115 HydrophobicContact CB-CB 4.26Å; R77-D115 WeakPolarHBondContact CB-O 2.96Å; R77-D115 IonicContact NH2-OD2 3.54Å; R77-F116 HydrophobicContact CG-CD1 3.88Å; R77-F116 HydrophobicContact CG-CD2 3.44Å; R77-F116 VanDerWaalsContact CG-CD2 3.44Å; R77-F116 HydrophobicContact CG-CE1 3.89Å; R77-F116 HydrophobicContact CG-CE2 3.45Å; R77-F116 VanDerWaalsContact CG-CE2 3.45Å; R77-F116 HydrophobicContact CG-CG 3.67Å; R77-F116 HydrophobicContact CG-CZ 3.69Å; R77-D145 IonicContact NH1-OD2 3.42Å; R77-D145 WeakPolarHBondContact O-CB 3.41Å; R77-D145 PolarHBondContact O-N 3.1Å; R77-C146 PolarHBondContact O-N 3.07Å; R77-C146 PolarHBondContact O-SG 3.46Å; R77-P317 PolarHBondContact NH2-O 3.29Å; R77-K319 VanDerWaalsContact CA-CE 3.45Å
78	G	96.5	Very high	93.5	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.021	21%	0.212	C	C	.	.			trans	146.3	167.2	-167.9	0	0	0	0	0	112.6	E76 F116 R117 C146	E76-G78 VanDerWaalsContact C-N 3.32Å; G78-F116 WeakPolarHBondContact O-CA 3.44Å; G78-F116 WeakPolarHBondContact O-CD1 3.32Å; G78-R117 PolarHBondContact O-N 3.15Å; G78-C146 WeakPolarHBondContact CA-O 3.44Å
79	L	98	Very high	93.9	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	141.2	164.5	-58.5	-177.4	0	0	0	109.5	V81 R117 I119 L141 H144 F147 A148	L79-V81 HydrophobicContact CB-CG2 4.13Å; L79-R117 WeakPolarHBondContact CA-O 3.24Å; L79-R117 HydrophobicContact CD2-CB 3.97Å; L79-R117 HydrophobicContact CD2-CG 4.12Å; L79-I119 HydrophobicContact CD1-CD1 4.38Å; L79-I119 HydrophobicContact CD2-CD1 4.12Å; L79-L141 HydrophobicContact CD1-CD2 4.16Å; L79-L141 HydrophobicContact CG-CD2 4.47Å; L79-H144 PolarHBondContact N-CD2 2.78Å; L79-F147 HydrophobicContact CB-CD2 4.33Å; L79-F147 HydrophobicContact CB-CE2 4.47Å; L79-A148 PolarHBondContact O-N 2.97Å
80	C	98.6	Very high	94.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.7	158.4	177.8	0	0	0	0	107.8	F111 F116 R117 V118 I119 A148	C80-F111 HydrophobicContact CB-CB 3.92Å; C80-F111 HydrophobicContact CB-CD1 3.77Å; C80-F111 HydrophobicContact CB-CG 3.97Å; C80-F111 VanDerWaalsContact SG-CD1 3.55Å; C80-F111 WeakPolarHBondContact SG-CG 3.44Å; C80-F116 HydrophobicContact CB-CB 3.86Å; C80-F116 HydrophobicContact CB-CD1 4.05Å; C80-F116 HydrophobicContact CB-CG 4.15Å; C80-R117 PolarHBondContact N-O 2.98Å; C80-V118 HydrophobicContact CB-CG1 4.46Å; C80-V118 HydrophobicContact CB-CG2 4.18Å; C80-V118 CarbonylContact O-C 3.42Å; C80-V118 VanDerWaalsContact O-CA 3.28Å; C80-V118 WeakPolarHBondContact O-CA 3.44Å; C80-I119 PolarHBondContact O-N 3.44Å; C80-A148 CarbonylContact C-O 3.57Å; C80-A148 VanDerWaalsContact CA-O 3.3Å; C80-A148 WeakPolarHBondContact CA-O 3.44Å; C80-A148 HydrophobicContact CB-CB 4.12Å
81	V	98.7	Very high	94.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.9	-179	-178.1	0	0	0	0	108.7	L79 F83 I119 I136 F147 A148 C149 V150	L79-V81 HydrophobicContact CB-CG2 4.13Å; V81-F83 HydrophobicContact CG1-CD2 4.22Å; V81-F83 HydrophobicContact CG1-CE1 4.46Å; V81-F83 HydrophobicContact CG1-CE2 3.55Å; V81-F83 HydrophobicContact CG1-CZ 3.72Å; V81-I119 CarbonylContact C-O 3.59Å; V81-I119 WeakPolarHBondContact CA-O 3.36Å; V81-I136 HydrophobicContact CB-CD1 4.39Å; V81-I136 HydrophobicContact CG1-CD1 3.75Å; V81-I136 HydrophobicContact CG2-CD1 3.88Å; V81-I136 HydrophobicContact CG2-CG2 4.32Å; V81-F147 HydrophobicContact CB-CE2 4.47Å; V81-F147 HydrophobicContact CG2-CE2 3.82Å; V81-F147 HydrophobicContact CG2-CZ 4.29Å; V81-A148 PolarHBondContact N-O 2.9Å; V81-C149 CarbonylContact O-C 3.57Å; V81-C149 VanDerWaalsContact O-CA 3.25Å; V81-C149 WeakPolarHBondContact O-CA 3.45Å; V81-V150 PolarHBondContact O-N 2.91Å
82	V	98.8	Very high	94.8	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.5	-179.2	-170.6	0	0	0	0	109.3	I107 V118 I119 V120 H121 V150 L152	V82-I107 HydrophobicContact CG2-CG2 3.59Å; V82-V118 HydrophobicContact CG2-CG1 3.83Å; V82-I119 PolarHBondContact N-O 3.2Å; V82-V120 HydrophobicContact CB-CB 4.38Å; V82-V120 HydrophobicContact CB-CG1 4.26Å; V82-V120 HydrophobicContact CB-CG2 3.87Å; V82-V120 HydrophobicContact CG2-CG2 4.04Å; V82-V120 CarbonylContact O-C 3.54Å; V82-V120 WeakPolarHBondContact O-CA 3.4Å; V82-H121 PolarHBondContact O-N 3.26Å; V82-V150 CarbonylContact C-O 3.46Å; V82-V150 VanDerWaalsContact CA-O 3.28Å; V82-V150 WeakPolarHBondContact CA-O 3.49Å; V82-V150 HydrophobicContact CG1-CB 4.29Å; V82-V150 HydrophobicContact CG2-CB 4.29Å; V82-L152 HydrophobicContact CG1-CD1 4.02Å; V82-L152 HydrophobicContact CG1-CG 4.35Å
83	F	98.6	Very high	95.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	112	167.6	-64.2	-76.9	0	0	0	108.6	V81 H121 P124 L129 L132 I133 V150 L152	V81-F83 HydrophobicContact CG1-CD2 4.22Å; V81-F83 HydrophobicContact CG1-CE1 4.46Å; V81-F83 HydrophobicContact CG1-CE2 3.55Å; V81-F83 HydrophobicContact CG1-CZ 3.72Å; F83-H121 WeakPolarHBondContact CA-O 3.34Å; F83-H121 HydrophobicContact CD1-CB 3.76Å; F83-H121 HydrophobicContact CE1-CB 3.95Å; F83-H121 AromaticContact CE1-CD2 3.88Å; F83-P124 HydrophobicContact CD1-CG 4.05Å; F83-L129 HydrophobicContact CD1-CD1 4.36Å; F83-L129 HydrophobicContact CD1-CG 4Å; F83-L129 HydrophobicContact CE1-CG 4.08Å; F83-L129 HydrophobicContact CG-CD1 4.39Å; F83-L129 HydrophobicContact CG-CG 4.34Å; F83-L132 HydrophobicContact CE1-CB 4.13Å; F83-L132 HydrophobicContact CE1-CD1 4.03Å; F83-L132 HydrophobicContact CZ-CB 4.27Å; F83-I133 HydrophobicContact CE2-CD1 3.45Å; F83-I133 VanDerWaalsContact CE2-CD1 3.45Å; F83-I133 HydrophobicContact CE2-CG1 4.17Å; F83-I133 HydrophobicContact CZ-CD1 3.7Å; F83-I133 HydrophobicContact CZ-CG1 4Å; F83-V150 PolarHBondContact N-O 2.59Å; F83-L152 PolarHBondContact O-N 3.19Å
84	S	98.3	Very high	95.7	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	108.2	178.8	-178.8	0	0	0	0	109.7	S100 V104 H121 S122 N123	S84-S100 PolarHBondContact OG-OG 2.81Å; S84-V104 VanDerWaalsContact CB-CG2 3.5Å; S84-V104 WeakPolarHBondContact OG-CG2 3.14Å; S84-H121 PolarHBondContact N-O 3.21Å; S84-S122 CarbonylContact O-C 3.57Å; S84-S122 WeakPolarHBondContact O-CA 3.46Å; S84-N123 PolarHBondContact O-N 3.08Å
85	V	98.2	Very high	96.1	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.012	25%	0.252	C	S	.	.			trans	-106.5	114	175.1	-167.1	0	0	0	0	107.4	F88 R97 N123 P124 L152 S153 T164	V85-F88 HydrophobicContact CB-CE1 4.17Å; V85-F88 HydrophobicContact CB-CZ 4.15Å; V85-F88 HydrophobicContact CG1-CD1 3.96Å; V85-F88 HydrophobicContact CG1-CE1 3.35Å; V85-F88 HydrophobicContact CG1-CE2 4.46Å; V85-F88 HydrophobicContact CG1-CZ 3.63Å; V85-R97 WeakPolarHBondContact O-CD 3.31Å; V85-R97 PolarHBondContact O-NH1 3.32Å; V85-N123 WeakPolarHBondContact CA-OD1 3.48Å; V85-P124 HydrophobicContact CG2-CG 4.44Å; V85-L152 PolarHBondContact N-O 2.96Å; V85-S153 WeakPolarHBondContact CB-OG 3.31Å; V85-T164 HydrophobicContact CG1-CG2 4.13Å
86	D	97	Very high	96.4	Very high	36 Å²	36	43.8 Å²	43.8	19%	0.193	24%	0.24	C	C	.	.			trans	-124.3	-6.9	178.8	63.1	17.6	0	0	0	113.8	P96 R97 N123	D86-P96 VanDerWaalsContact O-CA 3.26Å; D86-P96 WeakPolarHBondContact O-CA 3.4Å; D86-R97 HydrophobicContact CB-CB 4.02Å; D86-R97 PolarHBondContact O-N 3.19Å; D86-N123 PolarHBondContact N-OD1 3.41Å; D86-N123 PolarHBondContact OD1-ND2 2.87Å; D86-N123 PolarHBondContact OD1-OD1 2.85Å; D86-N123 VanDerWaalsContact OD1-OD1 3.09Å
87	K	96.6	Very high	96.5	Very high	140 Å²	140	39.8 Å²	39.8	61%	0.609	22%	0.221	S	C	*	.			trans	-127.9	140.5	175	-67.2	170.8	-172	-178.2	0	109.5	N123 T164	K87-N123 PolarHBondContact N-OD1 2.85Å; K87-N123 VanDerWaalsContact N-OD1 3.1Å; K87-T164 WeakPolarHBondContact O-CG2 3.44Å
88	F	97.9	Very high	96.2	Very high	25 Å²	25	43.3 Å²	43.3	11%	0.11	24%	0.24	C	C	.	.			trans	-132.9	151.7	-174.8	-58	-86.7	0	0	0	109.4	V85 L92 L94 R97 H154 A163 T164	V85-F88 HydrophobicContact CB-CE1 4.17Å; V85-F88 HydrophobicContact CB-CZ 4.15Å; V85-F88 HydrophobicContact CG1-CD1 3.96Å; V85-F88 HydrophobicContact CG1-CE1 3.35Å; V85-F88 HydrophobicContact CG1-CE2 4.46Å; V85-F88 HydrophobicContact CG1-CZ 3.63Å; F88-L92 HydrophobicContact CB-CD1 4.26Å; F88-L92 HydrophobicContact CD1-CD1 4.48Å; F88-L94 HydrophobicContact CB-CB 4.01Å; F88-L94 HydrophobicContact CB-CD1 4.5Å; F88-L94 HydrophobicContact CD1-CB 4.43Å; F88-L94 HydrophobicContact CD1-CD1 3.78Å; F88-L94 HydrophobicContact CD2-CB 3.96Å; F88-L94 HydrophobicContact CE1-CD1 4.18Å; F88-L94 HydrophobicContact CG-CB 3.86Å; F88-L94 HydrophobicContact CG-CD1 4.06Å; F88-R97 HydrophobicContact CE2-CG 4.12Å; F88-H154 AromaticContact CD2-CD2 3.96Å; F88-H154 AromaticContact CE2-CD2 3.3Å; F88-H154 WeakPolarHBondContact CE2-CD2 3.23Å; F88-H154 AromaticContact CE2-NE2 3.63Å; F88-H154 HydrophobicContact CZ-CB 4.37Å; F88-H154 AromaticContact CZ-CD2 3.4Å; F88-H154 WeakPolarHBondContact CZ-CD2 3.35Å; F88-A163 VanDerWaalsContact CD1-O 3.31Å; F88-A163 WeakPolarHBondContact CD1-O 3.17Å; F88-T164 CarbonylContact C-O 3.56Å; F88-T164 WeakPolarHBondContact CA-O 3.36Å
89	D	97.3	Very high	95.7	Very high	71 Å²	71	44.1 Å²	44.1	38%	0.38	25%	0.248	S	C	.	.			trans	-60	134.8	174	-75.8	-14.3	0	0	0	109.3	I91 L92 T164 D165	D89-I91 HydrophobicContact CB-CG2 4.19Å; D89-I91 PolarHBondContact O-N 3.22Å; D89-L92 HydrophobicContact CB-CG 4.45Å; D89-L92 WeakPolarHBondContact O-CB 3.08Å; D89-L92 PolarHBondContact O-N 3.35Å; D89-T164 PolarHBondContact N-O 2.84Å; D89-D165 VanDerWaalsContact OD2-CA 3.31Å; D89-D165 WeakPolarHBondContact OD2-CA 3.49Å; D89-D165 WeakPolarHBondContact OD2-CB 3.46Å
90	P	96.3	Very high	95.3	Very high	119 Å²	119	44 Å²	44	77%	0.773	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-56	-28.4	-173.9	-28.7	35.1	0	0	0	114.6	L92 C93	P90-L92 PolarHBondContact O-N 3.04Å; P90-C93 PolarHBondContact O-N 3.3Å; P90-C93 VanDerWaalsContact O-N 3.08Å
91	I	96.4	Very high	95.2	Very high	150 Å²	150	49.2 Å²	49.2	77%	0.769	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.6	-22.3	178.3	-165.6	165.3	0	0	0	113.2	D89 C93	D89-I91 HydrophobicContact CB-CG2 4.19Å; D89-I91 PolarHBondContact O-N 3.22Å; I91-C93 VanDerWaalsContact C-N 3.25Å; I91-C93 PolarHBondContact O-N 2.73Å
92	L	95.6	Very high	95.1	Very high	34 Å²	34	51.2 Å²	51.2	18%	0.178	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-77.2	-14.4	176.4	-59.2	179.1	0	0	0	112.4	F88 D89 P90 L94 Y162 T164	F88-L92 HydrophobicContact CB-CD1 4.26Å; F88-L92 HydrophobicContact CD1-CD1 4.48Å; D89-L92 HydrophobicContact CB-CG 4.45Å; D89-L92 WeakPolarHBondContact O-CB 3.08Å; D89-L92 PolarHBondContact O-N 3.35Å; P90-L92 PolarHBondContact O-N 3.04Å; L92-L94 HydrophobicContact CB-CD1 4.09Å; L92-L94 HydrophobicContact CB-CG 4.12Å; L92-L94 HydrophobicContact CD1-CD1 4.37Å; L92-L94 PolarHBondContact O-N 2.94Å; L92-L94 VanDerWaalsContact O-N 3.08Å; L92-Y162 HydrophobicContact CD1-CD1 4.39Å; L92-T164 WeakPolarHBondContact CD1-O 3.25Å
93	C	94.7	Very high	95	Very high	83 Å²	83	51.2 Å²	51.2	56%	0.561	29%	0.287	S	S	*	.			trans	53	28	-177	-58.9	0	0	0	0	114	P90 I91	P90-C93 PolarHBondContact O-N 3.3Å; P90-C93 VanDerWaalsContact O-N 3.08Å; I91-C93 VanDerWaalsContact C-N 3.25Å; I91-C93 PolarHBondContact O-N 2.73Å
94	L	94.1	Very high	95	Very high	43 Å²	43	51.6 Å²	51.6	23%	0.225	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-91.9	131.3	178.1	-69.9	172.7	0	0	0	110.7	F88 L92 H154 Y162	F88-L94 HydrophobicContact CB-CB 4.01Å; F88-L94 HydrophobicContact CB-CD1 4.5Å; F88-L94 HydrophobicContact CD1-CB 4.43Å; F88-L94 HydrophobicContact CD1-CD1 3.78Å; F88-L94 HydrophobicContact CD2-CB 3.96Å; F88-L94 HydrophobicContact CE1-CD1 4.18Å; F88-L94 HydrophobicContact CG-CB 3.86Å; F88-L94 HydrophobicContact CG-CD1 4.06Å; L92-L94 HydrophobicContact CB-CD1 4.09Å; L92-L94 HydrophobicContact CB-CG 4.12Å; L92-L94 HydrophobicContact CD1-CD1 4.37Å; L92-L94 PolarHBondContact O-N 2.94Å; L92-L94 VanDerWaalsContact O-N 3.08Å; L94-H154 HydrophobicContact CD1-CB 4.38Å; L94-H154 HydrophobicContact CD2-CB 4.42Å; L94-Y162 HydrophobicContact CD1-CD1 3.48Å; L94-Y162 VanDerWaalsContact CD1-CD1 3.48Å; L94-Y162 HydrophobicContact CD1-CD2 3.94Å; L94-Y162 HydrophobicContact CD1-CE1 3.85Å; L94-Y162 HydrophobicContact CD1-CE2 4.28Å; L94-Y162 HydrophobicContact CD1-CG 3.52Å
95	P	92.5	Very high	95	Very high	43 Å²	43	56.7 Å²	56.7	28%	0.279	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-70.4	151.6	178.4	30.1	-35.2	0	0	0	111.1	H18 H154	H18-P95 VanDerWaalsContact CE1-CG 3.46Å; H18-P95 WeakPolarHBondContact CE1-CG 3.38Å; H18-P95 WeakPolarHBondContact ND1-CG 3.47Å; P95-H154 PolarHBondContact O-NE2 3.13Å
96	P	92.9	Very high	95	Very high	72 Å²	72	57.7 Å²	57.7	47%	0.468	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-61	151.9	173.5	28	-34.9	0	0	0	111.1	D86 N98	D86-P96 VanDerWaalsContact O-CA 3.26Å; D86-P96 WeakPolarHBondContact O-CA 3.4Å; P96-N98 PolarHBondContact O-N 2.75Å
97	R	94.8	Very high	95.1	Very high	8 Å²	8	56 Å²	56	3%	0.03	31%	0.309	C	S	.	.			trans	-97.4	75.5	-178.2	-64.7	177.5	66.4	-92.5	-9.2	111.2	V85 D86 F88 S100 L152 S153 H154	V85-R97 WeakPolarHBondContact O-CD 3.31Å; V85-R97 PolarHBondContact O-NH1 3.32Å; D86-R97 HydrophobicContact CB-CB 4.02Å; D86-R97 PolarHBondContact O-N 3.19Å; F88-R97 HydrophobicContact CE2-CG 4.12Å; R97-S100 PolarHBondContact NH1-OG 2.95Å; R97-S100 WeakPolarHBondContact O-CB 3.49Å; R97-S100 PolarHBondContact O-N 3.26Å; R97-L152 PolarHBondContact NH1-O 3.25Å; R97-S153 VanDerWaalsContact NE-C 3.3Å; R97-S153 PolarHBondContact NE-O 2.94Å; R97-H154 WeakPolarHBondContact CG-CE1 3.43Å; R97-H154 WeakPolarHBondContact CG-NE2 3.41Å
98	N	88.2	Confident	95.2	Very high	77 Å²	77	54.1 Å²	54.1	41%	0.412	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	140.5	175.3	-67.9	-34.5	0	0	0	111.2	E16 P96 S100 R248 S250	E16-N98 PolarHBondContact OE1-ND2 2.91Å; P96-N98 PolarHBondContact O-N 2.75Å; N98-S100 PolarHBondContact O-N 3.48Å; N98-R248 WeakPolarHBondContact O-CD 3.43Å; N98-R248 PolarHBondContact O-NH1 3.21Å; N98-S250 CarbonylContact C-O 3.51Å
99	G	86.1	Confident	95.2	Very high	18 Å²	18	58.9 Å²	58.9	19%	0.186	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	-3.5	-175	0	0	0	0	0	115.4	L101 V102 D103 S250	G99-L101 PolarHBondContact O-N 3.39Å; G99-V102 WeakPolarHBondContact O-CB 3.22Å; G99-V102 PolarHBondContact O-N 2.82Å; G99-D103 PolarHBondContact O-N 3.45Å; G99-S250 VanDerWaalsContact CA-O 3.23Å; G99-S250 WeakPolarHBondContact CA-O 3.41Å; G99-S250 PolarHBondContact N-O 2.91Å
100	S	90.4	Very high	95.3	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.007	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-25.5	175.7	-167.4	0	0	0	0	113	S84 R97 N98 V102 D103 V104	S84-S100 PolarHBondContact OG-OG 2.81Å; R97-S100 PolarHBondContact NH1-OG 2.95Å; R97-S100 WeakPolarHBondContact O-CB 3.49Å; R97-S100 PolarHBondContact O-N 3.26Å; N98-S100 PolarHBondContact O-N 3.48Å; S100-V102 VanDerWaalsContact C-N 3.29Å; S100-V102 PolarHBondContact O-N 2.71Å; S100-D103 WeakPolarHBondContact O-CB 2.89Å; S100-D103 PolarHBondContact O-N 2.59Å; S100-V104 WeakPolarHBondContact O-CG2 3.38Å; S100-V104 PolarHBondContact O-N 2.53Å
101	L	95.4	Very high	95.4	Very high	110 Å²	110	50 Å²	50	58%	0.576	26%	0.264	S	S	*	.	H	α-helix	trans	-64.2	-35	173.5	-177.9	60.5	0	0	0	112.1	G99 D103 V104 Q105	G99-L101 PolarHBondContact O-N 3.39Å; L101-D103 VanDerWaalsContact C-N 3.35Å; L101-V104 PolarHBondContact O-N 3.07Å; L101-Q105 VanDerWaalsContact O-CG 3.32Å; L101-Q105 WeakPolarHBondContact O-CG 3.28Å; L101-Q105 PolarHBondContact O-N 3.17Å
102	V	96.4	Very high	95.4	Very high	41 Å²	41	44.8 Å²	44.8	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-41.4	176.3	179.3	0	0	0	0	110.1	G99 S100 V104 Q105 N106	G99-V102 WeakPolarHBondContact O-CB 3.22Å; G99-V102 PolarHBondContact O-N 2.82Å; S100-V102 VanDerWaalsContact C-N 3.29Å; S100-V102 PolarHBondContact O-N 2.71Å; V102-V104 PolarHBondContact O-N 2.84Å; V102-Q105 PolarHBondContact O-N 2.93Å; V102-N106 WeakPolarHBondContact O-CB 3.43Å; V102-N106 PolarHBondContact O-N 3.21Å; V102-N106 PolarHBondContact O-ND2 3.3Å
103	D	97.9	Very high	95.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.9	-46.8	173.2	-74.1	-14.1	0	0	0	111.6	G99 S100 L101 Q105 N106 I107 L152 G253 S254 I257	G99-D103 PolarHBondContact O-N 3.45Å; S100-D103 WeakPolarHBondContact O-CB 2.89Å; S100-D103 PolarHBondContact O-N 2.59Å; L101-D103 VanDerWaalsContact C-N 3.35Å; D103-Q105 VanDerWaalsContact C-N 3.34Å; D103-Q105 PolarHBondContact O-N 3.25Å; D103-N106 PolarHBondContact O-N 3.42Å; D103-I107 WeakPolarHBondContact O-CB 3.36Å; D103-I107 WeakPolarHBondContact O-CG1 3.27Å; D103-I107 PolarHBondContact O-N 3.33Å; D103-L152 HydrophobicContact CB-CD1 3.82Å; D103-L152 HydrophobicContact CB-CD2 4.42Å; D103-G253 WeakPolarHBondContact OD1-CA 3.47Å; D103-S254 VanDerWaalsContact CG-OG 3.22Å; D103-S254 PolarHBondContact OD1-N 2.86Å; D103-S254 PolarHBondContact OD1-OG 2.95Å; D103-S254 WeakPolarHBondContact OD2-CB 3.16Å; D103-S254 PolarHBondContact OD2-N 2.91Å; D103-S254 PolarHBondContact OD2-OG 2.69Å; D103-I257 HydrophobicContact CB-CB 4.29Å; D103-I257 HydrophobicContact CB-CG1 4.47Å; D103-I257 HydrophobicContact CB-CG2 3.8Å
104	V	98.5	Very high	95.6	Very high	9 Å²	9	42 Å²	42	6%	0.055	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-44.6	176.7	171.1	0	0	0	0	111.4	S84 S100 L101 V102 K108 V120 L152	S84-V104 VanDerWaalsContact CB-CG2 3.5Å; S84-V104 WeakPolarHBondContact OG-CG2 3.14Å; S100-V104 WeakPolarHBondContact O-CG2 3.38Å; S100-V104 PolarHBondContact O-N 2.53Å; L101-V104 PolarHBondContact O-N 3.07Å; V102-V104 PolarHBondContact O-N 2.84Å; V104-K108 HydrophobicContact CG1-CD 4.22Å; V104-K108 HydrophobicContact CG1-CG 4.46Å; V104-K108 WeakPolarHBondContact O-CB 3.16Å; V104-K108 VanDerWaalsContact O-CG 3.32Å; V104-K108 WeakPolarHBondContact O-CG 3.04Å; V104-K108 PolarHBondContact O-N 2.86Å; V104-V120 HydrophobicContact CG1-CG1 3.92Å; V104-V120 HydrophobicContact CG1-CG2 4.27Å; V104-L152 HydrophobicContact CG2-CD1 3.7Å
105	Q	98.3	Very high	95.7	Very high	108 Å²	108	41.8 Å²	41.8	51%	0.505	22%	0.222	S	C	.	.	H	α-helix	trans	-65.7	-42.4	179.5	-72.9	172.9	-10	0	0	112	L101 V102 D103 K108 R109	L101-Q105 VanDerWaalsContact O-CG 3.32Å; L101-Q105 WeakPolarHBondContact O-CG 3.28Å; L101-Q105 PolarHBondContact O-N 3.17Å; V102-Q105 PolarHBondContact O-N 2.93Å; D103-Q105 VanDerWaalsContact C-N 3.34Å; D103-Q105 PolarHBondContact O-N 3.25Å; Q105-K108 PolarHBondContact O-N 3.38Å; Q105-R109 WeakPolarHBondContact O-CB 3.41Å; Q105-R109 PolarHBondContact O-N 2.93Å
106	N	98.3	Very high	96	Very high	24 Å²	24	40.1 Å²	40.1	13%	0.128	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-46.3	176.7	-80.6	-28.6	0	0	0	111.8	V102 D103 R109 A110 I257 S261	V102-N106 WeakPolarHBondContact O-CB 3.43Å; V102-N106 PolarHBondContact O-N 3.21Å; V102-N106 PolarHBondContact O-ND2 3.3Å; D103-N106 PolarHBondContact O-N 3.42Å; N106-R109 PolarHBondContact O-N 3.49Å; N106-R109 PolarHBondContact OD1-NH2 3.3Å; N106-A110 WeakPolarHBondContact O-CB 3.49Å; N106-A110 PolarHBondContact O-N 3.15Å; N106-I257 HydrophobicContact CB-CG2 4.46Å; N106-S261 WeakPolarHBondContact CB-OG 3.4Å
107	I	98.6	Very high	96.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-45.1	176.5	-69.5	-66.4	0	0	0	111.6	V82 D103 R109 A110 F111 V150 I257 L260	V82-I107 HydrophobicContact CG2-CG2 3.59Å; D103-I107 WeakPolarHBondContact O-CB 3.36Å; D103-I107 WeakPolarHBondContact O-CG1 3.27Å; D103-I107 PolarHBondContact O-N 3.33Å; I107-R109 VanDerWaalsContact C-N 3.32Å; I107-R109 PolarHBondContact O-N 2.88Å; I107-A110 PolarHBondContact O-N 3.27Å; I107-F111 HydrophobicContact CD1-CD2 4.39Å; I107-F111 HydrophobicContact CD1-CE2 4.04Å; I107-F111 HydrophobicContact CG2-CD2 3.86Å; I107-F111 HydrophobicContact CG2-CE2 4.26Å; I107-F111 WeakPolarHBondContact O-CB 3.41Å; I107-F111 WeakPolarHBondContact O-CD2 3.42Å; I107-F111 PolarHBondContact O-N 3.27Å; I107-V150 HydrophobicContact CD1-CG1 4.04Å; I107-V150 HydrophobicContact CD1-CG2 4.4Å; I107-V150 HydrophobicContact CG1-CG1 4.07Å; I107-V150 HydrophobicContact CG2-CB 4.18Å; I107-V150 HydrophobicContact CG2-CG1 4.25Å; I107-V150 HydrophobicContact CG2-CG2 3.87Å; I107-I257 HydrophobicContact CD1-CD1 3.99Å; I107-I257 HydrophobicContact CD1-CG2 3.86Å; I107-I257 HydrophobicContact CG1-CD1 4.28Å; I107-I257 HydrophobicContact CG1-CG2 3.59Å; I107-L260 HydrophobicContact CD1-CD2 4.22Å
108	K	98.6	Very high	96.4	Very high	101 Å²	101	46 Å²	46	44%	0.439	23%	0.228	S	C	.	.	H	α-helix	trans	-54.4	-50.3	175	-81.5	-178.8	177.6	-174.2	0	111.1	V104 Q105 A112 V118 V120	V104-K108 HydrophobicContact CG1-CD 4.22Å; V104-K108 HydrophobicContact CG1-CG 4.46Å; V104-K108 WeakPolarHBondContact O-CB 3.16Å; V104-K108 VanDerWaalsContact O-CG 3.32Å; V104-K108 WeakPolarHBondContact O-CG 3.04Å; V104-K108 PolarHBondContact O-N 2.86Å; Q105-K108 PolarHBondContact O-N 3.38Å; K108-A112 WeakPolarHBondContact O-CB 3.33Å; K108-A112 PolarHBondContact O-N 3.1Å; K108-V118 HydrophobicContact CG-CG1 3.91Å; K108-V120 HydrophobicContact CD-CG2 4.23Å; K108-V120 HydrophobicContact CG-CG2 4.06Å
109	R	98.3	Very high	96.9	Very high	124 Å²	124	44.7 Å²	44.7	47%	0.468	22%	0.22	S	C	.	.	H	α-helix	trans	-61.9	-49.5	-180	-179.4	175.3	57.4	119.8	1.6	111.5	Q105 N106 I107 N113 L265	Q105-R109 WeakPolarHBondContact O-CB 3.41Å; Q105-R109 PolarHBondContact O-N 2.93Å; N106-R109 PolarHBondContact O-N 3.49Å; N106-R109 PolarHBondContact OD1-NH2 3.3Å; I107-R109 VanDerWaalsContact C-N 3.32Å; I107-R109 PolarHBondContact O-N 2.88Å; R109-N113 WeakPolarHBondContact O-CB 3.38Å; R109-N113 PolarHBondContact O-N 2.92Å; R109-L265 HydrophobicContact CG-CD1 4.28Å; R109-L265 HydrophobicContact CG-CD2 4.22Å; R109-L265 VanDerWaalsContact NH1-CD1 3.27Å
110	A	98.5	Very high	97.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-49.5	-177.5	0	0	0	0	0	112.5	N106 I107 N113 L114 L264 L265	N106-A110 WeakPolarHBondContact O-CB 3.49Å; N106-A110 PolarHBondContact O-N 3.15Å; I107-A110 PolarHBondContact O-N 3.27Å; A110-N113 WeakPolarHBondContact O-CB 3.4Å; A110-N113 PolarHBondContact O-N 2.91Å; A110-L114 PolarHBondContact O-N 3.49Å; A110-L264 HydrophobicContact CB-CB 4.19Å; A110-L264 HydrophobicContact CB-CD1 4.31Å; A110-L265 HydrophobicContact CB-CG 4.16Å
111	F	98.5	Very high	97.8	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-74	-33.5	-178.4	-81	-94.2	0	0	0	112.8	C80 I107 N113 L114 D115 F116 V118 A148 V150 F193 L264	C80-F111 HydrophobicContact CB-CB 3.92Å; C80-F111 HydrophobicContact CB-CD1 3.77Å; C80-F111 HydrophobicContact CB-CG 3.97Å; C80-F111 VanDerWaalsContact SG-CD1 3.55Å; C80-F111 WeakPolarHBondContact SG-CG 3.44Å; I107-F111 HydrophobicContact CD1-CD2 4.39Å; I107-F111 HydrophobicContact CD1-CE2 4.04Å; I107-F111 HydrophobicContact CG2-CD2 3.86Å; I107-F111 HydrophobicContact CG2-CE2 4.26Å; I107-F111 WeakPolarHBondContact O-CB 3.41Å; I107-F111 WeakPolarHBondContact O-CD2 3.42Å; I107-F111 PolarHBondContact O-N 3.27Å; F111-N113 VanDerWaalsContact C-N 3.27Å; F111-N113 PolarHBondContact O-N 3.44Å; F111-L114 CarbonylContact O-C 3.52Å; F111-L114 PolarHBondContact O-N 2.85Å; F111-L114 VanDerWaalsContact O-N 3.07Å; F111-D115 PolarHBondContact O-N 3.39Å; F111-F116 HydrophobicContact CB-CB 4.15Å; F111-F116 HydrophobicContact CB-CD2 4.49Å; F111-F116 HydrophobicContact CD1-CB 4.46Å; F111-F116 HydrophobicContact CD1-CD1 4.45Å; F111-F116 AromaticContact CD1-CD2 3.76Å; F111-F116 HydrophobicContact CD1-CD2 3.76Å; F111-F116 HydrophobicContact CD1-CE2 4.01Å; F111-F116 AromaticContact CD1-CG 3.99Å; F111-F116 HydrophobicContact CD1-CG 3.99Å; F111-F116 HydrophobicContact CD1-CZ 4.45Å; F111-F116 HydrophobicContact CE1-CE2 4.43Å; F111-F116 WeakPolarHBondContact O-CB 3.47Å; F111-F116 PolarHBondContact O-N 2.88Å; F111-V118 HydrophobicContact CB-CG2 3.81Å; F111-A148 HydrophobicContact CD1-CB 4.2Å; F111-A148 HydrophobicContact CE1-CB 3.71Å; F111-V150 HydrophobicContact CE2-CG2 4Å; F111-V150 HydrophobicContact CZ-CG2 4.19Å; F111-F193 HydrophobicContact CE1-CE2 4.13Å; F111-F193 AromaticContact CZ-CD2 3.89Å; F111-F193 HydrophobicContact CZ-CD2 3.89Å; F111-F193 AromaticContact CZ-CE2 3.63Å; F111-F193 HydrophobicContact CZ-CE2 3.63Å; F111-F193 HydrophobicContact CZ-CZ 4.22Å; F111-L264 HydrophobicContact CD2-CD1 4.35Å; F111-L264 HydrophobicContact CE2-CD1 3.78Å; F111-L264 HydrophobicContact CZ-CD1 4.06Å
112	A	97.5	Very high	98	Very high	41 Å²	41	46.5 Å²	46.5	34%	0.339	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-32.7	170.8	0	0	0	0	0	112.1	K108 L114 D115 V118 R322	K108-A112 WeakPolarHBondContact O-CB 3.33Å; K108-A112 PolarHBondContact O-N 3.1Å; A112-L114 PolarHBondContact O-N 2.81Å; A112-D115 PolarHBondContact O-N 2.69Å; A112-D115 VanDerWaalsContact O-N 3.15Å; A112-V118 HydrophobicContact CB-CG2 4.41Å; A112-R322 PolarHBondContact O-NH2 3.33Å
113	N	96.3	Very high	98.1	Very high	60 Å²	60	46.7 Å²	46.7	32%	0.321	23%	0.232	S	C	.	.	H	α-helix	trans	-65.3	-25.8	172.6	-171.3	71.1	0	0	0	112.7	R109 A110 F111 D115 L265	R109-N113 WeakPolarHBondContact O-CB 3.38Å; R109-N113 PolarHBondContact O-N 2.92Å; A110-N113 WeakPolarHBondContact O-CB 3.4Å; A110-N113 PolarHBondContact O-N 2.91Å; F111-N113 VanDerWaalsContact C-N 3.27Å; F111-N113 PolarHBondContact O-N 3.44Å; N113-D115 VanDerWaalsContact C-N 3.28Å; N113-L265 HydrophobicContact CB-CD2 3.65Å
114	L	96.9	Very high	98.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	15.4	175.3	-56.5	-179.2	0	0	0	113.2	R77 A110 F111 A112 F116 L264 F316	R77-L114 WeakPolarHBondContact CG-O 3.47Å; R77-L114 PolarHBondContact NE-O 2.93Å; A110-L114 PolarHBondContact O-N 3.49Å; F111-L114 CarbonylContact O-C 3.52Å; F111-L114 PolarHBondContact O-N 2.85Å; F111-L114 VanDerWaalsContact O-N 3.07Å; A112-L114 PolarHBondContact O-N 2.81Å; L114-F116 VanDerWaalsContact C-N 3.26Å; L114-F116 HydrophobicContact CB-CD2 3.89Å; L114-F116 HydrophobicContact CB-CE2 4.11Å; L114-F116 PolarHBondContact O-N 2.96Å; L114-L264 HydrophobicContact CD1-CB 4.23Å; L114-L264 HydrophobicContact CD1-CD2 3.72Å; L114-L264 HydrophobicContact CD1-CG 4.4Å; L114-F316 HydrophobicContact CB-CB 4.44Å; L114-F316 HydrophobicContact CD1-CD2 3.96Å; L114-F316 HydrophobicContact CD1-CE2 4.41Å; L114-F316 HydrophobicContact CD1-CG 4.42Å; L114-F316 HydrophobicContact CD2-CB 4.23Å
115	D	96.6	Very high	98.1	Very high	37 Å²	37	49.2 Å²	49.2	20%	0.198	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	17.9	179.3	-55.4	-53.6	0	0	0	115.2	R77 F111 A112 N113 K319 R322	R77-D115 HydrophobicContact CB-CB 4.26Å; R77-D115 WeakPolarHBondContact CB-O 2.96Å; R77-D115 IonicContact NH2-OD2 3.54Å; F111-D115 PolarHBondContact O-N 3.39Å; A112-D115 PolarHBondContact O-N 2.69Å; A112-D115 VanDerWaalsContact O-N 3.15Å; N113-D115 VanDerWaalsContact C-N 3.28Å; D115-K319 HydrophobicContact CB-CD 4.18Å; D115-K319 HydrophobicContact CB-CG 4.2Å; D115-K319 PolarHBondContact OD2-N 2.77Å; D115-R322 IonicContact OD1-CZ 3.09Å; D115-R322 IonicContact OD1-NE 3.83Å; D115-R322 PolarHBondContact OD1-NE 3.42Å; D115-R322 IonicContact OD1-NH2 2.56Å; D115-R322 PolarHBondContact OD1-NH2 3.44Å
116	F	98.1	Very high	98	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.039	23%	0.232	C	C	.	.			trans	-73.2	143.9	169.9	-74.4	-98.4	0	0	0	111.1	R77 G78 C80 F111 L114 V118 C146 A148 F316	R77-F116 HydrophobicContact CG-CD1 3.88Å; R77-F116 HydrophobicContact CG-CD2 3.44Å; R77-F116 VanDerWaalsContact CG-CD2 3.44Å; R77-F116 HydrophobicContact CG-CE1 3.89Å; R77-F116 HydrophobicContact CG-CE2 3.45Å; R77-F116 VanDerWaalsContact CG-CE2 3.45Å; R77-F116 HydrophobicContact CG-CG 3.67Å; R77-F116 HydrophobicContact CG-CZ 3.69Å; G78-F116 WeakPolarHBondContact O-CA 3.44Å; G78-F116 WeakPolarHBondContact O-CD1 3.32Å; C80-F116 HydrophobicContact CB-CB 3.86Å; C80-F116 HydrophobicContact CB-CD1 4.05Å; C80-F116 HydrophobicContact CB-CG 4.15Å; F111-F116 HydrophobicContact CB-CB 4.15Å; F111-F116 HydrophobicContact CB-CD2 4.49Å; F111-F116 HydrophobicContact CD1-CB 4.46Å; F111-F116 HydrophobicContact CD1-CD1 4.45Å; F111-F116 AromaticContact CD1-CD2 3.76Å; F111-F116 HydrophobicContact CD1-CD2 3.76Å; F111-F116 HydrophobicContact CD1-CE2 4.01Å; F111-F116 AromaticContact CD1-CG 3.99Å; F111-F116 HydrophobicContact CD1-CG 3.99Å; F111-F116 HydrophobicContact CD1-CZ 4.45Å; F111-F116 HydrophobicContact CE1-CE2 4.43Å; F111-F116 WeakPolarHBondContact O-CB 3.47Å; F111-F116 PolarHBondContact O-N 2.88Å; L114-F116 VanDerWaalsContact C-N 3.26Å; L114-F116 HydrophobicContact CB-CD2 3.89Å; L114-F116 HydrophobicContact CB-CE2 4.11Å; L114-F116 PolarHBondContact O-N 2.96Å; F116-V118 PolarHBondContact O-N 2.69Å; F116-C146 VanDerWaalsContact CE1-SG 3.5Å; F116-C146 WeakPolarHBondContact CZ-SG 3.48Å; F116-A148 HydrophobicContact CD1-CB 4.21Å; F116-A148 HydrophobicContact CE1-CB 3.75Å; F116-A148 HydrophobicContact CZ-CB 4.28Å; F116-F316 HydrophobicContact CE2-CD1 4.14Å; F116-F316 AromaticContact CE2-CE1 3.9Å; F116-F316 HydrophobicContact CE2-CE1 3.9Å; F116-F316 HydrophobicContact CE2-CZ 4.35Å; F116-F316 HydrophobicContact CZ-CD1 4.43Å; F116-F316 AromaticContact CZ-CE1 3.82Å; F116-F316 HydrophobicContact CZ-CE1 3.82Å; F116-F316 HydrophobicContact CZ-CZ 4.3Å
117	R	97.7	Very high	98	Very high	167 Å²	167	50.3 Å²	50.3	63%	0.63	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	109.6	163.6	179.1	179.2	175.1	-168.1	-1.8	108.7	G78 L79 C80	G78-R117 PolarHBondContact O-N 3.15Å; L79-R117 WeakPolarHBondContact CA-O 3.24Å; L79-R117 HydrophobicContact CD2-CB 3.97Å; L79-R117 HydrophobicContact CD2-CG 4.12Å; C80-R117 PolarHBondContact N-O 2.98Å
118	V	98.6	Very high	97.9	Very high	37 Å²	37	52.8 Å²	52.8	22%	0.224	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.9	-177.4	-168	0	0	0	0	110.9	C80 V82 K108 F111 A112 F116 V120	C80-V118 HydrophobicContact CB-CG1 4.46Å; C80-V118 HydrophobicContact CB-CG2 4.18Å; C80-V118 CarbonylContact O-C 3.42Å; C80-V118 VanDerWaalsContact O-CA 3.28Å; C80-V118 WeakPolarHBondContact O-CA 3.44Å; V82-V118 HydrophobicContact CG2-CG1 3.83Å; K108-V118 HydrophobicContact CG-CG1 3.91Å; F111-V118 HydrophobicContact CB-CG2 3.81Å; A112-V118 HydrophobicContact CB-CG2 4.41Å; F116-V118 PolarHBondContact O-N 2.69Å; V118-V120 HydrophobicContact CG1-CG2 4.15Å
119	I	98.5	Very high	97.9	Very high	49 Å²	49	48.1 Å²	48.1	25%	0.251	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.4	175.4	-57.5	175.1	0	0	0	107.6	L79 C80 V81 V82	L79-I119 HydrophobicContact CD1-CD1 4.38Å; L79-I119 HydrophobicContact CD2-CD1 4.12Å; C80-I119 PolarHBondContact O-N 3.44Å; V81-I119 CarbonylContact C-O 3.59Å; V81-I119 WeakPolarHBondContact CA-O 3.36Å; V82-I119 PolarHBondContact N-O 3.2Å
120	V	98.6	Very high	97.8	Very high	37 Å²	37	45.7 Å²	45.7	22%	0.224	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.1	-176.5	-176.9	0	0	0	0	110.6	V82 V104 K108 V118	V82-V120 HydrophobicContact CB-CB 4.38Å; V82-V120 HydrophobicContact CB-CG1 4.26Å; V82-V120 HydrophobicContact CB-CG2 3.87Å; V82-V120 HydrophobicContact CG2-CG2 4.04Å; V82-V120 CarbonylContact O-C 3.54Å; V82-V120 WeakPolarHBondContact O-CA 3.4Å; V104-V120 HydrophobicContact CG1-CG1 3.92Å; V104-V120 HydrophobicContact CG1-CG2 4.27Å; K108-V120 HydrophobicContact CD-CG2 4.23Å; K108-V120 HydrophobicContact CG-CG2 4.06Å; V118-V120 HydrophobicContact CG1-CG2 4.15Å
121	H	98.5	Very high	97.7	Very high	48 Å²	48	48.1 Å²	48.1	22%	0.222	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	110.9	173.3	-62.2	-75.6	0	0	0	108.7	V82 F83 S84 L132	V82-H121 PolarHBondContact O-N 3.26Å; F83-H121 WeakPolarHBondContact CA-O 3.34Å; F83-H121 HydrophobicContact CD1-CB 3.76Å; F83-H121 HydrophobicContact CE1-CB 3.95Å; F83-H121 AromaticContact CE1-CD2 3.88Å; S84-H121 PolarHBondContact N-O 3.21Å; H121-L132 HydrophobicContact CB-CD1 4.15Å
122	S	98.2	Very high	97.7	Very high	81 Å²	81	49.9 Å²	49.9	57%	0.566	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	132.2	179.5	-63.5	0	0	0	0	110.5	S84 P124	S84-S122 CarbonylContact O-C 3.57Å; S84-S122 WeakPolarHBondContact O-CA 3.46Å; S122-P124 VanDerWaalsContact C-CD 3.46Å
123	N	98.2	Very high	97.7	Very high	45 Å²	45	48 Å²	48	24%	0.241	26%	0.255	C	S	.	.	S	Bend	trans	48.9	51.8	173.2	-61.6	-46.5	0	0	0	114.6	S84 V85 D86 K87 T164	S84-N123 PolarHBondContact O-N 3.08Å; V85-N123 WeakPolarHBondContact CA-OD1 3.48Å; D86-N123 PolarHBondContact N-OD1 3.41Å; D86-N123 PolarHBondContact OD1-ND2 2.87Å; D86-N123 PolarHBondContact OD1-OD1 2.85Å; D86-N123 VanDerWaalsContact OD1-OD1 3.09Å; K87-N123 PolarHBondContact N-OD1 2.85Å; K87-N123 VanDerWaalsContact N-OD1 3.1Å; N123-T164 VanDerWaalsContact C-CG2 3.42Å; N123-T164 HydrophobicContact CB-CG2 3.64Å; N123-T164 WeakPolarHBondContact O-CG2 3.19Å
124	P	98.5	Very high	97.6	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.039	26%	0.255	C	S	.	.			trans	-69.2	144.1	170.1	33.2	-39.2	0	0	0	111.2	F83 V85 S122 L129 A163 T164	F83-P124 HydrophobicContact CD1-CG 4.05Å; V85-P124 HydrophobicContact CG2-CG 4.44Å; S122-P124 VanDerWaalsContact C-CD 3.46Å; P124-L129 HydrophobicContact CB-CB 3.98Å; P124-L129 HydrophobicContact CG-CB 4Å; P124-L129 HydrophobicContact CG-CD1 4.07Å; P124-L129 HydrophobicContact CG-CG 4.26Å; P124-A163 WeakPolarHBondContact O-CB 3.42Å; P124-T164 PolarHBondContact O-N 2.69Å; P124-T164 VanDerWaalsContact O-N 3.14Å
125	T	98.5	Very high	97.6	Very high	57 Å²	57	52.6 Å²	52.6	35%	0.35	28%	0.281	S	S	.	.			trans	-66.2	165.6	160	63.9	0	0	0	0	110.3	Q127 S128 L129 T164	T125-Q127 VanDerWaalsContact C-N 3.28Å; T125-Q127 PolarHBondContact O-N 2.68Å; T125-S128 PolarHBondContact O-N 2.88Å; T125-S128 VanDerWaalsContact O-N 3.13Å; T125-S128 VanDerWaalsContact OG1-CB 3.27Å; T125-S128 WeakPolarHBondContact OG1-CB 3.07Å; T125-S128 PolarHBondContact OG1-N 3.4Å; T125-S128 VanDerWaalsContact OG1-N 3.16Å; T125-L129 WeakPolarHBondContact O-CB 3.32Å; T125-L129 PolarHBondContact O-N 3.24Å; T125-T164 WeakPolarHBondContact CA-OG1 3.38Å; T125-T164 WeakPolarHBondContact CG2-OG1 3.38Å
126	S	97.6	Very high	97.7	Very high	25 Å²	25	51.3 Å²	51.3	18%	0.175	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-44.1	179.6	-60.6	0	0	0	0	111.3	F130 A163 D165	S126-F130 WeakPolarHBondContact O-CB 3.38Å; S126-F130 PolarHBondContact O-N 2.82Å; S126-A163 WeakPolarHBondContact OG-CB 3.34Å; S126-D165 VanDerWaalsContact CB-OD1 3.3Å; S126-D165 WeakPolarHBondContact CB-OD1 3.21Å; S126-D165 PolarHBondContact N-OD1 2.81Å; S126-D165 PolarHBondContact N-OD2 2.89Å; S126-D165 PolarHBondContact OG-OD1 2.87Å
127	Q	96.5	Very high	97.5	Very high	130 Å²	130	51.3 Å²	51.3	61%	0.607	28%	0.275	S	S	*	.	H	α-helix	trans	-65.1	-41.8	176.5	-175.2	61.5	25	0	0	112.1	T125 S131	T125-Q127 VanDerWaalsContact C-N 3.28Å; T125-Q127 PolarHBondContact O-N 2.68Å; Q127-S131 WeakPolarHBondContact O-CB 3.31Å; Q127-S131 PolarHBondContact O-N 2.97Å; Q127-S131 PolarHBondContact O-OG 3.44Å
128	S	97.9	Very high	97.3	Very high	51 Å²	51	48.6 Å²	48.6	36%	0.357	28%	0.277	S	S	.	.	H	α-helix	trans	-66.5	-45.7	178.7	-178.4	0	0	0	0	111.4	T125 F130 S131 L132	T125-S128 PolarHBondContact O-N 2.88Å; T125-S128 VanDerWaalsContact O-N 3.13Å; T125-S128 VanDerWaalsContact OG1-CB 3.27Å; T125-S128 WeakPolarHBondContact OG1-CB 3.07Å; T125-S128 PolarHBondContact OG1-N 3.4Å; T125-S128 VanDerWaalsContact OG1-N 3.16Å; S128-F130 PolarHBondContact O-N 2.92Å; S128-S131 PolarHBondContact O-N 2.72Å; S128-L132 WeakPolarHBondContact O-CB 3.18Å; S128-L132 VanDerWaalsContact O-CG 3.31Å; S128-L132 WeakPolarHBondContact O-CG 3.02Å; S128-L132 PolarHBondContact O-N 2.74Å
129	L	98.2	Very high	97.1	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-50.6	176.2	-169.1	160.9	0	0	0	110.1	F83 P124 T125 S131 L132 I133 I168 I173	F83-L129 HydrophobicContact CD1-CD1 4.36Å; F83-L129 HydrophobicContact CD1-CG 4Å; F83-L129 HydrophobicContact CE1-CG 4.08Å; F83-L129 HydrophobicContact CG-CD1 4.39Å; F83-L129 HydrophobicContact CG-CG 4.34Å; P124-L129 HydrophobicContact CB-CB 3.98Å; P124-L129 HydrophobicContact CG-CB 4Å; P124-L129 HydrophobicContact CG-CD1 4.07Å; P124-L129 HydrophobicContact CG-CG 4.26Å; T125-L129 WeakPolarHBondContact O-CB 3.32Å; T125-L129 PolarHBondContact O-N 3.24Å; L129-S131 PolarHBondContact O-N 2.94Å; L129-L132 PolarHBondContact O-N 2.88Å; L129-I133 HydrophobicContact CD2-CG1 3.84Å; L129-I133 WeakPolarHBondContact O-CG1 3.41Å; L129-I133 PolarHBondContact O-N 3.43Å; L129-I168 HydrophobicContact CB-CD1 4.12Å; L129-I168 HydrophobicContact CD1-CD1 4.12Å; L129-I168 HydrophobicContact CD2-CD1 4.05Å; L129-I168 HydrophobicContact CG-CD1 4.32Å; L129-I173 HydrophobicContact CD2-CD1 4.07Å; L129-I173 HydrophobicContact CD2-CG1 3.97Å
130	F	95.5	Very high	96.9	Very high	74 Å²	74	53 Å²	53	33%	0.325	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-43.3	178.7	-174.4	-104.8	0	0	0	112.3	S126 S128 L132 I133 Q134	S126-F130 WeakPolarHBondContact O-CB 3.38Å; S126-F130 PolarHBondContact O-N 2.82Å; S128-F130 PolarHBondContact O-N 2.92Å; F130-L132 VanDerWaalsContact C-N 3.33Å; F130-L132 PolarHBondContact O-N 3.28Å; F130-I133 PolarHBondContact O-N 2.97Å; F130-Q134 HydrophobicContact CD1-CG 4.15Å; F130-Q134 HydrophobicContact CE1-CG 3.79Å; F130-Q134 HydrophobicContact CE2-CG 4.39Å; F130-Q134 HydrophobicContact CZ-CG 3.94Å; F130-Q134 WeakPolarHBondContact O-CG 3.37Å; F130-Q134 PolarHBondContact O-N 3.26Å
131	S	96.8	Very high	96.6	Very high	51 Å²	51	51.2 Å²	51.2	36%	0.357	29%	0.287	S	S	.	.	H	α-helix	trans	-63.1	-38.9	178.2	-57.4	0	0	0	0	112.1	Q127 S128 L129 Q134 T135	Q127-S131 WeakPolarHBondContact O-CB 3.31Å; Q127-S131 PolarHBondContact O-N 2.97Å; Q127-S131 PolarHBondContact O-OG 3.44Å; S128-S131 PolarHBondContact O-N 2.72Å; L129-S131 PolarHBondContact O-N 2.94Å; S131-Q134 PolarHBondContact O-N 3.24Å; S131-T135 WeakPolarHBondContact O-CB 3.44Å; S131-T135 PolarHBondContact O-N 3.3Å; S131-T135 PolarHBondContact O-OG1 3.25Å
132	L	97.8	Very high	96.2	Very high	40 Å²	40	57.3 Å²	57.3	21%	0.209	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-46.5	174.9	-74.4	165.8	0	0	0	111.4	F83 H121 S128 L129 F130 Q134 T135 I136	F83-L132 HydrophobicContact CE1-CB 4.13Å; F83-L132 HydrophobicContact CE1-CD1 4.03Å; F83-L132 HydrophobicContact CZ-CB 4.27Å; H121-L132 HydrophobicContact CB-CD1 4.15Å; S128-L132 WeakPolarHBondContact O-CB 3.18Å; S128-L132 VanDerWaalsContact O-CG 3.31Å; S128-L132 WeakPolarHBondContact O-CG 3.02Å; S128-L132 PolarHBondContact O-N 2.74Å; L129-L132 PolarHBondContact O-N 2.88Å; F130-L132 VanDerWaalsContact C-N 3.33Å; F130-L132 PolarHBondContact O-N 3.28Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 3.48Å; L132-T135 PolarHBondContact O-N 3.42Å; L132-I136 WeakPolarHBondContact O-CB 3.39Å; L132-I136 WeakPolarHBondContact O-CD1 3.21Å; L132-I136 WeakPolarHBondContact O-CG1 3.43Å; L132-I136 PolarHBondContact O-N 3.24Å
133	I	97.2	Very high	95.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.3	-47.3	175.1	-70.8	-67.4	0	0	0	110.9	F83 L129 F130 I136 S137 I173 P176 F177	F83-I133 HydrophobicContact CE2-CD1 3.45Å; F83-I133 VanDerWaalsContact CE2-CD1 3.45Å; F83-I133 HydrophobicContact CE2-CG1 4.17Å; F83-I133 HydrophobicContact CZ-CD1 3.7Å; F83-I133 HydrophobicContact CZ-CG1 4Å; L129-I133 HydrophobicContact CD2-CG1 3.84Å; L129-I133 WeakPolarHBondContact O-CG1 3.41Å; L129-I133 PolarHBondContact O-N 3.43Å; F130-I133 PolarHBondContact O-N 2.97Å; I133-I136 PolarHBondContact O-N 3.32Å; I133-S137 WeakPolarHBondContact O-CB 3.39Å; I133-S137 PolarHBondContact O-N 3.07Å; I133-S137 PolarHBondContact O-OG 2.98Å; I133-I173 HydrophobicContact CD1-CG2 3.62Å; I133-I173 HydrophobicContact CG1-CG2 4.04Å; I133-P176 HydrophobicContact CG2-CB 4.01Å; I133-P176 HydrophobicContact CG2-CG 3.75Å; I133-F177 HydrophobicContact CD1-CE2 4Å; I133-F177 HydrophobicContact CD1-CZ 4.39Å; I133-F177 HydrophobicContact CG2-CE2 3.84Å; I133-F177 HydrophobicContact CG2-CZ 4.39Å
134	Q	95.8	Very high	95.6	Very high	69 Å²	69	57 Å²	57	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-61.2	-46.8	177.7	-71.1	-64.6	-14.3	0	0	111.7	F130 S131 L132 I136 S137 T138	F130-Q134 HydrophobicContact CD1-CG 4.15Å; F130-Q134 HydrophobicContact CE1-CG 3.79Å; F130-Q134 HydrophobicContact CE2-CG 4.39Å; F130-Q134 HydrophobicContact CZ-CG 3.94Å; F130-Q134 WeakPolarHBondContact O-CG 3.37Å; F130-Q134 PolarHBondContact O-N 3.26Å; S131-Q134 PolarHBondContact O-N 3.24Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 3.48Å; Q134-I136 VanDerWaalsContact C-N 3.32Å; Q134-I136 PolarHBondContact O-N 2.94Å; Q134-S137 PolarHBondContact O-N 2.98Å; Q134-S137 PolarHBondContact O-OG 3.14Å; Q134-T138 WeakPolarHBondContact O-CG2 3.43Å; Q134-T138 PolarHBondContact O-N 3.03Å; Q134-T138 VanDerWaalsContact O-N 3.15Å; Q134-T138 PolarHBondContact O-OG1 2.79Å
135	T	97.1	Very high	95.4	Very high	88 Å²	88	57.2 Å²	57.2	54%	0.54	30%	0.3	S	S	.	.	H	α-helix	trans	-57.8	-45.3	176.5	-57.4	0	0	0	0	111.4	S131 L132 T138 Q139	S131-T135 WeakPolarHBondContact O-CB 3.44Å; S131-T135 PolarHBondContact O-N 3.3Å; S131-T135 PolarHBondContact O-OG1 3.25Å; L132-T135 PolarHBondContact O-N 3.42Å; T135-T138 PolarHBondContact O-N 2.94Å; T135-T138 PolarHBondContact O-OG1 2.86Å; T135-Q139 PolarHBondContact O-N 2.94Å
136	I	97	Very high	95.3	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.056	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-41.7	-179.9	-69.7	159.1	0	0	0	111.1	V81 L132 I133 Q134 T138 Q139 F147 F177	V81-I136 HydrophobicContact CB-CD1 4.39Å; V81-I136 HydrophobicContact CG1-CD1 3.75Å; V81-I136 HydrophobicContact CG2-CD1 3.88Å; V81-I136 HydrophobicContact CG2-CG2 4.32Å; L132-I136 WeakPolarHBondContact O-CB 3.39Å; L132-I136 WeakPolarHBondContact O-CD1 3.21Å; L132-I136 WeakPolarHBondContact O-CG1 3.43Å; L132-I136 PolarHBondContact O-N 3.24Å; I133-I136 PolarHBondContact O-N 3.32Å; Q134-I136 VanDerWaalsContact C-N 3.32Å; Q134-I136 PolarHBondContact O-N 2.94Å; I136-T138 PolarHBondContact O-N 3.13Å; I136-Q139 VanDerWaalsContact CA-NE2 3.33Å; I136-Q139 VanDerWaalsContact CG2-NE2 3.31Å; I136-Q139 VanDerWaalsContact O-CG 3.24Å; I136-Q139 WeakPolarHBondContact O-CG 3.34Å; I136-Q139 PolarHBondContact O-N 2.81Å; I136-Q139 PolarHBondContact O-NE2 3.35Å; I136-F147 HydrophobicContact CG2-CE2 3.68Å; I136-F147 HydrophobicContact CG2-CZ 4.17Å; I136-F177 HydrophobicContact CB-CZ 4.41Å; I136-F177 HydrophobicContact CG2-CE1 3.86Å; I136-F177 HydrophobicContact CG2-CZ 3.82Å
137	S	94.6	Very high	95.3	Very high	9 Å²	9	53.3 Å²	53.3	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-20.3	-178.5	69.1	0	0	0	0	113.8	I133 Q134 P176 C182	I133-S137 WeakPolarHBondContact O-CB 3.39Å; I133-S137 PolarHBondContact O-N 3.07Å; I133-S137 PolarHBondContact O-OG 2.98Å; Q134-S137 PolarHBondContact O-N 2.98Å; Q134-S137 PolarHBondContact O-OG 3.14Å; S137-P176 WeakPolarHBondContact CB-O 3.34Å; S137-C182 PolarHBondContact O-SG 2.9Å
138	T	94.4	Very high	95.4	Very high	110 Å²	110	47.1 Å²	47.1	68%	0.675	25%	0.246	S	C	*	.	H	α-helix	trans	-104.3	-4.5	-177.6	55.9	0	0	0	0	113.8	Q134 T135 I136	Q134-T138 WeakPolarHBondContact O-CG2 3.43Å; Q134-T138 PolarHBondContact O-N 3.03Å; Q134-T138 VanDerWaalsContact O-N 3.15Å; Q134-T138 PolarHBondContact O-OG1 2.79Å; T135-T138 PolarHBondContact O-N 2.94Å; T135-T138 PolarHBondContact O-OG1 2.86Å; I136-T138 PolarHBondContact O-N 3.13Å
139	Q	94.1	Very high	95.4	Very high	71 Å²	71	44.7 Å²	44.7	33%	0.332	23%	0.229	S	C	.	.	S	Bend	trans	-73.7	163.3	174.2	84	-162.4	-48	0	0	111.4	T135 I136 L141	T135-Q139 PolarHBondContact O-N 2.94Å; I136-Q139 VanDerWaalsContact CA-NE2 3.33Å; I136-Q139 VanDerWaalsContact CG2-NE2 3.31Å; I136-Q139 VanDerWaalsContact O-CG 3.24Å; I136-Q139 WeakPolarHBondContact O-CG 3.34Å; I136-Q139 PolarHBondContact O-N 2.81Å; I136-Q139 PolarHBondContact O-NE2 3.35Å; Q139-L141 HydrophobicContact CG-CD1 4.29Å; Q139-L141 HydrophobicContact CG-CD2 3.65Å; Q139-L141 HydrophobicContact CG-CG 3.69Å; Q139-L141 PolarHBondContact O-N 3.05Å; Q139-L141 VanDerWaalsContact O-N 3.15Å
140	N	93	Very high	95.4	Very high	106 Å²	106	44.6 Å²	44.6	57%	0.567	23%	0.229	S	C	*	.			trans	-68.9	110.8	174.2	-179.9	7.5	0	0	0	110.6	R142 D184	N140-R142 WeakPolarHBondContact OD1-CB 3.32Å; N140-R142 VanDerWaalsContact OD1-CG 3.31Å; N140-R142 WeakPolarHBondContact OD1-CG 3.2Å; N140-R142 PolarHBondContact OD1-N 3.4Å; N140-R142 VanDerWaalsContact OD1-N 3.14Å; N140-D184 WeakPolarHBondContact CA-OD2 3.24Å
141	L	93.2	Very high	95.6	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.214	C	C	.	.			trans	-117.5	16.5	179.2	-63.3	174.2	0	0	0	112	L79 Q139 D143 H144 D184 L185 K188	L79-L141 HydrophobicContact CD1-CD2 4.16Å; L79-L141 HydrophobicContact CG-CD2 4.47Å; Q139-L141 HydrophobicContact CG-CD1 4.29Å; Q139-L141 HydrophobicContact CG-CD2 3.65Å; Q139-L141 HydrophobicContact CG-CG 3.69Å; Q139-L141 PolarHBondContact O-N 3.05Å; Q139-L141 VanDerWaalsContact O-N 3.15Å; L141-D143 VanDerWaalsContact C-N 3.31Å; L141-D143 PolarHBondContact O-N 3.15Å; L141-H144 VanDerWaalsContact CD2-CD2 3.48Å; L141-H144 WeakPolarHBondContact CD2-CD2 3.41Å; L141-H144 WeakPolarHBondContact O-CB 3.4Å; L141-H144 PolarHBondContact O-N 2.78Å; L141-D184 HydrophobicContact CB-CB 3.82Å; L141-D184 PolarHBondContact N-OD2 3.12Å; L141-L185 HydrophobicContact CB-CD2 4.17Å; L141-L185 HydrophobicContact CB-CG 4.36Å; L141-L185 HydrophobicContact CD1-CD1 3.87Å; L141-L185 HydrophobicContact CD1-CD2 4.34Å; L141-L185 HydrophobicContact CD1-CG 4.01Å; L141-K188 PolarHBondContact O-NZ 3.49Å
142	R	89.5	Confident	95.7	Very high	175 Å²	175	38.7 Å²	38.7	66%	0.66	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-39.1	-174	-69	-179.3	-177.7	168	1.4	113.4	N140 H144 D184 K188	N140-R142 WeakPolarHBondContact OD1-CB 3.32Å; N140-R142 VanDerWaalsContact OD1-CG 3.31Å; N140-R142 WeakPolarHBondContact OD1-CG 3.2Å; N140-R142 PolarHBondContact OD1-N 3.4Å; N140-R142 VanDerWaalsContact OD1-N 3.14Å; R142-H144 VanDerWaalsContact C-N 3.31Å; R142-D184 HydrophobicContact CG-CB 4.17Å; R142-D184 WeakPolarHBondContact CG-OD1 3.4Å; R142-D184 WeakPolarHBondContact CG-OD2 3.17Å; R142-D184 IonicContact NE-OD1 3.99Å; R142-D184 PolarHBondContact NE-OD1 3.04Å; R142-K188 PolarHBondContact O-NZ 3.08Å
143	D	90.1	Very high	95.7	Very high	106 Å²	106	37 Å²	37	57%	0.567	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	1	-176.7	-61.2	-43.3	0	0	0	113.6	E76 L141	E76-D143 PolarHBondContact N-O 2.89Å; L141-D143 VanDerWaalsContact C-N 3.31Å; L141-D143 PolarHBondContact O-N 3.15Å
144	H	93.8	Very high	95.7	Very high	15 Å²	15	37.5 Å²	37.5	7%	0.069	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-83.4	132.2	175.3	-66.4	38.8	0	0	0	110	E76 L79 L141 R142 K188	E76-H144 CarbonylContact O-C 3.58Å; E76-H144 WeakPolarHBondContact O-CA 3.44Å; E76-H144 IonicContact OE2-CE1 3.11Å; E76-H144 PolarHBondContact OE2-CE1 2.77Å; E76-H144 IonicContact OE2-ND1 3.2Å; E76-H144 PolarHBondContact OE2-ND1 2.86Å; E76-H144 IonicContact OE2-NE2 3.75Å; L79-H144 PolarHBondContact N-CD2 2.78Å; L141-H144 VanDerWaalsContact CD2-CD2 3.48Å; L141-H144 WeakPolarHBondContact CD2-CD2 3.41Å; L141-H144 WeakPolarHBondContact O-CB 3.4Å; L141-H144 PolarHBondContact O-N 2.78Å; R142-H144 VanDerWaalsContact C-N 3.31Å; H144-K188 WeakPolarHBondContact O-CD 3.49Å; H144-K188 WeakPolarHBondContact O-CE 3.44Å; H144-K188 PolarHBondContact O-NZ 2.91Å
145	D	94.1	Very high	95.6	Very high	9 Å²	9	34.8 Å²	34.8	5%	0.048	18%	0.18	C	C	.	.	S	Bend	trans	-69.2	-35.2	174.7	-63.2	-44.7	0	0	0	112.4	G74 E76 R77 K188 K319	G74-D145 WeakPolarHBondContact CA-OD1 3.3Å; G74-D145 PolarHBondContact N-OD1 2.89Å; G74-D145 PolarHBondContact N-OD2 3.15Å; E76-D145 PolarHBondContact O-N 3.09Å; R77-D145 IonicContact NH1-OD2 3.42Å; R77-D145 WeakPolarHBondContact O-CB 3.41Å; R77-D145 PolarHBondContact O-N 3.1Å; D145-K188 WeakPolarHBondContact O-CB 3.5Å; D145-K319 IonicContact OD2-NZ 2.76Å; D145-K319 PolarHBondContact OD2-NZ 3.18Å
146	C	96	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.			trans	-156.7	175.3	-176.6	59.2	0	0	0	0	111.6	R77 G78 F116 P189	R77-C146 PolarHBondContact O-N 3.07Å; R77-C146 PolarHBondContact O-SG 3.46Å; G78-C146 WeakPolarHBondContact CA-O 3.44Å; F116-C146 VanDerWaalsContact CE1-SG 3.5Å; F116-C146 WeakPolarHBondContact CZ-SG 3.48Å; C146-P189 WeakPolarHBondContact CA-O 3.3Å; C146-P189 HydrophobicContact CB-CB 3.96Å; C146-P189 HydrophobicContact CB-CG 4.07Å; C146-P189 VanDerWaalsContact CB-O 3.32Å; C146-P189 WeakPolarHBondContact CB-O 3.47Å
147	F	97.8	Very high	95.1	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.4	172.9	172	-103.1	0	0	0	109.8	L79 V81 I136 C149 F177 L185 P189 L191 F192	L79-F147 HydrophobicContact CB-CD2 4.33Å; L79-F147 HydrophobicContact CB-CE2 4.47Å; V81-F147 HydrophobicContact CB-CE2 4.47Å; V81-F147 HydrophobicContact CG2-CE2 3.82Å; V81-F147 HydrophobicContact CG2-CZ 4.29Å; I136-F147 HydrophobicContact CG2-CE2 3.68Å; I136-F147 HydrophobicContact CG2-CZ 4.17Å; F147-C149 HydrophobicContact CE1-CB 3.74Å; F147-C149 HydrophobicContact CZ-CB 3.89Å; F147-F177 AromaticContact CD1-CD1 3.89Å; F147-F177 HydrophobicContact CD1-CD1 3.89Å; F147-F177 AromaticContact CD1-CE1 3.94Å; F147-F177 HydrophobicContact CD1-CE1 3.94Å; F147-F177 HydrophobicContact CD1-CG 4.27Å; F147-F177 HydrophobicContact CD1-CZ 4.36Å; F147-F177 HydrophobicContact CD2-CE1 4.21Å; F147-F177 AromaticContact CE1-CD1 3.83Å; F147-F177 HydrophobicContact CE1-CD1 3.83Å; F147-F177 HydrophobicContact CE1-CD2 4.05Å; F147-F177 AromaticContact CE1-CE1 3.54Å; F147-F177 HydrophobicContact CE1-CE1 3.54Å; F147-F177 AromaticContact CE1-CE2 3.75Å; F147-F177 HydrophobicContact CE1-CE2 3.75Å; F147-F177 HydrophobicContact CE1-CG 4.07Å; F147-F177 AromaticContact CE1-CZ 3.5Å; F147-F177 HydrophobicContact CE1-CZ 3.5Å; F147-F177 AromaticContact CE2-CE1 3.84Å; F147-F177 HydrophobicContact CE2-CE1 3.84Å; F147-F177 HydrophobicContact CE2-CZ 4.01Å; F147-F177 HydrophobicContact CG-CD1 4.36Å; F147-F177 HydrophobicContact CG-CE1 4.26Å; F147-F177 HydrophobicContact CZ-CD1 4.25Å; F147-F177 AromaticContact CZ-CE1 3.48Å; F147-F177 HydrophobicContact CZ-CE1 3.48Å; F147-F177 VanDerWaalsContact CZ-CE1 3.48Å; F147-F177 AromaticContact CZ-CE2 3.92Å; F147-F177 HydrophobicContact CZ-CE2 3.92Å; F147-F177 AromaticContact CZ-CZ 3.29Å; F147-F177 HydrophobicContact CZ-CZ 3.29Å; F147-L185 HydrophobicContact CB-CD1 3.58Å; F147-L185 HydrophobicContact CB-CD2 4.15Å; F147-L185 HydrophobicContact CG-CD1 4.08Å; F147-P189 PolarHBondContact N-O 2.95Å; F147-L191 PolarHBondContact O-N 3.22Å; F147-F192 HydrophobicContact CD1-CZ 4.44Å; F147-F192 HydrophobicContact CE1-CE1 4.14Å; F147-F192 HydrophobicContact CE1-CZ 4.03Å
148	A	98.6	Very high	94.8	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.3	172.8	0	0	0	0	0	111.2	L79 C80 V81 F111 F116 L191	L79-A148 PolarHBondContact O-N 2.97Å; C80-A148 CarbonylContact C-O 3.57Å; C80-A148 VanDerWaalsContact CA-O 3.3Å; C80-A148 WeakPolarHBondContact CA-O 3.44Å; C80-A148 HydrophobicContact CB-CB 4.12Å; V81-A148 PolarHBondContact N-O 2.9Å; F111-A148 HydrophobicContact CD1-CB 4.2Å; F111-A148 HydrophobicContact CE1-CB 3.71Å; F116-A148 HydrophobicContact CD1-CB 4.21Å; F116-A148 HydrophobicContact CE1-CB 3.75Å; F116-A148 HydrophobicContact CZ-CB 4.28Å; A148-L191 CarbonylContact C-O 3.5Å; A148-L191 VanDerWaalsContact CA-O 3.23Å; A148-L191 WeakPolarHBondContact CA-O 3.37Å; A148-L191 HydrophobicContact CB-CB 4.38Å
149	C	98.7	Very high	94.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.7	173.4	-178.9	0	0	0	0	109.5	V81 F147 L191 F192 F193	V81-C149 CarbonylContact O-C 3.57Å; V81-C149 VanDerWaalsContact O-CA 3.25Å; V81-C149 WeakPolarHBondContact O-CA 3.45Å; F147-C149 HydrophobicContact CE1-CB 3.74Å; F147-C149 HydrophobicContact CZ-CB 3.89Å; C149-L191 PolarHBondContact N-O 2.77Å; C149-F192 HydrophobicContact CB-CD1 3.56Å; C149-F192 HydrophobicContact CB-CE1 3.72Å; C149-F192 HydrophobicContact CB-CG 4.43Å; C149-F192 CarbonylContact O-C 3.51Å; C149-F192 VanDerWaalsContact O-CA 3.31Å; C149-F192 WeakPolarHBondContact O-CA 3.4Å; C149-F193 PolarHBondContact O-N 3.42Å
150	V	98.8	Very high	94.7	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.1	177.2	-174.2	0	0	0	0	109	V81 V82 F83 I107 F111 L152 F193 I257	V81-V150 PolarHBondContact O-N 2.91Å; V82-V150 CarbonylContact C-O 3.46Å; V82-V150 VanDerWaalsContact CA-O 3.28Å; V82-V150 WeakPolarHBondContact CA-O 3.49Å; V82-V150 HydrophobicContact CG1-CB 4.29Å; V82-V150 HydrophobicContact CG2-CB 4.29Å; F83-V150 PolarHBondContact N-O 2.59Å; I107-V150 HydrophobicContact CD1-CG1 4.04Å; I107-V150 HydrophobicContact CD1-CG2 4.4Å; I107-V150 HydrophobicContact CG1-CG1 4.07Å; I107-V150 HydrophobicContact CG2-CB 4.18Å; I107-V150 HydrophobicContact CG2-CG1 4.25Å; I107-V150 HydrophobicContact CG2-CG2 3.87Å; F111-V150 HydrophobicContact CE2-CG2 4Å; F111-V150 HydrophobicContact CZ-CG2 4.19Å; V150-L152 HydrophobicContact CG1-CD2 3.81Å; V150-L152 HydrophobicContact CG1-CG 4.28Å; V150-F193 CarbonylContact C-O 3.57Å; V150-F193 VanDerWaalsContact CA-O 3.31Å; V150-F193 WeakPolarHBondContact CA-O 3.39Å; V150-F193 HydrophobicContact CG1-CB 4.41Å; V150-F193 HydrophobicContact CG2-CB 4.25Å; V150-F193 HydrophobicContact CG2-CD2 4.22Å; V150-I257 HydrophobicContact CG1-CD1 4.25Å
151	I	98.6	Very high	94.9	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.9	-179.5	-62.9	175.3	0	0	0	108.2	I161 I173 F193 I194 Q195	I151-I161 HydrophobicContact CG2-CD1 4.38Å; I151-I161 HydrophobicContact CG2-CG1 4.36Å; I151-I161 HydrophobicContact CG2-CG2 3.53Å; I151-I173 HydrophobicContact CD1-CD1 3.63Å; I151-I173 HydrophobicContact CD1-CG2 4.01Å; I151-F193 PolarHBondContact N-O 3.14Å; I151-I194 HydrophobicContact CD1-CG1 4.37Å; I151-Q195 PolarHBondContact O-N 2.91Å
152	L	98.5	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	99.4	178.9	-47.5	175.4	0	0	0	108.4	V82 F83 V85 R97 D103 V104 V150 Q195 I257	V82-L152 HydrophobicContact CG1-CD1 4.02Å; V82-L152 HydrophobicContact CG1-CG 4.35Å; F83-L152 PolarHBondContact O-N 3.19Å; V85-L152 PolarHBondContact N-O 2.96Å; R97-L152 PolarHBondContact NH1-O 3.25Å; D103-L152 HydrophobicContact CB-CD1 3.82Å; D103-L152 HydrophobicContact CB-CD2 4.42Å; V104-L152 HydrophobicContact CG2-CD1 3.7Å; V150-L152 HydrophobicContact CG1-CD2 3.81Å; V150-L152 HydrophobicContact CG1-CG 4.28Å; L152-Q195 HydrophobicContact CD2-CB 3.8Å; L152-Q195 HydrophobicContact CD2-CG 4.4Å; L152-I257 HydrophobicContact CD2-CD1 3.49Å; L152-I257 VanDerWaalsContact CD2-CD1 3.49Å; L152-I257 HydrophobicContact CD2-CG1 3.66Å
153	S	98.1	Very high	95.6	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.021	15%	0.154	C	C	.	.	S	Bend	trans	-157.1	-174.6	-178.7	-165.7	0	0	0	0	112.2	V85 R97 Y162 Q195	V85-S153 WeakPolarHBondContact CB-OG 3.31Å; R97-S153 VanDerWaalsContact NE-C 3.3Å; R97-S153 PolarHBondContact NE-O 2.94Å; S153-Y162 WeakPolarHBondContact CB-O 3.49Å; S153-Y162 PolarHBondContact OG-O 2.91Å; S153-Q195 PolarHBondContact N-O 2.97Å
154	H	96.8	Very high	96	Very high	12 Å²	12	20.3 Å²	20.3	6%	0.056	13%	0.131	C	C	.	.			trans	-74.6	156.3	156.1	-66	-41.9	0	0	0	110	H18 F88 L94 P95 R97 Y162	H18-H154 AromaticContact CE1-CE1 3.19Å; H18-H154 PolarHBondContact CE1-CE1 3.16Å; H18-H154 AromaticContact CE1-ND1 3.89Å; H18-H154 AromaticContact CE1-NE2 3.97Å; H18-H154 AromaticContact ND1-CE1 3.75Å; F88-H154 AromaticContact CD2-CD2 3.96Å; F88-H154 AromaticContact CE2-CD2 3.3Å; F88-H154 WeakPolarHBondContact CE2-CD2 3.23Å; F88-H154 AromaticContact CE2-NE2 3.63Å; F88-H154 HydrophobicContact CZ-CB 4.37Å; F88-H154 AromaticContact CZ-CD2 3.4Å; F88-H154 WeakPolarHBondContact CZ-CD2 3.35Å; L94-H154 HydrophobicContact CD1-CB 4.38Å; L94-H154 HydrophobicContact CD2-CB 4.42Å; P95-H154 PolarHBondContact O-NE2 3.13Å; R97-H154 WeakPolarHBondContact CG-CE1 3.43Å; R97-H154 WeakPolarHBondContact CG-NE2 3.41Å; H154-Y162 HydrophobicContact CB-CD2 3.84Å; H154-Y162 HydrophobicContact CB-CG 4.43Å; H154-Y162 PolarHBondContact O-N 3.15Å
155	G	95.2	Very high	96.2	Very high	11 Å²	11	22.6 Å²	22.6	11%	0.113	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	172.7	171.7	0	0	0	0	0	110	L160 C197	G155-L160 CarbonylContact C-O 3.56Å; G155-L160 WeakPolarHBondContact CA-O 3.4Å; G155-C197 CarbonylContact C-O 3.37Å; G155-C197 VanDerWaalsContact C-O 3.24Å; G155-C197 WeakPolarHBondContact CA-O 3.39Å
156	D	92	Very high	96.2	Very high	60 Å²	60	22.9 Å²	22.9	32%	0.321	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	171.7	-178	-142.2	-31.5	0	0	0	110.6	L160 Y162 C197	D156-L160 HydrophobicContact CB-CB 4.08Å; D156-L160 HydrophobicContact CB-CD1 4.37Å; D156-L160 PolarHBondContact N-O 3.02Å; D156-L160 PolarHBondContact O-N 3.45Å; D156-Y162 HydrophobicContact CB-CE2 4.06Å; D156-Y162 PolarHBondContact OD2-OH 3.46Å; D156-Y162 VanDerWaalsContact OD2-OH 3.07Å; D156-C197 PolarHBondContact N-O 3.34Å
157	E	90.2	Very high	96.2	Very high	116 Å²	116	25.4 Å²	25.4	54%	0.542	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	155.5	171.7	-63.6	-171	179.8	0	0	111.7	G159 G199	E157-G159 VanDerWaalsContact C-N 3.27Å; E157-G159 PolarHBondContact O-N 2.81Å; E157-G199 VanDerWaalsContact CG-CA 3.47Å
158	G	89.4	Confident	96.1	Very high	85 Å²	85	26 Å²	26	88%	0.876	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	6.8	-177.3	0	0	0	0	0	114.9
159	G	91	Very high	96	Very high	24 Å²	24	28.5 Å²	28.5	25%	0.247	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	39.4	175.9	0	0	0	0	0	112.8	E157 V170	E157-G159 VanDerWaalsContact C-N 3.27Å; E157-G159 PolarHBondContact O-N 2.81Å; G159-V170 WeakPolarHBondContact O-CG2 3.14Å; G159-V170 PolarHBondContact O-N 2.88Å
160	L	96	Very high	95.9	Very high	50 Å²	50	28.9 Å²	28.9	26%	0.262	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.5	176.7	-63.7	175.7	0	0	0	110.8	G155 D156 P169	G155-L160 CarbonylContact C-O 3.56Å; G155-L160 WeakPolarHBondContact CA-O 3.4Å; D156-L160 HydrophobicContact CB-CB 4.08Å; D156-L160 HydrophobicContact CB-CD1 4.37Å; D156-L160 PolarHBondContact N-O 3.02Å; D156-L160 PolarHBondContact O-N 3.45Å; L160-P169 HydrophobicContact CD2-CB 4.36Å; L160-P169 HydrophobicContact CD2-CG 3.96Å
161	I	97.5	Very high	95.7	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.5	173.3	-62.5	-62.7	0	0	0	108.5	I151 S167 I168 V170 I194 A196	I151-I161 HydrophobicContact CG2-CD1 4.38Å; I151-I161 HydrophobicContact CG2-CG1 4.36Å; I151-I161 HydrophobicContact CG2-CG2 3.53Å; I161-S167 CarbonylContact O-C 3.24Å; I161-S167 VanDerWaalsContact O-CA 3.26Å; I161-S167 WeakPolarHBondContact O-CA 3.44Å; I161-I168 PolarHBondContact N-O 3.2Å; I161-I168 PolarHBondContact O-N 3.24Å; I161-V170 HydrophobicContact CD1-CG2 4.14Å; I161-V170 HydrophobicContact CG1-CG2 3.49Å; I161-V170 VanDerWaalsContact CG1-CG2 3.49Å; I161-I194 HydrophobicContact CD1-CG2 3.55Å; I161-I194 HydrophobicContact CG1-CG2 4.42Å; I161-A196 HydrophobicContact CD1-CB 3.29Å
162	Y	98	Very high	95.6	Very high	20 Å²	20	40.3 Å²	40.3	8%	0.078	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.6	176.3	-71.1	-88.5	0	0	0	111.5	L92 L94 S153 H154 D156 G166	L92-Y162 HydrophobicContact CD1-CD1 4.39Å; L94-Y162 HydrophobicContact CD1-CD1 3.48Å; L94-Y162 VanDerWaalsContact CD1-CD1 3.48Å; L94-Y162 HydrophobicContact CD1-CD2 3.94Å; L94-Y162 HydrophobicContact CD1-CE1 3.85Å; L94-Y162 HydrophobicContact CD1-CE2 4.28Å; L94-Y162 HydrophobicContact CD1-CG 3.52Å; S153-Y162 WeakPolarHBondContact CB-O 3.49Å; S153-Y162 PolarHBondContact OG-O 2.91Å; H154-Y162 HydrophobicContact CB-CD2 3.84Å; H154-Y162 HydrophobicContact CB-CG 4.43Å; H154-Y162 PolarHBondContact O-N 3.15Å; D156-Y162 HydrophobicContact CB-CE2 4.06Å; D156-Y162 PolarHBondContact OD2-OH 3.46Å; D156-Y162 VanDerWaalsContact OD2-OH 3.07Å; Y162-G166 CarbonylContact C-O 3.56Å; Y162-G166 WeakPolarHBondContact CA-O 3.44Å
163	A	98.2	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.238	C	C	.	.			trans	-83.3	-171.4	154	0	0	0	0	0	109.2	F88 P124 S126 D165 G166 I168	F88-A163 VanDerWaalsContact CD1-O 3.31Å; F88-A163 WeakPolarHBondContact CD1-O 3.17Å; P124-A163 WeakPolarHBondContact O-CB 3.42Å; S126-A163 WeakPolarHBondContact OG-CB 3.34Å; A163-D165 VanDerWaalsContact C-N 3.29Å; A163-D165 PolarHBondContact O-N 2.79Å; A163-G166 PolarHBondContact N-O 3.38Å; A163-I168 HydrophobicContact CB-CD1 4.29Å
164	T	98.3	Very high	95.5	Very high	14 Å²	14	40.6 Å²	40.6	9%	0.086	24%	0.239	C	C	.	.	S	Bend	trans	-65	-33.1	179.7	59.8	0	0	0	0	113.2	V85 K87 F88 D89 L92 N123 P124 T125	V85-T164 HydrophobicContact CG1-CG2 4.13Å; K87-T164 WeakPolarHBondContact O-CG2 3.44Å; F88-T164 CarbonylContact C-O 3.56Å; F88-T164 WeakPolarHBondContact CA-O 3.36Å; D89-T164 PolarHBondContact N-O 2.84Å; L92-T164 WeakPolarHBondContact CD1-O 3.25Å; N123-T164 VanDerWaalsContact C-CG2 3.42Å; N123-T164 HydrophobicContact CB-CG2 3.64Å; N123-T164 WeakPolarHBondContact O-CG2 3.19Å; P124-T164 PolarHBondContact O-N 2.69Å; P124-T164 VanDerWaalsContact O-N 3.14Å; T125-T164 WeakPolarHBondContact CA-OG1 3.38Å; T125-T164 WeakPolarHBondContact CG2-OG1 3.38Å
165	D	97.8	Very high	95.4	Very high	62 Å²	62	41.1 Å²	41.1	33%	0.332	25%	0.245	S	C	.	.	S	Bend	trans	-111.1	-6.3	-166.4	63.3	-21.6	0	0	0	114.4	D89 S126 A163	D89-D165 VanDerWaalsContact OD2-CA 3.31Å; D89-D165 WeakPolarHBondContact OD2-CA 3.49Å; D89-D165 WeakPolarHBondContact OD2-CB 3.46Å; S126-D165 VanDerWaalsContact CB-OD1 3.3Å; S126-D165 WeakPolarHBondContact CB-OD1 3.21Å; S126-D165 PolarHBondContact N-OD1 2.81Å; S126-D165 PolarHBondContact N-OD2 2.89Å; S126-D165 PolarHBondContact OG-OD1 2.87Å; A163-D165 VanDerWaalsContact C-N 3.29Å; A163-D165 PolarHBondContact O-N 2.79Å
166	G	95.6	Very high	95.5	Very high	15 Å²	15	41 Å²	41	16%	0.155	24%	0.242	C	C	.	.	S	Bend	trans	171.3	-172.1	-176.5	0	0	0	0	0	112	Y162 A163	Y162-G166 CarbonylContact C-O 3.56Å; Y162-G166 WeakPolarHBondContact CA-O 3.44Å; A163-G166 PolarHBondContact N-O 3.38Å
167	S	95.5	Very high	95.6	Very high	53 Å²	53	38.1 Å²	38.1	37%	0.371	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	149.8	179.6	65.4	0	0	0	0	112.9	I161	I161-S167 CarbonylContact O-C 3.24Å; I161-S167 VanDerWaalsContact O-CA 3.26Å; I161-S167 WeakPolarHBondContact O-CA 3.44Å
168	I	95.7	Very high	95.6	Very high	14 Å²	14	35 Å²	35	7%	0.072	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.5	177.4	-51.4	171.9	0	0	0	107.9	L129 I161 A163 V170 R172 I173	L129-I168 HydrophobicContact CB-CD1 4.12Å; L129-I168 HydrophobicContact CD1-CD1 4.12Å; L129-I168 HydrophobicContact CD2-CD1 4.05Å; L129-I168 HydrophobicContact CG-CD1 4.32Å; I161-I168 PolarHBondContact N-O 3.2Å; I161-I168 PolarHBondContact O-N 3.24Å; A163-I168 HydrophobicContact CB-CD1 4.29Å; I168-V170 PolarHBondContact O-N 2.86Å; I168-R172 HydrophobicContact CG2-CB 3.96Å; I168-I173 HydrophobicContact CG2-CG1 4.23Å
169	P	96.6	Very high	95.2	Very high	52 Å²	52	31.5 Å²	31.5	34%	0.338	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	134.8	170	-22	32.4	0	0	0	111.3	L160 D171 R172	L160-P169 HydrophobicContact CD2-CB 4.36Å; L160-P169 HydrophobicContact CD2-CG 3.96Å; P169-D171 PolarHBondContact O-N 3.39Å; P169-D171 VanDerWaalsContact O-N 3.15Å; P169-R172 WeakPolarHBondContact O-CB 3.31Å; P169-R172 PolarHBondContact O-N 3.02Å
170	V	96.6	Very high	94.9	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-52.2	-38.2	175.7	169.4	0	0	0	0	111.5	G159 I161 I168 R172 I173 I174 I194	G159-V170 WeakPolarHBondContact O-CG2 3.14Å; G159-V170 PolarHBondContact O-N 2.88Å; I161-V170 HydrophobicContact CD1-CG2 4.14Å; I161-V170 HydrophobicContact CG1-CG2 3.49Å; I161-V170 VanDerWaalsContact CG1-CG2 3.49Å; I168-V170 PolarHBondContact O-N 2.86Å; V170-R172 VanDerWaalsContact C-N 3.25Å; V170-R172 PolarHBondContact O-N 3.26Å; V170-I173 WeakPolarHBondContact O-CB 3.44Å; V170-I173 PolarHBondContact O-N 2.98Å; V170-I174 HydrophobicContact CG1-CD1 3.51Å; V170-I174 HydrophobicContact CG1-CG1 4.09Å; V170-I174 WeakPolarHBondContact O-CG1 3.27Å; V170-I174 PolarHBondContact O-N 3.07Å; V170-I174 VanDerWaalsContact O-N 3.07Å; V170-I194 HydrophobicContact CB-CD1 4.42Å; V170-I194 HydrophobicContact CG1-CD1 3.51Å; V170-I194 HydrophobicContact CG2-CD1 3.94Å
171	D	95.1	Very high	94.5	Very high	83 Å²	83	37.2 Å²	37.2	44%	0.444	20%	0.196	S	C	.	.	H	α-helix	trans	-56.2	-37.4	177.3	-176.2	73.6	0	0	0	112.7	P169 I173 I174 A175 R178	P169-D171 PolarHBondContact O-N 3.39Å; P169-D171 VanDerWaalsContact O-N 3.15Å; D171-I173 PolarHBondContact O-N 2.86Å; D171-I174 PolarHBondContact O-N 3.43Å; D171-A175 WeakPolarHBondContact O-CB 3.28Å; D171-A175 PolarHBondContact O-N 3.37Å; D171-R178 IonicContact OD1-CZ 3.55Å; D171-R178 IonicContact OD1-NH1 3.43Å; D171-R178 PolarHBondContact OD1-NH1 3.33Å; D171-R178 IonicContact OD1-NH2 3.59Å; D171-R178 PolarHBondContact OD1-NH2 3.31Å; D171-R178 IonicContact OD2-NH1 3.44Å
172	R	95.1	Very high	94.2	Very high	158 Å²	158	37.1 Å²	37.1	60%	0.596	20%	0.195	S	C	*	.	H	α-helix	trans	-68.3	-23.7	177.3	-76.7	-167.5	161	-167.6	-4.7	113.5	I168 P169 V170 P176	I168-R172 HydrophobicContact CG2-CB 3.96Å; P169-R172 WeakPolarHBondContact O-CB 3.31Å; P169-R172 PolarHBondContact O-N 3.02Å; V170-R172 VanDerWaalsContact C-N 3.25Å; V170-R172 PolarHBondContact O-N 3.26Å; R172-P176 WeakPolarHBondContact O-CD 3.28Å
173	I	97.3	Very high	93.7	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-81.8	-37.8	175.8	-55.6	175	0	0	0	109.7	L129 I133 I151 I168 V170 D171	L129-I173 HydrophobicContact CD2-CD1 4.07Å; L129-I173 HydrophobicContact CD2-CG1 3.97Å; I133-I173 HydrophobicContact CD1-CG2 3.62Å; I133-I173 HydrophobicContact CG1-CG2 4.04Å; I151-I173 HydrophobicContact CD1-CD1 3.63Å; I151-I173 HydrophobicContact CD1-CG2 4.01Å; I168-I173 HydrophobicContact CG2-CG1 4.23Å; V170-I173 WeakPolarHBondContact O-CB 3.44Å; V170-I173 PolarHBondContact O-N 2.98Å; D171-I173 PolarHBondContact O-N 2.86Å
174	I	97	Very high	93.4	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-80.8	-40.3	-176.4	-63.6	179.6	0	0	0	112.2	V170 D171 P176 F177 F192 L234 I236	V170-I174 HydrophobicContact CG1-CD1 3.51Å; V170-I174 HydrophobicContact CG1-CG1 4.09Å; V170-I174 WeakPolarHBondContact O-CG1 3.27Å; V170-I174 PolarHBondContact O-N 3.07Å; V170-I174 VanDerWaalsContact O-N 3.07Å; D171-I174 PolarHBondContact O-N 3.43Å; I174-P176 VanDerWaalsContact C-CD 3.41Å; I174-P176 VanDerWaalsContact C-N 3.33Å; I174-P176 VanDerWaalsContact O-N 3.16Å; I174-F177 PolarHBondContact O-N 2.8Å; I174-F192 HydrophobicContact CB-CE2 4.44Å; I174-F192 HydrophobicContact CB-CZ 4.25Å; I174-F192 HydrophobicContact CD1-CD1 4.48Å; I174-F192 HydrophobicContact CD1-CD2 4.29Å; I174-F192 HydrophobicContact CD1-CG 4.2Å; I174-F192 HydrophobicContact CG1-CD1 3.85Å; I174-F192 HydrophobicContact CG1-CD2 4.12Å; I174-F192 HydrophobicContact CG1-CE1 3.84Å; I174-F192 HydrophobicContact CG1-CE2 4.1Å; I174-F192 HydrophobicContact CG1-CG 4.01Å; I174-F192 HydrophobicContact CG1-CZ 3.96Å; I174-F192 HydrophobicContact CG2-CE2 3.98Å; I174-F192 HydrophobicContact CG2-CZ 4.19Å; I174-L234 HydrophobicContact CG2-CD1 4.27Å; I174-L234 HydrophobicContact CG2-CD2 3.86Å; I174-I236 HydrophobicContact CD1-CD1 3.4Å; I174-I236 HydrophobicContact CD1-CG1 3.79Å; I174-I236 HydrophobicContact CD1-CG2 4.29Å
175	A	95.3	Very high	93	Very high	23 Å²	23	42.2 Å²	42.2	19%	0.19	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-51.4	-40.3	-171	0	0	0	0	0	114.6	D171 F177 R178	D171-A175 WeakPolarHBondContact O-CB 3.28Å; D171-A175 PolarHBondContact O-N 3.37Å; A175-F177 PolarHBondContact O-N 2.79Å; A175-F177 VanDerWaalsContact O-N 3.1Å; A175-R178 WeakPolarHBondContact O-CB 3.25Å; A175-R178 WeakPolarHBondContact O-CG 3.43Å; A175-R178 PolarHBondContact O-N 2.81Å
176	P	96.3	Very high	92.5	Very high	8 Å²	8	45.9 Å²	45.9	5%	0.052	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.6	-17.1	178	-27.1	40	0	0	0	114.7	I133 S137 R172 I174 Q181 C182	I133-P176 HydrophobicContact CG2-CB 4.01Å; I133-P176 HydrophobicContact CG2-CG 3.75Å; S137-P176 WeakPolarHBondContact CB-O 3.34Å; R172-P176 WeakPolarHBondContact O-CD 3.28Å; I174-P176 VanDerWaalsContact C-CD 3.41Å; I174-P176 VanDerWaalsContact C-N 3.33Å; I174-P176 VanDerWaalsContact O-N 3.16Å; P176-Q181 WeakPolarHBondContact O-CB 3.49Å; P176-C182 WeakPolarHBondContact O-CB 3.05Å
177	F	94.4	Very high	92.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-94.9	-2.7	177.4	-60.5	-80.1	0	0	0	113.7	I133 I136 F147 I174 A175 L185 K190 F192	I133-F177 HydrophobicContact CD1-CE2 4Å; I133-F177 HydrophobicContact CD1-CZ 4.39Å; I133-F177 HydrophobicContact CG2-CE2 3.84Å; I133-F177 HydrophobicContact CG2-CZ 4.39Å; I136-F177 HydrophobicContact CB-CZ 4.41Å; I136-F177 HydrophobicContact CG2-CE1 3.86Å; I136-F177 HydrophobicContact CG2-CZ 3.82Å; F147-F177 AromaticContact CD1-CD1 3.89Å; F147-F177 HydrophobicContact CD1-CD1 3.89Å; F147-F177 AromaticContact CD1-CE1 3.94Å; F147-F177 HydrophobicContact CD1-CE1 3.94Å; F147-F177 HydrophobicContact CD1-CG 4.27Å; F147-F177 HydrophobicContact CD1-CZ 4.36Å; F147-F177 HydrophobicContact CD2-CE1 4.21Å; F147-F177 AromaticContact CE1-CD1 3.83Å; F147-F177 HydrophobicContact CE1-CD1 3.83Å; F147-F177 HydrophobicContact CE1-CD2 4.05Å; F147-F177 AromaticContact CE1-CE1 3.54Å; F147-F177 HydrophobicContact CE1-CE1 3.54Å; F147-F177 AromaticContact CE1-CE2 3.75Å; F147-F177 HydrophobicContact CE1-CE2 3.75Å; F147-F177 HydrophobicContact CE1-CG 4.07Å; F147-F177 AromaticContact CE1-CZ 3.5Å; F147-F177 HydrophobicContact CE1-CZ 3.5Å; F147-F177 AromaticContact CE2-CE1 3.84Å; F147-F177 HydrophobicContact CE2-CE1 3.84Å; F147-F177 HydrophobicContact CE2-CZ 4.01Å; F147-F177 HydrophobicContact CG-CD1 4.36Å; F147-F177 HydrophobicContact CG-CE1 4.26Å; F147-F177 HydrophobicContact CZ-CD1 4.25Å; F147-F177 AromaticContact CZ-CE1 3.48Å; F147-F177 HydrophobicContact CZ-CE1 3.48Å; F147-F177 VanDerWaalsContact CZ-CE1 3.48Å; F147-F177 AromaticContact CZ-CE2 3.92Å; F147-F177 HydrophobicContact CZ-CE2 3.92Å; F147-F177 AromaticContact CZ-CZ 3.29Å; F147-F177 HydrophobicContact CZ-CZ 3.29Å; I174-F177 PolarHBondContact O-N 2.8Å; A175-F177 PolarHBondContact O-N 2.79Å; A175-F177 VanDerWaalsContact O-N 3.1Å; F177-L185 HydrophobicContact CD1-CD1 3.9Å; F177-K190 HydrophobicContact CB-CD 3.97Å; F177-K190 WeakPolarHBondContact O-CD 3.35Å; F177-K190 WeakPolarHBondContact O-CE 3.38Å; F177-F192 HydrophobicContact CB-CZ 4.26Å; F177-F192 HydrophobicContact CD2-CE1 4.15Å; F177-F192 AromaticContact CD2-CZ 3.66Å; F177-F192 HydrophobicContact CD2-CZ 3.66Å; F177-F192 HydrophobicContact CE2-CE1 4.4Å; F177-F192 HydrophobicContact CE2-CZ 4.31Å; F177-F192 HydrophobicContact CG-CZ 4.14Å
178	R	90.2	Very high	92	Very high	50 Å²	50	46.3 Å²	46.3	19%	0.189	23%	0.233	C	C	.	.	S	Bend	trans	-60.5	157.7	178.8	-72.9	174.6	167.8	151	-1.5	112	D171 A175 D180 Q181 C182 V230 E231	D171-R178 IonicContact OD1-CZ 3.55Å; D171-R178 IonicContact OD1-NH1 3.43Å; D171-R178 PolarHBondContact OD1-NH1 3.33Å; D171-R178 IonicContact OD1-NH2 3.59Å; D171-R178 PolarHBondContact OD1-NH2 3.31Å; D171-R178 IonicContact OD2-NH1 3.44Å; A175-R178 WeakPolarHBondContact O-CB 3.25Å; A175-R178 WeakPolarHBondContact O-CG 3.43Å; A175-R178 PolarHBondContact O-N 2.81Å; R178-D180 VanDerWaalsContact CB-OD1 3.25Å; R178-D180 WeakPolarHBondContact CB-OD1 3.48Å; R178-D180 PolarHBondContact O-N 3.4Å; R178-D180 VanDerWaalsContact O-N 3.14Å; R178-Q181 PolarHBondContact O-N 2.76Å; R178-C182 PolarHBondContact O-N 3.37Å; R178-V230 HydrophobicContact CB-CG1 3.97Å; R178-E231 VanDerWaalsContact CD-OE1 3.22Å; R178-E231 WeakPolarHBondContact CD-OE1 3.49Å; R178-E231 IonicContact CZ-OE1 3.56Å; R178-E231 IonicContact CZ-OE2 2.73Å; R178-E231 IonicContact NE-OE1 3.49Å; R178-E231 PolarHBondContact NE-OE1 2.94Å; R178-E231 IonicContact NE-OE2 2.88Å; R178-E231 PolarHBondContact NE-OE2 2.95Å; R178-E231 IonicContact NH2-OE1 2.78Å; R178-E231 IonicContact NH2-OE2 2.91Å; R178-E231 PolarHBondContact NH2-OE2 3.12Å
179	G	80.6	Confident	92	Very high	12 Å²	12	45.7 Å²	45.7	12%	0.124	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.6	-173.6	0	0	0	0	0	114.1	R186 V230	G179-R186 WeakPolarHBondContact O-CG 3.31Å; G179-R186 VanDerWaalsContact O-CZ 3.3Å; G179-R186 PolarHBondContact O-NE 2.85Å; G179-R186 PolarHBondContact O-NH2 3.25Å; G179-R186 VanDerWaalsContact O-NH2 3.1Å; G179-V230 PolarHBondContact N-O 3.35Å
180	D	85	Confident	92	Very high	75 Å²	75	43.2 Å²	43.2	40%	0.401	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-23	174.2	65.6	-37.8	0	0	0	113.6	R178 V230	R178-D180 VanDerWaalsContact CB-OD1 3.25Å; R178-D180 WeakPolarHBondContact CB-OD1 3.48Å; R178-D180 PolarHBondContact O-N 3.4Å; R178-D180 VanDerWaalsContact O-N 3.14Å; D180-V230 HydrophobicContact CB-CG1 4.05Å; D180-V230 HydrophobicContact CB-CG2 4.09Å; D180-V230 WeakPolarHBondContact OD1-CG1 3.47Å
181	Q	88.5	Confident	92.1	Very high	119 Å²	119	42.8 Å²	42.8	56%	0.556	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-47	-176.4	-57.9	-56.5	-52.7	0	0	113.2	P176 R178	P176-Q181 WeakPolarHBondContact O-CB 3.49Å; R178-Q181 PolarHBondContact O-N 2.76Å
182	C	90.9	Very high	92.3	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.02	19%	0.19	C	C	.	.			trans	-108.6	93	-178	-170.3	0	0	0	0	111.2	S137 P176 R178 D184 L185	S137-C182 PolarHBondContact O-SG 2.9Å; P176-C182 WeakPolarHBondContact O-CB 3.05Å; R178-C182 PolarHBondContact O-N 3.37Å; C182-D184 VanDerWaalsContact C-N 3.31Å; C182-D184 PolarHBondContact O-N 2.83Å; C182-L185 PolarHBondContact O-N 2.84Å
183	L	87.8	Confident	92.5	Very high	107 Å²	107	31.4 Å²	31.4	56%	0.56	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-61.2	-38.4	-174.8	-55.8	-174	0	0	0	113.1	L185 R186	L183-L185 PolarHBondContact O-N 3.37Å; L183-R186 WeakPolarHBondContact O-CG 3.48Å; L183-R186 PolarHBondContact O-N 3.46Å
184	D	91.3	Very high	92.5	Very high	34 Å²	34	31.5 Å²	31.5	18%	0.182	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-69.7	-16.7	-175.4	-73.3	-5.2	0	0	0	113.2	N140 L141 R142 C182 K188	N140-D184 WeakPolarHBondContact CA-OD2 3.24Å; L141-D184 HydrophobicContact CB-CB 3.82Å; L141-D184 PolarHBondContact N-OD2 3.12Å; R142-D184 HydrophobicContact CG-CB 4.17Å; R142-D184 WeakPolarHBondContact CG-OD1 3.4Å; R142-D184 WeakPolarHBondContact CG-OD2 3.17Å; R142-D184 IonicContact NE-OD1 3.99Å; R142-D184 PolarHBondContact NE-OD1 3.04Å; C182-D184 VanDerWaalsContact C-N 3.31Å; C182-D184 PolarHBondContact O-N 2.83Å; D184-K188 WeakPolarHBondContact O-CD 3.46Å; D184-K188 WeakPolarHBondContact O-CE 3.38Å; D184-K188 PolarHBondContact O-NZ 3.48Å
185	L	91	Very high	92.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-107.4	11.3	178.3	-64.1	-179.3	0	0	0	114.3	L141 F147 F177 C182 L183 K188 K190	L141-L185 HydrophobicContact CB-CD2 4.17Å; L141-L185 HydrophobicContact CB-CG 4.36Å; L141-L185 HydrophobicContact CD1-CD1 3.87Å; L141-L185 HydrophobicContact CD1-CD2 4.34Å; L141-L185 HydrophobicContact CD1-CG 4.01Å; F147-L185 HydrophobicContact CB-CD1 3.58Å; F147-L185 HydrophobicContact CB-CD2 4.15Å; F147-L185 HydrophobicContact CG-CD1 4.08Å; F177-L185 HydrophobicContact CD1-CD1 3.9Å; C182-L185 PolarHBondContact O-N 2.84Å; L183-L185 PolarHBondContact O-N 3.37Å; L185-K188 HydrophobicContact CD2-CD 4.23Å; L185-K188 PolarHBondContact O-N 3.4Å; L185-K190 HydrophobicContact CB-CD 4.25Å; L185-K190 HydrophobicContact CB-CG 4.33Å; L185-K190 HydrophobicContact CD1-CD 4.5Å; L185-K190 HydrophobicContact CD1-CG 4.19Å; L185-K190 PolarHBondContact O-NZ 3.45Å
186	R	85.9	Confident	92.6	Very high	139 Å²	139	30.3 Å²	30.3	53%	0.525	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	133.1	171.6	-73.1	178	179	-176	-5.1	111	G179 L183 K188	G179-R186 WeakPolarHBondContact O-CG 3.31Å; G179-R186 VanDerWaalsContact O-CZ 3.3Å; G179-R186 PolarHBondContact O-NE 2.85Å; G179-R186 PolarHBondContact O-NH2 3.25Å; G179-R186 VanDerWaalsContact O-NH2 3.1Å; L183-R186 WeakPolarHBondContact O-CG 3.48Å; L183-R186 PolarHBondContact O-N 3.46Å; R186-K188 PolarHBondContact O-N 3.41Å
187	G	87.2	Confident	92.6	Very high	35 Å²	35	30.7 Å²	30.7	36%	0.361	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	7.5	-178.4	0	0	0	0	0	113.8	Y70 D233	Y70-G187 WeakPolarHBondContact CD1-O 3.18Å; Y70-G187 WeakPolarHBondContact CE1-O 3.45Å; G187-D233 WeakPolarHBondContact CA-OD2 3.31Å; G187-D233 PolarHBondContact N-OD2 3.27Å; G187-D233 VanDerWaalsContact N-OD2 3.14Å
188	K	93.1	Very high	92.6	Very high	41 Å²	41	32.9 Å²	32.9	18%	0.178	16%	0.164	C	C	.	.	S	Bend	trans	-117.1	144.2	-179	-62.5	-177.1	-174.9	169.3	0	111	L141 R142 H144 D145 D184 L185 R186 K190 D233	L141-K188 PolarHBondContact O-NZ 3.49Å; R142-K188 PolarHBondContact O-NZ 3.08Å; H144-K188 WeakPolarHBondContact O-CD 3.49Å; H144-K188 WeakPolarHBondContact O-CE 3.44Å; H144-K188 PolarHBondContact O-NZ 2.91Å; D145-K188 WeakPolarHBondContact O-CB 3.5Å; D184-K188 WeakPolarHBondContact O-CD 3.46Å; D184-K188 WeakPolarHBondContact O-CE 3.38Å; D184-K188 PolarHBondContact O-NZ 3.48Å; L185-K188 HydrophobicContact CD2-CD 4.23Å; L185-K188 PolarHBondContact O-N 3.4Å; R186-K188 PolarHBondContact O-N 3.41Å; K188-K190 PolarHBondContact O-NZ 2.69Å; K188-D233 VanDerWaalsContact O-CB 3.27Å; K188-D233 WeakPolarHBondContact O-CB 3.41Å
189	P	96.8	Very high	92.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	16%	0.157	C	C	.	.			trans	-63.4	135.5	179.8	-17.8	29.8	0	0	0	112.3	Y70 C146 F147 L191 L310 V314	Y70-P189 HydrophobicContact CD1-CG 3.79Å; Y70-P189 HydrophobicContact CD2-CG 3.57Å; Y70-P189 HydrophobicContact CE1-CG 4.16Å; Y70-P189 HydrophobicContact CE2-CG 3.91Å; Y70-P189 HydrophobicContact CG-CG 3.49Å; Y70-P189 VanDerWaalsContact CG-CG 3.49Å; C146-P189 WeakPolarHBondContact CA-O 3.3Å; C146-P189 HydrophobicContact CB-CB 3.96Å; C146-P189 HydrophobicContact CB-CG 4.07Å; C146-P189 VanDerWaalsContact CB-O 3.32Å; C146-P189 WeakPolarHBondContact CB-O 3.47Å; F147-P189 PolarHBondContact N-O 2.95Å; P189-L191 HydrophobicContact CB-CD2 3.73Å; P189-L191 HydrophobicContact CB-CG 4.24Å; P189-L310 HydrophobicContact CB-CD2 4.09Å; P189-V314 HydrophobicContact CB-CG2 3.78Å; P189-V314 HydrophobicContact CG-CG1 4.44Å; P189-V314 HydrophobicContact CG-CG2 3.64Å
190	K	97.5	Very high	93	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	106.1	175.3	-68.8	167.6	-69.6	-67.1	0	108.3	F177 L185 K188 F192 A232 D233 L234 F235	F177-K190 HydrophobicContact CB-CD 3.97Å; F177-K190 WeakPolarHBondContact O-CD 3.35Å; F177-K190 WeakPolarHBondContact O-CE 3.38Å; L185-K190 HydrophobicContact CB-CD 4.25Å; L185-K190 HydrophobicContact CB-CG 4.33Å; L185-K190 HydrophobicContact CD1-CD 4.5Å; L185-K190 HydrophobicContact CD1-CG 4.19Å; L185-K190 PolarHBondContact O-NZ 3.45Å; K188-K190 PolarHBondContact O-NZ 2.69Å; K190-F192 HydrophobicContact CB-CE2 4.18Å; K190-A232 PolarHBondContact NZ-O 2.71Å; K190-D233 PolarHBondContact N-O 3.49Å; K190-L234 HydrophobicContact CB-CD2 3.74Å; K190-L234 HydrophobicContact CD-CD2 4.09Å; K190-F235 PolarHBondContact O-N 3.27Å
191	L	98.6	Very high	93.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.6	-163.4	-45.2	178.5	0	0	0	109.8	F147 A148 C149 P189 F193 F235 L273 L310 F316	F147-L191 PolarHBondContact O-N 3.22Å; A148-L191 CarbonylContact C-O 3.5Å; A148-L191 VanDerWaalsContact CA-O 3.23Å; A148-L191 WeakPolarHBondContact CA-O 3.37Å; A148-L191 HydrophobicContact CB-CB 4.38Å; C149-L191 PolarHBondContact N-O 2.77Å; P189-L191 HydrophobicContact CB-CD2 3.73Å; P189-L191 HydrophobicContact CB-CG 4.24Å; L191-F193 HydrophobicContact CB-CE2 3.7Å; L191-F193 HydrophobicContact CB-CZ 4.21Å; L191-F235 CarbonylContact C-O 3.46Å; L191-F235 WeakPolarHBondContact CA-O 3.32Å; L191-F235 HydrophobicContact CD2-CB 3.69Å; L191-F235 HydrophobicContact CD2-CD1 4.42Å; L191-F235 HydrophobicContact CD2-CG 4.34Å; L191-L273 HydrophobicContact CD1-CD2 4.11Å; L191-L273 HydrophobicContact CD2-CD2 3.56Å; L191-L273 HydrophobicContact CG-CD2 4.4Å; L191-L310 HydrophobicContact CD2-CD2 4.39Å; L191-F316 HydrophobicContact CD1-CE1 4.33Å; L191-F316 HydrophobicContact CD1-CZ 3.7Å
192	F	98.6	Very high	93.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.5	178.4	-64.3	-94.4	0	0	0	109.5	F147 C149 I174 F177 K190 L234 F235 I236 A237	F147-F192 HydrophobicContact CD1-CZ 4.44Å; F147-F192 HydrophobicContact CE1-CE1 4.14Å; F147-F192 HydrophobicContact CE1-CZ 4.03Å; C149-F192 HydrophobicContact CB-CD1 3.56Å; C149-F192 HydrophobicContact CB-CE1 3.72Å; C149-F192 HydrophobicContact CB-CG 4.43Å; C149-F192 CarbonylContact O-C 3.51Å; C149-F192 VanDerWaalsContact O-CA 3.31Å; C149-F192 WeakPolarHBondContact O-CA 3.4Å; I174-F192 HydrophobicContact CB-CE2 4.44Å; I174-F192 HydrophobicContact CB-CZ 4.25Å; I174-F192 HydrophobicContact CD1-CD1 4.48Å; I174-F192 HydrophobicContact CD1-CD2 4.29Å; I174-F192 HydrophobicContact CD1-CG 4.2Å; I174-F192 HydrophobicContact CG1-CD1 3.85Å; I174-F192 HydrophobicContact CG1-CD2 4.12Å; I174-F192 HydrophobicContact CG1-CE1 3.84Å; I174-F192 HydrophobicContact CG1-CE2 4.1Å; I174-F192 HydrophobicContact CG1-CG 4.01Å; I174-F192 HydrophobicContact CG1-CZ 3.96Å; I174-F192 HydrophobicContact CG2-CE2 3.98Å; I174-F192 HydrophobicContact CG2-CZ 4.19Å; F177-F192 HydrophobicContact CB-CZ 4.26Å; F177-F192 HydrophobicContact CD2-CE1 4.15Å; F177-F192 AromaticContact CD2-CZ 3.66Å; F177-F192 HydrophobicContact CD2-CZ 3.66Å; F177-F192 HydrophobicContact CE2-CE1 4.4Å; F177-F192 HydrophobicContact CE2-CZ 4.31Å; F177-F192 HydrophobicContact CG-CZ 4.14Å; K190-F192 HydrophobicContact CB-CE2 4.18Å; F192-L234 HydrophobicContact CE2-CD2 3.9Å; F192-F235 PolarHBondContact N-O 3.05Å; F192-I236 HydrophobicContact CB-CG1 4.41Å; F192-I236 HydrophobicContact CB-CG2 4.15Å; F192-I236 HydrophobicContact CD2-CG1 4.5Å; F192-I236 CarbonylContact O-C 3.59Å; F192-I236 WeakPolarHBondContact O-CA 3.29Å; F192-A237 PolarHBondContact O-N 3.1Å
193	F	98.7	Very high	93.2	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.7	177.2	-56.1	-93.9	0	0	0	108.9	F111 C149 V150 I151 L191 F235 A237 L260 L273 M277	F111-F193 HydrophobicContact CE1-CE2 4.13Å; F111-F193 AromaticContact CZ-CD2 3.89Å; F111-F193 HydrophobicContact CZ-CD2 3.89Å; F111-F193 AromaticContact CZ-CE2 3.63Å; F111-F193 HydrophobicContact CZ-CE2 3.63Å; F111-F193 HydrophobicContact CZ-CZ 4.22Å; C149-F193 PolarHBondContact O-N 3.42Å; V150-F193 CarbonylContact C-O 3.57Å; V150-F193 VanDerWaalsContact CA-O 3.31Å; V150-F193 WeakPolarHBondContact CA-O 3.39Å; V150-F193 HydrophobicContact CG1-CB 4.41Å; V150-F193 HydrophobicContact CG2-CB 4.25Å; V150-F193 HydrophobicContact CG2-CD2 4.22Å; I151-F193 PolarHBondContact N-O 3.14Å; L191-F193 HydrophobicContact CB-CE2 3.7Å; L191-F193 HydrophobicContact CB-CZ 4.21Å; F193-F235 HydrophobicContact CE1-CD1 4.49Å; F193-F235 AromaticContact CE1-CE1 3.97Å; F193-F235 HydrophobicContact CE1-CE1 3.97Å; F193-F235 HydrophobicContact CZ-CD1 4.46Å; F193-F235 HydrophobicContact CZ-CE1 4.35Å; F193-A237 CarbonylContact C-O 3.49Å; F193-A237 WeakPolarHBondContact CA-O 3.34Å; F193-A237 HydrophobicContact CD1-CB 3.86Å; F193-A237 HydrophobicContact CE1-CB 4.35Å; F193-L260 HydrophobicContact CB-CD2 4.08Å; F193-L260 HydrophobicContact CD1-CD1 4.07Å; F193-L260 HydrophobicContact CD1-CD2 3.57Å; F193-L260 HydrophobicContact CD1-CG 4.49Å; F193-L260 HydrophobicContact CE1-CD1 3.97Å; F193-L260 HydrophobicContact CE1-CD2 4.24Å; F193-L260 HydrophobicContact CG-CD2 3.96Å; F193-L273 HydrophobicContact CE1-CD1 4.43Å; F193-L273 HydrophobicContact CZ-CD1 4.14Å; F193-M277 HydrophobicContact CD1-SD 4.46Å; F193-M277 HydrophobicContact CE1-SD 4.03Å
194	I	98.4	Very high	93.1	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	104.5	-166.1	-57.5	177.5	0	0	0	109.4	I151 I161 V170 A196 I236 A237 Y238 A239	I151-I194 HydrophobicContact CD1-CG1 4.37Å; I161-I194 HydrophobicContact CD1-CG2 3.55Å; I161-I194 HydrophobicContact CG1-CG2 4.42Å; V170-I194 HydrophobicContact CB-CD1 4.42Å; V170-I194 HydrophobicContact CG1-CD1 3.51Å; V170-I194 HydrophobicContact CG2-CD1 3.94Å; I194-A196 HydrophobicContact CG2-CB 4.09Å; I194-A196 PolarHBondContact O-N 2.78Å; I194-I236 HydrophobicContact CD1-CG2 3.85Å; I194-A237 PolarHBondContact N-O 2.76Å; I194-Y238 HydrophobicContact CB-CD1 4.09Å; I194-Y238 HydrophobicContact CD1-CD1 4.18Å; I194-Y238 HydrophobicContact CD1-CE1 3.76Å; I194-Y238 HydrophobicContact CG2-CD1 4.3Å; I194-A239 PolarHBondContact O-N 2.81Å
195	Q	97.8	Very high	92.3	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.019	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	95.2	167.6	173	59.2	50.5	0	0	109.2	I151 L152 S153 S254 F256 I257	I151-Q195 PolarHBondContact O-N 2.91Å; L152-Q195 HydrophobicContact CD2-CB 3.8Å; L152-Q195 HydrophobicContact CD2-CG 4.4Å; S153-Q195 PolarHBondContact N-O 2.97Å; Q195-S254 VanDerWaalsContact CD-CB 3.44Å; Q195-S254 WeakPolarHBondContact CG-OG 3.44Å; Q195-S254 PolarHBondContact OE1-OG 2.81Å; Q195-F256 HydrophobicContact CB-CD1 4.48Å; Q195-I257 HydrophobicContact CB-CD1 3.95Å; Q195-I257 HydrophobicContact CB-CG1 3.82Å; Q195-I257 HydrophobicContact CG-CG1 4.03Å
196	A	96.4	Very high	91.9	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.017	23%	0.226	C	C	.	.	S	Bend	trans	-160.5	153.9	175.5	0	0	0	0	0	110.6	I161 I194 A246	I161-A196 HydrophobicContact CD1-CB 3.29Å; I194-A196 HydrophobicContact CG2-CB 4.09Å; I194-A196 PolarHBondContact O-N 2.78Å; A196-A246 WeakPolarHBondContact O-CB 3.47Å
197	C	95.3	Very high	91.3	Very high	16 Å²	16	44.3 Å²	44.3	11%	0.108	25%	0.247	C	C	.	.			trans	-63.6	152.1	169.4	-61	0	0	0	0	110.2	G155 D156 A246	G155-C197 CarbonylContact C-O 3.37Å; G155-C197 VanDerWaalsContact C-O 3.24Å; G155-C197 WeakPolarHBondContact CA-O 3.39Å; D156-C197 PolarHBondContact N-O 3.34Å; C197-A246 PolarHBondContact SG-N 3.4Å; C197-A246 VanDerWaalsContact SG-N 3.44Å
198	R	94.7	Very high	90	Very high	46 Å²	46	46.9 Å²	46.9	17%	0.174	26%	0.256	C	S	.	.	S	Bend	trans	-126.4	19.2	176.3	-60.4	-179	72.6	-170.8	6.2	112	Y238 V240 G243 Y244 S305	R198-Y238 VanDerWaalsContact NH1-CG 3.3Å; R198-V240 HydrophobicContact CB-CG1 4.27Å; R198-V240 WeakPolarHBondContact CD-O 3.26Å; R198-V240 HydrophobicContact CG-CG1 4.13Å; R198-V240 PolarHBondContact NH1-O 2.84Å; R198-G243 VanDerWaalsContact O-CA 3.28Å; R198-G243 WeakPolarHBondContact O-CA 3.4Å; R198-G243 PolarHBondContact O-N 3Å; R198-Y244 PolarHBondContact N-O 2.58Å; R198-S305 PolarHBondContact NH1-OG 3.09Å
199	G	90.5	Very high	87.7	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.031	29%	0.29	C	S	.	.	S	Bend	trans	151.8	-171.9	-175.2	0	0	0	0	0	110.1	E157 G243 Y244	E157-G199 VanDerWaalsContact CG-CA 3.47Å; G199-G243 CarbonylContact C-O 3.58Å; G199-G243 WeakPolarHBondContact CA-O 3.4Å; G199-Y244 PolarHBondContact N-O 3.06Å; G199-Y244 CarbonylContact O-C 3.54Å
200	M	88.7	Confident	85.3	Confident	134 Å²	134	57 Å²	57	66%	0.66	32%	0.32	S	S	*	.	S	Bend	trans	-115.7	1	-173.5	-55	-166	-48.9	0	0	114	G243	M200-G243 PolarHBondContact N-O 3.5Å
201	A	91.4	Very high	82.3	Confident	46 Å²	46	60.4 Å²	60.4	38%	0.38	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-67.1	141.8	179.2	0	0	0	0	0	111.3	G243 Y244 Y245	A201-G243 WeakPolarHBondContact CB-O 3.26Å; A201-G243 PolarHBondContact N-O 3.35Å; A201-Y244 HydrophobicContact CB-CD1 3.82Å; A201-Y244 HydrophobicContact CB-CE1 4.02Å; A201-Y244 HydrophobicContact CB-CG 4.22Å; A201-Y244 WeakPolarHBondContact O-CA 3.47Å; A201-Y244 WeakPolarHBondContact O-CD1 3.32Å; A201-Y245 PolarHBondContact O-N 2.97Å
202	L	89.4	Confident	79.3	Confident	43 Å²	43	66.5 Å²	66.5	23%	0.225	40%	0.395	C	S	.	.			trans	-107.1	137.2	175.1	-57	176.8	0	0	0	108.6	Y245 F247 S296 F297 K300	L202-Y245 HydrophobicContact CD2-CD1 4.23Å; L202-Y245 HydrophobicContact CD2-CG 4.05Å; L202-F247 HydrophobicContact CD2-CZ 3.95Å; L202-S296 WeakPolarHBondContact CD1-O 3.09Å; L202-F297 HydrophobicContact CD1-CD1 4.02Å; L202-F297 HydrophobicContact CD1-CE1 4.11Å; L202-F297 HydrophobicContact CD1-CG 4.23Å; L202-F297 HydrophobicContact CD1-CZ 4.4Å; L202-F297 HydrophobicContact CD2-CD1 4.04Å; L202-F297 HydrophobicContact CD2-CE1 3.91Å; L202-K300 HydrophobicContact CB-CD 3.93Å; L202-K300 HydrophobicContact CB-CG 4.13Å
203	D	88.3	Confident	76.4	Confident	54 Å²	54	75.2 Å²	75.2	29%	0.289	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-97.1	121	-177.9	-170.2	-14.6	0	0	0	110.2	G205 Y244 K300 K301	D203-G205 VanDerWaalsContact C-N 3.3Å; D203-G205 PolarHBondContact OD1-N 3.47Å; D203-Y244 HydrophobicContact CB-CD1 4.07Å; D203-Y244 HydrophobicContact CB-CE1 3.93Å; D203-K300 CarbonylContact O-C 3.6Å; D203-K300 VanDerWaalsContact O-CA 3.24Å; D203-K300 WeakPolarHBondContact O-CA 3.34Å; D203-K300 WeakPolarHBondContact O-CB 3.49Å; D203-K301 HydrophobicContact CB-CB 4.42Å; D203-K301 PolarHBondContact O-N 3.2Å
204	D	85.6	Confident	73.2	Confident	118 Å²	118	79.6 Å²	79.6	63%	0.631	47%	0.471	S	S	*	.			trans	-79.2	-11.4	178.2	-74.6	-51.2	0	0	0	113.4	K300	D204-K300 IonicContact OD1-NZ 3.52Å; D204-K300 PolarHBondContact OD1-NZ 3.34Å; D204-K300 IonicContact OD2-NZ 2.69Å
205	G	73.7	Confident	69.9	Low	31 Å²	31	86.5 Å²	86.5	32%	0.32	51%	0.509	S	S	.	.			trans	70	171.5	-176	0	0	0	0	0	114.2	D203	D203-G205 VanDerWaalsContact C-N 3.3Å; D203-G205 PolarHBondContact OD1-N 3.47Å
206	V	83.4	Confident	66.8	Low	131 Å²	131	91.4 Å²	91.4	79%	0.794	54%	0.543	S	S	*	.			trans	-143.7	155.6	176	-64.9	0	0	0	0	109.9	V208	V206-V208 HydrophobicContact CG2-CG1 4.42Å
207	F	72.8	Confident	63.6	Low	219 Å²	219	100.9 Å²	100.9	96%	0.961	58%	0.584	S	S	*	*			trans	-80.9	140.1	175.8	-61.9	-75.4	0	0	0	111.5
208	V	60.6	Low	60.6	Low	90 Å²	90	105.3 Å²	105.3	55%	0.545	62%	0.615	S	S	.	*			trans	-136.6	160.3	-178	-63.6	0	0	0	0	112.4	V206 F286	V206-V208 HydrophobicContact CG2-CG1 4.42Å; V208-F286 HydrophobicContact CG2-CE1 4.07Å; V208-F286 HydrophobicContact CG2-CZ 4.32Å
209	C	45.2	Very low	57.6	Low	133 Å²	133	106.2 Å²	106.2	90%	0.899	63%	0.633	S	S	*	*			trans	-124.6	130.2	170.9	-61.4	0	0	0	0	109.6
210	D	45.4	Very low	54.8	Low	121 Å²	121	113.3 Å²	113.3	65%	0.647	67%	0.67	S	S	*	*			trans	-108.2	148.8	-173.1	-76.1	-24.9	0	0	0	113.7	F286	D210-F286 WeakPolarHBondContact OD2-CZ 3.39Å
211	G	35.4	Very low	52.3	Low	72 Å²	72	110.6 Å²	110.6	74%	0.742	67%	0.669	S	S	*	*			trans	-136.4	155	178.9	0	0	0	0	0	113.5
212	P	35.1	Very low	50	Low	128 Å²	128	111.7 Å²	111.7	83%	0.831	68%	0.677	S	S	*	*			trans	-87.8	148.5	-164.7	32.7	-35.1	0	0	0	115
213	L	37.4	Very low	47.9	Very low	184 Å²	184	116 Å²	116	96%	0.963	71%	0.706	S	S	*	*			trans	-151.2	158.2	168.6	-147.9	72.9	0	0	0	115.1
214	S	32.2	Very low	46.3	Very low	93 Å²	93	118.1 Å²	118.1	65%	0.65	72%	0.721	S	S	*	*			trans	-113.8	138.4	-152.8	147.2	0	0	0	0	115.3
215	N	27.9	Very low	44.9	Very low	149 Å²	149	120.9 Å²	120.9	80%	0.797	73%	0.734	S	S	*	*			trans	37.6	129.7	136.5	-54	-16.1	0	0	0	124.3
216	S	32.9	Very low	44.9	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	75%	0.751	S	S	*	*				152.9	127.8	115.1	60.4	0	0	0	0	113.6
217	K	30.6	Very low	44.7	Very low	202 Å²	202	133.6 Å²	133.6	88%	0.878	76%	0.758	S	S	*	*				56.5	146.8	110.1	-61.5	-171.5	-178.6	-177.2	0	116.5
218	S	31	Very low	44.8	Very low	109 Å²	109	126.8 Å²	126.8	76%	0.762	73%	0.731	S	S	*	*			cis	174	162.5	-7.4	50.1	0	0	0	0	106.5
219	A	33	Very low	45.8	Very low	65 Å²	65	127.2 Å²	127.2	54%	0.537	74%	0.735	S	S	.	*			trans	145.3	150.9	140.9	0	0	0	0	0	117
220	D	30.8	Very low	47.4	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	71%	0.711	S	S	*	*			trans	-81.7	177.9	-160.3	-64.6	-43.4	0	0	0	117.8	S67	S67-D220 WeakPolarHBondContact CB-O 3.21Å; S67-D220 PolarHBondContact OG-O 3.48Å
221	A	36.4	Very low	49.3	Very low	77 Å²	77	121.7 Å²	121.7	64%	0.636	70%	0.697	S	S	*	*			trans	-127.4	141.7	-165.6	0	0	0	0	0	118.1	S67	S67-A221 VanDerWaalsContact CB-CA 3.49Å; S67-A221 WeakPolarHBondContact OG-CB 3.36Å
222	A	42.7	Very low	51.8	Low	68 Å²	68	118.6 Å²	118.6	56%	0.562	66%	0.664	S	S	*	*			trans	-133.9	151.8	158.5	0	0	0	0	0	110.5
223	T	45.6	Very low	54.6	Low	135 Å²	135	112.6 Å²	112.6	83%	0.828	63%	0.625	S	S	*	*			trans	-92.1	128.1	-169.3	-50.4	0	0	0	0	111.7
224	T	54.3	Low	57.4	Low	98 Å²	98	104.2 Å²	104.2	60%	0.601	58%	0.581	S	S	*	*			trans	-127.5	148.4	168.5	52.9	0	0	0	0	109.7	R226	T224-R226 PolarHBondContact OG1-NE 2.83Å
225	I	57.5	Low	60.5	Low	175 Å²	175	99.8 Å²	99.8	90%	0.897	55%	0.55	S	S	*	.			trans	-87	125.1	175.4	-60.9	174.8	0	0	0	108.6
226	R	73.9	Confident	63.8	Low	179 Å²	179	93.8 Å²	93.8	68%	0.675	52%	0.518	S	S	*	.			trans	-139.5	153.3	178	-62.5	-175.3	-178.5	-170.7	-3.9	110.3	T224	T224-R226 PolarHBondContact OG1-NE 2.83Å
227	R	78	Confident	67	Low	251 Å²	251	88.8 Å²	88.8	95%	0.947	48%	0.482	S	S	*	.			trans	-86.3	130	169.2	-172.7	177.5	-177.5	173.6	0.9	109.1
228	I	74.3	Confident	70.2	Confident	76 Å²	76	80.5 Å²	80.5	39%	0.39	45%	0.446	S	S	.	.			trans	-123.3	160.4	179.8	64	175.9	0	0	0	110.8	A232 D233	I228-A232 HydrophobicContact CB-CB 4.36Å; I228-A232 HydrophobicContact CD1-CB 3.97Å; I228-A232 HydrophobicContact CG1-CB 4.29Å; I228-D233 WeakPolarHBondContact CD1-OD2 3.33Å
229	P	81.7	Confident	73.3	Confident	98 Å²	98	75.3 Å²	75.3	64%	0.636	41%	0.409	S	S	*	.			trans	-59.8	154.2	175.4	-24.4	35.1	0	0	0	113.6	E231 A232	P229-E231 VanDerWaalsContact C-N 3.34Å; P229-E231 PolarHBondContact O-N 2.91Å; P229-A232 HydrophobicContact CB-CB 4.49Å; P229-A232 WeakPolarHBondContact O-CB 3.28Å; P229-A232 PolarHBondContact O-N 3.41Å
230	V	79.4	Confident	76.3	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.388	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-40	-179.9	169.6	0	0	0	0	112.6	R178 G179 D180 A232	R178-V230 HydrophobicContact CB-CG1 3.97Å; G179-V230 PolarHBondContact N-O 3.35Å; D180-V230 HydrophobicContact CB-CG1 4.05Å; D180-V230 HydrophobicContact CB-CG2 4.09Å; D180-V230 WeakPolarHBondContact OD1-CG1 3.47Å; V230-A232 PolarHBondContact O-N 2.93Å
231	E	85.8	Confident	79.3	Confident	75 Å²	75	69.4 Å²	69.4	35%	0.35	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	7	179.3	-58.2	-58.6	145.3	0	0	113.4	R178 P229 L234 T309	R178-E231 VanDerWaalsContact CD-OE1 3.22Å; R178-E231 WeakPolarHBondContact CD-OE1 3.49Å; R178-E231 IonicContact CZ-OE1 3.56Å; R178-E231 IonicContact CZ-OE2 2.73Å; R178-E231 IonicContact NE-OE1 3.49Å; R178-E231 PolarHBondContact NE-OE1 2.94Å; R178-E231 IonicContact NE-OE2 2.88Å; R178-E231 PolarHBondContact NE-OE2 2.95Å; R178-E231 IonicContact NH2-OE1 2.78Å; R178-E231 IonicContact NH2-OE2 2.91Å; R178-E231 PolarHBondContact NH2-OE2 3.12Å; P229-E231 VanDerWaalsContact C-N 3.34Å; P229-E231 PolarHBondContact O-N 2.91Å; E231-L234 HydrophobicContact CB-CD1 4.46Å; E231-L234 WeakPolarHBondContact OE2-CD1 3.21Å; E231-T309 VanDerWaalsContact O-CB 3.28Å; E231-T309 WeakPolarHBondContact O-CB 3.49Å; E231-T309 PolarHBondContact O-OG1 3.39Å
232	A	87.2	Confident	81.8	Confident	6 Å²	6	69 Å²	69	5%	0.05	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	154.2	-179	0	0	0	0	0	112.4	K190 I228 P229 V230 L234 T311	K190-A232 PolarHBondContact NZ-O 2.71Å; I228-A232 HydrophobicContact CB-CB 4.36Å; I228-A232 HydrophobicContact CD1-CB 3.97Å; I228-A232 HydrophobicContact CG1-CB 4.29Å; P229-A232 HydrophobicContact CB-CB 4.49Å; P229-A232 WeakPolarHBondContact O-CB 3.28Å; P229-A232 PolarHBondContact O-N 3.41Å; V230-A232 PolarHBondContact O-N 2.93Å; A232-L234 VanDerWaalsContact C-N 3.28Å; A232-L234 PolarHBondContact O-N 3.34Å; A232-T311 HydrophobicContact CB-CG2 4.26Å
233	D	93.9	Very high	84.1	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.011	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	26.9	175.5	-36.2	-57.3	0	0	0	114.1	Y70 G187 K188 K190 I228 T309 T311	Y70-D233 HydrophobicContact CE1-CB 4.31Å; Y70-D233 WeakPolarHBondContact CE1-OD1 3.2Å; Y70-D233 WeakPolarHBondContact OH-CB 3.34Å; Y70-D233 VanDerWaalsContact OH-CG 3.29Å; Y70-D233 PolarHBondContact OH-OD1 2.9Å; G187-D233 WeakPolarHBondContact CA-OD2 3.31Å; G187-D233 PolarHBondContact N-OD2 3.27Å; G187-D233 VanDerWaalsContact N-OD2 3.14Å; K188-D233 VanDerWaalsContact O-CB 3.27Å; K188-D233 WeakPolarHBondContact O-CB 3.41Å; K190-D233 PolarHBondContact N-O 3.49Å; I228-D233 WeakPolarHBondContact CD1-OD2 3.33Å; D233-T309 PolarHBondContact N-O 2.82Å; D233-T311 PolarHBondContact OD1-OG1 2.71Å
234	L	95.6	Very high	86.4	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	141.5	170.5	-67.7	164.4	0	0	0	110.5	I174 K190 F192 E231 A232 T309 L310	I174-L234 HydrophobicContact CG2-CD1 4.27Å; I174-L234 HydrophobicContact CG2-CD2 3.86Å; K190-L234 HydrophobicContact CB-CD2 3.74Å; K190-L234 HydrophobicContact CD-CD2 4.09Å; F192-L234 HydrophobicContact CE2-CD2 3.9Å; E231-L234 HydrophobicContact CB-CD1 4.46Å; E231-L234 WeakPolarHBondContact OE2-CD1 3.21Å; A232-L234 VanDerWaalsContact C-N 3.28Å; A232-L234 PolarHBondContact O-N 3.34Å; L234-T309 WeakPolarHBondContact CB-OG1 3.23Å; L234-T309 PolarHBondContact N-OG1 3.24Å; L234-T309 VanDerWaalsContact N-OG1 3.08Å; L234-T309 PolarHBondContact O-N 2.88Å; L234-T309 PolarHBondContact O-OG1 2.79Å; L234-L310 PolarHBondContact O-N 3.47Å
235	F	98.2	Very high	88.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.1	169.8	178.9	-95.1	0	0	0	108.4	K190 L191 F192 F193 A237 L273 L274 M277 F306 L310	K190-F235 PolarHBondContact O-N 3.27Å; L191-F235 CarbonylContact C-O 3.46Å; L191-F235 WeakPolarHBondContact CA-O 3.32Å; L191-F235 HydrophobicContact CD2-CB 3.69Å; L191-F235 HydrophobicContact CD2-CD1 4.42Å; L191-F235 HydrophobicContact CD2-CG 4.34Å; F192-F235 PolarHBondContact N-O 3.05Å; F193-F235 HydrophobicContact CE1-CD1 4.49Å; F193-F235 AromaticContact CE1-CE1 3.97Å; F193-F235 HydrophobicContact CE1-CE1 3.97Å; F193-F235 HydrophobicContact CZ-CD1 4.46Å; F193-F235 HydrophobicContact CZ-CE1 4.35Å; F235-A237 HydrophobicContact CE1-CB 3.67Å; F235-A237 HydrophobicContact CZ-CB 4.03Å; F235-L273 HydrophobicContact CB-CD2 4.39Å; F235-L273 HydrophobicContact CD1-CD2 3.72Å; F235-L273 HydrophobicContact CD1-CG 4.45Å; F235-L273 HydrophobicContact CD2-CD2 4.26Å; F235-L273 HydrophobicContact CE1-CD2 4.09Å; F235-L273 HydrophobicContact CE1-CG 4.35Å; F235-L273 HydrophobicContact CG-CD2 3.83Å; F235-L274 HydrophobicContact CD2-CD2 4.05Å; F235-L274 HydrophobicContact CE2-CD2 3.64Å; F235-M277 HydrophobicContact CE1-CG 4.11Å; F235-M277 HydrophobicContact CE1-SD 4.35Å; F235-M277 HydrophobicContact CZ-CB 4.42Å; F235-M277 HydrophobicContact CZ-CG 3.61Å; F235-M277 HydrophobicContact CZ-SD 4.28Å; F235-F306 HydrophobicContact CE2-CB 3.9Å; F235-F306 AromaticContact CE2-CD2 3.57Å; F235-F306 HydrophobicContact CE2-CD2 3.57Å; F235-F306 HydrophobicContact CE2-CE2 4.3Å; F235-F306 AromaticContact CE2-CG 3.86Å; F235-F306 HydrophobicContact CE2-CG 3.86Å; F235-F306 HydrophobicContact CZ-CB 3.62Å; F235-F306 HydrophobicContact CZ-CD2 4.02Å; F235-F306 AromaticContact CZ-CG 3.81Å; F235-F306 HydrophobicContact CZ-CG 3.81Å; F235-L310 HydrophobicContact CB-CD1 3.9Å; F235-L310 HydrophobicContact CB-CD2 4.15Å; F235-L310 HydrophobicContact CB-CG 3.98Å; F235-L310 HydrophobicContact CD2-CD1 3.94Å; F235-L310 HydrophobicContact CG-CD1 4.19Å
236	I	98.1	Very high	89.7	Confident	24 Å²	24	52.4 Å²	52.4	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	109.5	-178.3	-47	164.7	0	0	0	108.3	I174 F192 I194 Y238 F306 V307	I174-I236 HydrophobicContact CD1-CD1 3.4Å; I174-I236 HydrophobicContact CD1-CG1 3.79Å; I174-I236 HydrophobicContact CD1-CG2 4.29Å; F192-I236 HydrophobicContact CB-CG1 4.41Å; F192-I236 HydrophobicContact CB-CG2 4.15Å; F192-I236 HydrophobicContact CD2-CG1 4.5Å; F192-I236 CarbonylContact O-C 3.59Å; F192-I236 WeakPolarHBondContact O-CA 3.29Å; I194-I236 HydrophobicContact CD1-CG2 3.85Å; I236-Y238 HydrophobicContact CB-CE2 4.18Å; I236-Y238 HydrophobicContact CG2-CD2 4.28Å; I236-Y238 HydrophobicContact CG2-CE1 4.1Å; I236-Y238 HydrophobicContact CG2-CE2 3.57Å; I236-Y238 VanDerWaalsContact CG2-CZ 3.47Å; I236-F306 CarbonylContact O-C 3.5Å; I236-F306 WeakPolarHBondContact O-CA 3.46Å; I236-F306 WeakPolarHBondContact O-CB 3.45Å; I236-V307 PolarHBondContact N-O 3.02Å; I236-V307 PolarHBondContact O-N 2.91Å
237	A	98.2	Very high	90.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.3	171.9	0	0	0	0	0	110.7	F192 F193 I194 F235 F256 M277 F306	F192-A237 PolarHBondContact O-N 3.1Å; F193-A237 CarbonylContact C-O 3.49Å; F193-A237 WeakPolarHBondContact CA-O 3.34Å; F193-A237 HydrophobicContact CD1-CB 3.86Å; F193-A237 HydrophobicContact CE1-CB 4.35Å; I194-A237 PolarHBondContact N-O 2.76Å; F235-A237 HydrophobicContact CE1-CB 3.67Å; F235-A237 HydrophobicContact CZ-CB 4.03Å; A237-F256 HydrophobicContact CB-CZ 4.06Å; A237-M277 HydrophobicContact CB-CE 3.54Å; A237-M277 HydrophobicContact CB-SD 4.14Å; A237-F306 HydrophobicContact CB-CB 4.07Å
238	Y	98.2	Very high	91	Very high	28 Å²	28	32.4 Å²	32.4	11%	0.11	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.7	175.4	-59.8	-87.1	0	0	0	109.2	I194 R198 I236 V240 P304 S305	I194-Y238 HydrophobicContact CB-CD1 4.09Å; I194-Y238 HydrophobicContact CD1-CD1 4.18Å; I194-Y238 HydrophobicContact CD1-CE1 3.76Å; I194-Y238 HydrophobicContact CG2-CD1 4.3Å; R198-Y238 VanDerWaalsContact NH1-CG 3.3Å; I236-Y238 HydrophobicContact CB-CE2 4.18Å; I236-Y238 HydrophobicContact CG2-CD2 4.28Å; I236-Y238 HydrophobicContact CG2-CE1 4.1Å; I236-Y238 HydrophobicContact CG2-CE2 3.57Å; I236-Y238 VanDerWaalsContact CG2-CZ 3.47Å; Y238-V240 WeakPolarHBondContact CB-O 3.41Å; Y238-V240 PolarHBondContact O-N 2.92Å; Y238-V240 VanDerWaalsContact O-N 3.1Å; Y238-P304 WeakPolarHBondContact O-CA 3.45Å; Y238-P304 WeakPolarHBondContact O-CB 3.24Å; Y238-S305 PolarHBondContact N-O 2.76Å; Y238-S305 PolarHBondContact O-N 2.72Å
239	A	96.8	Very high	91.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-58.7	-24.2	177.3	0	0	0	0	0	113.8	I194 A246 F256 Q302 P304	I194-A239 PolarHBondContact O-N 2.81Å; A239-A246 HydrophobicContact CB-CB 4.17Å; A239-F256 VanDerWaalsContact CA-CG 3.47Å; A239-F256 HydrophobicContact CB-CB 3.56Å; A239-F256 HydrophobicContact CB-CD1 3.55Å; A239-F256 HydrophobicContact CB-CD2 4.46Å; A239-F256 HydrophobicContact CB-CE1 4.34Å; A239-F256 HydrophobicContact CB-CG 3.61Å; A239-Q302 PolarHBondContact O-NE2 3.47Å; A239-P304 WeakPolarHBondContact O-CA 3.49Å
240	V	95.4	Very high	91.4	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.018	14%	0.143	C	C	.	.	S	Bend	trans	-146.9	160.7	-176.3	73	0	0	0	0	111.9	R198 Y238 Y244 Y245 A246 Q302 M303 S305	R198-V240 HydrophobicContact CB-CG1 4.27Å; R198-V240 WeakPolarHBondContact CD-O 3.26Å; R198-V240 HydrophobicContact CG-CG1 4.13Å; R198-V240 PolarHBondContact NH1-O 2.84Å; Y238-V240 WeakPolarHBondContact CB-O 3.41Å; Y238-V240 PolarHBondContact O-N 2.92Å; Y238-V240 VanDerWaalsContact O-N 3.1Å; V240-Y244 VanDerWaalsContact CG1-O 3.31Å; V240-Y244 WeakPolarHBondContact CG1-O 3.37Å; V240-Y244 VanDerWaalsContact CG2-CB 3.46Å; V240-Y245 WeakPolarHBondContact CG2-O 3.3Å; V240-A246 HydrophobicContact CB-CB 4.21Å; V240-A246 HydrophobicContact CG1-CB 3.92Å; V240-Q302 HydrophobicContact CB-CG 4.24Å; V240-Q302 HydrophobicContact CG2-CG 3.93Å; V240-M303 CarbonylContact C-O 3.45Å; V240-M303 VanDerWaalsContact CA-O 3.29Å; V240-M303 WeakPolarHBondContact CA-O 3.43Å; V240-S305 PolarHBondContact O-OG 3.2Å; V240-S305 VanDerWaalsContact O-OG 3.12Å
241	Q	93.4	Very high	91.7	Very high	90 Å²	90	28.2 Å²	28.2	42%	0.421	15%	0.154	S	C	.	.			trans	-62.2	149.9	170.1	-163.8	64.8	-61.8	0	0	112.1	G243 Y244 M303 S305	Q241-G243 PolarHBondContact O-N 2.92Å; Q241-Y244 HydrophobicContact CB-CD2 3.93Å; Q241-Y244 HydrophobicContact CB-CE2 4.45Å; Q241-Y244 HydrophobicContact CG-CD2 4.34Å; Q241-Y244 HydrophobicContact CG-CE2 4.45Å; Q241-Y244 PolarHBondContact O-N 3.48Å; Q241-M303 PolarHBondContact N-O 3.46Å; Q241-S305 VanDerWaalsContact OE1-CB 3.24Å; Q241-S305 PolarHBondContact OE1-OG 3.01Å
242	P	90.8	Very high	91.8	Very high	68 Å²	68	27.8 Å²	27.8	44%	0.442	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	138.8	173.9	-22.1	29.7	0	0	0	112.4	Y244	P242-Y244 VanDerWaalsContact C-N 3.33Å; P242-Y244 VanDerWaalsContact O-CD2 3.32Å; P242-Y244 WeakPolarHBondContact O-CD2 3.12Å
243	G	90.8	Very high	92	Very high	24 Å²	24	27.6 Å²	27.6	25%	0.247	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	-13	-179.3	0	0	0	0	0	114.6	R198 G199 M200 A201 Q241	R198-G243 VanDerWaalsContact O-CA 3.28Å; R198-G243 WeakPolarHBondContact O-CA 3.4Å; R198-G243 PolarHBondContact O-N 3Å; G199-G243 CarbonylContact C-O 3.58Å; G199-G243 WeakPolarHBondContact CA-O 3.4Å; M200-G243 PolarHBondContact N-O 3.5Å; A201-G243 WeakPolarHBondContact CB-O 3.26Å; A201-G243 PolarHBondContact N-O 3.35Å; Q241-G243 PolarHBondContact O-N 2.92Å
244	Y	93.1	Very high	92.1	Very high	82 Å²	82	27.5 Å²	27.5	32%	0.322	15%	0.152	S	C	.	.	B	Isolated β-bridge	trans	-108	160.6	-171.5	-69.9	-94.3	0	0	0	114	R198 G199 A201 D203 V240 Q241 P242	R198-Y244 PolarHBondContact N-O 2.58Å; G199-Y244 PolarHBondContact N-O 3.06Å; G199-Y244 CarbonylContact O-C 3.54Å; A201-Y244 HydrophobicContact CB-CD1 3.82Å; A201-Y244 HydrophobicContact CB-CE1 4.02Å; A201-Y244 HydrophobicContact CB-CG 4.22Å; A201-Y244 WeakPolarHBondContact O-CA 3.47Å; A201-Y244 WeakPolarHBondContact O-CD1 3.32Å; D203-Y244 HydrophobicContact CB-CD1 4.07Å; D203-Y244 HydrophobicContact CB-CE1 3.93Å; V240-Y244 VanDerWaalsContact CG1-O 3.31Å; V240-Y244 WeakPolarHBondContact CG1-O 3.37Å; V240-Y244 VanDerWaalsContact CG2-CB 3.46Å; Q241-Y244 HydrophobicContact CB-CD2 3.93Å; Q241-Y244 HydrophobicContact CB-CE2 4.45Å; Q241-Y244 HydrophobicContact CG-CD2 4.34Å; Q241-Y244 HydrophobicContact CG-CE2 4.45Å; Q241-Y244 PolarHBondContact O-N 3.48Å; P242-Y244 VanDerWaalsContact C-N 3.33Å; P242-Y244 VanDerWaalsContact O-CD2 3.32Å; P242-Y244 WeakPolarHBondContact O-CD2 3.12Å
245	Y	89.3	Confident	92.1	Very high	18 Å²	18	27.3 Å²	27.3	7%	0.071	15%	0.15	C	C	.	.			trans	-82.4	136.7	179.1	-174.5	-90.9	0	0	0	112.1	H18 A201 L202 V240 F247	H18-Y245 HydrophobicContact CB-CE2 4.43Å; H18-Y245 AromaticContact CD2-CE2 3.84Å; H18-Y245 AromaticContact CD2-CZ 3.62Å; H18-Y245 PolarHBondContact CD2-OH 3.48Å; H18-Y245 PolarHBondContact NE2-OH 3.24Å; A201-Y245 PolarHBondContact O-N 2.97Å; L202-Y245 HydrophobicContact CD2-CD1 4.23Å; L202-Y245 HydrophobicContact CD2-CG 4.05Å; V240-Y245 WeakPolarHBondContact CG2-O 3.3Å; Y245-F247 HydrophobicContact CD1-CD1 4.06Å; Y245-F247 HydrophobicContact CD1-CD2 4.02Å; Y245-F247 AromaticContact CD1-CE1 3.97Å; Y245-F247 HydrophobicContact CD1-CE1 3.97Å; Y245-F247 AromaticContact CD1-CE2 3.94Å; Y245-F247 HydrophobicContact CD1-CE2 3.94Å; Y245-F247 HydrophobicContact CD1-CG 4.08Å; Y245-F247 AromaticContact CD1-CZ 3.9Å; Y245-F247 HydrophobicContact CD1-CZ 3.9Å; Y245-F247 AromaticContact CE1-CD1 3.91Å; Y245-F247 HydrophobicContact CE1-CD1 3.91Å; Y245-F247 HydrophobicContact CE1-CE1 4.08Å; Y245-F247 HydrophobicContact CE1-CG 4.14Å; Y245-F247 HydrophobicContact CE1-CZ 4.48Å
246	A	92.4	Very high	92.1	Very high	4 Å²	4	27.3 Å²	27.3	3%	0.033	15%	0.15	C	C	.	.			trans	-102.7	112.9	178.5	0	0	0	0	0	111.1	A196 C197 A239 V240	A196-A246 WeakPolarHBondContact O-CB 3.47Å; C197-A246 PolarHBondContact SG-N 3.4Å; C197-A246 VanDerWaalsContact SG-N 3.44Å; A239-A246 HydrophobicContact CB-CB 4.17Å; V240-A246 HydrophobicContact CB-CB 4.21Å; V240-A246 HydrophobicContact CG1-CB 3.92Å
247	F	90	Very high	92.1	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	15%	0.145	C	C	.	.			trans	-74.5	142.9	-173.3	-71.4	-88.9	0	0	0	113.8	V15 L202 Y245 W255 F297 K300 Q302	V15-F247 HydrophobicContact CG1-CD1 3.65Å; V15-F247 HydrophobicContact CG1-CE1 4.18Å; V15-F247 HydrophobicContact CG2-CD1 4.19Å; L202-F247 HydrophobicContact CD2-CZ 3.95Å; Y245-F247 HydrophobicContact CD1-CD1 4.06Å; Y245-F247 HydrophobicContact CD1-CD2 4.02Å; Y245-F247 AromaticContact CD1-CE1 3.97Å; Y245-F247 HydrophobicContact CD1-CE1 3.97Å; Y245-F247 AromaticContact CD1-CE2 3.94Å; Y245-F247 HydrophobicContact CD1-CE2 3.94Å; Y245-F247 HydrophobicContact CD1-CG 4.08Å; Y245-F247 AromaticContact CD1-CZ 3.9Å; Y245-F247 HydrophobicContact CD1-CZ 3.9Å; Y245-F247 AromaticContact CE1-CD1 3.91Å; Y245-F247 HydrophobicContact CE1-CD1 3.91Å; Y245-F247 HydrophobicContact CE1-CE1 4.08Å; Y245-F247 HydrophobicContact CE1-CG 4.14Å; Y245-F247 HydrophobicContact CE1-CZ 4.48Å; F247-W255 HydrophobicContact CB-CD2 3.64Å; F247-W255 HydrophobicContact CB-CE3 3.73Å; F247-W255 HydrophobicContact CB-CG 4.28Å; F247-W255 HydrophobicContact CB-CH2 3.88Å; F247-W255 HydrophobicContact CB-CZ2 3.83Å; F247-W255 HydrophobicContact CB-CZ3 3.85Å; F247-W255 HydrophobicContact CD1-CH2 4.12Å; F247-W255 HydrophobicContact CD1-CZ2 4.28Å; F247-W255 HydrophobicContact CD2-CE3 4.34Å; F247-W255 HydrophobicContact CD2-CH2 4.05Å; F247-W255 AromaticContact CD2-CZ3 3.82Å; F247-W255 HydrophobicContact CD2-CZ3 3.82Å; F247-W255 HydrophobicContact CG-CE3 4.25Å; F247-W255 AromaticContact CG-CH2 3.75Å; F247-W255 HydrophobicContact CG-CH2 3.75Å; F247-W255 HydrophobicContact CG-CZ2 4.07Å; F247-W255 AromaticContact CG-CZ3 3.86Å; F247-W255 HydrophobicContact CG-CZ3 3.86Å; F247-W255 PolarHBondContact O-N 3.35Å; F247-F297 HydrophobicContact CE1-CD1 4.48Å; F247-K300 HydrophobicContact CE1-CB 4.37Å; F247-K300 HydrophobicContact CE2-CB 4.04Å; F247-K300 HydrophobicContact CZ-CB 3.53Å; F247-K300 HydrophobicContact CZ-CG 4.15Å; F247-Q302 HydrophobicContact CD2-CB 4.23Å
248	R	88.8	Confident	92	Very high	9 Å²	9	29.3 Å²	29.3	3%	0.034	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.7	174.3	177.8	-174.7	55.3	69.6	5.4	110.5	E16 N98	E16-R248 IonicContact OE2-CZ 3.94Å; E16-R248 IonicContact OE2-NH1 2.88Å; E16-R248 PolarHBondContact OE2-NH1 3.04Å; E16-R248 VanDerWaalsContact OE2-NH1 3.09Å; E16-R248 IonicContact OE2-NH2 3.44Å; E16-R248 PolarHBondContact OE2-NH2 3.49Å; N98-R248 WeakPolarHBondContact O-CD 3.43Å; N98-R248 PolarHBondContact O-NH1 3.21Å
249	N	84.1	Confident	92	Very high	8 Å²	8	28 Å²	28	4%	0.043	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.9	165.6	-177.9	-91.4	0	0	0	110.3	S13 V14 V251 N252 G253	S13-N249 WeakPolarHBondContact CB-ND2 3.13Å; S13-N249 PolarHBondContact OG-ND2 3.28Å; V14-N249 PolarHBondContact O-ND2 2.74Å; N249-V251 PolarHBondContact O-N 3.49Å; N249-V251 WeakPolarHBondContact OD1-CA 3.29Å; N249-V251 WeakPolarHBondContact OD1-CB 3.36Å; N249-V251 PolarHBondContact OD1-N 3.37Å; N249-N252 HydrophobicContact CB-CB 4.21Å; N249-N252 WeakPolarHBondContact OD1-CB 3.49Å; N249-N252 PolarHBondContact OD1-N 3.45Å; N249-G253 WeakPolarHBondContact CA-O 3.4Å; N249-G253 WeakPolarHBondContact CB-O 3.31Å; N249-G253 PolarHBondContact N-O 2.94Å; N249-G253 CarbonylContact O-C 3.53Å; N249-G253 WeakPolarHBondContact O-CA 3.39Å; N249-G253 PolarHBondContact O-N 2.87Å
250	S	80.9	Confident	92.1	Very high	41 Å²	41	28 Å²	28	29%	0.287	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.2	-176.2	55.3	0	0	0	0	114.4	N98 G99	N98-S250 CarbonylContact C-O 3.51Å; G99-S250 VanDerWaalsContact CA-O 3.23Å; G99-S250 WeakPolarHBondContact CA-O 3.41Å; G99-S250 PolarHBondContact N-O 2.91Å
251	V	84.4	Confident	92.2	Very high	102 Å²	102	27.8 Å²	27.8	62%	0.618	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-43.4	-179.8	-177.5	0	0	0	0	111.4	N249	N249-V251 PolarHBondContact O-N 3.49Å; N249-V251 WeakPolarHBondContact OD1-CA 3.29Å; N249-V251 WeakPolarHBondContact OD1-CB 3.36Å; N249-V251 PolarHBondContact OD1-N 3.37Å
252	N	88	Confident	92.5	Very high	65 Å²	65	26.4 Å²	26.4	35%	0.348	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-2.2	-168.6	-67.5	-38.5	0	0	0	114.3	N249	N249-N252 HydrophobicContact CB-CB 4.21Å; N249-N252 WeakPolarHBondContact OD1-CB 3.49Å; N249-N252 PolarHBondContact OD1-N 3.45Å
253	G	91	Very high	92.9	Very high	2 Å²	2	23.1 Å²	23.1	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.1	-169.4	-174.8	0	0	0	0	0	113.3	D103 N249	D103-G253 WeakPolarHBondContact OD1-CA 3.47Å; N249-G253 WeakPolarHBondContact CA-O 3.4Å; N249-G253 WeakPolarHBondContact CB-O 3.31Å; N249-G253 PolarHBondContact N-O 2.94Å; N249-G253 CarbonylContact O-C 3.53Å; N249-G253 WeakPolarHBondContact O-CA 3.39Å; N249-G253 PolarHBondContact O-N 2.87Å
254	S	96	Very high	93.2	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	145.6	-179.5	56	0	0	0	0	113.1	D103 Q195 F256 I257 R258	D103-S254 VanDerWaalsContact CG-OG 3.22Å; D103-S254 PolarHBondContact OD1-N 2.86Å; D103-S254 PolarHBondContact OD1-OG 2.95Å; D103-S254 WeakPolarHBondContact OD2-CB 3.16Å; D103-S254 PolarHBondContact OD2-N 2.91Å; D103-S254 PolarHBondContact OD2-OG 2.69Å; Q195-S254 VanDerWaalsContact CD-CB 3.44Å; Q195-S254 WeakPolarHBondContact CG-OG 3.44Å; Q195-S254 PolarHBondContact OE1-OG 2.81Å; S254-F256 VanDerWaalsContact C-N 3.32Å; S254-F256 PolarHBondContact O-N 3.38Å; S254-I257 PolarHBondContact O-N 3.32Å; S254-I257 VanDerWaalsContact OG-CB 3.3Å; S254-I257 WeakPolarHBondContact OG-CB 3.33Å; S254-I257 WeakPolarHBondContact OG-CG1 3.45Å; S254-R258 WeakPolarHBondContact O-CB 3.22Å; S254-R258 PolarHBondContact O-N 3.39Å
255	W	95.7	Very high	93.5	Very high	5 Å²	5	20.2 Å²	20.2	2%	0.019	11%	0.108	C	C	.	.	H	α-helix	trans	-59.9	-44.9	-175	-61.9	-5	0	0	0	111.7	V15 F247 A259 Y288 E289 S290 Q302	V15-W255 HydrophobicContact CG2-CZ2 4.34Å; F247-W255 HydrophobicContact CB-CD2 3.64Å; F247-W255 HydrophobicContact CB-CE3 3.73Å; F247-W255 HydrophobicContact CB-CG 4.28Å; F247-W255 HydrophobicContact CB-CH2 3.88Å; F247-W255 HydrophobicContact CB-CZ2 3.83Å; F247-W255 HydrophobicContact CB-CZ3 3.85Å; F247-W255 HydrophobicContact CD1-CH2 4.12Å; F247-W255 HydrophobicContact CD1-CZ2 4.28Å; F247-W255 HydrophobicContact CD2-CE3 4.34Å; F247-W255 HydrophobicContact CD2-CH2 4.05Å; F247-W255 AromaticContact CD2-CZ3 3.82Å; F247-W255 HydrophobicContact CD2-CZ3 3.82Å; F247-W255 HydrophobicContact CG-CE3 4.25Å; F247-W255 AromaticContact CG-CH2 3.75Å; F247-W255 HydrophobicContact CG-CH2 3.75Å; F247-W255 HydrophobicContact CG-CZ2 4.07Å; F247-W255 AromaticContact CG-CZ3 3.86Å; F247-W255 HydrophobicContact CG-CZ3 3.86Å; F247-W255 PolarHBondContact O-N 3.35Å; W255-A259 WeakPolarHBondContact O-CB 3.47Å; W255-A259 PolarHBondContact O-N 2.76Å; W255-Y288 HydrophobicContact CB-CD1 3.61Å; W255-Y288 HydrophobicContact CB-CE1 3.88Å; W255-Y288 HydrophobicContact CB-CG 3.98Å; W255-Y288 AromaticContact CD1-CD1 3.44Å; W255-Y288 VanDerWaalsContact CD1-CD1 3.44Å; W255-Y288 AromaticContact CD1-CE1 3.89Å; W255-Y288 AromaticContact CD2-CD1 3.7Å; W255-Y288 HydrophobicContact CD2-CD1 3.7Å; W255-Y288 AromaticContact CD2-CG 3.93Å; W255-Y288 HydrophobicContact CD2-CG 3.93Å; W255-Y288 VanDerWaalsContact CE3-CB 3.45Å; W255-Y288 HydrophobicContact CE3-CD1 4.4Å; W255-Y288 HydrophobicContact CE3-CG 4.17Å; W255-Y288 AromaticContact CG-CD1 3.3Å; W255-Y288 HydrophobicContact CG-CD1 3.3Å; W255-Y288 AromaticContact CG-CE1 3.91Å; W255-Y288 HydrophobicContact CG-CE1 3.91Å; W255-Y288 AromaticContact CG-CG 3.87Å; W255-Y288 HydrophobicContact CG-CG 3.87Å; W255-Y288 AromaticContact NE1-CD1 3.88Å; W255-E289 VanDerWaalsContact CH2-C 3.44Å; W255-S290 VanDerWaalsContact CH2-N 3.26Å; W255-Q302 HydrophobicContact CE3-CB 3.87Å; W255-Q302 HydrophobicContact CZ3-CB 3.93Å
256	F	98.2	Very high	93.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-45.2	178.5	172.1	-113.5	0	0	0	112.3	Q195 A237 A239 S254 A259 L260 M277 V280 P304	Q195-F256 HydrophobicContact CB-CD1 4.48Å; A237-F256 HydrophobicContact CB-CZ 4.06Å; A239-F256 VanDerWaalsContact CA-CG 3.47Å; A239-F256 HydrophobicContact CB-CB 3.56Å; A239-F256 HydrophobicContact CB-CD1 3.55Å; A239-F256 HydrophobicContact CB-CD2 4.46Å; A239-F256 HydrophobicContact CB-CE1 4.34Å; A239-F256 HydrophobicContact CB-CG 3.61Å; S254-F256 VanDerWaalsContact C-N 3.32Å; S254-F256 PolarHBondContact O-N 3.38Å; F256-A259 PolarHBondContact O-N 3.5Å; F256-L260 HydrophobicContact CE1-CD2 4.22Å; F256-L260 HydrophobicContact CZ-CD2 4.15Å; F256-L260 WeakPolarHBondContact O-CB 3.35Å; F256-L260 PolarHBondContact O-N 3.1Å; F256-M277 HydrophobicContact CE2-CE 4Å; F256-M277 HydrophobicContact CZ-CE 4.38Å; F256-V280 HydrophobicContact CD2-CG1 3.87Å; F256-V280 HydrophobicContact CE2-CG1 3.88Å; F256-P304 HydrophobicContact CD2-CB 3.79Å; F256-P304 HydrophobicContact CD2-CG 3.84Å; F256-P304 HydrophobicContact CE2-CB 3.95Å; F256-P304 HydrophobicContact CE2-CG 4.43Å
257	I	98.1	Very high	94.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.8	-36.9	-178.7	-63.2	-64.1	0	0	0	111.7	D103 N106 I107 V150 L152 Q195 S254 S261	D103-I257 HydrophobicContact CB-CB 4.29Å; D103-I257 HydrophobicContact CB-CG1 4.47Å; D103-I257 HydrophobicContact CB-CG2 3.8Å; N106-I257 HydrophobicContact CB-CG2 4.46Å; I107-I257 HydrophobicContact CD1-CD1 3.99Å; I107-I257 HydrophobicContact CD1-CG2 3.86Å; I107-I257 HydrophobicContact CG1-CD1 4.28Å; I107-I257 HydrophobicContact CG1-CG2 3.59Å; V150-I257 HydrophobicContact CG1-CD1 4.25Å; L152-I257 HydrophobicContact CD2-CD1 3.49Å; L152-I257 VanDerWaalsContact CD2-CD1 3.49Å; L152-I257 HydrophobicContact CD2-CG1 3.66Å; Q195-I257 HydrophobicContact CB-CD1 3.95Å; Q195-I257 HydrophobicContact CB-CG1 3.82Å; Q195-I257 HydrophobicContact CG-CG1 4.03Å; S254-I257 PolarHBondContact O-N 3.32Å; S254-I257 VanDerWaalsContact OG-CB 3.3Å; S254-I257 WeakPolarHBondContact OG-CB 3.33Å; S254-I257 WeakPolarHBondContact OG-CG1 3.45Å; I257-S261 WeakPolarHBondContact O-CB 3.46Å; I257-S261 PolarHBondContact O-N 2.88Å; I257-S261 PolarHBondContact O-OG 2.77Å
258	R	97	Very high	94.4	Very high	65 Å²	65	28.4 Å²	28.4	25%	0.245	14%	0.139	C	C	.	.	H	α-helix	trans	-61.8	-53.3	173.4	-177.3	176.5	164.9	139.4	-7.7	111	S254 S261 D262 Y288	S254-R258 WeakPolarHBondContact O-CB 3.22Å; S254-R258 PolarHBondContact O-N 3.39Å; R258-S261 PolarHBondContact O-N 3.09Å; R258-D262 WeakPolarHBondContact O-CB 3.34Å; R258-D262 PolarHBondContact O-N 2.79Å; R258-Y288 WeakPolarHBondContact CD-OH 3.13Å; R258-Y288 WeakPolarHBondContact CG-OH 3.39Å
259	A	98.2	Very high	94.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-47.9	177.5	0	0	0	0	0	112	W255 F256 S261 D262 V263 V280 D283 V284 Y288	W255-A259 WeakPolarHBondContact O-CB 3.47Å; W255-A259 PolarHBondContact O-N 2.76Å; F256-A259 PolarHBondContact O-N 3.5Å; A259-S261 PolarHBondContact O-N 2.78Å; A259-D262 PolarHBondContact O-N 3.31Å; A259-V263 WeakPolarHBondContact O-CB 3.31Å; A259-V263 VanDerWaalsContact O-CG2 3.26Å; A259-V263 WeakPolarHBondContact O-CG2 3.37Å; A259-V263 PolarHBondContact O-N 2.87Å; A259-V280 HydrophobicContact CB-CG1 4.11Å; A259-D283 HydrophobicContact CB-CB 3.96Å; A259-V284 HydrophobicContact CB-CG2 3.6Å; A259-Y288 HydrophobicContact CB-CE2 4.3Å
260	L	98.7	Very high	95.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-50	176.6	177.9	63.3	0	0	0	111.5	I107 F193 F256 V263 L264 M277 V280	I107-L260 HydrophobicContact CD1-CD2 4.22Å; F193-L260 HydrophobicContact CB-CD2 4.08Å; F193-L260 HydrophobicContact CD1-CD1 4.07Å; F193-L260 HydrophobicContact CD1-CD2 3.57Å; F193-L260 HydrophobicContact CD1-CG 4.49Å; F193-L260 HydrophobicContact CE1-CD1 3.97Å; F193-L260 HydrophobicContact CE1-CD2 4.24Å; F193-L260 HydrophobicContact CG-CD2 3.96Å; F256-L260 HydrophobicContact CE1-CD2 4.22Å; F256-L260 HydrophobicContact CZ-CD2 4.15Å; F256-L260 WeakPolarHBondContact O-CB 3.35Å; F256-L260 PolarHBondContact O-N 3.1Å; L260-V263 PolarHBondContact O-N 3.35Å; L260-L264 HydrophobicContact CD1-CD1 3.76Å; L260-L264 HydrophobicContact CD1-CG 4.01Å; L260-L264 HydrophobicContact CG-CD1 3.79Å; L260-L264 HydrophobicContact CG-CG 4.41Å; L260-L264 VanDerWaalsContact O-CB 3.31Å; L260-L264 WeakPolarHBondContact O-CB 3.45Å; L260-L264 WeakPolarHBondContact O-CG 3.38Å; L260-L264 PolarHBondContact O-N 3.29Å; L260-M277 HydrophobicContact CD1-SD 3.98Å; L260-V280 HydrophobicContact CB-CG1 4.44Å; L260-V280 HydrophobicContact CB-CG2 4.37Å; L260-V280 HydrophobicContact CD1-CG2 4.08Å
261	S	98.4	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-43.1	-177.7	-58.1	0	0	0	0	111.7	N106 I257 R258 A259 L264 L265	N106-S261 WeakPolarHBondContact CB-OG 3.4Å; I257-S261 WeakPolarHBondContact O-CB 3.46Å; I257-S261 PolarHBondContact O-N 2.88Å; I257-S261 PolarHBondContact O-OG 2.77Å; R258-S261 PolarHBondContact O-N 3.09Å; A259-S261 PolarHBondContact O-N 2.78Å; S261-L264 PolarHBondContact O-N 3.06Å; S261-L265 WeakPolarHBondContact O-CB 3.36Å; S261-L265 WeakPolarHBondContact O-CD1 3.15Å; S261-L265 WeakPolarHBondContact O-CG 3.44Å; S261-L265 PolarHBondContact O-N 3.25Å
262	D	98.3	Very high	96.5	Very high	60 Å²	60	30.5 Å²	30.5	32%	0.321	15%	0.147	S	C	.	.	H	α-helix	trans	-66.2	-41.4	178.6	-95.8	20.7	0	0	0	112.6	R258 A259 L265 R266	R258-D262 WeakPolarHBondContact O-CB 3.34Å; R258-D262 PolarHBondContact O-N 2.79Å; A259-D262 PolarHBondContact O-N 3.31Å; D262-L265 PolarHBondContact O-N 2.68Å; D262-R266 WeakPolarHBondContact O-CB 3.34Å; D262-R266 VanDerWaalsContact O-CG 3.3Å; D262-R266 WeakPolarHBondContact O-CG 3.44Å; D262-R266 PolarHBondContact O-N 3.45Å; D262-R266 PolarHBondContact O-NE 3.07Å
263	V	98.6	Very high	97	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.7	-41.7	176.8	178.2	0	0	0	0	110.8	A259 L260 L265 R266 Y267 I276 R279 V280 D283	A259-V263 WeakPolarHBondContact O-CB 3.31Å; A259-V263 VanDerWaalsContact O-CG2 3.26Å; A259-V263 WeakPolarHBondContact O-CG2 3.37Å; A259-V263 PolarHBondContact O-N 2.87Å; L260-V263 PolarHBondContact O-N 3.35Å; V263-L265 VanDerWaalsContact C-N 3.34Å; V263-L265 PolarHBondContact O-N 3.21Å; V263-R266 PolarHBondContact O-N 3.26Å; V263-Y267 HydrophobicContact CG1-CD2 3.98Å; V263-Y267 WeakPolarHBondContact O-CA 3.32Å; V263-Y267 WeakPolarHBondContact O-CB 3.36Å; V263-Y267 PolarHBondContact O-N 2.92Å; V263-I276 HydrophobicContact CG1-CB 4.36Å; V263-I276 HydrophobicContact CG1-CG2 3.82Å; V263-R279 HydrophobicContact CG1-CB 3.73Å; V263-R279 HydrophobicContact CG2-CB 4.15Å; V263-V280 HydrophobicContact CB-CG2 3.86Å; V263-V280 HydrophobicContact CG1-CG2 4.18Å; V263-V280 HydrophobicContact CG2-CG2 3.93Å; V263-D283 VanDerWaalsContact CG2-OD2 3.29Å; V263-D283 WeakPolarHBondContact CG2-OD2 3.37Å
264	L	98.4	Very high	97.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-39.9	175.7	-73.4	171.8	0	0	0	111.9	A110 F111 L114 L260 S261 G268 I276	A110-L264 HydrophobicContact CB-CB 4.19Å; A110-L264 HydrophobicContact CB-CD1 4.31Å; F111-L264 HydrophobicContact CD2-CD1 4.35Å; F111-L264 HydrophobicContact CE2-CD1 3.78Å; F111-L264 HydrophobicContact CZ-CD1 4.06Å; L114-L264 HydrophobicContact CD1-CB 4.23Å; L114-L264 HydrophobicContact CD1-CD2 3.72Å; L114-L264 HydrophobicContact CD1-CG 4.4Å; L260-L264 HydrophobicContact CD1-CD1 3.76Å; L260-L264 HydrophobicContact CD1-CG 4.01Å; L260-L264 HydrophobicContact CG-CD1 3.79Å; L260-L264 HydrophobicContact CG-CG 4.41Å; L260-L264 VanDerWaalsContact O-CB 3.31Å; L260-L264 WeakPolarHBondContact O-CB 3.45Å; L260-L264 WeakPolarHBondContact O-CG 3.38Å; L260-L264 PolarHBondContact O-N 3.29Å; S261-L264 PolarHBondContact O-N 3.06Å; L264-G268 WeakPolarHBondContact O-CA 3.3Å; L264-G268 PolarHBondContact O-N 3.3Å; L264-I276 HydrophobicContact CD2-CD1 4.2Å; L264-I276 HydrophobicContact CD2-CG2 3.84Å; L264-I276 HydrophobicContact CG-CG2 4.38Å
265	L	98	Very high	97.4	Very high	43 Å²	43	32.4 Å²	32.4	23%	0.225	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-40.2	177.4	-75.2	165.9	0	0	0	112.6	R109 A110 N113 S261 D262 V263	R109-L265 HydrophobicContact CG-CD1 4.28Å; R109-L265 HydrophobicContact CG-CD2 4.22Å; R109-L265 VanDerWaalsContact NH1-CD1 3.27Å; A110-L265 HydrophobicContact CB-CG 4.16Å; N113-L265 HydrophobicContact CB-CD2 3.65Å; S261-L265 WeakPolarHBondContact O-CB 3.36Å; S261-L265 WeakPolarHBondContact O-CD1 3.15Å; S261-L265 WeakPolarHBondContact O-CG 3.44Å; S261-L265 PolarHBondContact O-N 3.25Å; D262-L265 PolarHBondContact O-N 2.68Å; V263-L265 VanDerWaalsContact C-N 3.34Å; V263-L265 PolarHBondContact O-N 3.21Å
266	R	97.5	Very high	97.6	Very high	123 Å²	123	32.1 Å²	32.1	46%	0.464	16%	0.159	S	C	.	.	H	α-helix	trans	-76.4	-37.9	-179.8	-71.7	-177.4	-69.3	164.4	-1.2	113.1	D262 V263 D283	D262-R266 WeakPolarHBondContact O-CB 3.34Å; D262-R266 VanDerWaalsContact O-CG 3.3Å; D262-R266 WeakPolarHBondContact O-CG 3.44Å; D262-R266 PolarHBondContact O-N 3.45Å; D262-R266 PolarHBondContact O-NE 3.07Å; V263-R266 PolarHBondContact O-N 3.26Å; R266-D283 IonicContact NH2-OD2 3.42Å; R266-D283 PolarHBondContact NH2-OD2 3.05Å
267	Y	97.7	Very high	97.6	Very high	72 Å²	72	32.1 Å²	32.1	28%	0.282	16%	0.159	S	C	.	.	H	α-helix	trans	-133.6	-2.8	-163.6	-52.9	-61.3	0	0	0	114.8	V263 N269 T270 L271	V263-Y267 HydrophobicContact CG1-CD2 3.98Å; V263-Y267 WeakPolarHBondContact O-CA 3.32Å; V263-Y267 WeakPolarHBondContact O-CB 3.36Å; V263-Y267 PolarHBondContact O-N 2.92Å; Y267-N269 PolarHBondContact O-N 3.33Å; Y267-N269 VanDerWaalsContact O-N 3.09Å; Y267-T270 PolarHBondContact O-N 2.89Å; Y267-T270 PolarHBondContact O-OG1 3.42Å; Y267-L271 HydrophobicContact CG-CD1 4.07Å; Y267-L271 PolarHBondContact O-N 3.26Å
268	G	95.9	Very high	97.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.5	-176.6	0	0	0	0	0	113.9	L264 F316	L264-G268 WeakPolarHBondContact O-CA 3.3Å; L264-G268 PolarHBondContact O-N 3.3Å; G268-F316 WeakPolarHBondContact O-CB 3.43Å
269	N	94.8	Very high	97.6	Very high	43 Å²	43	37.6 Å²	37.6	23%	0.23	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.5	176.4	-58.1	118.4	0	0	0	114.7	Y267 F316 P318	Y267-N269 PolarHBondContact O-N 3.33Å; Y267-N269 VanDerWaalsContact O-N 3.09Å; N269-F316 WeakPolarHBondContact CA-O 2.87Å; N269-F316 PolarHBondContact ND2-O 3.39Å; N269-P318 HydrophobicContact CB-CG 4.1Å
270	T	94.4	Very high	97.7	Very high	99 Å²	99	37.6 Å²	37.6	61%	0.607	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-20.9	-170.7	55.3	0	0	0	0	114.5	Y267	Y267-T270 PolarHBondContact O-N 2.89Å; Y267-T270 PolarHBondContact O-OG1 3.42Å
271	L	96.9	Very high	97.6	Very high	32 Å²	32	39.1 Å²	39.1	17%	0.168	20%	0.198	C	C	.	.	S	Bend	trans	-113	156.7	177.9	-63	-179.5	0	0	0	112	Y267 I276 R279	Y267-L271 HydrophobicContact CG-CD1 4.07Å; Y267-L271 PolarHBondContact O-N 3.26Å; L271-I276 HydrophobicContact CB-CD1 4.45Å; L271-I276 HydrophobicContact CB-CG1 3.83Å; L271-I276 HydrophobicContact CD1-CG1 4.47Å; L271-R279 VanDerWaalsContact CD1-NE 3.3Å
272	D	96.8	Very high	97.6	Very high	30 Å²	30	44.7 Å²	44.7	16%	0.16	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-73	156.7	165.3	78.8	-81.4	0	0	0	111.5	L274 S275 I276 H313 V314 I315	D272-L274 VanDerWaalsContact C-N 3.27Å; D272-L274 PolarHBondContact O-N 3.44Å; D272-L274 WeakPolarHBondContact OD2-CB 3.31Å; D272-L274 PolarHBondContact OD2-N 3.33Å; D272-S275 WeakPolarHBondContact O-CB 3.33Å; D272-S275 PolarHBondContact O-N 3.29Å; D272-S275 VanDerWaalsContact O-N 3.1Å; D272-S275 WeakPolarHBondContact OD1-CB 3.2Å; D272-S275 PolarHBondContact OD1-OG 3.47Å; D272-S275 PolarHBondContact OD2-N 3.45Å; D272-I276 WeakPolarHBondContact O-CG1 3.22Å; D272-I276 PolarHBondContact O-N 2.97Å; D272-H313 HydrophobicContact CB-CB 4.14Å; D272-H313 IonicContact OD2-ND1 2.69Å; D272-V314 CarbonylContact C-O 3.58Å; D272-V314 WeakPolarHBondContact CA-O 3.25Å; D272-I315 HydrophobicContact CB-CG1 3.99Å
273	L	97.9	Very high	97.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-34.9	-175.5	-178.2	63.1	0	0	0	113.9	L191 F193 F235 I276 M277 L310 V314 F316	L191-L273 HydrophobicContact CD1-CD2 4.11Å; L191-L273 HydrophobicContact CD2-CD2 3.56Å; L191-L273 HydrophobicContact CG-CD2 4.4Å; F193-L273 HydrophobicContact CE1-CD1 4.43Å; F193-L273 HydrophobicContact CZ-CD1 4.14Å; F235-L273 HydrophobicContact CB-CD2 4.39Å; F235-L273 HydrophobicContact CD1-CD2 3.72Å; F235-L273 HydrophobicContact CD1-CG 4.45Å; F235-L273 HydrophobicContact CD2-CD2 4.26Å; F235-L273 HydrophobicContact CE1-CD2 4.09Å; F235-L273 HydrophobicContact CE1-CG 4.35Å; F235-L273 HydrophobicContact CG-CD2 3.83Å; L273-I276 WeakPolarHBondContact O-CB 3.34Å; L273-I276 PolarHBondContact O-N 3.37Å; L273-M277 HydrophobicContact CD1-CG 4.36Å; L273-M277 WeakPolarHBondContact O-CB 3.5Å; L273-M277 VanDerWaalsContact O-CG 3.24Å; L273-M277 WeakPolarHBondContact O-CG 3.33Å; L273-M277 PolarHBondContact O-N 3.22Å; L273-L310 HydrophobicContact CD2-CD1 4.24Å; L273-V314 HydrophobicContact CB-CB 3.85Å; L273-V314 HydrophobicContact CB-CG1 4.34Å; L273-V314 HydrophobicContact CD2-CB 4.33Å; L273-V314 HydrophobicContact CD2-CG1 4.48Å; L273-V314 PolarHBondContact N-O 2.83Å; L273-F316 HydrophobicContact CD1-CE2 4.5Å
274	L	98.1	Very high	97.5	Very high	61 Å²	61	43 Å²	43	32%	0.319	21%	0.211	S	C	.	.	H	α-helix	trans	-71.6	-41.3	178.9	-57.7	-176.6	0	0	0	110.2	F235 D272 I276 M277 T278 F306	F235-L274 HydrophobicContact CD2-CD2 4.05Å; F235-L274 HydrophobicContact CE2-CD2 3.64Å; D272-L274 VanDerWaalsContact C-N 3.27Å; D272-L274 PolarHBondContact O-N 3.44Å; D272-L274 WeakPolarHBondContact OD2-CB 3.31Å; D272-L274 PolarHBondContact OD2-N 3.33Å; L274-I276 VanDerWaalsContact C-N 3.33Å; L274-I276 PolarHBondContact O-N 3.06Å; L274-M277 PolarHBondContact O-N 3.44Å; L274-T278 PolarHBondContact O-N 3.31Å; L274-T278 PolarHBondContact O-OG1 2.92Å; L274-T278 VanDerWaalsContact O-OG1 3.07Å; L274-F306 HydrophobicContact CD2-CD2 4.4Å; L274-F306 HydrophobicContact CD2-CE2 3.93Å
275	S	98.2	Very high	97.2	Very high	45 Å²	45	43.8 Å²	43.8	32%	0.315	22%	0.217	S	C	.	.	H	α-helix	trans	-61.5	-38.9	171.9	-65.9	0	0	0	0	112.8	D272 M277 T278 R279	D272-S275 WeakPolarHBondContact O-CB 3.33Å; D272-S275 PolarHBondContact O-N 3.29Å; D272-S275 VanDerWaalsContact O-N 3.1Å; D272-S275 WeakPolarHBondContact OD1-CB 3.2Å; D272-S275 PolarHBondContact OD1-OG 3.47Å; D272-S275 PolarHBondContact OD2-N 3.45Å; S275-M277 VanDerWaalsContact C-N 3.35Å; S275-T278 PolarHBondContact O-N 3.01Å; S275-R279 PolarHBondContact O-N 2.95Å; S275-R279 VanDerWaalsContact O-N 3.12Å
276	I	98.5	Very high	96.9	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.6	-50.4	171.9	-71.5	167	0	0	0	109.6	V263 L264 L271 D272 L273 L274 T278 R279 V280	V263-I276 HydrophobicContact CG1-CB 4.36Å; V263-I276 HydrophobicContact CG1-CG2 3.82Å; L264-I276 HydrophobicContact CD2-CD1 4.2Å; L264-I276 HydrophobicContact CD2-CG2 3.84Å; L264-I276 HydrophobicContact CG-CG2 4.38Å; L271-I276 HydrophobicContact CB-CD1 4.45Å; L271-I276 HydrophobicContact CB-CG1 3.83Å; L271-I276 HydrophobicContact CD1-CG1 4.47Å; D272-I276 WeakPolarHBondContact O-CG1 3.22Å; D272-I276 PolarHBondContact O-N 2.97Å; L273-I276 WeakPolarHBondContact O-CB 3.34Å; L273-I276 PolarHBondContact O-N 3.37Å; L274-I276 VanDerWaalsContact C-N 3.33Å; L274-I276 PolarHBondContact O-N 3.06Å; I276-T278 VanDerWaalsContact C-N 3.32Å; I276-T278 PolarHBondContact O-N 2.93Å; I276-R279 WeakPolarHBondContact O-CA 3.39Å; I276-R279 WeakPolarHBondContact O-CB 3.4Å; I276-R279 PolarHBondContact O-N 3.19Å; I276-V280 HydrophobicContact CG2-CG2 4.49Å; I276-V280 WeakPolarHBondContact O-CG2 3.22Å; I276-V280 PolarHBondContact O-N 3.27Å
277	M	98.5	Very high	96.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-32.3	-177.6	-70.2	-66.8	-43.4	0	0	113	F193 F235 A237 F256 L260 L273 L274 S275 R279 V280 N281 F306	F193-M277 HydrophobicContact CD1-SD 4.46Å; F193-M277 HydrophobicContact CE1-SD 4.03Å; F235-M277 HydrophobicContact CE1-CG 4.11Å; F235-M277 HydrophobicContact CE1-SD 4.35Å; F235-M277 HydrophobicContact CZ-CB 4.42Å; F235-M277 HydrophobicContact CZ-CG 3.61Å; F235-M277 HydrophobicContact CZ-SD 4.28Å; A237-M277 HydrophobicContact CB-CE 3.54Å; A237-M277 HydrophobicContact CB-SD 4.14Å; F256-M277 HydrophobicContact CE2-CE 4Å; F256-M277 HydrophobicContact CZ-CE 4.38Å; L260-M277 HydrophobicContact CD1-SD 3.98Å; L273-M277 HydrophobicContact CD1-CG 4.36Å; L273-M277 WeakPolarHBondContact O-CB 3.5Å; L273-M277 VanDerWaalsContact O-CG 3.24Å; L273-M277 WeakPolarHBondContact O-CG 3.33Å; L273-M277 PolarHBondContact O-N 3.22Å; L274-M277 PolarHBondContact O-N 3.44Å; S275-M277 VanDerWaalsContact C-N 3.35Å; M277-R279 VanDerWaalsContact C-N 3.32Å; M277-R279 PolarHBondContact O-N 3.49Å; M277-V280 PolarHBondContact O-N 3.38Å; M277-V280 HydrophobicContact SD-CG2 4.47Å; M277-N281 PolarHBondContact O-N 2.78Å; M277-N281 PolarHBondContact O-OD1 2.9Å; M277-F306 HydrophobicContact CB-CD1 3.85Å; M277-F306 HydrophobicContact CB-CE1 3.68Å; M277-F306 HydrophobicContact CB-CZ 4.29Å; M277-F306 HydrophobicContact CE-CD1 4.05Å
278	T	98.2	Very high	96.3	Very high	86 Å²	86	43.8 Å²	43.8	53%	0.528	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-39.9	169.4	-58.6	0	0	0	0	111.8	L274 S275 I276 N281 Y282	L274-T278 PolarHBondContact O-N 3.31Å; L274-T278 PolarHBondContact O-OG1 2.92Å; L274-T278 VanDerWaalsContact O-OG1 3.07Å; S275-T278 PolarHBondContact O-N 3.01Å; I276-T278 VanDerWaalsContact C-N 3.32Å; I276-T278 PolarHBondContact O-N 2.93Å; T278-N281 PolarHBondContact O-N 2.76Å; T278-Y282 PolarHBondContact O-N 2.94Å
279	R	98.3	Very high	96.1	Very high	93 Å²	93	49.1 Å²	49.1	35%	0.351	25%	0.247	S	C	.	.	H	α-helix	trans	-69.8	-35.3	174	-69.2	-175.5	-177.4	-169.4	2.1	112.6	V263 L271 S275 I276 M277 N281 Y282 D283	V263-R279 HydrophobicContact CG1-CB 3.73Å; V263-R279 HydrophobicContact CG2-CB 4.15Å; L271-R279 VanDerWaalsContact CD1-NE 3.3Å; S275-R279 PolarHBondContact O-N 2.95Å; S275-R279 VanDerWaalsContact O-N 3.12Å; I276-R279 WeakPolarHBondContact O-CA 3.39Å; I276-R279 WeakPolarHBondContact O-CB 3.4Å; I276-R279 PolarHBondContact O-N 3.19Å; M277-R279 VanDerWaalsContact C-N 3.32Å; M277-R279 PolarHBondContact O-N 3.49Å; R279-N281 VanDerWaalsContact C-N 3.33Å; R279-Y282 WeakPolarHBondContact O-CB 3.47Å; R279-Y282 PolarHBondContact O-N 3.33Å; R279-D283 PolarHBondContact O-N 3.49Å
280	V	98.6	Very high	95.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-43.4	171.9	176	0	0	0	0	110.6	F256 A259 L260 V263 I276 M277 Y282 D283 V284	F256-V280 HydrophobicContact CD2-CG1 3.87Å; F256-V280 HydrophobicContact CE2-CG1 3.88Å; A259-V280 HydrophobicContact CB-CG1 4.11Å; L260-V280 HydrophobicContact CB-CG1 4.44Å; L260-V280 HydrophobicContact CB-CG2 4.37Å; L260-V280 HydrophobicContact CD1-CG2 4.08Å; V263-V280 HydrophobicContact CB-CG2 3.86Å; V263-V280 HydrophobicContact CG1-CG2 4.18Å; V263-V280 HydrophobicContact CG2-CG2 3.93Å; I276-V280 HydrophobicContact CG2-CG2 4.49Å; I276-V280 WeakPolarHBondContact O-CG2 3.22Å; I276-V280 PolarHBondContact O-N 3.27Å; M277-V280 PolarHBondContact O-N 3.38Å; M277-V280 HydrophobicContact SD-CG2 4.47Å; V280-Y282 VanDerWaalsContact C-N 3.34Å; V280-Y282 PolarHBondContact O-N 2.93Å; V280-D283 PolarHBondContact O-N 3.08Å; V280-V284 HydrophobicContact CG1-CG2 4.39Å; V280-V284 WeakPolarHBondContact O-CG2 3.49Å; V280-V284 PolarHBondContact O-N 2.88Å
281	N	98.4	Very high	95.4	Very high	32 Å²	32	45 Å²	45	17%	0.171	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-45.2	175	-73.5	7.5	0	0	0	111.1	M277 T278 R279 V284 A285 M303 P304	M277-N281 PolarHBondContact O-N 2.78Å; M277-N281 PolarHBondContact O-OD1 2.9Å; T278-N281 PolarHBondContact O-N 2.76Å; R279-N281 VanDerWaalsContact C-N 3.33Å; N281-V284 PolarHBondContact O-N 2.91Å; N281-A285 WeakPolarHBondContact O-CB 3.18Å; N281-A285 PolarHBondContact O-N 3.01Å; N281-M303 HydrophobicContact CB-SD 4.05Å; N281-P304 WeakPolarHBondContact OD1-CB 3.44Å; N281-P304 PolarHBondContact OD1-O 3.17Å
282	Y	97.2	Very high	94.8	Very high	117 Å²	117	44.2 Å²	44.2	46%	0.459	22%	0.221	S	C	.	.	H	α-helix	trans	-56.9	-54.9	174.7	-179.5	-82.3	0	0	0	111.1	T278 R279 V280 V284 A285 F286	T278-Y282 PolarHBondContact O-N 2.94Å; R279-Y282 WeakPolarHBondContact O-CB 3.47Å; R279-Y282 PolarHBondContact O-N 3.33Å; V280-Y282 VanDerWaalsContact C-N 3.34Å; V280-Y282 PolarHBondContact O-N 2.93Å; Y282-V284 VanDerWaalsContact C-N 3.34Å; Y282-V284 PolarHBondContact O-N 3.28Å; Y282-A285 PolarHBondContact O-N 3.28Å; Y282-F286 HydrophobicContact CD1-CD2 4.27Å; Y282-F286 AromaticContact CD2-CD2 3.45Å; Y282-F286 HydrophobicContact CD2-CD2 3.45Å; Y282-F286 VanDerWaalsContact CD2-CD2 3.45Å; Y282-F286 AromaticContact CD2-CE2 3.57Å; Y282-F286 HydrophobicContact CD2-CE2 3.57Å; Y282-F286 HydrophobicContact CD2-CG 4.44Å; Y282-F286 HydrophobicContact CE1-CB 4.32Å; Y282-F286 HydrophobicContact CE1-CD2 4.32Å; Y282-F286 AromaticContact CE2-CD2 3.54Å; Y282-F286 HydrophobicContact CE2-CD2 3.54Å; Y282-F286 AromaticContact CE2-CE2 3.71Å; Y282-F286 HydrophobicContact CE2-CE2 3.71Å; Y282-F286 HydrophobicContact CE2-CG 4.15Å; Y282-F286 HydrophobicContact CE2-CZ 4.43Å; Y282-F286 AromaticContact CG-CD2 3.84Å; Y282-F286 HydrophobicContact CG-CD2 3.84Å; Y282-F286 HydrophobicContact CG-CE2 4.33Å; Y282-F286 AromaticContact CZ-CD2 3.97Å; Y282-F286 WeakPolarHBondContact O-CB 3.39Å; Y282-F286 WeakPolarHBondContact O-CD2 3.45Å; Y282-F286 PolarHBondContact O-N 3.06Å
283	D	97.9	Very high	94.2	Very high	25 Å²	25	47.3 Å²	47.3	13%	0.134	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-48.2	-177.9	-75	5.9	0	0	0	110.5	A259 V263 R266 R279 V280 A285 E287 Y288	A259-D283 HydrophobicContact CB-CB 3.96Å; V263-D283 VanDerWaalsContact CG2-OD2 3.29Å; V263-D283 WeakPolarHBondContact CG2-OD2 3.37Å; R266-D283 IonicContact NH2-OD2 3.42Å; R266-D283 PolarHBondContact NH2-OD2 3.05Å; R279-D283 PolarHBondContact O-N 3.49Å; V280-D283 PolarHBondContact O-N 3.08Å; D283-A285 PolarHBondContact O-N 3.08Å; D283-E287 WeakPolarHBondContact O-CA 3.48Å; D283-E287 WeakPolarHBondContact O-CB 3.01Å; D283-E287 PolarHBondContact O-N 2.93Å; D283-Y288 WeakPolarHBondContact O-CD2 3.32Å
284	V	96.9	Very high	93.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-40.2	179.8	-178.9	0	0	0	0	112.4	A259 V280 N281 Y282 Q302 P304	A259-V284 HydrophobicContact CB-CG2 3.6Å; V280-V284 HydrophobicContact CG1-CG2 4.39Å; V280-V284 WeakPolarHBondContact O-CG2 3.49Å; V280-V284 PolarHBondContact O-N 2.88Å; N281-V284 PolarHBondContact O-N 2.91Å; Y282-V284 VanDerWaalsContact C-N 3.34Å; Y282-V284 PolarHBondContact O-N 3.28Å; V284-Q302 HydrophobicContact CG1-CB 3.9Å; V284-Q302 HydrophobicContact CG1-CG 4.06Å; V284-Q302 WeakPolarHBondContact CG1-O 3.47Å; V284-P304 HydrophobicContact CB-CG 3.74Å; V284-P304 HydrophobicContact CG1-CG 3.89Å; V284-P304 HydrophobicContact CG2-CG 3.71Å
285	A	92.1	Very high	92.9	Very high	18 Å²	18	51.2 Å²	51.2	15%	0.149	28%	0.281	C	S	.	.	H	α-helix	trans	-70.4	-42.3	-177.7	0	0	0	0	0	112.9	N281 Y282 D283 K301 M303	N281-A285 WeakPolarHBondContact O-CB 3.18Å; N281-A285 PolarHBondContact O-N 3.01Å; Y282-A285 PolarHBondContact O-N 3.28Å; D283-A285 PolarHBondContact O-N 3.08Å; A285-K301 WeakPolarHBondContact O-CE 3.5Å; A285-K301 PolarHBondContact O-NZ 2.89Å; A285-M303 HydrophobicContact CB-CE 3.42Å; A285-M303 VanDerWaalsContact CB-CE 3.42Å; A285-M303 HydrophobicContact CB-SD 4.48Å
286	F	91.4	Very high	92.3	Very high	90 Å²	90	52.1 Å²	52.1	40%	0.395	29%	0.287	S	S	.	.	H	α-helix	trans	-96.5	-34	-171.1	-70.4	-80.7	0	0	0	113	V208 D210 Y282	V208-F286 HydrophobicContact CG2-CE1 4.07Å; V208-F286 HydrophobicContact CG2-CZ 4.32Å; D210-F286 WeakPolarHBondContact OD2-CZ 3.39Å; Y282-F286 HydrophobicContact CD1-CD2 4.27Å; Y282-F286 AromaticContact CD2-CD2 3.45Å; Y282-F286 HydrophobicContact CD2-CD2 3.45Å; Y282-F286 VanDerWaalsContact CD2-CD2 3.45Å; Y282-F286 AromaticContact CD2-CE2 3.57Å; Y282-F286 HydrophobicContact CD2-CE2 3.57Å; Y282-F286 HydrophobicContact CD2-CG 4.44Å; Y282-F286 HydrophobicContact CE1-CB 4.32Å; Y282-F286 HydrophobicContact CE1-CD2 4.32Å; Y282-F286 AromaticContact CE2-CD2 3.54Å; Y282-F286 HydrophobicContact CE2-CD2 3.54Å; Y282-F286 AromaticContact CE2-CE2 3.71Å; Y282-F286 HydrophobicContact CE2-CE2 3.71Å; Y282-F286 HydrophobicContact CE2-CG 4.15Å; Y282-F286 HydrophobicContact CE2-CZ 4.43Å; Y282-F286 AromaticContact CG-CD2 3.84Å; Y282-F286 HydrophobicContact CG-CD2 3.84Å; Y282-F286 HydrophobicContact CG-CE2 4.33Å; Y282-F286 AromaticContact CZ-CD2 3.97Å; Y282-F286 WeakPolarHBondContact O-CB 3.39Å; Y282-F286 WeakPolarHBondContact O-CD2 3.45Å; Y282-F286 PolarHBondContact O-N 3.06Å
287	E	92.1	Very high	91.7	Very high	119 Å²	119	53.6 Å²	53.6	56%	0.556	29%	0.294	S	S	*	.	H	α-helix	trans	-99.5	-8.9	-169.7	-52.2	-60.2	150.4	0	0	114.5	D283	D283-E287 WeakPolarHBondContact O-CA 3.48Å; D283-E287 WeakPolarHBondContact O-CB 3.01Å; D283-E287 PolarHBondContact O-N 2.93Å
288	Y	91.4	Very high	91.3	Very high	28 Å²	28	56.1 Å²	56.1	11%	0.11	31%	0.31	C	S	.	.			trans	-120.1	134.7	-177.5	-61.2	-100.4	0	0	0	112.3	W255 R258 A259 D283 K301	W255-Y288 HydrophobicContact CB-CD1 3.61Å; W255-Y288 HydrophobicContact CB-CE1 3.88Å; W255-Y288 HydrophobicContact CB-CG 3.98Å; W255-Y288 AromaticContact CD1-CD1 3.44Å; W255-Y288 VanDerWaalsContact CD1-CD1 3.44Å; W255-Y288 AromaticContact CD1-CE1 3.89Å; W255-Y288 AromaticContact CD2-CD1 3.7Å; W255-Y288 HydrophobicContact CD2-CD1 3.7Å; W255-Y288 AromaticContact CD2-CG 3.93Å; W255-Y288 HydrophobicContact CD2-CG 3.93Å; W255-Y288 VanDerWaalsContact CE3-CB 3.45Å; W255-Y288 HydrophobicContact CE3-CD1 4.4Å; W255-Y288 HydrophobicContact CE3-CG 4.17Å; W255-Y288 AromaticContact CG-CD1 3.3Å; W255-Y288 HydrophobicContact CG-CD1 3.3Å; W255-Y288 AromaticContact CG-CE1 3.91Å; W255-Y288 HydrophobicContact CG-CE1 3.91Å; W255-Y288 AromaticContact CG-CG 3.87Å; W255-Y288 HydrophobicContact CG-CG 3.87Å; W255-Y288 AromaticContact NE1-CD1 3.88Å; R258-Y288 WeakPolarHBondContact CD-OH 3.13Å; R258-Y288 WeakPolarHBondContact CG-OH 3.39Å; A259-Y288 HydrophobicContact CB-CE2 4.3Å; D283-Y288 WeakPolarHBondContact O-CD2 3.32Å; Y288-K301 WeakPolarHBondContact O-CE 3.3Å; Y288-K301 PolarHBondContact O-NZ 3.02Å
289	E	90.8	Very high	90.7	Very high	113 Å²	113	53.4 Å²	53.4	53%	0.528	30%	0.299	S	S	.	.			trans	-147.7	141.5	173.4	-174.5	178.5	111.2	0	0	108.1	W255 K300 K301	W255-E289 VanDerWaalsContact CH2-C 3.44Å; E289-K300 WeakPolarHBondContact CA-O 3.5Å; E289-K301 HydrophobicContact CB-CD 4.45Å; E289-K301 HydrophobicContact CG-CD 4.32Å
290	S	90.5	Very high	90.4	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.			trans	-78.7	139.9	-174.7	63.1	0	0	0	0	111	W255 F297 G299 K300	W255-S290 VanDerWaalsContact CH2-N 3.26Å; S290-F297 VanDerWaalsContact CB-O 3.26Å; S290-F297 WeakPolarHBondContact CB-O 3.35Å; S290-F297 PolarHBondContact OG-O 3.46Å; S290-G299 PolarHBondContact O-N 3.06Å; S290-G299 PolarHBondContact OG-N 2.82Å; S290-K300 PolarHBondContact N-O 3.02Å; S290-K300 WeakPolarHBondContact OG-CA 3.23Å; S290-K300 VanDerWaalsContact OG-CB 3.25Å; S290-K300 WeakPolarHBondContact OG-CB 3.45Å; S290-K300 PolarHBondContact OG-N 3Å
291	T	85.3	Confident	90.1	Very high	55 Å²	55	52 Å²	52	34%	0.337	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-120.6	119.4	164.8	-48.7	0	0	0	0	107.3	S13 V14 V15	S13-T291 WeakPolarHBondContact O-CB 3.11Å; V14-T291 WeakPolarHBondContact CA-O 3.26Å; V15-T291 PolarHBondContact N-O 2.87Å
292	A	84.1	Confident	90	Very high	15 Å²	15	50.6 Å²	50.6	12%	0.124	29%	0.288	C	S	.	.			trans	-136	155.4	-176.7	0	0	0	0	0	110.5	F297	A292-F297 HydrophobicContact CB-CB 3.46Å; A292-F297 VanDerWaalsContact CB-CB 3.46Å
293	A	83.9	Confident	89.9	Confident	96 Å²	96	48.5 Å²	48.5	79%	0.793	28%	0.284	S	S	*	.	S	Bend	trans	-66.9	-42.4	175.3	0	0	0	0	0	110.9	P295	A293-P295 WeakPolarHBondContact O-CD 3.39Å
294	S	84.1	Confident	89.9	Confident	29 Å²	29	47.4 Å²	47.4	20%	0.203	28%	0.278	C	S	.	.	S	Bend	trans	-70.3	125.8	170.1	179.6	0	0	0	0	111.1	E17 S296 F297 C298	E17-S294 WeakPolarHBondContact OE1-CA 3.11Å; E17-S294 WeakPolarHBondContact OE1-CB 3.16Å; E17-S294 PolarHBondContact OE1-N 2.98Å; S294-S296 PolarHBondContact O-N 2.99Å; S294-S296 VanDerWaalsContact O-N 3.1Å; S294-S296 PolarHBondContact OG-N 3.29Å; S294-S296 PolarHBondContact OG-OG 2.98Å; S294-F297 PolarHBondContact O-N 2.65Å; S294-C298 PolarHBondContact O-N 3.17Å
295	P	84.3	Confident	89.9	Confident	115 Å²	115	48.1 Å²	48.1	75%	0.747	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-55.4	-30.5	175.4	-26.2	34.6	0	0	0	113.1	A293 F297 C298	A293-P295 WeakPolarHBondContact O-CD 3.39Å; P295-F297 VanDerWaalsContact C-N 3.26Å; P295-F297 PolarHBondContact O-N 2.85Å; P295-C298 PolarHBondContact O-N 3.19Å
296	S	86.6	Confident	90.1	Very high	63 Å²	63	50.4 Å²	50.4	44%	0.441	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-67.1	-24	-179.8	64.9	0	0	0	0	113.8	L202 S294 K300	L202-S296 WeakPolarHBondContact CD1-O 3.09Å; S294-S296 PolarHBondContact O-N 2.99Å; S294-S296 VanDerWaalsContact O-N 3.1Å; S294-S296 PolarHBondContact OG-N 3.29Å; S294-S296 PolarHBondContact OG-OG 2.98Å; S296-K300 WeakPolarHBondContact O-CE 3.46Å
297	F	86.1	Confident	90.4	Very high	32 Å²	32	50.2 Å²	50.2	14%	0.14	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-103.5	-1.7	178.7	-78.6	-92.7	0	0	0	113.1	E17 L202 F247 S290 A292 S294 P295	E17-F297 HydrophobicContact CG-CD2 3.94Å; E17-F297 HydrophobicContact CG-CE2 4.25Å; E17-F297 HydrophobicContact CG-CG 4.27Å; L202-F297 HydrophobicContact CD1-CD1 4.02Å; L202-F297 HydrophobicContact CD1-CE1 4.11Å; L202-F297 HydrophobicContact CD1-CG 4.23Å; L202-F297 HydrophobicContact CD1-CZ 4.4Å; L202-F297 HydrophobicContact CD2-CD1 4.04Å; L202-F297 HydrophobicContact CD2-CE1 3.91Å; F247-F297 HydrophobicContact CE1-CD1 4.48Å; S290-F297 VanDerWaalsContact CB-O 3.26Å; S290-F297 WeakPolarHBondContact CB-O 3.35Å; S290-F297 PolarHBondContact OG-O 3.46Å; A292-F297 HydrophobicContact CB-CB 3.46Å; A292-F297 VanDerWaalsContact CB-CB 3.46Å; S294-F297 PolarHBondContact O-N 2.65Å; P295-F297 VanDerWaalsContact C-N 3.26Å; P295-F297 PolarHBondContact O-N 2.85Å
298	C	88.3	Confident	90.6	Very high	52 Å²	52	46.8 Å²	46.8	35%	0.351	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	147.4	-179.3	-162.7	0	0	0	0	111	S294 P295 K300	S294-C298 PolarHBondContact O-N 3.17Å; P295-C298 PolarHBondContact O-N 3.19Å; C298-K300 VanDerWaalsContact C-N 3.31Å; C298-K300 PolarHBondContact O-N 2.73Å
299	G	87	Confident	90.9	Very high	29 Å²	29	48.2 Å²	48.2	30%	0.299	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	21.5	176.5	0	0	0	0	0	114.8	S290	S290-G299 PolarHBondContact O-N 3.06Å; S290-G299 PolarHBondContact OG-N 2.82Å
300	K	91.7	Very high	91.1	Very high	23 Å²	23	44.1 Å²	44.1	10%	0.1	28%	0.278	C	S	.	.			trans	-93.7	152.3	-176.5	-52.8	-59.2	-176.5	175.9	0	112.3	L202 D203 D204 F247 E289 S290 S296 C298	L202-K300 HydrophobicContact CB-CD 3.93Å; L202-K300 HydrophobicContact CB-CG 4.13Å; D203-K300 CarbonylContact O-C 3.6Å; D203-K300 VanDerWaalsContact O-CA 3.24Å; D203-K300 WeakPolarHBondContact O-CA 3.34Å; D203-K300 WeakPolarHBondContact O-CB 3.49Å; D204-K300 IonicContact OD1-NZ 3.52Å; D204-K300 PolarHBondContact OD1-NZ 3.34Å; D204-K300 IonicContact OD2-NZ 2.69Å; F247-K300 HydrophobicContact CE1-CB 4.37Å; F247-K300 HydrophobicContact CE2-CB 4.04Å; F247-K300 HydrophobicContact CZ-CB 3.53Å; F247-K300 HydrophobicContact CZ-CG 4.15Å; E289-K300 WeakPolarHBondContact CA-O 3.5Å; S290-K300 PolarHBondContact N-O 3.02Å; S290-K300 WeakPolarHBondContact OG-CA 3.23Å; S290-K300 VanDerWaalsContact OG-CB 3.25Å; S290-K300 WeakPolarHBondContact OG-CB 3.45Å; S290-K300 PolarHBondContact OG-N 3Å; S296-K300 WeakPolarHBondContact O-CE 3.46Å; C298-K300 VanDerWaalsContact C-N 3.31Å; C298-K300 PolarHBondContact O-N 2.73Å
301	K	92.7	Very high	91.2	Very high	40 Å²	40	47.6 Å²	47.6	17%	0.174	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-109.7	168	-179.8	-56.5	-59.6	-66.8	-177.8	0	111.4	D203 A285 Y288 E289	D203-K301 HydrophobicContact CB-CB 4.42Å; D203-K301 PolarHBondContact O-N 3.2Å; A285-K301 WeakPolarHBondContact O-CE 3.5Å; A285-K301 PolarHBondContact O-NZ 2.89Å; Y288-K301 WeakPolarHBondContact O-CE 3.3Å; Y288-K301 PolarHBondContact O-NZ 3.02Å; E289-K301 HydrophobicContact CB-CD 4.45Å; E289-K301 HydrophobicContact CG-CD 4.32Å
302	Q	94.8	Very high	91.5	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.019	30%	0.3	C	S	.	.			trans	-141.7	143.6	175.9	-175.1	179.3	-53.9	0	0	108.9	A239 V240 F247 W255 V284	A239-Q302 PolarHBondContact O-NE2 3.47Å; V240-Q302 HydrophobicContact CB-CG 4.24Å; V240-Q302 HydrophobicContact CG2-CG 3.93Å; F247-Q302 HydrophobicContact CD2-CB 4.23Å; W255-Q302 HydrophobicContact CE3-CB 3.87Å; W255-Q302 HydrophobicContact CZ3-CB 3.93Å; V284-Q302 HydrophobicContact CG1-CB 3.9Å; V284-Q302 HydrophobicContact CG1-CG 4.06Å; V284-Q302 WeakPolarHBondContact CG1-O 3.47Å
303	M	96.1	Very high	92	Very high	72 Å²	72	52.3 Å²	52.3	36%	0.355	31%	0.314	S	S	.	.			trans	-130.5	112.3	172.4	-178.7	57.6	66.8	0	0	110	V240 Q241 N281 A285	V240-M303 CarbonylContact C-O 3.45Å; V240-M303 VanDerWaalsContact CA-O 3.29Å; V240-M303 WeakPolarHBondContact CA-O 3.43Å; Q241-M303 PolarHBondContact N-O 3.46Å; N281-M303 HydrophobicContact CB-SD 4.05Å; A285-M303 HydrophobicContact CB-CE 3.42Å; A285-M303 VanDerWaalsContact CB-CE 3.42Å; A285-M303 HydrophobicContact CB-SD 4.48Å
304	P	98	Very high	92.6	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.013	28%	0.276	C	S	.	.			trans	-63.1	153.7	170.3	-14.9	28.9	0	0	0	111	Y238 A239 F256 N281 V284	Y238-P304 WeakPolarHBondContact O-CA 3.45Å; Y238-P304 WeakPolarHBondContact O-CB 3.24Å; A239-P304 WeakPolarHBondContact O-CA 3.49Å; F256-P304 HydrophobicContact CD2-CB 3.79Å; F256-P304 HydrophobicContact CD2-CG 3.84Å; F256-P304 HydrophobicContact CE2-CB 3.95Å; F256-P304 HydrophobicContact CE2-CG 4.43Å; N281-P304 WeakPolarHBondContact OD1-CB 3.44Å; N281-P304 PolarHBondContact OD1-O 3.17Å; V284-P304 HydrophobicContact CB-CG 3.74Å; V284-P304 HydrophobicContact CG1-CG 3.89Å; V284-P304 HydrophobicContact CG2-CG 3.71Å
305	S	96.7	Very high	93.1	Very high	16 Å²	16	48.9 Å²	48.9	11%	0.112	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151	179.8	64	0	0	0	0	110	R198 Y238 V240 Q241	R198-S305 PolarHBondContact NH1-OG 3.09Å; Y238-S305 PolarHBondContact N-O 2.76Å; Y238-S305 PolarHBondContact O-N 2.72Å; V240-S305 PolarHBondContact O-OG 3.2Å; V240-S305 VanDerWaalsContact O-OG 3.12Å; Q241-S305 VanDerWaalsContact OE1-CB 3.24Å; Q241-S305 PolarHBondContact OE1-OG 3.01Å
306	F	97.1	Very high	93.7	Very high	65 Å²	65	43.6 Å²	43.6	29%	0.285	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	152.7	177.5	58.2	-95.7	0	0	0	112.2	F235 I236 A237 L274 M277	F235-F306 HydrophobicContact CE2-CB 3.9Å; F235-F306 AromaticContact CE2-CD2 3.57Å; F235-F306 HydrophobicContact CE2-CD2 3.57Å; F235-F306 HydrophobicContact CE2-CE2 4.3Å; F235-F306 AromaticContact CE2-CG 3.86Å; F235-F306 HydrophobicContact CE2-CG 3.86Å; F235-F306 HydrophobicContact CZ-CB 3.62Å; F235-F306 HydrophobicContact CZ-CD2 4.02Å; F235-F306 AromaticContact CZ-CG 3.81Å; F235-F306 HydrophobicContact CZ-CG 3.81Å; I236-F306 CarbonylContact O-C 3.5Å; I236-F306 WeakPolarHBondContact O-CA 3.46Å; I236-F306 WeakPolarHBondContact O-CB 3.45Å; A237-F306 HydrophobicContact CB-CB 4.07Å; L274-F306 HydrophobicContact CD2-CD2 4.4Å; L274-F306 HydrophobicContact CD2-CE2 3.93Å; M277-F306 HydrophobicContact CB-CD1 3.85Å; M277-F306 HydrophobicContact CB-CE1 3.68Å; M277-F306 HydrophobicContact CB-CZ 4.29Å; M277-F306 HydrophobicContact CE-CD1 4.05Å
307	V	96.8	Very high	94	Very high	87 Å²	87	43.2 Å²	43.2	53%	0.527	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.1	173.6	180	0	0	0	0	107.6	I236	I236-V307 PolarHBondContact N-O 3.02Å; I236-V307 PolarHBondContact O-N 2.91Å
308	S	97.4	Very high	94.2	Very high	46 Å²	46	46 Å²	46	32%	0.322	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.5	-178.1	-175.5	0	0	0	0	111	L310	S308-L310 WeakPolarHBondContact OG-CB 3.43Å; S308-L310 WeakPolarHBondContact OG-CG 3.46Å; S308-L310 PolarHBondContact OG-N 3.19Å
309	T	95.9	Very high	94.2	Very high	58 Å²	58	45.7 Å²	45.7	36%	0.356	25%	0.254	S	S	.	.			trans	-117.6	19.9	162.6	61.9	0	0	0	0	110.6	E231 D233 L234 T311	E231-T309 VanDerWaalsContact O-CB 3.28Å; E231-T309 WeakPolarHBondContact O-CB 3.49Å; E231-T309 PolarHBondContact O-OG1 3.39Å; D233-T309 PolarHBondContact N-O 2.82Å; L234-T309 WeakPolarHBondContact CB-OG1 3.23Å; L234-T309 PolarHBondContact N-OG1 3.24Å; L234-T309 VanDerWaalsContact N-OG1 3.08Å; L234-T309 PolarHBondContact O-N 2.88Å; L234-T309 PolarHBondContact O-OG1 2.79Å; T309-T311 PolarHBondContact O-N 2.95Å
310	L	95.8	Very high	93.5	Very high	28 Å²	28	53.8 Å²	53.8	15%	0.147	28%	0.281	C	S	.	.			trans	-57.4	133.2	170.9	-63.9	174.8	0	0	0	109.9	Y70 P189 L191 L234 F235 L273 S308 V314	Y70-L310 HydrophobicContact CE2-CB 4.19Å; Y70-L310 HydrophobicContact CE2-CD2 3.92Å; P189-L310 HydrophobicContact CB-CD2 4.09Å; L191-L310 HydrophobicContact CD2-CD2 4.39Å; L234-L310 PolarHBondContact O-N 3.47Å; F235-L310 HydrophobicContact CB-CD1 3.9Å; F235-L310 HydrophobicContact CB-CD2 4.15Å; F235-L310 HydrophobicContact CB-CG 3.98Å; F235-L310 HydrophobicContact CD2-CD1 3.94Å; F235-L310 HydrophobicContact CG-CD1 4.19Å; L273-L310 HydrophobicContact CD2-CD1 4.24Å; S308-L310 WeakPolarHBondContact OG-CB 3.43Å; S308-L310 WeakPolarHBondContact OG-CG 3.46Å; S308-L310 PolarHBondContact OG-N 3.19Å; L310-V314 HydrophobicContact CD1-CG2 3.84Å; L310-V314 HydrophobicContact CD2-CG2 4.09Å
311	T	91.8	Very high	91.9	Very high	72 Å²	72	58.6 Å²	58.6	44%	0.442	32%	0.315	S	S	.	.	S	Bend	trans	-94.9	-7.7	180	60.4	0	0	0	0	112.8	Y70 A232 D233 T309	Y70-T311 PolarHBondContact OH-N 2.55Å; Y70-T311 PolarHBondContact OH-OG1 2.56Å; A232-T311 HydrophobicContact CB-CG2 4.26Å; D233-T311 PolarHBondContact OD1-OG1 2.71Å; T309-T311 PolarHBondContact O-N 2.95Å
312	K	92.7	Very high	90	Very high	83 Å²	83	64.2 Å²	64.2	36%	0.361	34%	0.335	S	S	.	.	S	Bend	trans	-148.3	164.8	-178.4	-59.2	179.7	-171.2	173.7	0	110.5	S67 Y68 V69 Y70	S67-K312 WeakPolarHBondContact O-CE 3.45Å; Y68-K312 CarbonylContact O-C 3.55Å; Y68-K312 WeakPolarHBondContact O-CA 3.48Å; Y68-K312 WeakPolarHBondContact O-CB 3.42Å; V69-K312 WeakPolarHBondContact O-CD 3.26Å; Y70-K312 HydrophobicContact CD1-CB 4.29Å; Y70-K312 HydrophobicContact CD1-CD 4.2Å; Y70-K312 HydrophobicContact CD2-CB 3.54Å; Y70-K312 WeakPolarHBondContact CD2-O 3.16Å; Y70-K312 HydrophobicContact CE1-CB 4.31Å; Y70-K312 HydrophobicContact CE1-CD 4.43Å; Y70-K312 HydrophobicContact CE2-CB 3.61Å; Y70-K312 WeakPolarHBondContact CE2-O 3.1Å; Y70-K312 HydrophobicContact CG-CB 3.91Å; Y70-K312 HydrophobicContact CG-CD 4.4Å
313	H	95.2	Very high	87.7	Confident	87 Å²	87	69.3 Å²	69.3	40%	0.403	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-68.7	133.3	170.3	-60.4	-71.2	0	0	0	110.7	Y68 V69 Y70 D272	Y68-H313 WeakPolarHBondContact O-CB 3.34Å; Y68-H313 PolarHBondContact O-CD2 3.44Å; Y68-H313 PolarHBondContact O-N 3.41Å; V69-H313 WeakPolarHBondContact CA-O 2.84Å; V69-H313 HydrophobicContact CG2-CB 4.4Å; Y70-H313 PolarHBondContact N-O 2.84Å; D272-H313 HydrophobicContact CB-CB 4.14Å; D272-H313 IonicContact OD2-ND1 2.69Å
314	V	96.5	Very high	85.5	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.006	38%	0.38	C	S	.	.			trans	-98.9	116.3	173.3	179.6	0	0	0	0	107.6	Y70 P189 D272 L273 L310 F316	Y70-V314 HydrophobicContact CD2-CB 4.48Å; Y70-V314 HydrophobicContact CD2-CG2 3.46Å; Y70-V314 VanDerWaalsContact CD2-CG2 3.46Å; Y70-V314 HydrophobicContact CE2-CG2 3.78Å; Y70-V314 HydrophobicContact CG-CG2 4.47Å; P189-V314 HydrophobicContact CB-CG2 3.78Å; P189-V314 HydrophobicContact CG-CG1 4.44Å; P189-V314 HydrophobicContact CG-CG2 3.64Å; D272-V314 CarbonylContact C-O 3.58Å; D272-V314 WeakPolarHBondContact CA-O 3.25Å; L273-V314 HydrophobicContact CB-CB 3.85Å; L273-V314 HydrophobicContact CB-CG1 4.34Å; L273-V314 HydrophobicContact CD2-CB 4.33Å; L273-V314 HydrophobicContact CD2-CG1 4.48Å; L273-V314 PolarHBondContact N-O 2.83Å; L310-V314 HydrophobicContact CD1-CG2 3.84Å; L310-V314 HydrophobicContact CD2-CG2 4.09Å; V314-F316 HydrophobicContact CG1-CD1 4.33Å; V314-F316 HydrophobicContact CG1-CE1 3.53Å; V314-F316 HydrophobicContact CG1-CE2 3.93Å; V314-F316 HydrophobicContact CG1-CZ 3.3Å
315	I	94.6	Very high	83.2	Confident	52 Å²	52	74.9 Å²	74.9	27%	0.267	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-127.4	138.2	176.8	-51.9	172.1	0	0	0	107.1	V69 T72 D272 P317	V69-I315 HydrophobicContact CG1-CD1 4.02Å; V69-I315 HydrophobicContact CG1-CG1 4.31Å; V69-I315 HydrophobicContact CG2-CD1 4.41Å; T72-I315 WeakPolarHBondContact CB-O 3.1Å; T72-I315 VanDerWaalsContact CG2-O 3.31Å; T72-I315 WeakPolarHBondContact CG2-O 3.42Å; T72-I315 PolarHBondContact OG1-O 2.72Å; D272-I315 HydrophobicContact CB-CG1 3.99Å; I315-P317 WeakPolarHBondContact O-CD 3.35Å
316	F	95.6	Very high	80.8	Confident	3 Å²	3	83.3 Å²	83.3	1%	0.013	44%	0.441	C	S	.	.			trans	-109.3	67.5	-178.1	-51.7	-71	0	0	0	112.1	L114 F116 L191 G268 N269 L273 V314	L114-F316 HydrophobicContact CB-CB 4.44Å; L114-F316 HydrophobicContact CD1-CD2 3.96Å; L114-F316 HydrophobicContact CD1-CE2 4.41Å; L114-F316 HydrophobicContact CD1-CG 4.42Å; L114-F316 HydrophobicContact CD2-CB 4.23Å; F116-F316 HydrophobicContact CE2-CD1 4.14Å; F116-F316 AromaticContact CE2-CE1 3.9Å; F116-F316 HydrophobicContact CE2-CE1 3.9Å; F116-F316 HydrophobicContact CE2-CZ 4.35Å; F116-F316 HydrophobicContact CZ-CD1 4.43Å; F116-F316 AromaticContact CZ-CE1 3.82Å; F116-F316 HydrophobicContact CZ-CE1 3.82Å; F116-F316 HydrophobicContact CZ-CZ 4.3Å; L191-F316 HydrophobicContact CD1-CE1 4.33Å; L191-F316 HydrophobicContact CD1-CZ 3.7Å; G268-F316 WeakPolarHBondContact O-CB 3.43Å; N269-F316 WeakPolarHBondContact CA-O 2.87Å; N269-F316 PolarHBondContact ND2-O 3.39Å; L273-F316 HydrophobicContact CD1-CE2 4.5Å; V314-F316 HydrophobicContact CG1-CD1 4.33Å; V314-F316 HydrophobicContact CG1-CE1 3.53Å; V314-F316 HydrophobicContact CG1-CE2 3.93Å; V314-F316 HydrophobicContact CG1-CZ 3.3Å
317	P	92.6	Very high	78.2	Confident	55 Å²	55	88.1 Å²	88.1	36%	0.357	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.6	176.4	28.9	-34.4	0	0	0	109.7	T72 R77 I315 K319	T72-P317 WeakPolarHBondContact OG1-CD 3.48Å; R77-P317 PolarHBondContact NH2-O 3.29Å; I315-P317 WeakPolarHBondContact O-CD 3.35Å; P317-K319 PolarHBondContact O-N 2.91Å
318	P	91.4	Very high	75.4	Confident	91 Å²	91	95.7 Å²	95.7	59%	0.591	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-55	136.8	-177.8	-22.9	33.4	0	0	0	111.1	N269	N269-P318 HydrophobicContact CB-CG 4.1Å
319	K	87.7	Confident	74.3	Confident	45 Å²	45	98.2 Å²	98.2	20%	0.196	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-68.9	152.3	169.3	-67.1	-167.6	-180	-69.8	0	109.5	T72 G74 R77 D115 D145 P317	T72-K319 PolarHBondContact O-NZ 2.96Å; G74-K319 PolarHBondContact O-NZ 3.14Å; R77-K319 VanDerWaalsContact CA-CE 3.45Å; D115-K319 HydrophobicContact CB-CD 4.18Å; D115-K319 HydrophobicContact CB-CG 4.2Å; D115-K319 PolarHBondContact OD2-N 2.77Å; D145-K319 IonicContact OD2-NZ 2.76Å; D145-K319 PolarHBondContact OD2-NZ 3.18Å; P317-K319 PolarHBondContact O-N 2.91Å
320	K	72.7	Confident	73.1	Confident	199 Å²	199	100.3 Å²	100.3	87%	0.865	52%	0.518	S	S	*	.	S	Bend	trans	-41.4	146.5	-177.1	-77.1	-176.8	-178.8	178.5	0	112.2	R322	K320-R322 PolarHBondContact O-N 3.04Å
321	P	57.5	Low	71.9	Confident	125 Å²	125	104.3 Å²	104.3	81%	0.812	54%	0.539	S	S	*	.			trans	-52.6	125.5	-159.5	17.6	-31.3	0	0	0	112.2	N323	P321-N323 PolarHBondContact O-N 2.78Å; P321-N323 VanDerWaalsContact O-N 3.08Å
322	R	52.9	Low	70.7	Confident	157 Å²	157	106.2 Å²	106.2	59%	0.592	55%	0.545	S	S	*	.			trans	-50.7	116.8	172.8	-69.9	178.3	-179.9	171.9	-1.1	107.8	A112 D115 K320 P324	A112-R322 PolarHBondContact O-NH2 3.33Å; D115-R322 IonicContact OD1-CZ 3.09Å; D115-R322 IonicContact OD1-NE 3.83Å; D115-R322 PolarHBondContact OD1-NE 3.42Å; D115-R322 IonicContact OD1-NH2 2.56Å; D115-R322 PolarHBondContact OD1-NH2 3.44Å; K320-R322 PolarHBondContact O-N 3.04Å; R322-P324 WeakPolarHBondContact O-CD 3.46Å; R322-P324 VanDerWaalsContact O-N 3.09Å
323	N	46.8	Very low	69.3	Low	112 Å²	112	107.7 Å²	107.7	60%	0.599	56%	0.556	S	S	*	*			trans	-62.6	113.4	175.6	-162.4	-4.5	0	0	0	107.6	P321 S325 K326	P321-N323 PolarHBondContact O-N 2.78Å; P321-N323 VanDerWaalsContact O-N 3.08Å; N323-S325 VanDerWaalsContact CG-OG 3.26Å; N323-S325 PolarHBondContact ND2-OG 3.39Å; N323-S325 PolarHBondContact O-N 3.46Å; N323-S325 PolarHBondContact OD1-OG 3.43Å; N323-S325 VanDerWaalsContact OD1-OG 3.13Å; N323-K326 PolarHBondContact O-N 3.1Å; N323-K326 VanDerWaalsContact O-N 3.14Å
324	P	50.4	Low	67.6	Low	109 Å²	109	109.1 Å²	109.1	71%	0.708	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-59	-23.5	-173	-23.3	33.5	0	0	0	112.9	R322 K326 L327	R322-P324 WeakPolarHBondContact O-CD 3.46Å; R322-P324 VanDerWaalsContact O-N 3.09Å; P324-K326 PolarHBondContact O-N 3.33Å; P324-L327 PolarHBondContact O-N 3.13Å
325	S	50	Low	65.5	Low	82 Å²	82	116.8 Å²	116.8	57%	0.573	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-69.9	-6.9	-179.8	57.2	0	0	0	0	115.4	N323	N323-S325 VanDerWaalsContact CG-OG 3.26Å; N323-S325 PolarHBondContact ND2-OG 3.39Å; N323-S325 PolarHBondContact O-N 3.46Å; N323-S325 PolarHBondContact OD1-OG 3.43Å; N323-S325 VanDerWaalsContact OD1-OG 3.13Å
326	K	45.6	Very low	63.3	Low	193 Å²	193	121.8 Å²	121.8	84%	0.839	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-96	5.3	173.2	-93.2	-172.1	175.8	-176.2	0	114.3	N323 P324	N323-K326 PolarHBondContact O-N 3.1Å; N323-K326 VanDerWaalsContact O-N 3.14Å; P324-K326 PolarHBondContact O-N 3.33Å
327	L	42.4	Very low	60.6	Low	165 Å²	165	131.7 Å²	131.7	86%	0.864	68%	0.684	S	S	*	*			trans	-101.3	3.1	176.4	-143.4	79.5	0	0	0	113.8	P324	P324-L327 PolarHBondContact O-N 3.13Å
328	M	36.9	Very low	57.7	Low	247 Å²	247	138.6 Å²	138.6	100%	1.217	71%	0.714	S	S	*	*			trans	-97.6	0	170.7	-77.1	-171.4	159.3	0	0	111.1

Retrieved 328 of 328 residues in 117.9 ms (Link to these results)

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