G4VCP6_SCHMA Loading...

U3 small nucleolar RNA-associated protein 18 homolog

AlphaFold DB , UniProt , Accession G4VCP6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 442 aa.

Structure Viewer

Loading PAE data...

(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	37.3	Very low	36.1	Very low	242 Å²	242	148.3 Å²	148.3	100%	1.192	82%	0.821	S	S	*	*				0	99.1	0	-73.3	-175.7	-145	0	0	108.6
2	L	33	Very low	36.1	Very low	165 Å²	165	149 Å²	149	86%	0.864	82%	0.823	S	S	*	*			trans	-96	112.2	174.3	-83.6	147.1	0	0	0	107.9
3	K	31.2	Very low	35.9	Very low	210 Å²	210	151 Å²	151	91%	0.913	82%	0.818	S	S	*	*			trans	-79.5	117	176.9	-83.2	-178.2	173.6	179.3	0	108.9	G5	K3-G5 PolarHBondContact O-N 2.67Å
4	F	34.6	Very low	35.6	Very low	194 Å²	194	153 Å²	153	85%	0.851	82%	0.82	S	S	*	*			trans	-75	113.6	168.6	-72	-87.4	0	0	0	109.1
5	G	32.9	Very low	35.4	Very low	76 Å²	76	153 Å²	153	78%	0.784	82%	0.817	S	S	*	*			trans	-74.2	123.6	170.1	0	0	0	0	0	109.9	K3 A7	K3-G5 PolarHBondContact O-N 2.67Å; G5-A7 PolarHBondContact O-N 2.87Å
6	I	35.7	Very low	35.2	Very low	165 Å²	165	150.8 Å²	150.8	85%	0.846	81%	0.811	S	S	*	*			trans	-75.5	106.4	172.4	-61	163.5	0	0	0	106.5
7	A	36.8	Very low	35.2	Very low	91 Å²	91	148.6 Å²	148.6	75%	0.752	80%	0.804	S	S	*	*			trans	-72.7	128.1	171.7	0	0	0	0	0	109.4	G5	G5-A7 PolarHBondContact O-N 2.87Å
8	N	37.1	Very low	35	Very low	136 Å²	136	151.4 Å²	151.4	73%	0.727	81%	0.807	S	S	*	*			trans	-64.6	141.5	180	-103.2	-14.9	0	0	0	111.2	T10	N8-T10 VanDerWaalsContact C-N 3.32Å; N8-T10 PolarHBondContact O-N 3.37Å
9	P	41.4	Very low	34.9	Very low	121 Å²	121	149.7 Å²	149.7	79%	0.786	80%	0.803	S	S	*	*	S	Bend	trans	-84.7	13.9	-171.8	-8.2	27.5	0	0	0	115.8
10	T	38.8	Very low	34.8	Very low	104 Å²	104	148.1 Å²	148.1	64%	0.638	80%	0.801	S	S	*	*			trans	-109.2	14	-163.5	54.1	0	0	0	0	116.2	N8 D12	N8-T10 VanDerWaalsContact C-N 3.32Å; N8-T10 PolarHBondContact O-N 3.37Å; T10-D12 VanDerWaalsContact C-N 3.32Å; T10-D12 PolarHBondContact O-N 3.11Å
11	D	37.8	Very low	34.9	Very low	127 Å²	127	151.1 Å²	151.1	68%	0.679	81%	0.807	S	S	*	*			trans	-83	82.8	171.1	-76.1	-11.9	0	0	0	110	F13	D11-F13 HydrophobicContact CB-CD2 4.23Å; D11-F13 HydrophobicContact CB-CE2 3.7Å; D11-F13 HydrophobicContact CB-CZ 4.21Å; D11-F13 VanDerWaalsContact O-CD2 3.28Å; D11-F13 WeakPolarHBondContact O-CD2 3.43Å; D11-F13 PolarHBondContact O-N 3Å; D11-F13 VanDerWaalsContact O-N 3.11Å
12	D	36.6	Very low	34.8	Very low	157 Å²	157	144.8 Å²	144.8	84%	0.84	79%	0.786	S	S	*	*			trans	-66.6	97	164	-76	-32.8	0	0	0	108.6	T10 E14	T10-D12 VanDerWaalsContact C-N 3.32Å; T10-D12 PolarHBondContact O-N 3.11Å; D12-E14 PolarHBondContact O-N 3.06Å
13	F	33.2	Very low	34.8	Very low	175 Å²	175	142.6 Å²	142.6	77%	0.768	78%	0.784	S	S	*	*			trans	-75.9	104.3	173.6	-73.2	-85.7	0	0	0	110.2	D11 I15	D11-F13 HydrophobicContact CB-CD2 4.23Å; D11-F13 HydrophobicContact CB-CE2 3.7Å; D11-F13 HydrophobicContact CB-CZ 4.21Å; D11-F13 VanDerWaalsContact O-CD2 3.28Å; D11-F13 WeakPolarHBondContact O-CD2 3.43Å; D11-F13 PolarHBondContact O-N 3Å; D11-F13 VanDerWaalsContact O-N 3.11Å; F13-I15 PolarHBondContact O-N 3.37Å
14	E	32	Very low	35	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	78%	0.783	S	S	*	*			trans	-66.6	116.9	166.4	-85	-171.6	147.6	0	0	110.6	D12 V16	D12-E14 PolarHBondContact O-N 3.06Å; E14-V16 PolarHBondContact O-N 3.37Å; E14-V16 VanDerWaalsContact O-N 3.14Å
15	I	33.1	Very low	35	Very low	153 Å²	153	144.3 Å²	144.3	79%	0.785	79%	0.785	S	S	*	*			trans	-76.7	99.2	171.2	-60.7	173.3	0	0	0	108.1	F13 T17	F13-I15 PolarHBondContact O-N 3.37Å; I15-T17 HydrophobicContact CG2-CG2 4.13Å; I15-T17 PolarHBondContact O-N 2.93Å
16	V	32.4	Very low	34.9	Very low	118 Å²	118	152.1 Å²	152.1	72%	0.715	79%	0.791	S	S	*	*			trans	-74.5	91.7	173.5	-177.8	0	0	0	0	109.6	E14 K18	E14-V16 PolarHBondContact O-N 3.37Å; E14-V16 VanDerWaalsContact O-N 3.14Å; V16-K18 PolarHBondContact O-N 2.81Å
17	T	34	Very low	34.7	Very low	113 Å²	113	153.1 Å²	153.1	69%	0.693	79%	0.792	S	S	*	*			trans	-75.5	101.7	169.4	50.5	0	0	0	0	110.4	I15 V19	I15-T17 HydrophobicContact CG2-CG2 4.13Å; I15-T17 PolarHBondContact O-N 2.93Å; T17-V19 PolarHBondContact O-N 3.09Å
18	K	31.7	Very low	34.6	Very low	199 Å²	199	158 Å²	158	87%	0.865	80%	0.796	S	S	*	*			trans	-74	95.9	167.1	-83.3	-178.5	176.4	173.9	0	109.8	V16	V16-K18 PolarHBondContact O-N 2.81Å
19	V	34.4	Very low	34.4	Very low	119 Å²	119	157.7 Å²	157.7	72%	0.721	80%	0.799	S	S	*	*			trans	-87.8	127	167.3	-176	0	0	0	0	109.4	T17 K21	T17-V19 PolarHBondContact O-N 3.09Å; V19-K21 PolarHBondContact O-N 3.33Å
20	P	33	Very low	33.8	Very low	118 Å²	118	159.5 Å²	159.5	77%	0.766	80%	0.801	S	S	*	*			trans	-68.7	124.5	178.3	-13.4	28.3	0	0	0	110.7	S22	P20-S22 PolarHBondContact O-N 3.38Å; P20-S22 VanDerWaalsContact O-N 3.11Å
21	K	35.4	Very low	33.6	Very low	212 Å²	212	162.2 Å²	162.2	92%	0.922	81%	0.811	S	S	*	*			trans	-68.4	103.1	174	-69.1	178.9	179.3	175.5	0	109.6	V19	V19-K21 PolarHBondContact O-N 3.33Å
22	S	35	Very low	33.4	Very low	109 Å²	109	165.4 Å²	165.4	76%	0.762	82%	0.818	S	S	*	*			trans	-83	124.9	167.2	69.9	0	0	0	0	110.4	P20 R24	P20-S22 PolarHBondContact O-N 3.38Å; P20-S22 VanDerWaalsContact O-N 3.11Å; S22-R24 PolarHBondContact O-N 2.99Å
23	S	33.2	Very low	33	Very low	118 Å²	118	164 Å²	164	83%	0.825	82%	0.821	S	S	*	*			trans	-81.9	86.3	-173.5	45	0	0	0	0	111.5	K25	S23-K25 PolarHBondContact O-N 2.98Å
24	R	35.7	Very low	32.8	Very low	236 Å²	236	159.2 Å²	159.2	89%	0.891	82%	0.821	S	S	*	*			trans	-78.3	106	168.9	-89.2	-177.3	171.1	169.3	-2.1	110.9	S22 R26	S22-R24 PolarHBondContact O-N 2.99Å; R24-R26 PolarHBondContact O-N 3.24Å; R24-R26 VanDerWaalsContact O-N 3.16Å
25	K	33.9	Very low	32.8	Very low	205 Å²	205	160.9 Å²	160.9	89%	0.891	83%	0.825	S	S	*	*			trans	-56	110	167.9	-76.6	178.5	175.9	176.2	0	109.9	S23	S23-K25 PolarHBondContact O-N 2.98Å
26	R	32.1	Very low	32.6	Very low	239 Å²	239	160.6 Å²	160.6	90%	0.902	83%	0.831	S	S	*	*			trans	-78	114.8	170.1	-83.8	-179.2	163.4	-177.9	-4.8	109.7	R24 K28	R24-R26 PolarHBondContact O-N 3.24Å; R24-R26 VanDerWaalsContact O-N 3.16Å; R26-K28 PolarHBondContact O-N 3.45Å
27	H	31.5	Very low	32.5	Very low	187 Å²	187	158.5 Å²	158.5	87%	0.866	83%	0.833	S	S	*	*			trans	-67.8	120.1	163.4	-102.9	-81.9	0	0	0	109.1
28	K	34.3	Very low	32.1	Very low	192 Å²	192	163.4 Å²	163.4	84%	0.835	85%	0.845	S	S	*	*			trans	-81.3	110.8	173.4	-72.2	178.7	176.4	178.3	0	108.9	R26	R26-K28 PolarHBondContact O-N 3.45Å
29	T	32.1	Very low	32.1	Very low	131 Å²	131	163.5 Å²	163.5	80%	0.804	85%	0.845	S	S	*	*			trans	-100.1	112.4	161	22.9	0	0	0	0	108.6
30	L	30.6	Very low	31.6	Very low	158 Å²	158	168.1 Å²	168.1	83%	0.827	86%	0.855	S	S	*	*			trans	-69.1	123.8	171.2	-88.1	89.9	0	0	0	109.2
31	I	33.2	Very low	31.4	Very low	162 Å²	162	168.6 Å²	168.6	83%	0.831	86%	0.86	S	S	*	*			trans	-115.6	115.2	162.7	-58.9	177.9	0	0	0	107.2
32	K	33.2	Very low	31.1	Very low	194 Å²	194	168.4 Å²	168.4	84%	0.843	86%	0.859	S	S	*	*			trans	-67.4	133.6	-179.2	-79.7	178.1	174.1	176.1	0	110.7	G34	K32-G34 PolarHBondContact O-N 3.22Å
33	S	28.3	Very low	30.6	Very low	127 Å²	127	173.4 Å²	173.4	89%	0.888	87%	0.867	S	S	*	*			trans	-71.2	109.9	172.7	43.2	0	0	0	0	111.3
34	G	30.3	Very low	30.4	Very low	74 Å²	74	177.6 Å²	177.6	76%	0.763	87%	0.87	S	S	*	*			trans	-98.5	135.5	172	0	0	0	0	0	111.5	K32	K32-G34 PolarHBondContact O-N 3.22Å
35	K	32.3	Very low	30	Very low	215 Å²	215	172 Å²	172	94%	0.935	86%	0.863	S	S	*	*			trans	-62.3	144.9	-169.3	-71	175.8	176	177.1	0	114.7
36	T	28.6	Very low	29.8	Very low	147 Å²	147	169.7 Å²	169.7	90%	0.902	86%	0.86	S	S	*	*			trans	-71.7	113.4	179.9	42.9	0	0	0	0	112.5
37	G	30.2	Very low	29.9	Very low	73 Å²	73	167 Å²	167	75%	0.753	86%	0.858	S	S	*	*			trans	-104.6	110	170.3	0	0	0	0	0	110.9	K39	G37-K39 PolarHBondContact O-N 3.47Å
38	K	25.5	Very low	30.3	Very low	217 Å²	217	164.8 Å²	164.8	94%	0.943	85%	0.852	S	S	*	*			trans	-63.6	112.4	173.3	-73.7	176.2	175.3	174	0	110.2
39	K	31.6	Very low	30.6	Very low	201 Å²	201	163.4 Å²	163.4	87%	0.874	85%	0.854	S	S	*	*			trans	-125.2	116.7	159	-85	-173.8	176.4	178.4	0	109.8	G37 C41	G37-K39 PolarHBondContact O-N 3.47Å; K39-C41 PolarHBondContact O-N 3.22Å
40	K	24.5	Very low	31.3	Very low	216 Å²	216	165.1 Å²	165.1	94%	0.939	85%	0.853	S	S	*	*			trans	-64	114.3	169.3	-73.4	176.6	173.3	178.3	0	108.4
41	C	28	Very low	32.5	Very low	128 Å²	128	164 Å²	164	87%	0.865	85%	0.852	S	S	*	*			trans	-114.8	138.2	162.9	-95.4	0	0	0	0	109.8	K39	K39-C41 PolarHBondContact O-N 3.22Å
42	K	28.9	Very low	33.4	Very low	207 Å²	207	164.1 Å²	164.1	90%	0.9	85%	0.854	S	S	*	*			trans	-69	147.1	-169.7	-74.7	172.9	172.4	177.1	0	111.8	K44	K42-K44 PolarHBondContact O-N 3.41Å
43	K	25.1	Very low	34.5	Very low	215 Å²	215	161.9 Å²	161.9	94%	0.935	84%	0.844	S	S	*	*			trans	-39	115.4	168.6	-71.9	177.8	172.3	-175.9	0	111.8
44	K	28.6	Very low	36.2	Very low	205 Å²	205	160.4 Å²	160.4	89%	0.891	83%	0.831	S	S	*	*			trans	-118.1	140.6	151.8	-91.9	-171.6	173.2	-173.5	0	107.4	K42	K42-K44 PolarHBondContact O-N 3.41Å
45	T	27.2	Very low	37.8	Very low	120 Å²	120	161.8 Å²	161.8	74%	0.736	84%	0.836	S	S	*	*			trans	-57.8	135.7	-169.3	40.2	0	0	0	0	113.8	E47	T45-E47 PolarHBondContact O-N 2.9Å; T45-E47 VanDerWaalsContact O-N 3.13Å
46	D	30.8	Very low	39.3	Very low	155 Å²	155	163.3 Å²	163.3	83%	0.829	84%	0.836	S	S	*	*			trans	-1.9	90.8	149.9	-50	-31.8	0	0	0	114.6
47	E	33.8	Very low	40.5	Very low	184 Å²	184	159.8 Å²	159.8	86%	0.86	81%	0.814	S	S	*	*			trans	-97.1	106.3	153.1	-79.3	179.8	176.5	0	0	105.2	T45 D49	T45-E47 PolarHBondContact O-N 2.9Å; T45-E47 VanDerWaalsContact O-N 3.13Å; E47-D49 PolarHBondContact O-N 3.11Å
48	D	40.2	Very low	41.8	Very low	139 Å²	139	161.7 Å²	161.7	74%	0.743	81%	0.807	S	S	*	*			trans	-47.9	121.6	176.3	-72.3	-48.6	0	0	0	109.9	Q50	D48-Q50 PolarHBondContact O-N 2.89Å
49	D	40.8	Very low	43.5	Very low	164 Å²	164	157.3 Å²	157.3	88%	0.877	79%	0.794	S	S	*	*			trans	-61.4	80.8	169.4	-80.6	-36.5	0	0	0	108.6	E47 V51	E47-D49 PolarHBondContact O-N 3.11Å; D49-V51 PolarHBondContact O-N 3.06Å
50	Q	45.8	Very low	44.8	Very low	166 Å²	166	155 Å²	155	78%	0.776	79%	0.791	S	S	*	*			trans	-66.2	102.6	172	-70.7	-173.6	7.2	0	0	107.2	D48 L52	D48-Q50 PolarHBondContact O-N 2.89Å; Q50-L52 VanDerWaalsContact C-N 3.34Å; Q50-L52 PolarHBondContact O-N 2.8Å
51	V	55.1	Low	46.1	Very low	135 Å²	135	150.4 Å²	150.4	82%	0.818	78%	0.777	S	S	*	*			trans	-54.9	100.7	169.2	179.1	0	0	0	0	107.3	D49 K53	D49-V51 PolarHBondContact O-N 3.06Å; V51-K53 PolarHBondContact O-N 2.94Å
52	L	52.5	Low	47	Very low	164 Å²	164	150.1 Å²	150.1	86%	0.859	77%	0.766	S	S	*	*			trans	-61	109.8	179	-75.2	165.4	0	0	0	108.6	Q50	Q50-L52 VanDerWaalsContact C-N 3.34Å; Q50-L52 PolarHBondContact O-N 2.8Å
53	K	56.1	Low	47.8	Very low	147 Å²	147	144.8 Å²	144.8	64%	0.639	76%	0.755	S	S	*	*			trans	-66.7	144	170.4	-54.3	-179.5	-170.2	173.1	0	108.5	V51	V51-K53 PolarHBondContact O-N 2.94Å
54	P	65.4	Low	48.5	Very low	96 Å²	96	139 Å²	139	62%	0.623	74%	0.739	S	S	*	*			trans	-59	141.6	175.7	22.2	-29.7	0	0	0	110.6	W56 T57	P54-W56 PolarHBondContact O-N 3.05Å; P54-T57 PolarHBondContact O-N 3.4Å; P54-T57 PolarHBondContact O-OG1 2.99Å
55	A	63.2	Low	48.9	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	4.3	-172	0	0	0	0	0	116
56	W	62.8	Low	49.5	Very low	247 Å²	247	138.4 Å²	138.4	94%	0.936	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	14.3	-178.7	-57.5	79	0	0	0	112.1	P54	P54-W56 PolarHBondContact O-N 3.05Å
57	T	53.6	Low	49.8	Very low	72 Å²	72	136.1 Å²	136.1	44%	0.442	73%	0.73	S	S	.	*			trans	-93.1	99.3	172.8	-24.3	0	0	0	0	106	P54 D59	P54-T57 PolarHBondContact O-N 3.4Å; P54-T57 PolarHBondContact O-OG1 2.99Å; T57-D59 PolarHBondContact O-N 3.27Å
58	D	58.1	Low	50.7	Low	114 Å²	114	134.1 Å²	134.1	61%	0.61	72%	0.724	S	S	*	*			trans	-65	132.3	170.2	-91.3	-26.7	0	0	0	108	D60 D61	D58-D60 PolarHBondContact O-N 3.22Å; D58-D61 WeakPolarHBondContact O-CB 3.5Å; D58-D61 PolarHBondContact O-N 3.21Å
59	D	61.3	Low	51.2	Low	124 Å²	124	137.7 Å²	137.7	66%	0.663	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-62.6	-13	175.5	-75.8	-43.1	0	0	0	111.9	T57	T57-D59 PolarHBondContact O-N 3.27Å
60	D	58.7	Low	51.9	Low	152 Å²	152	131.1 Å²	131.1	81%	0.813	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-79.1	-12.4	173.1	-67.3	-29	0	0	0	113.9	D58 I62	D58-D60 PolarHBondContact O-N 3.22Å; D60-I62 PolarHBondContact O-N 2.87Å
61	D	52.8	Low	52.8	Low	121 Å²	121	125.1 Å²	125.1	65%	0.647	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-79.9	1.2	177.3	-86.2	-18.8	0	0	0	113.6	D58 S63	D58-D61 WeakPolarHBondContact O-CB 3.5Å; D58-D61 PolarHBondContact O-N 3.21Å; D61-S63 PolarHBondContact O-N 3.09Å
62	I	46.3	Very low	53.4	Low	121 Å²	121	126.4 Å²	126.4	62%	0.621	66%	0.658	S	S	*	*			trans	-74	79.5	170.2	-50.8	170.4	0	0	0	107.7	D60 P64	D60-I62 PolarHBondContact O-N 2.87Å; I62-P64 VanDerWaalsContact O-CD 3.29Å; I62-P64 WeakPolarHBondContact O-CD 3.21Å
63	S	46.1	Very low	54.2	Low	96 Å²	96	119.1 Å²	119.1	67%	0.671	62%	0.622	S	S	*	*			trans	-54.7	116.3	162.8	57.8	0	0	0	0	106.9	D61 Q65	D61-S63 PolarHBondContact O-N 3.09Å; S63-Q65 PolarHBondContact O-N 3.05Å
64	P	38.7	Very low	54.8	Low	92 Å²	92	118.1 Å²	118.1	60%	0.597	62%	0.623	S	S	*	*			trans	-63.7	124.2	-175.3	27.3	-34.3	0	0	0	106.2	I62 I66	I62-P64 VanDerWaalsContact O-CD 3.29Å; I62-P64 WeakPolarHBondContact O-CD 3.21Å; P64-I66 HydrophobicContact CB-CD1 3.97Å; P64-I66 HydrophobicContact CB-CG1 3.98Å; P64-I66 HydrophobicContact CG-CD1 3.81Å; P64-I66 HydrophobicContact CG-CG1 4.3Å; P64-I66 PolarHBondContact O-N 2.88Å
65	Q	38.1	Very low	55.3	Low	195 Å²	195	117.5 Å²	117.5	91%	0.911	61%	0.614	S	S	*	*			trans	-70.2	60.5	167.3	-73.3	-143.8	1.8	0	0	109	S63 S67	S63-Q65 PolarHBondContact O-N 3.05Å; Q65-S67 VanDerWaalsContact C-N 3.29Å; Q65-S67 PolarHBondContact O-N 3.01Å
66	I	40.6	Very low	55.7	Low	118 Å²	118	112.8 Å²	112.8	61%	0.605	58%	0.575	S	S	*	*			trans	-68.8	102.1	160.5	-64.1	160.6	0	0	0	102.9	P64 I68	P64-I66 HydrophobicContact CB-CD1 3.97Å; P64-I66 HydrophobicContact CB-CG1 3.98Å; P64-I66 HydrophobicContact CG-CD1 3.81Å; P64-I66 HydrophobicContact CG-CG1 4.3Å; P64-I66 PolarHBondContact O-N 2.88Å; I66-I68 HydrophobicContact CB-CG1 4.26Å; I66-I68 HydrophobicContact CG2-CG1 3.65Å; I66-I68 PolarHBondContact O-N 3.39Å
67	S	35.8	Very low	56.2	Low	108 Å²	108	105 Å²	105	76%	0.755	55%	0.548	S	S	*	.			trans	-62.7	86.1	160.1	50.3	0	0	0	0	106.3	Q65 R69	Q65-S67 VanDerWaalsContact C-N 3.29Å; Q65-S67 PolarHBondContact O-N 3.01Å; S67-R69 VanDerWaalsContact C-N 3.28Å; S67-R69 PolarHBondContact O-N 3.03Å
68	I	52.2	Low	57.1	Low	142 Å²	142	103.7 Å²	103.7	73%	0.728	54%	0.544	S	S	*	.			trans	-63.4	99.8	176.6	-59.5	168	0	0	0	104.4	I66	I66-I68 HydrophobicContact CB-CG1 4.26Å; I66-I68 HydrophobicContact CG2-CG1 3.65Å; I66-I68 PolarHBondContact O-N 3.39Å
69	R	51.4	Low	57.7	Low	213 Å²	213	103.8 Å²	103.8	80%	0.804	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-56.1	132.5	170.1	-75.3	-172.9	179.7	-172.5	0.8	106.3	S67	S67-R69 VanDerWaalsContact C-N 3.28Å; S67-R69 PolarHBondContact O-N 3.03Å
70	P	56	Low	57.9	Low	27 Å²	27	98.7 Å²	98.7	18%	0.175	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-53	135.4	173.1	22.4	-33.6	0	0	0	108.9	N179	P70-N179 HydrophobicContact CG-CB 4.5Å
71	P	64.6	Low	58.6	Low	39 Å²	39	95.5 Å²	95.5	25%	0.253	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-60.5	144.8	-178.5	26.1	-34.1	0	0	0	110.1	D75 V76 D156	P71-D75 HydrophobicContact CB-CB 4.31Å; P71-V76 HydrophobicContact CB-CG2 3.96Å; P71-V76 HydrophobicContact CG-CG2 3.92Å; P71-D156 HydrophobicContact CG-CB 4.33Å
72	R	67.3	Low	59.4	Low	162 Å²	162	95.7 Å²	95.7	61%	0.611	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-72.5	159.1	172.7	-57.7	-174.8	-144.6	178.5	7.7	109.4	L74 D75 V76	R72-L74 PolarHBondContact O-N 2.83Å; R72-D75 WeakPolarHBondContact CB-OD2 3.37Å; R72-D75 PolarHBondContact N-OD2 2.68Å; R72-D75 WeakPolarHBondContact O-CB 3.4Å; R72-D75 PolarHBondContact O-N 3.27Å; R72-V76 WeakPolarHBondContact O-CG2 3.26Å; R72-V76 PolarHBondContact O-N 3.28Å; R72-V76 VanDerWaalsContact O-N 3.09Å
73	A	70.2	Confident	60.2	Low	11 Å²	11	93.7 Å²	93.7	9%	0.091	48%	0.482	C	S	.	.	H	α-helix	trans	-58.2	-38.8	178.2	0	0	0	0	0	111.2	D75 V76 F77 V176 E178	A73-D75 VanDerWaalsContact C-N 3.34Å; A73-D75 PolarHBondContact O-N 3.13Å; A73-V76 WeakPolarHBondContact O-CB 3.49Å; A73-V76 PolarHBondContact O-N 2.9Å; A73-F77 HydrophobicContact CB-CD2 4.19Å; A73-F77 HydrophobicContact CB-CE2 3.85Å; A73-F77 WeakPolarHBondContact O-CD2 3.46Å; A73-F77 WeakPolarHBondContact O-CG 3.39Å; A73-F77 PolarHBondContact O-N 2.9Å; A73-V176 HydrophobicContact CB-CB 3.95Å; A73-V176 HydrophobicContact CB-CG1 3.76Å; A73-E178 HydrophobicContact CB-CG 3.68Å; A73-E178 VanDerWaalsContact CB-OE1 3.29Å; A73-E178 WeakPolarHBondContact CB-OE1 3.29Å; A73-E178 PolarHBondContact N-OE1 2.8Å
74	L	69	Low	60.9	Low	126 Å²	126	94.7 Å²	94.7	66%	0.66	47%	0.474	S	S	*	.	H	α-helix	trans	-59.2	-40.4	174.6	-172.5	65.7	0	0	0	113.1	R72 V76 F77 A78	R72-L74 PolarHBondContact O-N 2.83Å; L74-V76 VanDerWaalsContact C-N 3.32Å; L74-F77 PolarHBondContact O-N 3.32Å; L74-A78 WeakPolarHBondContact O-CB 2.94Å; L74-A78 PolarHBondContact O-N 3.24Å
75	D	74.8	Confident	61.6	Low	84 Å²	84	95.9 Å²	95.9	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-66.2	-39.8	178.4	-57.2	-37.4	0	0	0	110.7	P71 R72 A73 K79	P71-D75 HydrophobicContact CB-CB 4.31Å; R72-D75 WeakPolarHBondContact CB-OD2 3.37Å; R72-D75 PolarHBondContact N-OD2 2.68Å; R72-D75 WeakPolarHBondContact O-CB 3.4Å; R72-D75 PolarHBondContact O-N 3.27Å; A73-D75 VanDerWaalsContact C-N 3.34Å; A73-D75 PolarHBondContact O-N 3.13Å; D75-K79 WeakPolarHBondContact O-CB 3.4Å; D75-K79 PolarHBondContact O-N 2.8Å; D75-K79 VanDerWaalsContact O-N 3.09Å
76	V	70.7	Confident	62.4	Low	4 Å²	4	91.4 Å²	91.4	2%	0.024	46%	0.461	C	S	.	.	H	α-helix	trans	-63.7	-46.7	175.6	177.3	0	0	0	0	110.6	P71 R72 A73 L74 L80 T158 V176	P71-V76 HydrophobicContact CB-CG2 3.96Å; P71-V76 HydrophobicContact CG-CG2 3.92Å; R72-V76 WeakPolarHBondContact O-CG2 3.26Å; R72-V76 PolarHBondContact O-N 3.28Å; R72-V76 VanDerWaalsContact O-N 3.09Å; A73-V76 WeakPolarHBondContact O-CB 3.49Å; A73-V76 PolarHBondContact O-N 2.9Å; L74-V76 VanDerWaalsContact C-N 3.32Å; V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 PolarHBondContact O-N 2.79Å; V76-T158 HydrophobicContact CG1-CG2 3.72Å; V76-V176 HydrophobicContact CG2-CG1 4.4Å
77	F	74.6	Confident	62.7	Low	85 Å²	85	92 Å²	92	37%	0.373	46%	0.459	S	S	.	.	H	α-helix	trans	-68.2	-43.9	179.3	-68.1	-56.6	0	0	0	112.2	A73 L74 K79 L80 D81 V176	A73-F77 HydrophobicContact CB-CD2 4.19Å; A73-F77 HydrophobicContact CB-CE2 3.85Å; A73-F77 WeakPolarHBondContact O-CD2 3.46Å; A73-F77 WeakPolarHBondContact O-CG 3.39Å; A73-F77 PolarHBondContact O-N 2.9Å; L74-F77 PolarHBondContact O-N 3.32Å; F77-K79 VanDerWaalsContact C-N 3.29Å; F77-K79 PolarHBondContact O-N 3.34Å; F77-L80 WeakPolarHBondContact O-CB 3.38Å; F77-L80 PolarHBondContact O-N 2.88Å; F77-L80 VanDerWaalsContact O-N 3.11Å; F77-D81 PolarHBondContact O-N 2.72Å; F77-V176 HydrophobicContact CE1-CG2 4.25Å; F77-V176 HydrophobicContact CE2-CG2 4.25Å; F77-V176 HydrophobicContact CZ-CG2 3.74Å
78	A	72.7	Confident	63	Low	43 Å²	43	91.5 Å²	91.5	36%	0.355	46%	0.456	S	S	.	.	H	α-helix	trans	-59.7	-40.9	177.6	0	0	0	0	0	111.8	L74 D81 Q82	L74-A78 WeakPolarHBondContact O-CB 2.94Å; L74-A78 PolarHBondContact O-N 3.24Å; A78-D81 PolarHBondContact O-N 3.05Å; A78-Q82 WeakPolarHBondContact O-CG 3.28Å; A78-Q82 PolarHBondContact O-N 3.32Å
79	K	70.4	Confident	62.2	Low	116 Å²	116	91 Å²	91	50%	0.504	46%	0.459	S	S	.	.	H	α-helix	trans	-72.7	-31.1	177.7	-158.3	156	176.8	174.4	0	112.6	D75 F77 Q82 L83 M135	D75-K79 WeakPolarHBondContact O-CB 3.4Å; D75-K79 PolarHBondContact O-N 2.8Å; D75-K79 VanDerWaalsContact O-N 3.09Å; F77-K79 VanDerWaalsContact C-N 3.29Å; F77-K79 PolarHBondContact O-N 3.34Å; K79-Q82 PolarHBondContact O-N 3Å; K79-L83 WeakPolarHBondContact O-CG 3.45Å; K79-L83 PolarHBondContact O-N 2.89Å; K79-M135 HydrophobicContact CB-CE 4.15Å; K79-M135 HydrophobicContact CD-CE 3.53Å; K79-M135 HydrophobicContact CG-CE 3.47Å; K79-M135 VanDerWaalsContact CG-CE 3.47Å; K79-M135 HydrophobicContact CG-SD 4.44Å
80	L	65.6	Low	61.1	Low	17 Å²	17	83.3 Å²	83.3	9%	0.089	45%	0.446	C	S	.	.	H	α-helix	trans	-64.8	-42.7	171.2	-174.5	69.3	0	0	0	111.4	V76 F77 Q82 L83 K84	V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 PolarHBondContact O-N 2.79Å; F77-L80 WeakPolarHBondContact O-CB 3.38Å; F77-L80 PolarHBondContact O-N 2.88Å; F77-L80 VanDerWaalsContact O-N 3.11Å; L80-Q82 VanDerWaalsContact C-N 3.35Å; L80-L83 PolarHBondContact O-N 2.88Å; L80-K84 WeakPolarHBondContact O-CG 3.29Å; L80-K84 PolarHBondContact O-N 3.3Å
81	D	73.5	Confident	59.9	Low	86 Å²	86	87.5 Å²	87.5	46%	0.46	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-38	177.2	-69.9	-20.9	0	0	0	111.4	F77 A78 K84 N85	F77-D81 PolarHBondContact O-N 2.72Å; A78-D81 PolarHBondContact O-N 3.05Å; D81-K84 PolarHBondContact O-N 2.84Å; D81-N85 WeakPolarHBondContact O-CB 3.46Å; D81-N85 VanDerWaalsContact O-CG 3.24Å; D81-N85 PolarHBondContact O-N 3.39Å
82	Q	69.1	Low	58.4	Low	124 Å²	124	92.6 Å²	92.6	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-46.2	170.1	-72.8	176.5	6.3	0	0	112	A78 K79 L80 K84 N85 V86	A78-Q82 WeakPolarHBondContact O-CG 3.28Å; A78-Q82 PolarHBondContact O-N 3.32Å; K79-Q82 PolarHBondContact O-N 3Å; L80-Q82 VanDerWaalsContact C-N 3.35Å; Q82-K84 VanDerWaalsContact C-N 3.34Å; Q82-K84 PolarHBondContact O-N 3.28Å; Q82-N85 PolarHBondContact O-N 3.35Å; Q82-V86 VanDerWaalsContact O-CG2 3.26Å; Q82-V86 WeakPolarHBondContact O-CG2 3.38Å; Q82-V86 PolarHBondContact O-N 3.36Å
83	L	63.3	Low	56.9	Low	80 Å²	80	92.3 Å²	92.3	42%	0.419	51%	0.512	S	S	.	.	H	α-helix	trans	-65	-35.1	177.9	-82	160.2	0	0	0	113	K79 L80 K87 M135	K79-L83 WeakPolarHBondContact O-CG 3.45Å; K79-L83 PolarHBondContact O-N 2.89Å; L80-L83 PolarHBondContact O-N 2.88Å; L83-K87 PolarHBondContact O-N 3.47Å; L83-M135 HydrophobicContact CD1-CE 3.69Å; L83-M135 HydrophobicContact CD1-SD 3.44Å; L83-M135 WeakPolarHBondContact CD1-SD 3.18Å
84	K	60.7	Low	55.3	Low	116 Å²	116	100.8 Å²	100.8	50%	0.504	55%	0.55	S	S	.	.	H	α-helix	trans	-67.1	-40	173.2	-75.2	176.1	179.6	175.6	0	111.2	L80 D81 Q82 K87	L80-K84 WeakPolarHBondContact O-CG 3.29Å; L80-K84 PolarHBondContact O-N 3.3Å; D81-K84 PolarHBondContact O-N 2.84Å; Q82-K84 VanDerWaalsContact C-N 3.34Å; Q82-K84 PolarHBondContact O-N 3.28Å; K84-K87 PolarHBondContact O-N 3.36Å
85	N	53.5	Low	53.5	Low	117 Å²	117	97.8 Å²	97.8	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-69.9	-38.4	177.2	-71.4	-11.3	0	0	0	112.2	D81 Q82 K87 S88	D81-N85 WeakPolarHBondContact O-CB 3.46Å; D81-N85 VanDerWaalsContact O-CG 3.24Å; D81-N85 PolarHBondContact O-N 3.39Å; Q82-N85 PolarHBondContact O-N 3.35Å; N85-K87 VanDerWaalsContact C-N 3.27Å; N85-K87 PolarHBondContact O-N 2.88Å; N85-S88 WeakPolarHBondContact O-CB 3.5Å; N85-S88 PolarHBondContact O-N 2.88Å; N85-S88 VanDerWaalsContact O-N 3.11Å; N85-S88 PolarHBondContact O-OG 3.25Å
86	V	54.9	Low	51.3	Low	101 Å²	101	101.2 Å²	101.2	61%	0.612	57%	0.567	S	S	*	*	H	α-helix	trans	-65.2	-30.9	176.3	173.4	0	0	0	0	111.8	Q82 S88 V89	Q82-V86 VanDerWaalsContact O-CG2 3.26Å; Q82-V86 WeakPolarHBondContact O-CG2 3.38Å; Q82-V86 PolarHBondContact O-N 3.36Å; V86-S88 PolarHBondContact O-N 2.96Å; V86-V89 PolarHBondContact O-N 2.75Å
87	K	46.7	Very low	49.4	Very low	131 Å²	131	105.9 Å²	105.9	57%	0.57	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-5.1	173.4	-83.1	-175.9	178.2	179.7	0	114.5	L83 K84 N85	L83-K87 PolarHBondContact O-N 3.47Å; K84-K87 PolarHBondContact O-N 3.36Å; N85-K87 VanDerWaalsContact C-N 3.27Å; N85-K87 PolarHBondContact O-N 2.88Å
88	S	41.1	Very low	47.2	Very low	97 Å²	97	107.8 Å²	107.8	68%	0.678	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-7.1	170.9	66.8	0	0	0	0	114.9	N85 V86	N85-S88 WeakPolarHBondContact O-CB 3.5Å; N85-S88 PolarHBondContact O-N 2.88Å; N85-S88 VanDerWaalsContact O-N 3.11Å; N85-S88 PolarHBondContact O-OG 3.25Å; V86-S88 PolarHBondContact O-N 2.96Å
89	V	35.7	Very low	45.2	Very low	132 Å²	132	116.5 Å²	116.5	80%	0.8	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	-4.8	-173.8	-172.1	0	0	0	0	115.3	V86	V86-V89 PolarHBondContact O-N 2.75Å
90	G	29.1	Very low	43.2	Very low	52 Å²	52	115.6 Å²	115.6	54%	0.536	66%	0.657	S	S	.	*			trans	-120.3	97.7	178.5	0	0	0	0	0	113
91	S	30.8	Very low	41.3	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	70%	0.696	S	S	*	*			trans	-78.7	109.9	156.1	64.9	0	0	0	0	107.1
92	D	33.4	Very low	39.1	Very low	146 Å²	146	132.2 Å²	132.2	78%	0.781	72%	0.718	S	S	*	*			trans	-148.5	127.5	169	-79.6	-40	0	0	0	109.3
93	D	35.7	Very low	37.1	Very low	157 Å²	157	131.8 Å²	131.8	84%	0.84	73%	0.728	S	S	*	*			trans	65.9	61.5	165.9	-54.8	-20.3	0	0	0	117.2	G95	D93-G95 PolarHBondContact O-N 3.39Å
94	E	35.2	Very low	35.7	Very low	189 Å²	189	132.7 Å²	132.7	88%	0.883	75%	0.747	S	S	*	*			trans	-64.2	93.6	144.9	-69.6	-153	163.2	0	0	108.2	D96	E94-D96 PolarHBondContact O-N 2.93Å
95	G	31	Very low	34.2	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	76%	0.756	S	S	*	*			trans	-56.4	113.7	160.1	0	0	0	0	0	107.8	D93 C97	D93-G95 PolarHBondContact O-N 3.39Å; G95-C97 PolarHBondContact O-N 2.57Å
96	D	29.4	Very low	33	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	77%	0.769	S	S	*	*			trans	-27.4	98.3	-179	-86.7	-38.2	0	0	0	112.6	E94 V98	E94-D96 PolarHBondContact O-N 2.93Å; D96-V98 HydrophobicContact CB-CG2 4.28Å; D96-V98 PolarHBondContact O-N 2.97Å
97	C	31.8	Very low	31.8	Very low	103 Å²	103	133.5 Å²	133.5	70%	0.696	77%	0.774	S	S	*	*			trans	-74.6	80.2	165.8	-77.7	0	0	0	0	107.5	G95 Y99	G95-C97 PolarHBondContact O-N 2.57Å; C97-Y99 WeakPolarHBondContact O-CD2 3.44Å; C97-Y99 PolarHBondContact O-N 2.88Å
98	V	28.4	Very low	31	Very low	124 Å²	124	134.1 Å²	134.1	75%	0.752	78%	0.779	S	S	*	*			trans	-60.2	105.7	171.2	-178.6	0	0	0	0	107.8	D96 A100	D96-V98 HydrophobicContact CB-CG2 4.28Å; D96-V98 PolarHBondContact O-N 2.97Å; V98-A100 PolarHBondContact O-N 3.14Å
99	Y	30.1	Very low	30.5	Very low	226 Å²	226	137.3 Å²	137.3	89%	0.886	78%	0.781	S	S	*	*			trans	-59.9	92.8	171.7	-69.5	-89.5	0	0	0	109.9	C97	C97-Y99 WeakPolarHBondContact O-CD2 3.44Å; C97-Y99 PolarHBondContact O-N 2.88Å
100	A	28.6	Very low	30.5	Very low	97 Å²	97	137.4 Å²	137.4	80%	0.802	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-84.5	120.7	163.2	0	0	0	0	0	109.5	V98	V98-A100 PolarHBondContact O-N 3.14Å
101	R	25.5	Very low	31	Very low	243 Å²	243	140.7 Å²	140.7	92%	0.917	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-48.9	151	-177.2	-86.1	174.1	165.6	153.6	-5.1	115.2	S103	R101-S103 PolarHBondContact O-N 3.25Å
102	K	27	Very low	31.9	Very low	210 Å²	210	141.6 Å²	141.6	91%	0.913	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-53.8	122	159	-67.9	176.1	175.6	178.5	0	111.9
103	S	27.8	Very low	33	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	77%	0.771	S	S	*	*			trans	170.2	127	139.8	60.9	0	0	0	0	105.8	R101	R101-S103 PolarHBondContact O-N 3.25Å
104	A	32.5	Very low	34.1	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	73%	0.732	S	S	*	*				-162.7	160.9	79.2	0	0	0	0	0	110.5
105	A	29.6	Very low	35.2	Very low	85 Å²	85	127.6 Å²	127.6	70%	0.702	72%	0.718	S	S	*	*			trans	-48.8	146.7	179.3	0	0	0	0	0	113.2	D107	A105-D107 PolarHBondContact O-N 2.91Å
106	C	28.2	Very low	36.4	Very low	132 Å²	132	133.1 Å²	133.1	89%	0.892	72%	0.721	S	S	*	*			trans	-60.7	103.3	165.2	-60.7	0	0	0	0	108.6
107	D	29.9	Very low	38.2	Very low	134 Å²	134	127.4 Å²	127.4	72%	0.717	70%	0.698	S	S	*	*			trans	-106.6	148.7	163.2	-93.4	-30.2	0	0	0	111.5	A105	A105-D107 PolarHBondContact O-N 2.91Å
108	E	30.1	Very low	40.3	Very low	145 Å²	145	127.7 Å²	127.7	68%	0.678	69%	0.688	S	S	*	*			trans	-69.1	160.1	-158.2	-55.3	-165.4	155.4	0	0	114.7
109	K	30.1	Very low	43.1	Very low	164 Å²	164	128.9 Å²	128.9	71%	0.713	69%	0.685	S	S	*	*			trans	38	112.6	141.5	-65.9	166.8	-171.8	149.3	0	117.6
110	I	35.9	Very low	45.8	Very low	134 Å²	134	118.4 Å²	118.4	69%	0.687	64%	0.644	S	S	*	*				174.9	136.4	117.9	-81.7	147.2	0	0	0	103.5	E112	I110-E112 HydrophobicContact CB-CG 4.05Å; I110-E112 HydrophobicContact CG2-CG 3.77Å; I110-E112 PolarHBondContact O-N 2.77Å
111	S	39.1	Very low	48.7	Very low	120 Å²	120	115.4 Å²	115.4	84%	0.839	62%	0.623	S	S	*	*			trans	-65.8	77.6	162.4	52.2	0	0	0	0	106.6	I113	S111-I113 PolarHBondContact O-N 3.38Å
112	E	51.2	Low	51.9	Low	133 Å²	133	105 Å²	105	62%	0.621	59%	0.587	S	S	*	*			trans	-67.3	118.6	176.7	-70.3	-177	168.2	0	0	105	I110 L114 H438	I110-E112 HydrophobicContact CB-CG 4.05Å; I110-E112 HydrophobicContact CG2-CG 3.77Å; I110-E112 PolarHBondContact O-N 2.77Å; E112-L114 PolarHBondContact O-N 2.68Å; E112-H438 PolarHBondContact O-CE1 3.19Å; E112-H438 PolarHBondContact O-NE2 3.21Å
113	I	56.4	Low	55	Low	108 Å²	108	101.9 Å²	101.9	55%	0.554	57%	0.573	S	S	*	*			trans	-42	140.7	163.6	-64.7	160	0	0	0	107.6	S111 S115	S111-I113 PolarHBondContact O-N 3.38Å; I113-S115 PolarHBondContact O-N 3.25Å; I113-S115 VanDerWaalsContact O-N 3.17Å
114	L	58.2	Low	58.1	Low	6 Å²	6	99.6 Å²	99.6	3%	0.031	55%	0.547	C	S	.	.			trans	-39.6	127.7	175.2	-76.4	160.5	0	0	0	109.8	E112 Y116 I120 E373 I374 F397 H438	E112-L114 PolarHBondContact O-N 2.68Å; L114-Y116 PolarHBondContact O-N 2.86Å; L114-Y116 VanDerWaalsContact O-N 3.15Å; L114-I120 HydrophobicContact CD2-CD1 4.27Å; L114-E373 HydrophobicContact CD1-CB 3.83Å; L114-I374 HydrophobicContact CD1-CD1 4.03Å; L114-I374 HydrophobicContact CD1-CG1 3.71Å; L114-I374 HydrophobicContact CD2-CD1 4.4Å; L114-F397 HydrophobicContact CD1-CZ 4.11Å; L114-H438 HydrophobicContact CD2-CB 4.1Å; L114-H438 PolarHBondContact N-NE2 3.14Å
115	S	58.1	Low	61.1	Low	85 Å²	85	96.3 Å²	96.3	59%	0.594	52%	0.515	S	S	*	.			trans	-54.5	125.2	-177.4	54	0	0	0	0	109.5	I113 G117	I113-S115 PolarHBondContact O-N 3.25Å; I113-S115 VanDerWaalsContact O-N 3.17Å; S115-G117 PolarHBondContact O-N 3.12Å
116	Y	56.4	Low	64.1	Low	179 Å²	179	93.7 Å²	93.7	70%	0.702	49%	0.492	S	S	*	.	S	Bend	trans	-46.1	112.3	176.2	-88.5	-87.5	0	0	0	110.8	L114 E393	L114-Y116 PolarHBondContact O-N 2.86Å; L114-Y116 VanDerWaalsContact O-N 3.15Å; Y116-E393 HydrophobicContact CE1-CG 4.32Å; Y116-E393 WeakPolarHBondContact CE1-OE1 3.45Å; Y116-E393 WeakPolarHBondContact CE1-OE2 3.34Å; Y116-E393 PolarHBondContact OH-OE1 3.32Å
117	G	66.9	Low	67.3	Low	34 Å²	34	88.2 Å²	88.2	35%	0.351	45%	0.454	S	S	.	.	S	Bend	trans	158.6	163.6	179.3	0	0	0	0	0	114.5	S115 Q119 I395	S115-G117 PolarHBondContact O-N 3.12Å; G117-Q119 PolarHBondContact O-N 2.92Å; G117-I395 WeakPolarHBondContact O-CD1 3.39Å
118	K	77.3	Confident	70.4	Confident	110 Å²	110	81.9 Å²	81.9	48%	0.478	42%	0.42	S	S	.	.	S	Bend	trans	-80.3	8.2	178.5	-65.7	178.2	163.2	-161.3	0	113.8	F397 E398	K118-F397 WeakPolarHBondContact O-CA 3.32Å; K118-E398 HydrophobicContact CB-CG 4.47Å; K118-E398 HydrophobicContact CD-CG 4.39Å; K118-E398 WeakPolarHBondContact CD-OE1 3.49Å; K118-E398 WeakPolarHBondContact CE-OE1 3.23Å; K118-E398 IonicContact NZ-OE1 2.72Å; K118-E398 PolarHBondContact NZ-OE1 2.99Å; K118-E398 IonicContact NZ-OE2 3.97Å; K118-E398 PolarHBondContact O-N 3.5Å
119	Q	85.3	Confident	73.5	Confident	148 Å²	148	75 Å²	75	69%	0.692	39%	0.388	S	S	*	.			trans	-119.1	131	-176.8	-65.2	-173.6	5.8	0	0	110.3	G117 N399	G117-Q119 PolarHBondContact O-N 2.92Å; Q119-N399 WeakPolarHBondContact CA-OD1 3.19Å
120	I	88.5	Confident	76.5	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.031	38%	0.38	C	S	.	.			trans	-115.1	136.2	171.1	-176.4	170.9	0	0	0	109.3	L114 V122 I374 L388 F397 N399 L436	L114-I120 HydrophobicContact CD2-CD1 4.27Å; I120-V122 HydrophobicContact CB-CG2 4.41Å; I120-V122 HydrophobicContact CG1-CG2 4.31Å; I120-V122 HydrophobicContact CG2-CG2 3.6Å; I120-V122 PolarHBondContact O-N 3.47Å; I120-I374 HydrophobicContact CD1-CD1 3.41Å; I120-I374 VanDerWaalsContact CD1-CD1 3.41Å; I120-L388 HydrophobicContact CD1-CD1 4.37Å; I120-L388 HydrophobicContact CG2-CD1 4.32Å; I120-F397 HydrophobicContact CB-CB 4.34Å; I120-F397 HydrophobicContact CB-CD1 3.57Å; I120-F397 HydrophobicContact CB-CD2 4.11Å; I120-F397 HydrophobicContact CB-CE1 3.81Å; I120-F397 HydrophobicContact CB-CE2 4.31Å; I120-F397 HydrophobicContact CB-CG 3.74Å; I120-F397 HydrophobicContact CB-CZ 4.18Å; I120-F397 HydrophobicContact CD1-CD2 4.25Å; I120-F397 HydrophobicContact CD1-CE2 4.02Å; I120-F397 HydrophobicContact CD1-CZ 4.3Å; I120-F397 HydrophobicContact CG2-CB 3.53Å; I120-F397 HydrophobicContact CG2-CD1 3.76Å; I120-F397 HydrophobicContact CG2-CD2 3.83Å; I120-F397 HydrophobicContact CG2-CE1 4.43Å; I120-F397 HydrophobicContact CG2-CE2 4.49Å; I120-F397 HydrophobicContact CG2-CG 3.41Å; I120-F397 VanDerWaalsContact CG2-CG 3.41Å; I120-N399 PolarHBondContact N-OD1 2.92Å; I120-N399 PolarHBondContact O-ND2 2.91Å; I120-L436 HydrophobicContact CD1-CD2 4.16Å
121	G	88.9	Confident	79.3	Confident	35 Å²	35	72.6 Å²	72.6	36%	0.361	37%	0.37	S	S	.	.			trans	-69.7	101.7	177.1	0	0	0	0	0	110.6	L436 S437	G121-L436 CarbonylContact O-C 3.42Å; G121-L436 WeakPolarHBondContact O-CA 3.2Å; G121-S437 VanDerWaalsContact CA-OG 3.29Å; G121-S437 WeakPolarHBondContact CA-OG 3.46Å; G121-S437 PolarHBondContact O-N 3.11Å; G121-S437 PolarHBondContact O-OG 3.25Å
122	V	92.1	Very high	81.9	Confident	25 Å²	25	67.1 Å²	67.1	15%	0.152	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.3	177.8	-168.6	0	0	0	0	109.7	I120 F400 V404 Y434 A435 L436	I120-V122 HydrophobicContact CB-CG2 4.41Å; I120-V122 HydrophobicContact CG1-CG2 4.31Å; I120-V122 HydrophobicContact CG2-CG2 3.6Å; I120-V122 PolarHBondContact O-N 3.47Å; V122-F400 HydrophobicContact CB-CD2 4.41Å; V122-F400 HydrophobicContact CG1-CD2 3.96Å; V122-F400 HydrophobicContact CG1-CE2 4.17Å; V122-F400 HydrophobicContact CG2-CD2 4.22Å; V122-V404 HydrophobicContact CB-CG2 4.22Å; V122-V404 HydrophobicContact CG1-CG1 4.14Å; V122-V404 HydrophobicContact CG1-CG2 4.45Å; V122-Y434 HydrophobicContact CG1-CD1 3.85Å; V122-Y434 HydrophobicContact CG1-CG 4.23Å; V122-A435 CarbonylContact C-O 3.52Å; V122-A435 WeakPolarHBondContact CA-O 3.42Å; V122-L436 HydrophobicContact CB-CD2 4.38Å; V122-L436 HydrophobicContact CG1-CD2 4.12Å; V122-L436 HydrophobicContact CG2-CD2 3.67Å
123	K	92.4	Very high	83.9	Confident	144 Å²	144	64.5 Å²	64.5	63%	0.626	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.4	173.4	-175.6	175.4	179	178.1	0	110.5	L125 Y434 A435	K123-L125 HydrophobicContact CD-CD2 4.22Å; K123-L125 HydrophobicContact CG-CD2 4.21Å; K123-L125 PolarHBondContact O-N 2.92Å; K123-Y434 CarbonylContact O-C 3.56Å; K123-Y434 WeakPolarHBondContact O-CA 3.16Å; K123-A435 PolarHBondContact N-O 3.06Å; K123-A435 PolarHBondContact O-N 3.34Å
124	R	93.9	Very high	85.7	Confident	66 Å²	66	59.7 Å²	59.7	25%	0.249	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.5	167.9	-166.7	63.2	170.8	100.6	5.8	109.1	D127 V404 A432 L433 Y434	R124-D127 IonicContact CZ-OD1 3.8Å; R124-D127 IonicContact NH1-OD1 3.32Å; R124-D127 PolarHBondContact NH1-OD1 2.95Å; R124-D127 IonicContact NH2-OD1 3.05Å; R124-D127 PolarHBondContact NH2-OD1 2.94Å; R124-V404 HydrophobicContact CB-CG1 3.74Å; R124-V404 WeakPolarHBondContact CB-O 3.27Å; R124-V404 WeakPolarHBondContact CD-O 3.42Å; R124-V404 WeakPolarHBondContact CG-O 3.38Å; R124-V404 VanDerWaalsContact N-CG1 3.28Å; R124-A432 VanDerWaalsContact CZ-CB 3.41Å; R124-A432 VanDerWaalsContact NH1-C 3.34Å; R124-A432 VanDerWaalsContact NH1-CB 3.29Å; R124-A432 VanDerWaalsContact NH2-CB 3.29Å; R124-L433 PolarHBondContact NH1-O 2.83Å; R124-Y434 HydrophobicContact CG-CE1 4.46Å
125	L	94.3	Very high	87.4	Confident	29 Å²	29	62.2 Å²	62.2	15%	0.152	30%	0.304	C	S	.	.			trans	-108.8	172.9	172.1	-60.2	179.9	0	0	0	109.9	K123 F421 L433 A435	K123-L125 HydrophobicContact CD-CD2 4.22Å; K123-L125 HydrophobicContact CG-CD2 4.21Å; K123-L125 PolarHBondContact O-N 2.92Å; L125-F421 HydrophobicContact CD1-CD1 3.9Å; L125-F421 HydrophobicContact CD1-CE1 3.63Å; L125-L433 HydrophobicContact CB-CB 4.07Å; L125-L433 HydrophobicContact CB-CD2 4.1Å; L125-L433 HydrophobicContact CB-CG 4.19Å; L125-L433 HydrophobicContact CD1-CD2 3.81Å; L125-L433 HydrophobicContact CD1-CG 4.06Å; L125-L433 PolarHBondContact N-O 3.41Å; L125-A435 HydrophobicContact CD1-CB 3.69Å; L125-A435 HydrophobicContact CG-CB 4.2Å
126	S	92.6	Very high	89.1	Confident	31 Å²	31	59.5 Å²	59.5	22%	0.217	29%	0.287	C	S	.	.			trans	-58.3	144.2	171.7	53.6	0	0	0	0	110.3	V128 S167 N169 L433	S126-V128 PolarHBondContact O-N 2.83Å; S126-S167 PolarHBondContact OG-O 3.25Å; S126-N169 PolarHBondContact O-ND2 3.32Å; S126-N169 PolarHBondContact OG-ND2 2.98Å; S126-N169 VanDerWaalsContact OG-ND2 3.13Å; S126-L433 WeakPolarHBondContact O-CB 3.33Å
127	D	94.9	Very high	91	Very high	17 Å²	17	52.5 Å²	52.5	9%	0.091	26%	0.264	C	S	.	.			trans	-54.5	132.6	173.9	-72.9	-15.8	0	0	0	109.9	R124 N129 R130 A431	R124-D127 IonicContact CZ-OD1 3.8Å; R124-D127 IonicContact NH1-OD1 3.32Å; R124-D127 PolarHBondContact NH1-OD1 2.95Å; R124-D127 IonicContact NH2-OD1 3.05Å; R124-D127 PolarHBondContact NH2-OD1 2.94Å; D127-N129 PolarHBondContact O-N 3.45Å; D127-R130 WeakPolarHBondContact O-CB 3.44Å; D127-R130 PolarHBondContact O-N 3.3Å; D127-A431 CarbonylContact C-O 3.08Å; D127-A431 VanDerWaalsContact CA-O 3.26Å; D127-A431 WeakPolarHBondContact CA-O 3.45Å
128	V	96.1	Very high	92.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-41	-176.3	-173.6	0	0	0	0	110.5	S126 R130 L150 F162 N169 A431 L433	S126-V128 PolarHBondContact O-N 2.83Å; V128-R130 VanDerWaalsContact C-N 3.3Å; V128-R130 PolarHBondContact O-N 3.09Å; V128-L150 HydrophobicContact CB-CD2 4.31Å; V128-L150 HydrophobicContact CG1-CB 4.13Å; V128-L150 HydrophobicContact CG1-CD2 3.84Å; V128-L150 HydrophobicContact CG1-CG 4.41Å; V128-L150 HydrophobicContact CG2-CD1 4.4Å; V128-F162 HydrophobicContact CG1-CB 3.51Å; V128-F162 HydrophobicContact CG1-CD2 4.11Å; V128-F162 HydrophobicContact CG1-CG 3.88Å; V128-F162 WeakPolarHBondContact O-CD1 3.42Å; V128-N169 HydrophobicContact CG1-CB 4.25Å; V128-N169 WeakPolarHBondContact O-CB 3.42Å; V128-A431 HydrophobicContact CB-CB 4.28Å; V128-A431 PolarHBondContact N-O 3.5Å; V128-L433 HydrophobicContact CG2-CB 3.62Å; V128-L433 HydrophobicContact CG2-CD1 3.69Å; V128-L433 HydrophobicContact CG2-CD2 4.04Å; V128-L433 HydrophobicContact CG2-CG 3.97Å
129	N	95.9	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	32.3	-175.3	73.1	-22.4	0	0	0	113.3	D127 E131 R132 R133 T152 F162 G429 A431	D127-N129 PolarHBondContact O-N 3.45Å; N129-E131 VanDerWaalsContact C-N 3.34Å; N129-E131 PolarHBondContact O-N 2.86Å; N129-R132 CarbonylContact O-C 3.37Å; N129-R132 PolarHBondContact O-N 2.75Å; N129-R133 WeakPolarHBondContact O-CA 3.46Å; N129-R133 VanDerWaalsContact O-CG 3.27Å; N129-R133 WeakPolarHBondContact O-CG 3.35Å; N129-R133 PolarHBondContact O-N 2.94Å; N129-T152 HydrophobicContact CB-CG2 4.48Å; N129-F162 HydrophobicContact CB-CD2 4.35Å; N129-F162 HydrophobicContact CB-CE1 4Å; N129-F162 HydrophobicContact CB-CE2 3.59Å; N129-F162 HydrophobicContact CB-CZ 3.39Å; N129-G429 PolarHBondContact ND2-O 3.42Å; N129-A431 HydrophobicContact CB-CB 4.27Å; N129-A431 PolarHBondContact OD1-N 3.27Å
130	R	92.9	Very high	94.1	Very high	146 Å²	146	40.6 Å²	40.6	55%	0.551	20%	0.204	S	C	*	.	S	Bend	trans	-59.7	-41.6	-177.6	-173.9	-178.6	-177.1	-171	2.4	112.9	D127 V128	D127-R130 WeakPolarHBondContact O-CB 3.44Å; D127-R130 PolarHBondContact O-N 3.3Å; V128-R130 VanDerWaalsContact C-N 3.3Å; V128-R130 PolarHBondContact O-N 3.09Å
131	E	93.1	Very high	94.5	Very high	102 Å²	102	40.4 Å²	40.4	48%	0.477	20%	0.203	S	C	.	.	S	Bend	trans	-70.7	-36.4	178.8	-70.6	-170.7	-179.8	0	0	112.4	N129 L171	N129-E131 VanDerWaalsContact C-N 3.34Å; N129-E131 PolarHBondContact O-N 2.86Å; E131-L171 HydrophobicContact CB-CB 4.11Å; E131-L171 VanDerWaalsContact OE2-CB 3.28Å; E131-L171 WeakPolarHBondContact OE2-CB 3.19Å; E131-L171 PolarHBondContact OE2-N 3.03Å
132	R	93.6	Very high	95	Very high	6 Å²	6	40.6 Å²	40.6	2%	0.023	19%	0.194	C	C	.	.	S	Bend	trans	-132.8	78	-179.7	-173.9	64.3	178.7	95.7	-4.6	111.2	N129 F162 L171 D174	N129-R132 CarbonylContact O-C 3.37Å; N129-R132 PolarHBondContact O-N 2.75Å; R132-F162 HydrophobicContact CB-CE1 3.94Å; R132-F162 HydrophobicContact CB-CZ 3.89Å; R132-L171 HydrophobicContact CB-CD1 3.87Å; R132-L171 HydrophobicContact CB-CD2 3.97Å; R132-L171 HydrophobicContact CB-CG 4.4Å; R132-L171 HydrophobicContact CG-CD1 4.34Å; R132-L171 HydrophobicContact CG-CD2 4.4Å; R132-D174 HydrophobicContact CG-CB 4.34Å; R132-D174 IonicContact CZ-OD2 3.8Å; R132-D174 IonicContact NE-OD2 2.88Å; R132-D174 PolarHBondContact NE-OD2 3.01Å; R132-D174 IonicContact NH2-OD2 3.83Å
133	R	93.9	Very high	95.2	Very high	77 Å²	77	39.9 Å²	39.9	29%	0.291	19%	0.189	S	C	.	.			trans	-66.4	138.6	176	-66.5	-178.5	173.6	-167.7	-5.9	110.1	N129	N129-R133 WeakPolarHBondContact O-CA 3.46Å; N129-R133 VanDerWaalsContact O-CG 3.27Å; N129-R133 WeakPolarHBondContact O-CG 3.35Å; N129-R133 PolarHBondContact O-N 2.94Å
134	S	95	Very high	95.4	Very high	7 Å²	7	33 Å²	33	5%	0.049	16%	0.159	C	C	.	.			trans	-76.4	149.6	172.7	-58	0	0	0	0	110	G429	S134-G429 PolarHBondContact N-O 3.24Å
135	M	93	Very high	95.2	Very high	60 Å²	60	33.2 Å²	33.2	30%	0.296	17%	0.168	S	C	.	.	S	Bend	trans	-90.6	-9.7	-178.5	-62.1	-54.6	-49.7	0	0	113	K79 L83 D156	K79-M135 HydrophobicContact CB-CE 4.15Å; K79-M135 HydrophobicContact CD-CE 3.53Å; K79-M135 HydrophobicContact CG-CE 3.47Å; K79-M135 VanDerWaalsContact CG-CE 3.47Å; K79-M135 HydrophobicContact CG-SD 4.44Å; L83-M135 HydrophobicContact CD1-CE 3.69Å; L83-M135 HydrophobicContact CD1-SD 3.44Å; L83-M135 WeakPolarHBondContact CD1-SD 3.18Å; M135-D156 HydrophobicContact CB-CB 4.12Å; M135-D156 PolarHBondContact N-OD2 2.8Å
136	A	94.4	Very high	94.9	Very high	28 Å²	28	37.9 Å²	37.9	23%	0.231	19%	0.189	C	C	.	.	S	Bend	trans	-142.3	178.9	177.5	0	0	0	0	0	111	I138 S154 V155 D156 G429	A136-I138 PolarHBondContact O-N 2.78Å; A136-S154 VanDerWaalsContact C-OG 3.3Å; A136-S154 PolarHBondContact O-OG 2.91Å; A136-V155 HydrophobicContact CB-CB 4.04Å; A136-D156 HydrophobicContact CB-CB 3.87Å; A136-G429 WeakPolarHBondContact O-CA 3.13Å
137	S	96.9	Very high	94.9	Very high	32 Å²	32	41.8 Å²	41.8	22%	0.224	20%	0.203	C	C	.	.			trans	-48.6	133.5	179.6	-177.4	0	0	0	0	113.1	S154 V155 T411 C427	S137-S154 WeakPolarHBondContact O-CA 3.33Å; S137-S154 PolarHBondContact O-OG 3.01Å; S137-V155 PolarHBondContact O-N 2.77Å; S137-T411 WeakPolarHBondContact OG-CG2 3.3Å; S137-C427 VanDerWaalsContact CA-O 3.3Å; S137-C427 WeakPolarHBondContact CA-O 3.49Å; S137-C427 PolarHBondContact N-O 2.98Å
138	I	98.2	Very high	94.8	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.2	173	-64.9	165.3	0	0	0	108.5	A136 S140 T141 A153 T411 Q426 R430 A431	A136-I138 PolarHBondContact O-N 2.78Å; I138-S140 WeakPolarHBondContact CG2-O 3.23Å; I138-T141 HydrophobicContact CG2-CG2 3.74Å; I138-A153 CarbonylContact C-O 3.56Å; I138-A153 WeakPolarHBondContact CA-O 3.26Å; I138-A153 WeakPolarHBondContact CG2-O 3.43Å; I138-T411 WeakPolarHBondContact O-CB 3.4Å; I138-T411 PolarHBondContact O-OG1 3.16Å; I138-Q426 PolarHBondContact N-O 3.06Å; I138-R430 VanDerWaalsContact CD1-C 3.46Å; I138-R430 WeakPolarHBondContact CD1-O 3.11Å; I138-A431 HydrophobicContact CD1-CB 3.89Å
139	V	97.4	Very high	94.8	Very high	37 Å²	37	49.8 Å²	49.8	22%	0.224	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-23.5	-178.7	-63.6	0	0	0	0	112.9	A153 V155 L182 S183	V139-A153 HydrophobicContact CG2-CB 4.03Å; V139-A153 VanDerWaalsContact CG2-O 3.29Å; V139-A153 WeakPolarHBondContact CG2-O 3.49Å; V139-A153 PolarHBondContact N-O 3.14Å; V139-V155 HydrophobicContact CG1-CG2 3.5Å; V139-L182 HydrophobicContact CG2-CB 4.26Å; V139-S183 WeakPolarHBondContact CB-O 3.34Å
140	S	98.3	Very high	94.9	Very high	5 Å²	5	49.8 Å²	49.8	4%	0.035	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	135.4	175.9	-162.8	0	0	0	0	111.2	I138 T152 A153 A185	I138-S140 WeakPolarHBondContact CG2-O 3.23Å; S140-T152 WeakPolarHBondContact O-CA 3.49Å; S140-A153 PolarHBondContact N-O 3.04Å; S140-A153 PolarHBondContact O-N 3.27Å; S140-A185 WeakPolarHBondContact CB-O 3.16Å; S140-A185 PolarHBondContact OG-O 2.98Å
141	T	97.5	Very high	95.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	114.9	169.4	43.2	0	0	0	0	107.2	I138 L151 T152 S412	I138-T141 HydrophobicContact CG2-CG2 3.74Å; T141-L151 WeakPolarHBondContact CA-O 3.3Å; T141-T152 HydrophobicContact CG2-CG2 4.44Å; T141-S412 VanDerWaalsContact CG2-OG 3.3Å; T141-S412 WeakPolarHBondContact CG2-OG 3.19Å; T141-S412 PolarHBondContact N-OG 3.04Å; T141-S412 PolarHBondContact OG1-OG 3.15Å
142	E	97.5	Very high	95.4	Very high	39 Å²	39	38 Å²	38	18%	0.182	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.2	-176.4	-166.4	-177.5	-142.4	0	0	111.4	L150 L151 K186 F187	E142-L150 CarbonylContact O-C 3.06Å; E142-L150 WeakPolarHBondContact O-CA 3.42Å; E142-L151 PolarHBondContact N-O 3.22Å; E142-L151 PolarHBondContact O-N 3.11Å; E142-K186 WeakPolarHBondContact OE1-CD 3.3Å; E142-K186 IonicContact OE1-NZ 3.45Å; E142-K186 VanDerWaalsContact OE2-C 3.28Å; E142-K186 WeakPolarHBondContact OE2-CA 3.32Å; E142-F187 HydrophobicContact CB-CD2 4.29Å; E142-F187 HydrophobicContact CG-CD2 4.08Å; E142-F187 WeakPolarHBondContact O-CE2 3.21Å; E142-F187 PolarHBondContact OE2-N 3.14Å
143	F	97.5	Very high	95.6	Very high	10 Å²	10	37.7 Å²	37.7	4%	0.044	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	138.5	175.3	-69	-92.8	0	0	0	110	L150 V164 G414 F415 F421 C423 L433 Y442	F143-L150 HydrophobicContact CD1-CB 4.21Å; F143-L150 HydrophobicContact CD1-CD1 3.94Å; F143-L150 HydrophobicContact CD2-CD1 3.92Å; F143-L150 HydrophobicContact CE1-CB 4.28Å; F143-L150 HydrophobicContact CE1-CD1 3.57Å; F143-L150 HydrophobicContact CE2-CD1 3.53Å; F143-L150 HydrophobicContact CG-CD1 4.13Å; F143-L150 HydrophobicContact CZ-CD1 3.36Å; F143-V164 HydrophobicContact CD1-CG2 4.06Å; F143-V164 HydrophobicContact CE1-CB 4.49Å; F143-V164 HydrophobicContact CE1-CG1 4Å; F143-V164 HydrophobicContact CE1-CG2 3.84Å; F143-G414 WeakPolarHBondContact CE2-O 3.13Å; F143-F415 VanDerWaalsContact CD2-O 3.25Å; F143-F415 WeakPolarHBondContact CD2-O 3.46Å; F143-F421 HydrophobicContact CE1-CB 3.91Å; F143-F421 HydrophobicContact CZ-CB 3.73Å; F143-C423 HydrophobicContact CE2-CB 3.61Å; F143-C423 HydrophobicContact CZ-CB 3.74Å; F143-L433 HydrophobicContact CE1-CD1 4.43Å; F143-L433 HydrophobicContact CZ-CD1 3.94Å; F143-Y442 AromaticContact CD1-CE2 3.73Å; F143-Y442 HydrophobicContact CD1-CE2 3.73Å; F143-Y442 HydrophobicContact CE1-CE2 4.34Å
144	N	96.4	Very high	95.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.			trans	-71.7	142.6	171.1	-171.2	-80.7	0	0	0	109.7	H146 H147 M149 F187 G191 P417 Y442	N144-H146 PolarHBondContact OD1-N 3.09Å; N144-H147 HydrophobicContact CB-CB 4.49Å; N144-H147 PolarHBondContact OD1-N 3.23Å; N144-M149 HydrophobicContact CB-CB 4.12Å; N144-M149 HydrophobicContact CB-CE 4.02Å; N144-M149 PolarHBondContact N-O 3.47Å; N144-F187 HydrophobicContact CB-CD2 4.14Å; N144-F187 HydrophobicContact CB-CE1 4.29Å; N144-F187 HydrophobicContact CB-CE2 3.8Å; N144-F187 HydrophobicContact CB-CZ 3.9Å; N144-F187 WeakPolarHBondContact ND2-CD1 3.36Å; N144-F187 WeakPolarHBondContact ND2-CE1 3.32Å; N144-G191 WeakPolarHBondContact ND2-CA 3.43Å; N144-G191 PolarHBondContact ND2-O 2.99Å; N144-P417 WeakPolarHBondContact O-CG 3.28Å; N144-Y442 PolarHBondContact N-OH 3.36Å; N144-Y442 WeakPolarHBondContact O-CE1 3.3Å; N144-Y442 PolarHBondContact O-OH 3.37Å
145	T	89.9	Confident	95.8	Very high	70 Å²	70	36.3 Å²	36.3	43%	0.429	18%	0.183	S	C	.	.	S	Bend	trans	-75.3	-30.7	-176.6	47.3	0	0	0	0	113.9
146	H	88.6	Confident	95.9	Very high	126 Å²	126	33.6 Å²	33.6	58%	0.583	17%	0.169	S	C	*	.	S	Bend	trans	-108	-28.2	-173	-62	-74.5	0	0	0	113.3	N144 C190	N144-H146 PolarHBondContact OD1-N 3.09Å; H146-C190 VanDerWaalsContact CD2-C 3.42Å; H146-C190 PolarHBondContact CD2-O 3.01Å; H146-C190 PolarHBondContact NE2-O 2.76Å
147	H	91	Very high	95.9	Very high	113 Å²	113	32.2 Å²	32.2	52%	0.523	16%	0.158	S	C	.	.	S	Bend	trans	-112.7	146	-179.2	-57.7	-63	0	0	0	110.5	N144 M149 Y442	N144-H147 HydrophobicContact CB-CB 4.49Å; N144-H147 PolarHBondContact OD1-N 3.23Å; H147-M149 HydrophobicContact CB-CB 4.25Å; H147-M149 PolarHBondContact O-N 2.84Å; H147-Y442 WeakPolarHBondContact O-CE1 3.44Å; H147-Y442 PolarHBondContact O-OH 3.38Å
148	R	93.7	Very high	95.9	Very high	169 Å²	169	30.8 Å²	30.8	64%	0.638	15%	0.148	S	C	*	.	S	Bend	trans	-72.5	70.9	172.1	-69.3	-170.3	174.5	175.4	-0.3	110.9	K163 V164 Y442	R148-K163 WeakPolarHBondContact O-CA 3.3Å; R148-V164 PolarHBondContact O-N 2.8Å; R148-Y442 HydrophobicContact CB-CD2 4.28Å; R148-Y442 HydrophobicContact CB-CE2 4.24Å; R148-Y442 HydrophobicContact CG-CD1 4.14Å; R148-Y442 HydrophobicContact CG-CD2 3.89Å; R148-Y442 HydrophobicContact CG-CE1 4.5Å; R148-Y442 HydrophobicContact CG-CE2 4.29Å; R148-Y442 HydrophobicContact CG-CG 3.82Å
149	M	95.6	Very high	95.8	Very high	16 Å²	16	30.8 Å²	30.8	8%	0.079	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.2	-170.1	175.4	171.3	71	0	0	110.7	N144 H147 F161 F162 L172 F187 L208 Y442	N144-M149 HydrophobicContact CB-CB 4.12Å; N144-M149 HydrophobicContact CB-CE 4.02Å; N144-M149 PolarHBondContact N-O 3.47Å; H147-M149 HydrophobicContact CB-CB 4.25Å; H147-M149 PolarHBondContact O-N 2.84Å; M149-F161 HydrophobicContact CE-CD1 4.17Å; M149-F161 HydrophobicContact CG-CB 4.31Å; M149-F161 HydrophobicContact CG-CD1 4.36Å; M149-F161 HydrophobicContact SD-CB 3.91Å; M149-F161 HydrophobicContact SD-CD1 3.81Å; M149-F161 HydrophobicContact SD-CG 4.18Å; M149-F162 CarbonylContact C-O 3.56Å; M149-F162 WeakPolarHBondContact CA-O 3.07Å; M149-L172 HydrophobicContact CB-CD1 4.19Å; M149-L172 HydrophobicContact CG-CD1 3.81Å; M149-L172 HydrophobicContact SD-CD1 3.72Å; M149-F187 HydrophobicContact CE-CE1 3.62Å; M149-F187 HydrophobicContact CE-CZ 3.61Å; M149-L208 HydrophobicContact CE-CD1 3.84Å; M149-L208 HydrophobicContact CE-CD2 4.03Å; M149-Y442 PolarHBondContact N-OH 3.44Å; M149-Y442 PolarHBondContact O-OH 3.09Å
150	L	97.5	Very high	95.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133	173	-178.1	138.4	0	0	0	110.7	V128 E142 F143 T152 F161 F162 V164 C423	V128-L150 HydrophobicContact CB-CD2 4.31Å; V128-L150 HydrophobicContact CG1-CB 4.13Å; V128-L150 HydrophobicContact CG1-CD2 3.84Å; V128-L150 HydrophobicContact CG1-CG 4.41Å; V128-L150 HydrophobicContact CG2-CD1 4.4Å; E142-L150 CarbonylContact O-C 3.06Å; E142-L150 WeakPolarHBondContact O-CA 3.42Å; F143-L150 HydrophobicContact CD1-CB 4.21Å; F143-L150 HydrophobicContact CD1-CD1 3.94Å; F143-L150 HydrophobicContact CD2-CD1 3.92Å; F143-L150 HydrophobicContact CE1-CB 4.28Å; F143-L150 HydrophobicContact CE1-CD1 3.57Å; F143-L150 HydrophobicContact CE2-CD1 3.53Å; F143-L150 HydrophobicContact CG-CD1 4.13Å; F143-L150 HydrophobicContact CZ-CD1 3.36Å; L150-T152 HydrophobicContact CD2-CG2 3.43Å; L150-T152 VanDerWaalsContact CD2-CG2 3.43Å; L150-F161 CarbonylContact O-C 3.59Å; L150-F161 WeakPolarHBondContact O-CA 3.34Å; L150-F162 PolarHBondContact N-O 2.86Å; L150-F162 PolarHBondContact O-N 2.89Å; L150-V164 HydrophobicContact CB-CG2 3.6Å; L150-C423 HydrophobicContact CD1-CB 3.44Å; L150-C423 VanDerWaalsContact CD1-CB 3.44Å
151	L	98.1	Very high	95.8	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.2	169.4	165.5	65.8	0	0	0	109.6	T141 E142 M159 A160 F161 A185 F187 V194	T141-L151 WeakPolarHBondContact CA-O 3.3Å; E142-L151 PolarHBondContact N-O 3.22Å; E142-L151 PolarHBondContact O-N 3.11Å; L151-M159 HydrophobicContact CD1-CG 3.38Å; L151-M159 HydrophobicContact CD1-SD 3.95Å; L151-A160 WeakPolarHBondContact CA-O 3.48Å; L151-F161 HydrophobicContact CB-CD1 4.32Å; L151-F161 HydrophobicContact CB-CE1 4.19Å; L151-F161 HydrophobicContact CD1-CD1 4.24Å; L151-F161 HydrophobicContact CD1-CE1 3.68Å; L151-F161 HydrophobicContact CD1-CZ 3.91Å; L151-F161 HydrophobicContact CG-CE1 4.41Å; L151-A185 HydrophobicContact CD2-CB 3.87Å; L151-F187 HydrophobicContact CB-CD2 4.32Å; L151-F187 HydrophobicContact CB-CE2 3.44Å; L151-F187 VanDerWaalsContact CB-CE2 3.44Å; L151-F187 HydrophobicContact CB-CZ 3.6Å; L151-F187 HydrophobicContact CD2-CD2 4.46Å; L151-F187 HydrophobicContact CD2-CE2 4.29Å; L151-F187 HydrophobicContact CD2-CZ 4.48Å; L151-V194 HydrophobicContact CD2-CG1 3.62Å; L151-V194 HydrophobicContact CD2-CG2 4.15Å
152	T	98.4	Very high	95.8	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.1	161	64.6	0	0	0	0	109.6	N129 S140 T141 L150 M159 A160 F162 A431	N129-T152 HydrophobicContact CB-CG2 4.48Å; S140-T152 WeakPolarHBondContact O-CA 3.49Å; T141-T152 HydrophobicContact CG2-CG2 4.44Å; L150-T152 HydrophobicContact CD2-CG2 3.43Å; L150-T152 VanDerWaalsContact CD2-CG2 3.43Å; T152-M159 WeakPolarHBondContact O-CA 3.39Å; T152-A160 PolarHBondContact N-O 2.84Å; T152-A160 PolarHBondContact O-N 2.87Å; T152-A160 PolarHBondContact OG1-O 2.94Å; T152-F162 HydrophobicContact CG2-CD2 4.19Å; T152-F162 HydrophobicContact CG2-CE2 3.94Å; T152-F162 WeakPolarHBondContact OG1-CE2 3.38Å; T152-A431 HydrophobicContact CG2-CB 4.06Å
153	A	98.3	Very high	95.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.4	170.9	0	0	0	0	0	109.3	I138 V139 S140 L182 A185	I138-A153 CarbonylContact C-O 3.56Å; I138-A153 WeakPolarHBondContact CA-O 3.26Å; I138-A153 WeakPolarHBondContact CG2-O 3.43Å; V139-A153 HydrophobicContact CG2-CB 4.03Å; V139-A153 VanDerWaalsContact CG2-O 3.29Å; V139-A153 WeakPolarHBondContact CG2-O 3.49Å; V139-A153 PolarHBondContact N-O 3.14Å; S140-A153 PolarHBondContact N-O 3.04Å; S140-A153 PolarHBondContact O-N 3.27Å; A153-L182 HydrophobicContact CB-CB 4.41Å; A153-L182 HydrophobicContact CB-CD1 3.81Å; A153-A185 HydrophobicContact CB-CB 3.56Å
154	S	97.7	Very high	95.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154.4	-176.9	174.1	0	0	0	0	112.9	A136 S137 D156 S157 T158 L182	A136-S154 VanDerWaalsContact C-OG 3.3Å; A136-S154 PolarHBondContact O-OG 2.91Å; S137-S154 WeakPolarHBondContact O-CA 3.33Å; S137-S154 PolarHBondContact O-OG 3.01Å; S154-D156 WeakPolarHBondContact CB-OD1 3.15Å; S154-D156 PolarHBondContact O-N 2.91Å; S154-D156 VanDerWaalsContact O-N 3.14Å; S154-D156 PolarHBondContact OG-N 3.39Å; S154-D156 PolarHBondContact OG-OD1 2.81Å; S154-S157 PolarHBondContact O-N 2.81Å; S154-S157 VanDerWaalsContact O-N 3.14Å; S154-T158 PolarHBondContact N-O 3.04Å; S154-L182 WeakPolarHBondContact O-CB 3.4Å
155	V	95.9	Very high	95.3	Very high	56 Å²	56	33.9 Å²	33.9	34%	0.339	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-23	174	-179.2	0	0	0	0	111.7	A136 S137 V139 S157 S181	A136-V155 HydrophobicContact CB-CB 4.04Å; S137-V155 PolarHBondContact O-N 2.77Å; V139-V155 HydrophobicContact CG1-CG2 3.5Å; V155-S157 PolarHBondContact O-N 3.34Å; V155-S181 WeakPolarHBondContact CG1-OG 3.33Å; V155-S181 PolarHBondContact O-OG 3.22Å; V155-S181 VanDerWaalsContact O-OG 3.09Å
156	D	93.9	Very high	94.9	Very high	2 Å²	2	31 Å²	31	1%	0.011	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	11.5	175.7	70.8	-0.4	0	0	0	114.3	P71 M135 A136 S154 T158	P71-D156 HydrophobicContact CG-CB 4.33Å; M135-D156 HydrophobicContact CB-CB 4.12Å; M135-D156 PolarHBondContact N-OD2 2.8Å; A136-D156 HydrophobicContact CB-CB 3.87Å; S154-D156 WeakPolarHBondContact CB-OD1 3.15Å; S154-D156 PolarHBondContact O-N 2.91Å; S154-D156 VanDerWaalsContact O-N 3.14Å; S154-D156 PolarHBondContact OG-N 3.39Å; S154-D156 PolarHBondContact OG-OD1 2.81Å; D156-T158 VanDerWaalsContact CG-OG1 3.26Å; D156-T158 PolarHBondContact O-N 2.96Å; D156-T158 WeakPolarHBondContact OD1-CB 2.85Å; D156-T158 VanDerWaalsContact OD1-CG2 3.3Å; D156-T158 WeakPolarHBondContact OD1-CG2 3.19Å; D156-T158 PolarHBondContact OD1-N 2.79Å; D156-T158 PolarHBondContact OD1-OG1 2.79Å; D156-T158 PolarHBondContact OD2-OG1 2.82Å
157	S	95.4	Very high	94.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	69.6	9.6	-176	75.3	0	0	0	0	115.7	S154 V155 V176 Y177 F180	S154-S157 PolarHBondContact O-N 2.81Å; S154-S157 VanDerWaalsContact O-N 3.14Å; V155-S157 PolarHBondContact O-N 3.34Å; S157-V176 VanDerWaalsContact OG-CG1 3.3Å; S157-V176 WeakPolarHBondContact OG-CG1 3.17Å; S157-Y177 VanDerWaalsContact CB-O 3.23Å; S157-Y177 WeakPolarHBondContact CB-O 3.39Å; S157-Y177 PolarHBondContact O-N 3.27Å; S157-F180 WeakPolarHBondContact CB-O 3.23Å
158	T	96.1	Very high	94.8	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.6	179	69.5	0	0	0	0	112.7	V76 S154 D156 R175 V176 L182	V76-T158 HydrophobicContact CG1-CG2 3.72Å; S154-T158 PolarHBondContact N-O 3.04Å; D156-T158 VanDerWaalsContact CG-OG1 3.26Å; D156-T158 PolarHBondContact O-N 2.96Å; D156-T158 WeakPolarHBondContact OD1-CB 2.85Å; D156-T158 VanDerWaalsContact OD1-CG2 3.3Å; D156-T158 WeakPolarHBondContact OD1-CG2 3.19Å; D156-T158 PolarHBondContact OD1-N 2.79Å; D156-T158 PolarHBondContact OD1-OG1 2.79Å; D156-T158 PolarHBondContact OD2-OG1 2.82Å; T158-R175 WeakPolarHBondContact CA-O 3.16Å; T158-V176 HydrophobicContact CG2-CG1 4.28Å; T158-V176 HydrophobicContact CG2-CG2 3.87Å; T158-L182 WeakPolarHBondContact O-CD1 3.44Å
159	M	97.4	Very high	94.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.3	167.6	-169.1	171	70.3	0	0	108	L151 T152 F161 D174 R175 Y177 L182 V194 F196 Y206	L151-M159 HydrophobicContact CD1-CG 3.38Å; L151-M159 HydrophobicContact CD1-SD 3.95Å; T152-M159 WeakPolarHBondContact O-CA 3.39Å; M159-F161 HydrophobicContact CE-CE2 3.91Å; M159-F161 HydrophobicContact CE-CZ 3.81Å; M159-F161 HydrophobicContact CG-CE2 4.27Å; M159-F161 HydrophobicContact CG-CZ 4.21Å; M159-F161 HydrophobicContact SD-CZ 4.2Å; M159-D174 CarbonylContact O-C 3.41Å; M159-D174 WeakPolarHBondContact O-CA 3.41Å; M159-R175 PolarHBondContact N-O 3.28Å; M159-R175 PolarHBondContact O-N 2.47Å; M159-Y177 HydrophobicContact CB-CD2 4.47Å; M159-Y177 HydrophobicContact CB-CE2 3.91Å; M159-Y177 HydrophobicContact CE-CE2 3.86Å; M159-Y177 VanDerWaalsContact CE-OH 3.28Å; M159-Y177 WeakPolarHBondContact CE-OH 3.44Å; M159-Y177 HydrophobicContact SD-CE2 4.38Å; M159-L182 HydrophobicContact CB-CD1 3.97Å; M159-V194 HydrophobicContact SD-CB 4.42Å; M159-V194 HydrophobicContact SD-CG1 3.81Å; M159-F196 HydrophobicContact CE-CD1 4.42Å; M159-F196 HydrophobicContact CE-CE1 4.33Å; M159-F196 HydrophobicContact SD-CD1 4.11Å; M159-F196 HydrophobicContact SD-CG 4.34Å; M159-Y206 HydrophobicContact CE-CD1 3.57Å; M159-Y206 HydrophobicContact CE-CE1 4.25Å; M159-Y206 HydrophobicContact CE-CG 3.75Å
160	A	97.9	Very high	94.7	Very high	2 Å²	2	22.2 Å²	22.2	2%	0.017	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.5	-176.5	0	0	0	0	0	111.6	L151 T152 F162 L171 R173 D174	L151-A160 WeakPolarHBondContact CA-O 3.48Å; T152-A160 PolarHBondContact N-O 2.84Å; T152-A160 PolarHBondContact O-N 2.87Å; T152-A160 PolarHBondContact OG1-O 2.94Å; A160-F162 HydrophobicContact CB-CE2 3.6Å; A160-F162 HydrophobicContact CB-CZ 3.74Å; A160-L171 HydrophobicContact CB-CD1 4.17Å; A160-R173 CarbonylContact C-O 3.53Å; A160-R173 WeakPolarHBondContact CA-O 3.39Å; A160-D174 HydrophobicContact CB-CB 4Å
161	F	97.8	Very high	94.7	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.013	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.2	-178.5	-60.3	-83.3	0	0	0	109.3	M149 L150 L151 M159 L172 R173 F187 V194 Y206 L208	M149-F161 HydrophobicContact CE-CD1 4.17Å; M149-F161 HydrophobicContact CG-CB 4.31Å; M149-F161 HydrophobicContact CG-CD1 4.36Å; M149-F161 HydrophobicContact SD-CB 3.91Å; M149-F161 HydrophobicContact SD-CD1 3.81Å; M149-F161 HydrophobicContact SD-CG 4.18Å; L150-F161 CarbonylContact O-C 3.59Å; L150-F161 WeakPolarHBondContact O-CA 3.34Å; L151-F161 HydrophobicContact CB-CD1 4.32Å; L151-F161 HydrophobicContact CB-CE1 4.19Å; L151-F161 HydrophobicContact CD1-CD1 4.24Å; L151-F161 HydrophobicContact CD1-CE1 3.68Å; L151-F161 HydrophobicContact CD1-CZ 3.91Å; L151-F161 HydrophobicContact CG-CE1 4.41Å; M159-F161 HydrophobicContact CE-CE2 3.91Å; M159-F161 HydrophobicContact CE-CZ 3.81Å; M159-F161 HydrophobicContact CG-CE2 4.27Å; M159-F161 HydrophobicContact CG-CZ 4.21Å; M159-F161 HydrophobicContact SD-CZ 4.2Å; F161-L172 HydrophobicContact CB-CB 4.21Å; F161-L172 WeakPolarHBondContact O-CB 3.25Å; F161-L172 PolarHBondContact O-N 2.92Å; F161-R173 HydrophobicContact CD2-CB 4.21Å; F161-R173 PolarHBondContact N-O 3.41Å; F161-R173 PolarHBondContact O-N 3.33Å; F161-F187 HydrophobicContact CD1-CE1 4.33Å; F161-F187 HydrophobicContact CD1-CZ 4.01Å; F161-F187 AromaticContact CE1-CE1 3.84Å; F161-F187 HydrophobicContact CE1-CE1 3.84Å; F161-F187 AromaticContact CE1-CZ 3.85Å; F161-F187 HydrophobicContact CE1-CZ 3.85Å; F161-V194 HydrophobicContact CE1-CG2 3.71Å; F161-V194 HydrophobicContact CZ-CG2 3.81Å; F161-Y206 HydrophobicContact CD2-CE1 4.35Å; F161-Y206 AromaticContact CE2-CD1 3.85Å; F161-Y206 HydrophobicContact CE2-CD1 3.85Å; F161-Y206 AromaticContact CE2-CE1 3.39Å; F161-Y206 HydrophobicContact CE2-CE1 3.39Å; F161-Y206 AromaticContact CZ-CD1 3.62Å; F161-Y206 HydrophobicContact CZ-CD1 3.62Å; F161-Y206 AromaticContact CZ-CE1 3.59Å; F161-Y206 HydrophobicContact CZ-CE1 3.59Å; F161-L208 HydrophobicContact CD1-CD2 4Å; F161-L208 HydrophobicContact CE1-CD2 3.47Å; F161-L208 VanDerWaalsContact CE1-CD2 3.47Å; F161-L208 HydrophobicContact CE2-CD2 4.31Å; F161-L208 HydrophobicContact CZ-CD2 3.65Å
162	F	97.9	Very high	94.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.8	-178.8	-59.4	-85.7	0	0	0	109.8	V128 N129 R132 M149 L150 T152 A160 A170 L171	V128-F162 HydrophobicContact CG1-CB 3.51Å; V128-F162 HydrophobicContact CG1-CD2 4.11Å; V128-F162 HydrophobicContact CG1-CG 3.88Å; V128-F162 WeakPolarHBondContact O-CD1 3.42Å; N129-F162 HydrophobicContact CB-CD2 4.35Å; N129-F162 HydrophobicContact CB-CE1 4Å; N129-F162 HydrophobicContact CB-CE2 3.59Å; N129-F162 HydrophobicContact CB-CZ 3.39Å; R132-F162 HydrophobicContact CB-CE1 3.94Å; R132-F162 HydrophobicContact CB-CZ 3.89Å; M149-F162 CarbonylContact C-O 3.56Å; M149-F162 WeakPolarHBondContact CA-O 3.07Å; L150-F162 PolarHBondContact N-O 2.86Å; L150-F162 PolarHBondContact O-N 2.89Å; T152-F162 HydrophobicContact CG2-CD2 4.19Å; T152-F162 HydrophobicContact CG2-CE2 3.94Å; T152-F162 WeakPolarHBondContact OG1-CE2 3.38Å; A160-F162 HydrophobicContact CB-CE2 3.6Å; A160-F162 HydrophobicContact CB-CZ 3.74Å; F162-A170 CarbonylContact C-O 3.56Å; F162-A170 WeakPolarHBondContact CA-O 3.32Å; F162-L171 HydrophobicContact CD1-CB 4.23Å; F162-L171 HydrophobicContact CD1-CD1 4.09Å; F162-L171 HydrophobicContact CE1-CB 4.09Å; F162-L171 HydrophobicContact CE1-CD1 3.56Å; F162-L171 HydrophobicContact CE1-CG 4.44Å; F162-L171 HydrophobicContact CZ-CD1 3.89Å
163	K	96.2	Very high	94.4	Very high	99 Å²	99	33.9 Å²	33.9	43%	0.43	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	143.7	165.2	-173.6	-176.1	173.2	-161.2	0	108.5	R148 N169 A170 L172	R148-K163 WeakPolarHBondContact O-CA 3.3Å; K163-N169 CarbonylContact O-C 3.53Å; K163-N169 WeakPolarHBondContact O-CA 3.16Å; K163-A170 PolarHBondContact N-O 2.82Å; K163-L172 HydrophobicContact CB-CD1 4.37Å; K163-L172 HydrophobicContact CB-CD2 4.11Å; K163-L172 HydrophobicContact CB-CG 4.23Å
164	V	94.7	Very high	94.3	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.012	19%	0.191	C	C	.	.			trans	-109.7	102	175.3	-175.8	0	0	0	0	109.2	F143 R148 L150 F421 L433 Y442	F143-V164 HydrophobicContact CD1-CG2 4.06Å; F143-V164 HydrophobicContact CE1-CB 4.49Å; F143-V164 HydrophobicContact CE1-CG1 4Å; F143-V164 HydrophobicContact CE1-CG2 3.84Å; R148-V164 PolarHBondContact O-N 2.8Å; L150-V164 HydrophobicContact CB-CG2 3.6Å; V164-F421 HydrophobicContact CG1-CD1 4.42Å; V164-F421 HydrophobicContact CG1-CD2 3.88Å; V164-F421 HydrophobicContact CG1-CE1 4.5Å; V164-F421 HydrophobicContact CG1-CE2 3.98Å; V164-F421 HydrophobicContact CG1-CG 4.1Å; V164-F421 HydrophobicContact CG1-CZ 4.28Å; V164-L433 HydrophobicContact CG1-CD2 4.43Å; V164-Y442 HydrophobicContact CB-CE2 4.01Å; V164-Y442 HydrophobicContact CG1-CD2 4.44Å; V164-Y442 HydrophobicContact CG1-CE2 4.23Å; V164-Y442 HydrophobicContact CG2-CE2 4.29Å
165	D	88.1	Confident	94.1	Very high	51 Å²	51	40.4 Å²	40.4	27%	0.273	21%	0.207	S	C	.	.			trans	-117.5	-19	170.4	54.5	29	0	0	0	112.6	S167 E168 N169	D165-S167 PolarHBondContact OD1-N 3.21Å; D165-E168 PolarHBondContact OD1-N 2.89Å; D165-N169 PolarHBondContact N-OD1 2.78Å; D165-N169 PolarHBondContact OD1-N 3.14Å; D165-N169 PolarHBondContact OD1-OD1 2.84Å
166	G	82.3	Confident	94.1	Very high	11 Å²	11	39 Å²	39	11%	0.113	20%	0.199	C	C	.	.	S	Bend	trans	89.2	-0.7	-179.4	0	0	0	0	0	114.9	N169	G166-N169 PolarHBondContact N-OD1 3.03Å
167	S	88	Confident	94.1	Very high	77 Å²	77	39.7 Å²	39.7	54%	0.538	20%	0.201	S	C	.	.	S	Bend	trans	-124.1	-62.4	179.2	54.1	0	0	0	0	112.3	S126 D165	S126-S167 PolarHBondContact OG-O 3.25Å; D165-S167 PolarHBondContact OD1-N 3.21Å
168	E	89.4	Confident	93.7	Very high	135 Å²	135	44.9 Å²	44.9	63%	0.631	23%	0.225	S	C	*	.			trans	-91.1	-40.7	-176	-65	-176.8	169.8	0	0	110.6	D165 A170	D165-E168 PolarHBondContact OD1-N 2.89Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.4Å
169	N	93	Very high	93.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.251	C	S	.	.			trans	47.3	51.1	-177	-57.3	-46.1	0	0	0	112.9	S126 V128 K163 D165 G166	S126-N169 PolarHBondContact O-ND2 3.32Å; S126-N169 PolarHBondContact OG-ND2 2.98Å; S126-N169 VanDerWaalsContact OG-ND2 3.13Å; V128-N169 HydrophobicContact CG1-CB 4.25Å; V128-N169 WeakPolarHBondContact O-CB 3.42Å; K163-N169 CarbonylContact O-C 3.53Å; K163-N169 WeakPolarHBondContact O-CA 3.16Å; D165-N169 PolarHBondContact N-OD1 2.78Å; D165-N169 PolarHBondContact OD1-N 3.14Å; D165-N169 PolarHBondContact OD1-OD1 2.84Å; G166-N169 PolarHBondContact N-OD1 3.03Å
170	A	95.4	Very high	93	Very high	27 Å²	27	49.8 Å²	49.8	22%	0.223	25%	0.252	C	S	.	.			trans	-55.9	141.5	-172.3	0	0	0	0	0	113.3	F162 K163 E168 L172	F162-A170 CarbonylContact C-O 3.56Å; F162-A170 WeakPolarHBondContact CA-O 3.32Å; K163-A170 PolarHBondContact N-O 2.82Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.4Å; A170-L172 PolarHBondContact O-N 2.89Å
171	L	96.8	Very high	92.9	Very high	53 Å²	53	50.9 Å²	50.9	28%	0.277	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	120.3	172.2	177.7	70.8	0	0	0	109.3	E131 R132 A160 F162 D174	E131-L171 HydrophobicContact CB-CB 4.11Å; E131-L171 VanDerWaalsContact OE2-CB 3.28Å; E131-L171 WeakPolarHBondContact OE2-CB 3.19Å; E131-L171 PolarHBondContact OE2-N 3.03Å; R132-L171 HydrophobicContact CB-CD1 3.87Å; R132-L171 HydrophobicContact CB-CD2 3.97Å; R132-L171 HydrophobicContact CB-CG 4.4Å; R132-L171 HydrophobicContact CG-CD1 4.34Å; R132-L171 HydrophobicContact CG-CD2 4.4Å; A160-L171 HydrophobicContact CB-CD1 4.17Å; F162-L171 HydrophobicContact CD1-CB 4.23Å; F162-L171 HydrophobicContact CD1-CD1 4.09Å; F162-L171 HydrophobicContact CE1-CB 4.09Å; F162-L171 HydrophobicContact CE1-CD1 3.56Å; F162-L171 HydrophobicContact CE1-CG 4.44Å; F162-L171 HydrophobicContact CZ-CD1 3.89Å; L171-D174 HydrophobicContact CD1-CB 4.27Å
172	L	95.6	Very high	92.9	Very high	95 Å²	95	50.8 Å²	50.8	50%	0.497	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-46.5	173.7	-62.9	173.7	0	0	0	110.7	M149 F161 K163 A170	M149-L172 HydrophobicContact CB-CD1 4.19Å; M149-L172 HydrophobicContact CG-CD1 3.81Å; M149-L172 HydrophobicContact SD-CD1 3.72Å; F161-L172 HydrophobicContact CB-CB 4.21Å; F161-L172 WeakPolarHBondContact O-CB 3.25Å; F161-L172 PolarHBondContact O-N 2.92Å; K163-L172 HydrophobicContact CB-CD1 4.37Å; K163-L172 HydrophobicContact CB-CD2 4.11Å; K163-L172 HydrophobicContact CB-CG 4.23Å; A170-L172 PolarHBondContact O-N 2.89Å
173	R	94.9	Very high	92.8	Very high	96 Å²	96	52.5 Å²	52.5	36%	0.362	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	144.5	-177.7	-165.2	159	-178.7	175	4.6	111	A160 F161 R175 Y206	A160-R173 CarbonylContact C-O 3.53Å; A160-R173 WeakPolarHBondContact CA-O 3.39Å; F161-R173 HydrophobicContact CD2-CB 4.21Å; F161-R173 PolarHBondContact N-O 3.41Å; F161-R173 PolarHBondContact O-N 3.33Å; R173-R175 VanDerWaalsContact NH2-NH2 3.2Å; R173-Y206 WeakPolarHBondContact CD-OH 3.48Å; R173-Y206 PolarHBondContact NE-OH 3.32Å; R173-Y206 PolarHBondContact NH1-OH 2.66Å
174	D	94.9	Very high	92.9	Very high	48 Å²	48	48.3 Å²	48.3	26%	0.257	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	156.8	164.8	72.3	-26	0	0	0	111.9	R132 M159 A160 L171	R132-D174 HydrophobicContact CG-CB 4.34Å; R132-D174 IonicContact CZ-OD2 3.8Å; R132-D174 IonicContact NE-OD2 2.88Å; R132-D174 PolarHBondContact NE-OD2 3.01Å; R132-D174 IonicContact NH2-OD2 3.83Å; M159-D174 CarbonylContact O-C 3.41Å; M159-D174 WeakPolarHBondContact O-CA 3.41Å; A160-D174 HydrophobicContact CB-CB 4Å; L171-D174 HydrophobicContact CD1-CB 4.27Å
175	R	94.5	Very high	93.1	Very high	89 Å²	89	48.2 Å²	48.2	34%	0.336	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134.8	177.4	-76.1	-76.6	-164.1	179.1	0.1	107.9	T158 M159 R173 Y177 G211 E213	T158-R175 WeakPolarHBondContact CA-O 3.16Å; M159-R175 PolarHBondContact N-O 3.28Å; M159-R175 PolarHBondContact O-N 2.47Å; R173-R175 VanDerWaalsContact NH2-NH2 3.2Å; R175-Y177 HydrophobicContact CB-CE2 4.06Å; R175-G211 PolarHBondContact NH2-O 2.65Å; R175-E213 IonicContact NE-OE1 3.7Å
176	V	95.3	Very high	93.5	Very high	28 Å²	28	48.3 Å²	48.3	17%	0.17	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.7	173.6	-170	0	0	0	0	108.7	A73 V76 F77 S157 T158	A73-V176 HydrophobicContact CB-CB 3.95Å; A73-V176 HydrophobicContact CB-CG1 3.76Å; V76-V176 HydrophobicContact CG2-CG1 4.4Å; F77-V176 HydrophobicContact CE1-CG2 4.25Å; F77-V176 HydrophobicContact CE2-CG2 4.25Å; F77-V176 HydrophobicContact CZ-CG2 3.74Å; S157-V176 VanDerWaalsContact OG-CG1 3.3Å; S157-V176 WeakPolarHBondContact OG-CG1 3.17Å; T158-V176 HydrophobicContact CG2-CG1 4.28Å; T158-V176 HydrophobicContact CG2-CG2 3.87Å
177	Y	93.9	Very high	94.2	Very high	16 Å²	16	48.1 Å²	48.1	6%	0.063	25%	0.247	C	C	.	.			trans	-98.4	90.2	-178.8	-65.8	-80.2	0	0	0	110.7	S157 M159 R175 N179 F180 L182 F196 E213	S157-Y177 VanDerWaalsContact CB-O 3.23Å; S157-Y177 WeakPolarHBondContact CB-O 3.39Å; S157-Y177 PolarHBondContact O-N 3.27Å; M159-Y177 HydrophobicContact CB-CD2 4.47Å; M159-Y177 HydrophobicContact CB-CE2 3.91Å; M159-Y177 HydrophobicContact CE-CE2 3.86Å; M159-Y177 VanDerWaalsContact CE-OH 3.28Å; M159-Y177 WeakPolarHBondContact CE-OH 3.44Å; M159-Y177 HydrophobicContact SD-CE2 4.38Å; R175-Y177 HydrophobicContact CB-CE2 4.06Å; Y177-N179 PolarHBondContact O-N 2.6Å; Y177-F180 WeakPolarHBondContact O-CB 3.34Å; Y177-F180 PolarHBondContact O-N 3.1Å; Y177-L182 HydrophobicContact CD2-CD2 4.31Å; Y177-F196 HydrophobicContact CD1-CE2 4.16Å; Y177-F196 HydrophobicContact CD1-CZ 4.14Å; Y177-F196 AromaticContact CD2-CE2 3.95Å; Y177-F196 HydrophobicContact CD2-CE2 3.95Å; Y177-F196 HydrophobicContact CD2-CZ 4.31Å; Y177-F196 AromaticContact CE1-CE2 3.95Å; Y177-F196 HydrophobicContact CE1-CE2 3.95Å; Y177-F196 AromaticContact CE1-CZ 3.49Å; Y177-F196 HydrophobicContact CE1-CZ 3.49Å; Y177-F196 VanDerWaalsContact CE1-CZ 3.49Å; Y177-F196 HydrophobicContact CE2-CD2 4.47Å; Y177-F196 HydrophobicContact CE2-CE1 4.39Å; Y177-F196 AromaticContact CE2-CE2 3.71Å; Y177-F196 HydrophobicContact CE2-CE2 3.71Å; Y177-F196 AromaticContact CE2-CZ 3.68Å; Y177-F196 HydrophobicContact CE2-CZ 3.68Å; Y177-F196 HydrophobicContact CG-CE2 4.15Å; Y177-F196 AromaticContact CZ-CE1 3.93Å; Y177-F196 AromaticContact CZ-CE2 3.71Å; Y177-F196 AromaticContact CZ-CZ 3.21Å; Y177-F196 VanDerWaalsContact OH-CZ 3.3Å; Y177-F196 WeakPolarHBondContact OH-CZ 3.42Å; Y177-E213 HydrophobicContact CE1-CG 4.27Å; Y177-E213 VanDerWaalsContact OH-CD 3.27Å; Y177-E213 PolarHBondContact OH-OE1 2.79Å; Y177-E213 VanDerWaalsContact OH-OE1 3.12Å; Y177-E213 PolarHBondContact OH-OE2 3.18Å
178	E	88.4	Confident	94.6	Very high	108 Å²	108	44.9 Å²	44.9	51%	0.505	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	135.5	-178.4	-63	-162.9	144.7	0	0	112.8	A73 F180	A73-E178 HydrophobicContact CB-CG 3.68Å; A73-E178 VanDerWaalsContact CB-OE1 3.29Å; A73-E178 WeakPolarHBondContact CB-OE1 3.29Å; A73-E178 PolarHBondContact N-OE1 2.8Å; E178-F180 PolarHBondContact O-N 3.38Å; E178-F180 VanDerWaalsContact O-N 3.16Å
179	N	87.3	Confident	94.6	Very high	105 Å²	105	40.2 Å²	40.2	56%	0.561	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	23	-177.7	-56.4	-41.4	0	0	0	114.8	P70 Y177	P70-N179 HydrophobicContact CG-CB 4.5Å; Y177-N179 PolarHBondContact O-N 2.6Å
180	F	91.7	Very high	94.5	Very high	1 Å²	1	43.6 Å²	43.6	0%	0.004	23%	0.231	C	C	.	.			trans	-133.1	86.9	178.4	-167.3	-85.6	0	0	0	109.5	S157 Y177 E178 L182 F196 V200 R204	S157-F180 WeakPolarHBondContact CB-O 3.23Å; Y177-F180 WeakPolarHBondContact O-CB 3.34Å; Y177-F180 PolarHBondContact O-N 3.1Å; E178-F180 PolarHBondContact O-N 3.38Å; E178-F180 VanDerWaalsContact O-N 3.16Å; F180-L182 HydrophobicContact CD1-CD2 3.73Å; F180-L182 HydrophobicContact CE1-CD2 3.74Å; F180-L182 PolarHBondContact O-N 3.41Å; F180-F196 HydrophobicContact CD1-CD2 4.43Å; F180-F196 HydrophobicContact CD1-CE2 4.27Å; F180-F196 AromaticContact CE1-CD2 3.71Å; F180-F196 HydrophobicContact CE1-CD2 3.71Å; F180-F196 AromaticContact CE1-CE2 3.83Å; F180-F196 HydrophobicContact CE1-CE2 3.83Å; F180-F196 HydrophobicContact CZ-CD2 4.38Å; F180-F196 HydrophobicContact CZ-CE2 4.43Å; F180-V200 HydrophobicContact CD2-CG2 3.89Å; F180-V200 HydrophobicContact CE2-CG2 3.28Å; F180-V200 HydrophobicContact CZ-CG2 4.14Å; F180-R204 HydrophobicContact CE2-CG 4.39Å; F180-R204 HydrophobicContact CZ-CG 4.27Å
181	S	95.1	Very high	94.3	Very high	25 Å²	25	42.3 Å²	42.3	18%	0.175	22%	0.221	C	C	.	.			trans	-68.1	118.1	175.2	173.2	0	0	0	0	108.8	V155 G198 N199	V155-S181 WeakPolarHBondContact CG1-OG 3.33Å; V155-S181 PolarHBondContact O-OG 3.22Å; V155-S181 VanDerWaalsContact O-OG 3.09Å; S181-G198 CarbonylContact O-C 3.57Å; S181-G198 WeakPolarHBondContact O-CA 3.39Å; S181-N199 PolarHBondContact N-OD1 2.83Å; S181-N199 PolarHBondContact O-N 3.3Å; S181-N199 VanDerWaalsContact O-N 3.08Å
182	L	97.6	Very high	94.1	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	141	-178.4	-57.6	171.7	0	0	0	110.5	V139 A153 S154 T158 M159 Y177 F180 F196 T197	V139-L182 HydrophobicContact CG2-CB 4.26Å; A153-L182 HydrophobicContact CB-CB 4.41Å; A153-L182 HydrophobicContact CB-CD1 3.81Å; S154-L182 WeakPolarHBondContact O-CB 3.4Å; T158-L182 WeakPolarHBondContact O-CD1 3.44Å; M159-L182 HydrophobicContact CB-CD1 3.97Å; Y177-L182 HydrophobicContact CD2-CD2 4.31Å; F180-L182 HydrophobicContact CD1-CD2 3.73Å; F180-L182 HydrophobicContact CE1-CD2 3.74Å; F180-L182 PolarHBondContact O-N 3.41Å; L182-F196 HydrophobicContact CD2-CB 4.44Å; L182-F196 HydrophobicContact CD2-CD2 3.42Å; L182-F196 VanDerWaalsContact CD2-CD2 3.42Å; L182-F196 HydrophobicContact CD2-CE2 4.02Å; L182-F196 HydrophobicContact CD2-CG 4.29Å; L182-T197 WeakPolarHBondContact CA-O 3.3Å
183	S	96.8	Very high	94.1	Very high	36 Å²	36	41.5 Å²	41.5	25%	0.252	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-28.6	177	73.8	0	0	0	0	112.1	V139 T197 G198 I228 T229	V139-S183 WeakPolarHBondContact CB-O 3.34Å; S183-T197 PolarHBondContact N-O 2.98Å; S183-T197 PolarHBondContact OG-O 2.98Å; S183-T197 PolarHBondContact OG-OG1 3.45Å; S183-G198 PolarHBondContact OG-N 3.43Å; S183-I228 PolarHBondContact OG-O 3.32Å; S183-T229 CarbonylContact C-O 3.55Å; S183-T229 VanDerWaalsContact CB-O 3.29Å; S183-T229 WeakPolarHBondContact CB-O 3.38Å; S183-T229 PolarHBondContact OG-O 2.94Å
184	S	97.8	Very high	94.2	Very high	11 Å²	11	37 Å²	37	8%	0.077	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	150	175.8	-165.4	0	0	0	0	109.7	F196 T197 C231	S184-F196 CarbonylContact O-C 3.47Å; S184-F196 WeakPolarHBondContact O-CA 3.37Å; S184-F196 WeakPolarHBondContact O-CB 3.13Å; S184-T197 WeakPolarHBondContact CB-OG1 3.32Å; S184-T197 PolarHBondContact N-OG1 2.73Å; S184-T197 PolarHBondContact O-N 2.61Å; S184-C231 PolarHBondContact OG-N 3.37Å
185	A	98.4	Very high	94.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	134.3	173.9	0	0	0	0	0	109.5	S140 L151 A153 V194 I195 F196	S140-A185 WeakPolarHBondContact CB-O 3.16Å; S140-A185 PolarHBondContact OG-O 2.98Å; L151-A185 HydrophobicContact CD2-CB 3.87Å; A153-A185 HydrophobicContact CB-CB 3.56Å; A185-V194 HydrophobicContact CB-CG1 4.15Å; A185-I195 CarbonylContact C-O 3.53Å; A185-I195 VanDerWaalsContact CA-O 3.3Å; A185-I195 WeakPolarHBondContact CA-O 3.3Å; A185-F196 HydrophobicContact CB-CB 3.72Å
186	K	97.4	Very high	94.5	Very high	53 Å²	53	30.4 Å²	30.4	23%	0.23	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	132.4	-176.7	-67.4	-65.7	-179.2	-176.6	0	112.9	E142 V194 I195 C231 I233	E142-K186 WeakPolarHBondContact OE1-CD 3.3Å; E142-K186 IonicContact OE1-NZ 3.45Å; E142-K186 VanDerWaalsContact OE2-C 3.28Å; E142-K186 WeakPolarHBondContact OE2-CA 3.32Å; K186-V194 CarbonylContact O-C 3.53Å; K186-V194 WeakPolarHBondContact O-CA 3.49Å; K186-I195 PolarHBondContact N-O 2.88Å; K186-I195 PolarHBondContact O-N 3.4Å; K186-C231 VanDerWaalsContact CG-O 3.31Å; K186-C231 WeakPolarHBondContact CG-O 3.34Å; K186-I233 HydrophobicContact CB-CD1 4.45Å; K186-I233 HydrophobicContact CB-CG1 3.9Å
187	F	97	Very high	94.6	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	141.2	165.1	-74.6	-65.6	0	0	0	109.8	E142 N144 M149 L151 F161 K193 V194 L208 I233	E142-F187 HydrophobicContact CB-CD2 4.29Å; E142-F187 HydrophobicContact CG-CD2 4.08Å; E142-F187 WeakPolarHBondContact O-CE2 3.21Å; E142-F187 PolarHBondContact OE2-N 3.14Å; N144-F187 HydrophobicContact CB-CD2 4.14Å; N144-F187 HydrophobicContact CB-CE1 4.29Å; N144-F187 HydrophobicContact CB-CE2 3.8Å; N144-F187 HydrophobicContact CB-CZ 3.9Å; N144-F187 WeakPolarHBondContact ND2-CD1 3.36Å; N144-F187 WeakPolarHBondContact ND2-CE1 3.32Å; M149-F187 HydrophobicContact CE-CE1 3.62Å; M149-F187 HydrophobicContact CE-CZ 3.61Å; L151-F187 HydrophobicContact CB-CD2 4.32Å; L151-F187 HydrophobicContact CB-CE2 3.44Å; L151-F187 VanDerWaalsContact CB-CE2 3.44Å; L151-F187 HydrophobicContact CB-CZ 3.6Å; L151-F187 HydrophobicContact CD2-CD2 4.46Å; L151-F187 HydrophobicContact CD2-CE2 4.29Å; L151-F187 HydrophobicContact CD2-CZ 4.48Å; F161-F187 HydrophobicContact CD1-CE1 4.33Å; F161-F187 HydrophobicContact CD1-CZ 4.01Å; F161-F187 AromaticContact CE1-CE1 3.84Å; F161-F187 HydrophobicContact CE1-CE1 3.84Å; F161-F187 AromaticContact CE1-CZ 3.85Å; F161-F187 HydrophobicContact CE1-CZ 3.85Å; F187-K193 CarbonylContact C-O 3.59Å; F187-K193 VanDerWaalsContact CA-O 3.32Å; F187-K193 WeakPolarHBondContact CA-O 3.4Å; F187-V194 HydrophobicContact CD1-CG2 3.5Å; F187-V194 HydrophobicContact CE1-CG2 3.48Å; F187-V194 VanDerWaalsContact CE1-CG2 3.48Å; F187-V194 HydrophobicContact CG-CG2 4.37Å; F187-V194 HydrophobicContact CZ-CG2 4.37Å; F187-L208 HydrophobicContact CD1-CD1 3.94Å; F187-L208 HydrophobicContact CE1-CD1 3.63Å; F187-L208 HydrophobicContact CE1-CD2 4.12Å; F187-L208 HydrophobicContact CE1-CG 4.45Å; F187-I233 WeakPolarHBondContact O-CG1 3.47Å
188	T	94.8	Very high	94.6	Very high	8 Å²	8	28.4 Å²	28.4	5%	0.049	16%	0.158	C	C	.	.			trans	-59.9	160.6	165.3	47	0	0	0	0	110.6	C190 G191 D192 K193 I195 L255	T188-C190 PolarHBondContact O-N 2.71Å; T188-C190 VanDerWaalsContact O-N 3.14Å; T188-G191 WeakPolarHBondContact O-CA 3.32Å; T188-G191 PolarHBondContact O-N 2.81Å; T188-D192 PolarHBondContact OG1-N 3.14Å; T188-D192 PolarHBondContact OG1-OD1 2.99Å; T188-K193 HydrophobicContact CG2-CB 3.73Å; T188-K193 PolarHBondContact N-O 2.89Å; T188-K193 PolarHBondContact OG1-N 2.76Å; T188-K193 VanDerWaalsContact OG1-N 3.14Å; T188-K193 PolarHBondContact OG1-O 3.08Å; T188-I195 HydrophobicContact CG2-CD1 3.63Å; T188-L255 HydrophobicContact CG2-CD1 4.21Å
189	A	90.1	Very high	94.8	Very high	37 Å²	37	26.9 Å²	26.9	31%	0.306	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-33	178.8	0	0	0	0	0	112.6	G191 I233 P238	A189-G191 VanDerWaalsContact C-N 3.31Å; A189-I233 HydrophobicContact CB-CG2 4.3Å; A189-P238 HydrophobicContact CB-CB 4.13Å
190	C	90.3	Very high	95	Very high	71 Å²	71	23.6 Å²	23.6	48%	0.48	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.7	175.7	-58.1	0	0	0	0	114.1	H146 T188 D192	H146-C190 VanDerWaalsContact CD2-C 3.42Å; H146-C190 PolarHBondContact CD2-O 3.01Å; H146-C190 PolarHBondContact NE2-O 2.76Å; T188-C190 PolarHBondContact O-N 2.71Å; T188-C190 VanDerWaalsContact O-N 3.14Å; C190-D192 PolarHBondContact O-N 2.97Å; C190-D192 VanDerWaalsContact O-N 3.1Å
191	G	91.4	Very high	95	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	62.4	16.6	179.1	0	0	0	0	0	115.4	N144 T188 A189 L208	N144-G191 WeakPolarHBondContact ND2-CA 3.43Å; N144-G191 PolarHBondContact ND2-O 2.99Å; T188-G191 WeakPolarHBondContact O-CA 3.32Å; T188-G191 PolarHBondContact O-N 2.81Å; A189-G191 VanDerWaalsContact C-N 3.31Å; G191-L208 WeakPolarHBondContact O-CD1 3.48Å
192	D	92.7	Very high	94.9	Very high	62 Å²	62	22.9 Å²	22.9	33%	0.332	13%	0.133	S	C	.	.	S	Bend	trans	-91.7	-24.1	-177.1	67.4	-44.6	0	0	0	113.2	T188 C190 L208	T188-D192 PolarHBondContact OG1-N 3.14Å; T188-D192 PolarHBondContact OG1-OD1 2.99Å; C190-D192 PolarHBondContact O-N 2.97Å; C190-D192 VanDerWaalsContact O-N 3.1Å; D192-L208 WeakPolarHBondContact O-CB 3.2Å; D192-L208 WeakPolarHBondContact O-CG 3.42Å; D192-L208 PolarHBondContact O-N 2.81Å
193	K	95.6	Very high	94.8	Very high	69 Å²	69	22.9 Å²	22.9	30%	0.3	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.9	-176	-68.6	158.9	-170.1	154.4	0	110.8	F187 T188 I205 Y206 N207	F187-K193 CarbonylContact C-O 3.59Å; F187-K193 VanDerWaalsContact CA-O 3.32Å; F187-K193 WeakPolarHBondContact CA-O 3.4Å; T188-K193 HydrophobicContact CG2-CB 3.73Å; T188-K193 PolarHBondContact N-O 2.89Å; T188-K193 PolarHBondContact OG1-N 2.76Å; T188-K193 VanDerWaalsContact OG1-N 3.14Å; T188-K193 PolarHBondContact OG1-O 3.08Å; K193-I205 HydrophobicContact CB-CG2 3.88Å; K193-I205 HydrophobicContact CD-CG2 4.04Å; K193-I205 HydrophobicContact CG-CG2 4.09Å; K193-Y206 CarbonylContact C-O 3.49Å; K193-Y206 WeakPolarHBondContact CA-O 3.35Å; K193-Y206 WeakPolarHBondContact CB-O 3.29Å; K193-N207 HydrophobicContact CG-CB 4.33Å
194	V	97.7	Very high	94.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.9	170.5	-179.9	0	0	0	0	109.2	L151 M159 F161 A185 K186 F187 F196 I205 Y206 L208	L151-V194 HydrophobicContact CD2-CG1 3.62Å; L151-V194 HydrophobicContact CD2-CG2 4.15Å; M159-V194 HydrophobicContact SD-CB 4.42Å; M159-V194 HydrophobicContact SD-CG1 3.81Å; F161-V194 HydrophobicContact CE1-CG2 3.71Å; F161-V194 HydrophobicContact CZ-CG2 3.81Å; A185-V194 HydrophobicContact CB-CG1 4.15Å; K186-V194 CarbonylContact O-C 3.53Å; K186-V194 WeakPolarHBondContact O-CA 3.49Å; F187-V194 HydrophobicContact CD1-CG2 3.5Å; F187-V194 HydrophobicContact CE1-CG2 3.48Å; F187-V194 VanDerWaalsContact CE1-CG2 3.48Å; F187-V194 HydrophobicContact CG-CG2 4.37Å; F187-V194 HydrophobicContact CZ-CG2 4.37Å; V194-F196 HydrophobicContact CG1-CD1 4.42Å; V194-I205 CarbonylContact O-C 3.56Å; V194-I205 VanDerWaalsContact O-CA 3.3Å; V194-I205 WeakPolarHBondContact O-CA 3.28Å; V194-Y206 PolarHBondContact N-O 3.42Å; V194-Y206 PolarHBondContact O-N 2.84Å; V194-L208 HydrophobicContact CG2-CD2 4.18Å
195	I	97.6	Very high	94.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.8	168.2	-67	134.5	0	0	0	108.1	A185 K186 T188 F203 R204 I205 C231 I233 V241 L255	A185-I195 CarbonylContact C-O 3.53Å; A185-I195 VanDerWaalsContact CA-O 3.3Å; A185-I195 WeakPolarHBondContact CA-O 3.3Å; K186-I195 PolarHBondContact N-O 2.88Å; K186-I195 PolarHBondContact O-N 3.4Å; T188-I195 HydrophobicContact CG2-CD1 3.63Å; I195-F203 HydrophobicContact CG2-CD2 3.85Å; I195-R204 WeakPolarHBondContact CA-O 2.87Å; I195-I205 HydrophobicContact CG1-CD1 4.1Å; I195-I205 HydrophobicContact CG1-CG1 3.89Å; I195-C231 HydrophobicContact CG2-CB 4.12Å; I195-I233 HydrophobicContact CB-CD1 4.43Å; I195-I233 HydrophobicContact CD1-CD1 3.26Å; I195-I233 HydrophobicContact CD1-CG1 4.46Å; I195-I233 HydrophobicContact CG1-CD1 4.45Å; I195-V241 HydrophobicContact CG2-CG2 4.35Å; I195-L255 HydrophobicContact CD1-CD1 3.42Å; I195-L255 VanDerWaalsContact CD1-CD1 3.42Å; I195-L255 HydrophobicContact CD1-CD2 3.31Å; I195-L255 HydrophobicContact CD1-CG 3.99Å; I195-L255 HydrophobicContact CG1-CD2 3.66Å
196	F	97.9	Very high	94.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.7	-179.9	62.3	-82.6	0	0	0	111.7	M159 Y177 F180 L182 S184 A185 V194 F203 R204	M159-F196 HydrophobicContact CE-CD1 4.42Å; M159-F196 HydrophobicContact CE-CE1 4.33Å; M159-F196 HydrophobicContact SD-CD1 4.11Å; M159-F196 HydrophobicContact SD-CG 4.34Å; Y177-F196 HydrophobicContact CD1-CE2 4.16Å; Y177-F196 HydrophobicContact CD1-CZ 4.14Å; Y177-F196 AromaticContact CD2-CE2 3.95Å; Y177-F196 HydrophobicContact CD2-CE2 3.95Å; Y177-F196 HydrophobicContact CD2-CZ 4.31Å; Y177-F196 AromaticContact CE1-CE2 3.95Å; Y177-F196 HydrophobicContact CE1-CE2 3.95Å; Y177-F196 AromaticContact CE1-CZ 3.49Å; Y177-F196 HydrophobicContact CE1-CZ 3.49Å; Y177-F196 VanDerWaalsContact CE1-CZ 3.49Å; Y177-F196 HydrophobicContact CE2-CD2 4.47Å; Y177-F196 HydrophobicContact CE2-CE1 4.39Å; Y177-F196 AromaticContact CE2-CE2 3.71Å; Y177-F196 HydrophobicContact CE2-CE2 3.71Å; Y177-F196 AromaticContact CE2-CZ 3.68Å; Y177-F196 HydrophobicContact CE2-CZ 3.68Å; Y177-F196 HydrophobicContact CG-CE2 4.15Å; Y177-F196 AromaticContact CZ-CE1 3.93Å; Y177-F196 AromaticContact CZ-CE2 3.71Å; Y177-F196 AromaticContact CZ-CZ 3.21Å; Y177-F196 VanDerWaalsContact OH-CZ 3.3Å; Y177-F196 WeakPolarHBondContact OH-CZ 3.42Å; F180-F196 HydrophobicContact CD1-CD2 4.43Å; F180-F196 HydrophobicContact CD1-CE2 4.27Å; F180-F196 AromaticContact CE1-CD2 3.71Å; F180-F196 HydrophobicContact CE1-CD2 3.71Å; F180-F196 AromaticContact CE1-CE2 3.83Å; F180-F196 HydrophobicContact CE1-CE2 3.83Å; F180-F196 HydrophobicContact CZ-CD2 4.38Å; F180-F196 HydrophobicContact CZ-CE2 4.43Å; L182-F196 HydrophobicContact CD2-CB 4.44Å; L182-F196 HydrophobicContact CD2-CD2 3.42Å; L182-F196 VanDerWaalsContact CD2-CD2 3.42Å; L182-F196 HydrophobicContact CD2-CE2 4.02Å; L182-F196 HydrophobicContact CD2-CG 4.29Å; S184-F196 CarbonylContact O-C 3.47Å; S184-F196 WeakPolarHBondContact O-CA 3.37Å; S184-F196 WeakPolarHBondContact O-CB 3.13Å; A185-F196 HydrophobicContact CB-CB 3.72Å; V194-F196 HydrophobicContact CG1-CD1 4.42Å; F196-F203 WeakPolarHBondContact O-CA 3.25Å; F196-R204 HydrophobicContact CD1-CB 4.22Å; F196-R204 HydrophobicContact CD2-CB 4.19Å; F196-R204 HydrophobicContact CE1-CB 3.63Å; F196-R204 HydrophobicContact CE2-CB 3.64Å; F196-R204 HydrophobicContact CE2-CG 4.17Å; F196-R204 HydrophobicContact CG-CB 4.47Å; F196-R204 HydrophobicContact CZ-CB 3.31Å; F196-R204 HydrophobicContact CZ-CG 4.15Å; F196-R204 PolarHBondContact N-O 3.06Å; F196-R204 PolarHBondContact O-N 2.89Å
197	T	97.5	Very high	94.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	165.3	-175.4	66.3	0	0	0	0	109.1	L182 S183 S184 F203 I228 T229 C231 L243	L182-T197 WeakPolarHBondContact CA-O 3.3Å; S183-T197 PolarHBondContact N-O 2.98Å; S183-T197 PolarHBondContact OG-O 2.98Å; S183-T197 PolarHBondContact OG-OG1 3.45Å; S184-T197 WeakPolarHBondContact CB-OG1 3.32Å; S184-T197 PolarHBondContact N-OG1 2.73Å; S184-T197 PolarHBondContact O-N 2.61Å; T197-F203 HydrophobicContact CG2-CB 3.84Å; T197-I228 WeakPolarHBondContact CB-O 3.48Å; T197-I228 HydrophobicContact CG2-CB 4.37Å; T197-I228 HydrophobicContact CG2-CG2 3.6Å; T197-T229 PolarHBondContact OG1-O 3.26Å; T197-C231 HydrophobicContact CG2-CB 3.94Å; T197-L243 HydrophobicContact CG2-CD2 4.16Å
198	G	94.1	Very high	94.4	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	-156	-177.8	0	0	0	0	0	112.2	S181 S183 V200	S181-G198 CarbonylContact O-C 3.57Å; S181-G198 WeakPolarHBondContact O-CA 3.39Å; S183-G198 PolarHBondContact OG-N 3.43Å; G198-V200 PolarHBondContact O-N 2.79Å
199	N	92.2	Very high	94.3	Very high	76 Å²	76	32.1 Å²	32.1	41%	0.406	17%	0.172	S	C	.	.	S	Bend	trans	-73.3	27.9	179.8	66.7	-43.4	0	0	0	114.7	S181	S181-N199 PolarHBondContact N-OD1 2.83Å; S181-N199 PolarHBondContact O-N 3.3Å; S181-N199 VanDerWaalsContact O-N 3.08Å
200	V	92.5	Very high	94.5	Very high	37 Å²	37	34.5 Å²	34.5	22%	0.224	18%	0.183	C	C	.	.	S	Bend	trans	-135.5	160.3	-179.7	-57.1	0	0	0	0	111.6	F180 G198 S202 I228	F180-V200 HydrophobicContact CD2-CG2 3.89Å; F180-V200 HydrophobicContact CE2-CG2 3.28Å; F180-V200 HydrophobicContact CZ-CG2 4.14Å; G198-V200 PolarHBondContact O-N 2.79Å; V200-S202 WeakPolarHBondContact CG2-O 3.36Å; V200-S202 PolarHBondContact O-N 3.07Å; V200-I228 PolarHBondContact O-N 2.78Å; V200-I228 VanDerWaalsContact O-N 3.15Å
201	G	91.2	Very high	94.6	Very high	5 Å²	5	31.3 Å²	31.3	5%	0.052	16%	0.162	C	C	.	.	S	Bend	trans	-76.4	27.6	178.3	0	0	0	0	0	115.6	E226	G201-E226 WeakPolarHBondContact CA-O 3.44Å
202	S	92.3	Very high	94.7	Very high	5 Å²	5	34 Å²	34	4%	0.035	18%	0.18	C	C	.	.			trans	-146.1	146.3	-179.5	63.2	0	0	0	0	110.9	V200 A216	V200-S202 WeakPolarHBondContact CG2-O 3.36Å; V200-S202 PolarHBondContact O-N 3.07Å; S202-A216 WeakPolarHBondContact CB-O 3.39Å
203	F	95.8	Very high	94.7	Very high	1 Å²	1	34.2 Å²	34.2	0%	0.004	18%	0.18	C	C	.	.			trans	-97.7	165.4	172.9	72.5	-81.3	0	0	0	111.4	I195 F196 T197 I205 A216 F219 L243 A253 L255 L258	I195-F203 HydrophobicContact CG2-CD2 3.85Å; F196-F203 WeakPolarHBondContact O-CA 3.25Å; T197-F203 HydrophobicContact CG2-CB 3.84Å; F203-I205 HydrophobicContact CD2-CG1 4.23Å; F203-I205 HydrophobicContact CE2-CD1 4.12Å; F203-I205 HydrophobicContact CE2-CG1 3.95Å; F203-A216 HydrophobicContact CD1-CB 3.56Å; F203-A216 HydrophobicContact CD2-CB 4.31Å; F203-A216 HydrophobicContact CE1-CB 3.27Å; F203-A216 HydrophobicContact CE2-CB 4.11Å; F203-A216 HydrophobicContact CG-CB 4.08Å; F203-A216 HydrophobicContact CZ-CB 3.61Å; F203-A216 WeakPolarHBondContact O-CB 3.46Å; F203-A216 PolarHBondContact O-N 3.23Å; F203-F219 HydrophobicContact CD1-CZ 4.24Å; F203-F219 HydrophobicContact CE1-CE1 4.24Å; F203-F219 AromaticContact CE1-CZ 3.7Å; F203-F219 HydrophobicContact CE1-CZ 3.7Å; F203-L243 HydrophobicContact CB-CD2 4.24Å; F203-L243 HydrophobicContact CD1-CD1 3.35Å; F203-L243 HydrophobicContact CD1-CD2 4.44Å; F203-L243 HydrophobicContact CE1-CD1 3.65Å; F203-L243 HydrophobicContact CG-CD1 4.03Å; F203-L243 HydrophobicContact CG-CD2 4.31Å; F203-L243 HydrophobicContact CZ-CD1 4.48Å; F203-A253 HydrophobicContact CE1-CB 4.2Å; F203-A253 HydrophobicContact CZ-CB 4.3Å; F203-L255 HydrophobicContact CE2-CD2 4.16Å; F203-L258 HydrophobicContact CE2-CD2 3.99Å; F203-L258 HydrophobicContact CZ-CB 4.3Å; F203-L258 HydrophobicContact CZ-CD2 4.05Å
204	R	96.3	Very high	94.6	Very high	50 Å²	50	33.7 Å²	33.7	19%	0.189	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	157.6	175.9	-63.8	-175.2	-172.6	-164.8	4.8	109.8	F180 I195 F196 S214 R215	F180-R204 HydrophobicContact CE2-CG 4.39Å; F180-R204 HydrophobicContact CZ-CG 4.27Å; I195-R204 WeakPolarHBondContact CA-O 2.87Å; F196-R204 HydrophobicContact CD1-CB 4.22Å; F196-R204 HydrophobicContact CD2-CB 4.19Å; F196-R204 HydrophobicContact CE1-CB 3.63Å; F196-R204 HydrophobicContact CE2-CB 3.64Å; F196-R204 HydrophobicContact CE2-CG 4.17Å; F196-R204 HydrophobicContact CG-CB 4.47Å; F196-R204 HydrophobicContact CZ-CB 3.31Å; F196-R204 HydrophobicContact CZ-CG 4.15Å; F196-R204 PolarHBondContact N-O 3.06Å; F196-R204 PolarHBondContact O-N 2.89Å; R204-S214 CarbonylContact C-O 3.59Å; R204-S214 WeakPolarHBondContact CA-O 3.31Å; R204-R215 HydrophobicContact CG-CB 4.36Å; R204-R215 HydrophobicContact CG-CG 4.26Å
205	I	97	Very high	94.5	Very high	9 Å²	9	41.2 Å²	41.2	5%	0.046	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.6	174.4	-55.1	-167.5	0	0	0	108.4	K193 V194 I195 F203 E213 S214 L255 L258	K193-I205 HydrophobicContact CB-CG2 3.88Å; K193-I205 HydrophobicContact CD-CG2 4.04Å; K193-I205 HydrophobicContact CG-CG2 4.09Å; V194-I205 CarbonylContact O-C 3.56Å; V194-I205 VanDerWaalsContact O-CA 3.3Å; V194-I205 WeakPolarHBondContact O-CA 3.28Å; I195-I205 HydrophobicContact CG1-CD1 4.1Å; I195-I205 HydrophobicContact CG1-CG1 3.89Å; F203-I205 HydrophobicContact CD2-CG1 4.23Å; F203-I205 HydrophobicContact CE2-CD1 4.12Å; F203-I205 HydrophobicContact CE2-CG1 3.95Å; I205-E213 WeakPolarHBondContact O-CA 3.32Å; I205-S214 PolarHBondContact N-O 3.11Å; I205-S214 PolarHBondContact O-N 2.88Å; I205-L255 HydrophobicContact CD1-CB 4.37Å; I205-L255 HydrophobicContact CD1-CD2 3.76Å; I205-L258 HydrophobicContact CD1-CD2 3.31Å; I205-L258 HydrophobicContact CG1-CD2 4.06Å
206	Y	96.8	Very high	94.3	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129	169.6	174.7	-124.1	0	0	0	110.2	M159 F161 R173 K193 V194 L208 E213	M159-Y206 HydrophobicContact CE-CD1 3.57Å; M159-Y206 HydrophobicContact CE-CE1 4.25Å; M159-Y206 HydrophobicContact CE-CG 3.75Å; F161-Y206 HydrophobicContact CD2-CE1 4.35Å; F161-Y206 AromaticContact CE2-CD1 3.85Å; F161-Y206 HydrophobicContact CE2-CD1 3.85Å; F161-Y206 AromaticContact CE2-CE1 3.39Å; F161-Y206 HydrophobicContact CE2-CE1 3.39Å; F161-Y206 AromaticContact CZ-CD1 3.62Å; F161-Y206 HydrophobicContact CZ-CD1 3.62Å; F161-Y206 AromaticContact CZ-CE1 3.59Å; F161-Y206 HydrophobicContact CZ-CE1 3.59Å; R173-Y206 WeakPolarHBondContact CD-OH 3.48Å; R173-Y206 PolarHBondContact NE-OH 3.32Å; R173-Y206 PolarHBondContact NH1-OH 2.66Å; K193-Y206 CarbonylContact C-O 3.49Å; K193-Y206 WeakPolarHBondContact CA-O 3.35Å; K193-Y206 WeakPolarHBondContact CB-O 3.29Å; V194-Y206 PolarHBondContact N-O 3.42Å; V194-Y206 PolarHBondContact O-N 2.84Å; Y206-L208 HydrophobicContact CD1-CD2 3.98Å; Y206-L208 HydrophobicContact CE1-CD2 3.77Å; Y206-E213 WeakPolarHBondContact CA-OE2 3.47Å; Y206-E213 VanDerWaalsContact CB-OE2 3.23Å; Y206-E213 WeakPolarHBondContact CB-OE2 3.43Å; Y206-E213 WeakPolarHBondContact CD2-OE1 3.28Å; Y206-E213 WeakPolarHBondContact CD2-OE2 3.35Å; Y206-E213 WeakPolarHBondContact CE2-OE1 3.44Å
207	N	95.4	Very high	94	Very high	35 Å²	35	51.9 Å²	51.9	19%	0.187	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123	172.8	-179.9	-49.9	0	0	0	109.8	K193 E209 T210 G211 S212	K193-N207 HydrophobicContact CG-CB 4.33Å; N207-E209 PolarHBondContact OD1-N 2.87Å; N207-T210 WeakPolarHBondContact CB-OG1 3.28Å; N207-T210 PolarHBondContact OD1-N 2.98Å; N207-T210 PolarHBondContact OD1-OG1 2.74Å; N207-T210 VanDerWaalsContact OD1-OG1 3.09Å; N207-G211 WeakPolarHBondContact O-CA 2.89Å; N207-G211 PolarHBondContact O-N 2.75Å; N207-S212 PolarHBondContact N-O 2.75Å
208	L	93.7	Very high	93.8	Very high	35 Å²	35	56.2 Å²	56.2	18%	0.183	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-36.2	-174	-66.2	163.7	0	0	0	112.9	M149 F161 F187 G191 D192 V194 Y206	M149-L208 HydrophobicContact CE-CD1 3.84Å; M149-L208 HydrophobicContact CE-CD2 4.03Å; F161-L208 HydrophobicContact CD1-CD2 4Å; F161-L208 HydrophobicContact CE1-CD2 3.47Å; F161-L208 VanDerWaalsContact CE1-CD2 3.47Å; F161-L208 HydrophobicContact CE2-CD2 4.31Å; F161-L208 HydrophobicContact CZ-CD2 3.65Å; F187-L208 HydrophobicContact CD1-CD1 3.94Å; F187-L208 HydrophobicContact CE1-CD1 3.63Å; F187-L208 HydrophobicContact CE1-CD2 4.12Å; F187-L208 HydrophobicContact CE1-CG 4.45Å; G191-L208 WeakPolarHBondContact O-CD1 3.48Å; D192-L208 WeakPolarHBondContact O-CB 3.2Å; D192-L208 WeakPolarHBondContact O-CG 3.42Å; D192-L208 PolarHBondContact O-N 2.81Å; V194-L208 HydrophobicContact CG2-CD2 4.18Å; Y206-L208 HydrophobicContact CD1-CD2 3.98Å; Y206-L208 HydrophobicContact CE1-CD2 3.77Å
209	E	92.2	Very high	93.8	Very high	179 Å²	179	56.8 Å²	56.8	84%	0.836	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-54.7	-177.6	-177.3	-178.5	-172.1	0	0	111.2	N207	N207-E209 PolarHBondContact OD1-N 2.87Å
210	T	93.9	Very high	93.6	Very high	87 Å²	87	60.4 Å²	60.4	53%	0.534	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.8	-176.4	59.8	0	0	0	0	112.8	N207 S212	N207-T210 WeakPolarHBondContact CB-OG1 3.28Å; N207-T210 PolarHBondContact OD1-N 2.98Å; N207-T210 PolarHBondContact OD1-OG1 2.74Å; N207-T210 VanDerWaalsContact OD1-OG1 3.09Å; T210-S212 PolarHBondContact O-N 2.92Å; T210-S212 WeakPolarHBondContact OG1-CB 3.26Å; T210-S212 PolarHBondContact OG1-N 2.98Å; T210-S212 PolarHBondContact OG1-OG 3.32Å
211	G	92.2	Very high	93.3	Very high	5 Å²	5	61.9 Å²	61.9	5%	0.052	31%	0.312	C	S	.	.			trans	66.5	18.5	-169.9	0	0	0	0	0	113.9	R175 N207	R175-G211 PolarHBondContact NH2-O 2.65Å; N207-G211 WeakPolarHBondContact O-CA 2.89Å; N207-G211 PolarHBondContact O-N 2.75Å
212	S	94.1	Very high	93.3	Very high	56 Å²	56	62.6 Å²	62.6	39%	0.392	32%	0.317	S	S	.	.			trans	-86.1	150.9	-179.5	62.8	0	0	0	0	112.3	N207 T210	N207-S212 PolarHBondContact N-O 2.75Å; T210-S212 PolarHBondContact O-N 2.92Å; T210-S212 WeakPolarHBondContact OG1-CB 3.26Å; T210-S212 PolarHBondContact OG1-N 2.98Å; T210-S212 PolarHBondContact OG1-OG 3.32Å
213	E	93	Very high	93.2	Very high	68 Å²	68	65.6 Å²	65.6	32%	0.318	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.8	178.4	-48.7	-52.4	163.9	0	0	111.5	R175 Y177 I205 Y206	R175-E213 IonicContact NE-OE1 3.7Å; Y177-E213 HydrophobicContact CE1-CG 4.27Å; Y177-E213 VanDerWaalsContact OH-CD 3.27Å; Y177-E213 PolarHBondContact OH-OE1 2.79Å; Y177-E213 VanDerWaalsContact OH-OE1 3.12Å; Y177-E213 PolarHBondContact OH-OE2 3.18Å; I205-E213 WeakPolarHBondContact O-CA 3.32Å; Y206-E213 WeakPolarHBondContact CA-OE2 3.47Å; Y206-E213 VanDerWaalsContact CB-OE2 3.23Å; Y206-E213 WeakPolarHBondContact CB-OE2 3.43Å; Y206-E213 WeakPolarHBondContact CD2-OE1 3.28Å; Y206-E213 WeakPolarHBondContact CD2-OE2 3.35Å; Y206-E213 WeakPolarHBondContact CE2-OE1 3.44Å
214	S	94.2	Very high	92.7	Very high	57 Å²	57	72.2 Å²	72.2	40%	0.399	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.6	170.1	-63.1	0	0	0	0	109.8	R204 I205	R204-S214 CarbonylContact C-O 3.59Å; R204-S214 WeakPolarHBondContact CA-O 3.31Å; I205-S214 PolarHBondContact N-O 3.11Å; I205-S214 PolarHBondContact O-N 2.88Å
215	R	94.1	Very high	92.4	Very high	159 Å²	159	76.1 Å²	76.1	60%	0.6	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.7	-179.9	178.4	176.7	179.3	-176.2	0.6	110	R204	R204-R215 HydrophobicContact CG-CB 4.36Å; R204-R215 HydrophobicContact CG-CG 4.26Å
216	A	93.7	Very high	92.2	Very high	1 Å²	1	77 Å²	77	1%	0.008	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-69.5	145.5	170.5	0	0	0	0	0	110.4	S202 F203 L258	S202-A216 WeakPolarHBondContact CB-O 3.39Å; F203-A216 HydrophobicContact CD1-CB 3.56Å; F203-A216 HydrophobicContact CD2-CB 4.31Å; F203-A216 HydrophobicContact CE1-CB 3.27Å; F203-A216 HydrophobicContact CE2-CB 4.11Å; F203-A216 HydrophobicContact CG-CB 4.08Å; F203-A216 HydrophobicContact CZ-CB 3.61Å; F203-A216 WeakPolarHBondContact O-CB 3.46Å; F203-A216 PolarHBondContact O-N 3.23Å; A216-L258 HydrophobicContact CB-CB 4.01Å
217	R	93	Very high	92.2	Very high	222 Å²	222	78.5 Å²	78.5	84%	0.838	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-74	153.8	168.9	-67.4	-176.6	-179.1	-84.8	-1.2	109.3	F219	R217-F219 PolarHBondContact O-N 2.99Å
218	R	93.1	Very high	92.2	Very high	91 Å²	91	77 Å²	77	34%	0.343	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-58.1	132.2	169.7	-176.5	172.5	-153.3	118.9	18.6	109.1	S222 S223 I224 E226	R218-S222 WeakPolarHBondContact CG-OG 3.3Å; R218-S222 PolarHBondContact NE-OG 2.91Å; R218-S223 PolarHBondContact NE-O 3.26Å; R218-S223 PolarHBondContact NH2-O 2.8Å; R218-I224 PolarHBondContact NH1-O 3.33Å; R218-I224 VanDerWaalsContact NH2-C 3.34Å; R218-I224 PolarHBondContact NH2-O 3.09Å; R218-E226 PolarHBondContact NH2-O 3.17Å
219	F	92.6	Very high	92.2	Very high	13 Å²	13	77.1 Å²	77.1	6%	0.057	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-68.2	139.6	-176.9	-61.4	-44.3	0	0	0	112	F203 R217 G221 S222 I228 L243 Y251 A253 K260	F203-F219 HydrophobicContact CD1-CZ 4.24Å; F203-F219 HydrophobicContact CE1-CE1 4.24Å; F203-F219 AromaticContact CE1-CZ 3.7Å; F203-F219 HydrophobicContact CE1-CZ 3.7Å; R217-F219 PolarHBondContact O-N 2.99Å; F219-G221 PolarHBondContact O-N 2.76Å; F219-S222 WeakPolarHBondContact O-CB 3.42Å; F219-S222 PolarHBondContact O-N 2.78Å; F219-S222 VanDerWaalsContact O-N 3.11Å; F219-S222 PolarHBondContact O-OG 3.07Å; F219-I228 HydrophobicContact CE2-CD1 4.33Å; F219-L243 HydrophobicContact CE2-CD1 3.81Å; F219-L243 HydrophobicContact CZ-CD1 3.89Å; F219-Y251 HydrophobicContact CB-CE1 4.34Å; F219-Y251 AromaticContact CD2-CD1 3.64Å; F219-Y251 HydrophobicContact CD2-CD1 3.64Å; F219-Y251 AromaticContact CD2-CD2 3.89Å; F219-Y251 HydrophobicContact CD2-CD2 3.89Å; F219-Y251 HydrophobicContact CD2-CE1 4.08Å; F219-Y251 HydrophobicContact CD2-CE2 4.3Å; F219-Y251 AromaticContact CD2-CG 3.53Å; F219-Y251 HydrophobicContact CD2-CG 3.53Å; F219-Y251 HydrophobicContact CE2-CD1 4.2Å; F219-Y251 HydrophobicContact CE2-CD2 4.18Å; F219-Y251 AromaticContact CE2-CG 3.74Å; F219-Y251 HydrophobicContact CE2-CG 3.74Å; F219-Y251 HydrophobicContact CG-CD1 4.41Å; F219-A253 HydrophobicContact CE1-CB 4.31Å; F219-A253 HydrophobicContact CZ-CB 3.65Å; F219-K260 HydrophobicContact CB-CB 4.3Å; F219-K260 HydrophobicContact CB-CD 4.19Å; F219-K260 HydrophobicContact CD1-CB 3.58Å; F219-K260 HydrophobicContact CD2-CB 4.38Å; F219-K260 HydrophobicContact CE1-CB 3.88Å; F219-K260 HydrophobicContact CG-CB 3.85Å; F219-K260 HydrophobicContact CG-CD 4.4Å; F219-K260 HydrophobicContact CG-CG 4.44Å; F219-K260 HydrophobicContact CZ-CB 4.39Å
220	I	88.9	Confident	92.4	Very high	153 Å²	153	71.8 Å²	71.8	79%	0.785	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	129.8	174.7	-61.4	164.7	0	0	0	109.2	K260	I220-K260 PolarHBondContact O-NZ 3.14Å
221	G	86.4	Confident	92.5	Very high	68 Å²	68	67.6 Å²	67.6	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	0.4	-178.3	0	0	0	0	0	115.4	F219	F219-G221 PolarHBondContact O-N 2.76Å
222	S	90.6	Very high	92.7	Very high	20 Å²	20	69.4 Å²	69.4	14%	0.14	36%	0.358	C	S	.	.			trans	-76	140.1	166.3	61.4	0	0	0	0	110.3	R218 F219 E226 Y251	R218-S222 WeakPolarHBondContact CG-OG 3.3Å; R218-S222 PolarHBondContact NE-OG 2.91Å; F219-S222 WeakPolarHBondContact O-CB 3.42Å; F219-S222 PolarHBondContact O-N 2.78Å; F219-S222 VanDerWaalsContact O-N 3.11Å; F219-S222 PolarHBondContact O-OG 3.07Å; S222-E226 WeakPolarHBondContact CB-OE1 3.47Å; S222-Y251 WeakPolarHBondContact CB-OH 3.27Å
223	S	89.3	Confident	92.7	Very high	67 Å²	67	68 Å²	68	47%	0.469	35%	0.347	S	S	.	.			trans	-64.7	155.6	170.9	-178.9	0	0	0	0	110	R218 D225 E226	R218-S223 PolarHBondContact NE-O 3.26Å; R218-S223 PolarHBondContact NH2-O 2.8Å; S223-D225 VanDerWaalsContact C-N 3.28Å; S223-D225 PolarHBondContact O-N 2.93Å; S223-E226 WeakPolarHBondContact O-CB 3.37Å; S223-E226 PolarHBondContact O-N 2.87Å
224	I	87.1	Confident	92.8	Very high	140 Å²	140	64.8 Å²	64.8	72%	0.718	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.5	178.7	-65.2	167.4	0	0	0	111.8	R218 E226	R218-I224 PolarHBondContact NH1-O 3.33Å; R218-I224 VanDerWaalsContact NH2-C 3.34Å; R218-I224 PolarHBondContact NH2-O 3.09Å; I224-E226 VanDerWaalsContact C-N 3.32Å
225	D	89.9	Confident	92.6	Very high	133 Å²	133	64.5 Å²	64.5	71%	0.711	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-5.8	-178.2	-53.6	-42	0	0	0	113.3	S223 N246	S223-D225 VanDerWaalsContact C-N 3.28Å; S223-D225 PolarHBondContact O-N 2.93Å; D225-N246 PolarHBondContact O-ND2 3.39Å
226	E	93	Very high	92.4	Very high	26 Å²	26	59 Å²	59	12%	0.121	32%	0.317	C	S	.	.			trans	-69.6	136	177.3	-165.4	175.5	90.3	0	0	110.2	G201 R218 S222 S223 I224 T245 Y251	G201-E226 WeakPolarHBondContact CA-O 3.44Å; R218-E226 PolarHBondContact NH2-O 3.17Å; S222-E226 WeakPolarHBondContact CB-OE1 3.47Å; S223-E226 WeakPolarHBondContact O-CB 3.37Å; S223-E226 PolarHBondContact O-N 2.87Å; I224-E226 VanDerWaalsContact C-N 3.32Å; E226-T245 HydrophobicContact CG-CG2 3.81Å; E226-Y251 WeakPolarHBondContact OE1-CE2 2.93Å; E226-Y251 VanDerWaalsContact OE1-CZ 3.25Å; E226-Y251 PolarHBondContact OE1-OH 3.03Å
227	T	94.9	Very high	92.3	Very high	34 Å²	34	63 Å²	63	21%	0.209	34%	0.335	C	S	.	.			trans	-123.6	140.6	174.8	59.4	0	0	0	0	109.3	T229 T245 N246	T227-T229 PolarHBondContact O-N 2.95Å; T227-T245 CarbonylContact O-C 3.58Å; T227-T245 WeakPolarHBondContact O-CA 3.29Å; T227-N246 PolarHBondContact N-OD1 3.02Å; T227-N246 PolarHBondContact O-N 2.98Å; T227-N246 PolarHBondContact O-OD1 3.34Å
228	I	95.9	Very high	92.2	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	109.4	173.3	-57.3	-179.4	0	0	0	107.2	S183 T197 V200 F219 L243 G244	S183-I228 PolarHBondContact OG-O 3.32Å; T197-I228 WeakPolarHBondContact CB-O 3.48Å; T197-I228 HydrophobicContact CG2-CB 4.37Å; T197-I228 HydrophobicContact CG2-CG2 3.6Å; V200-I228 PolarHBondContact O-N 2.78Å; V200-I228 VanDerWaalsContact O-N 3.15Å; F219-I228 HydrophobicContact CE2-CD1 4.33Å; I228-L243 HydrophobicContact CD1-CD1 4.24Å; I228-L243 HydrophobicContact CG2-CB 3.77Å; I228-L243 HydrophobicContact CG2-CD2 4.03Å; I228-L243 HydrophobicContact CG2-CG 4.38Å; I228-G244 CarbonylContact C-O 3.58Å; I228-G244 WeakPolarHBondContact CA-O 3.44Å
229	T	94.5	Very high	92.2	Very high	39 Å²	39	53.8 Å²	53.8	24%	0.239	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-32.7	-170.4	55.1	0	0	0	0	112.4	S183 T197 T227 G244 T245 N246	S183-T229 CarbonylContact C-O 3.55Å; S183-T229 VanDerWaalsContact CB-O 3.29Å; S183-T229 WeakPolarHBondContact CB-O 3.38Å; S183-T229 PolarHBondContact OG-O 2.94Å; T197-T229 PolarHBondContact OG1-O 3.26Å; T227-T229 PolarHBondContact O-N 2.95Å; T229-G244 PolarHBondContact N-O 3.18Å; T229-G244 PolarHBondContact OG1-O 3.15Å; T229-T245 PolarHBondContact OG1-O 3.44Å; T229-T245 VanDerWaalsContact OG1-O 3.12Å; T229-N246 HydrophobicContact CG2-CB 3.88Å
230	K	95.6	Very high	92.2	Very high	66 Å²	66	54.1 Å²	54.1	29%	0.287	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	144.5	-176.1	-62.8	-173.8	179	179.3	0	111.7	F232 L243 G244 N271	K230-F232 HydrophobicContact CB-CD2 4.38Å; K230-F232 HydrophobicContact CB-CE2 3.51Å; K230-F232 HydrophobicContact CB-CZ 3.97Å; K230-F232 HydrophobicContact CD-CE2 4.2Å; K230-F232 HydrophobicContact CD-CZ 3.91Å; K230-F232 HydrophobicContact CG-CE2 4.49Å; K230-L243 CarbonylContact O-C 3.52Å; K230-L243 WeakPolarHBondContact O-CA 3.21Å; K230-G244 PolarHBondContact N-O 2.58Å; K230-G244 PolarHBondContact O-N 3.01Å; K230-N271 PolarHBondContact NZ-O 2.84Å
231	C	96.5	Very high	92.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.7	170.3	57.3	0	0	0	0	110.9	S184 K186 I195 T197 V241 A242 L243	S184-C231 PolarHBondContact OG-N 3.37Å; K186-C231 VanDerWaalsContact CG-O 3.31Å; K186-C231 WeakPolarHBondContact CG-O 3.34Å; I195-C231 HydrophobicContact CG2-CB 4.12Å; T197-C231 HydrophobicContact CG2-CB 3.94Å; C231-V241 HydrophobicContact CB-CG2 4.16Å; C231-A242 CarbonylContact C-O 3.41Å; C231-A242 WeakPolarHBondContact CA-O 3.4Å; C231-L243 HydrophobicContact CB-CD2 3.69Å
232	F	95.6	Very high	93	Very high	42 Å²	42	43.6 Å²	43.6	18%	0.184	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	127.6	179.3	-58.7	-91.2	0	0	0	108.8	K230 V241 A242 I273 F275	K230-F232 HydrophobicContact CB-CD2 4.38Å; K230-F232 HydrophobicContact CB-CE2 3.51Å; K230-F232 HydrophobicContact CB-CZ 3.97Å; K230-F232 HydrophobicContact CD-CE2 4.2Å; K230-F232 HydrophobicContact CD-CZ 3.91Å; K230-F232 HydrophobicContact CG-CE2 4.49Å; F232-V241 WeakPolarHBondContact O-CA 3.4Å; F232-V241 WeakPolarHBondContact O-CG2 3.49Å; F232-A242 HydrophobicContact CB-CB 4.38Å; F232-A242 PolarHBondContact N-O 3.45Å; F232-A242 PolarHBondContact O-N 2.79Å; F232-I273 WeakPolarHBondContact CD1-O 3.35Å; F232-I273 HydrophobicContact CD2-CB 3.86Å; F232-I273 HydrophobicContact CD2-CD1 4.06Å; F232-I273 HydrophobicContact CD2-CG1 4.43Å; F232-I273 HydrophobicContact CD2-CG2 4.46Å; F232-I273 WeakPolarHBondContact CE1-O 3.42Å; F232-I273 HydrophobicContact CE2-CB 3.71Å; F232-I273 HydrophobicContact CE2-CD1 3.88Å; F232-I273 HydrophobicContact CE2-CG1 4.05Å; F232-I273 HydrophobicContact CG-CB 4.41Å; F232-I273 HydrophobicContact CZ-CB 4.15Å; F232-F275 HydrophobicContact CB-CD2 4.22Å; F232-F275 HydrophobicContact CB-CE2 3.84Å; F232-F275 WeakPolarHBondContact O-CE2 3.44Å
233	I	95.5	Very high	93.3	Very high	28 Å²	28	42.7 Å²	42.7	14%	0.144	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	136.9	180	-55.5	-55.3	0	0	0	109.1	K186 F187 A189 I195 V241	K186-I233 HydrophobicContact CB-CD1 4.45Å; K186-I233 HydrophobicContact CB-CG1 3.9Å; F187-I233 WeakPolarHBondContact O-CG1 3.47Å; A189-I233 HydrophobicContact CB-CG2 4.3Å; I195-I233 HydrophobicContact CB-CD1 4.43Å; I195-I233 HydrophobicContact CD1-CD1 3.26Å; I195-I233 HydrophobicContact CD1-CG1 4.46Å; I195-I233 HydrophobicContact CG1-CD1 4.45Å; I233-V241 HydrophobicContact CD1-CB 4.09Å; I233-V241 HydrophobicContact CD1-CG2 3.85Å
234	S	94.1	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.			trans	-70.5	127	172.2	-180	0	0	0	0	109.6	A236 H237 L240	S234-A236 VanDerWaalsContact C-N 3.32Å; S234-A236 PolarHBondContact O-N 3.46Å; S234-H237 PolarHBondContact OG-N 2.68Å; S234-L240 PolarHBondContact N-O 2.83Å; S234-L240 VanDerWaalsContact N-O 3.1Å
235	P	90.4	Very high	94	Very high	51 Å²	51	33.2 Å²	33.2	33%	0.331	18%	0.184	S	C	.	.	S	Bend	trans	-69.6	-29.1	178.5	25.9	-32.6	0	0	0	112.9	F275	P235-F275 HydrophobicContact CG-CB 4.33Å
236	A	90	Very high	94.2	Very high	43 Å²	43	31 Å²	31	36%	0.355	17%	0.172	S	C	.	.	S	Bend	trans	-94	-23.2	-178.9	0	0	0	0	0	113.7	S234 D278	S234-A236 VanDerWaalsContact C-N 3.32Å; S234-A236 PolarHBondContact O-N 3.46Å; A236-D278 WeakPolarHBondContact CB-O 3.37Å
237	H	91.4	Very high	94.1	Very high	85 Å²	85	30.9 Å²	30.9	39%	0.394	18%	0.178	S	C	.	.			trans	-119.7	95	-175.9	-58.8	-39.7	0	0	0	110.2	S234 N239 L240	S234-H237 PolarHBondContact OG-N 2.68Å; H237-N239 PolarHBondContact O-N 3.43Å; H237-L240 HydrophobicContact CB-CB 3.69Å; H237-L240 HydrophobicContact CB-CD2 4.22Å; H237-L240 PolarHBondContact O-N 2.87Å
238	P	91	Very high	93.9	Very high	56 Å²	56	31 Å²	31	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.4	-168.8	23.7	-34.8	0	0	0	114.3	A189	A189-P238 HydrophobicContact CB-CB 4.13Å
239	N	92.1	Very high	93.8	Very high	63 Å²	63	31.1 Å²	31.1	34%	0.337	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	6.5	178.3	-64	-54.9	0	0	0	113.5	H237 D254 L255 R256	H237-N239 PolarHBondContact O-N 3.43Å; N239-D254 CarbonylContact O-C 3.53Å; N239-D254 WeakPolarHBondContact O-CA 3.39Å; N239-L255 WeakPolarHBondContact O-CB 3.36Å; N239-L255 WeakPolarHBondContact O-CG 3.13Å; N239-L255 PolarHBondContact O-N 3.11Å; N239-R256 HydrophobicContact CB-CG 4.15Å; N239-R256 WeakPolarHBondContact OD1-CG 3.06Å
240	L	94	Very high	93.8	Very high	21 Å²	21	29.3 Å²	29.3	11%	0.11	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.3	-177.6	-173.9	67.7	0	0	0	110.8	S234 H237 L252 I261 F275 L296	S234-L240 PolarHBondContact N-O 2.83Å; S234-L240 VanDerWaalsContact N-O 3.1Å; H237-L240 HydrophobicContact CB-CB 3.69Å; H237-L240 HydrophobicContact CB-CD2 4.22Å; H237-L240 PolarHBondContact O-N 2.87Å; L240-L252 HydrophobicContact CD1-CB 4.23Å; L240-L252 HydrophobicContact CD1-CD2 4.46Å; L240-I261 HydrophobicContact CD1-CD1 3.49Å; L240-I261 VanDerWaalsContact CD1-CD1 3.49Å; L240-F275 HydrophobicContact CD2-CE1 4.33Å; L240-L296 HydrophobicContact CD2-CD1 4.38Å
241	V	95.7	Very high	93.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.3	172.4	62	0	0	0	0	110.5	I195 C231 F232 I233 L243 L252 A253 L255	I195-V241 HydrophobicContact CG2-CG2 4.35Å; C231-V241 HydrophobicContact CB-CG2 4.16Å; F232-V241 WeakPolarHBondContact O-CA 3.4Å; F232-V241 WeakPolarHBondContact O-CG2 3.49Å; I233-V241 HydrophobicContact CD1-CB 4.09Å; I233-V241 HydrophobicContact CD1-CG2 3.85Å; V241-L243 HydrophobicContact CG1-CD1 4.26Å; V241-L243 HydrophobicContact CG1-CD2 4.38Å; V241-L243 HydrophobicContact CG1-CG 4.18Å; V241-L243 HydrophobicContact CG2-CD2 3.67Å; V241-L243 HydrophobicContact CG2-CG 4.05Å; V241-L252 WeakPolarHBondContact O-CA 3.39Å; V241-A253 HydrophobicContact CG1-CB 3.9Å; V241-A253 PolarHBondContact N-O 2.81Å; V241-A253 VanDerWaalsContact N-O 3.11Å; V241-A253 PolarHBondContact O-N 3.36Å; V241-L255 HydrophobicContact CB-CD1 4.46Å; V241-L255 HydrophobicContact CB-CD2 3.95Å; V241-L255 HydrophobicContact CB-CG 4.29Å; V241-L255 HydrophobicContact CG1-CD2 3.52Å; V241-L255 HydrophobicContact CG1-CG 4.09Å
242	A	96.2	Very high	93.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.1	164.3	0	0	0	0	0	110.1	C231 F232 V250 Y251 L252 F275 L282	C231-A242 CarbonylContact C-O 3.41Å; C231-A242 WeakPolarHBondContact CA-O 3.4Å; F232-A242 HydrophobicContact CB-CB 4.38Å; F232-A242 PolarHBondContact N-O 3.45Å; F232-A242 PolarHBondContact O-N 2.79Å; A242-V250 HydrophobicContact CB-CG1 4.21Å; A242-Y251 CarbonylContact C-O 3.59Å; A242-Y251 WeakPolarHBondContact CA-O 3.34Å; A242-L252 HydrophobicContact CB-CD2 3.8Å; A242-F275 HydrophobicContact CB-CE2 3.62Å; A242-F275 HydrophobicContact CB-CZ 3.47Å; A242-F275 VanDerWaalsContact CB-CZ 3.47Å; A242-L282 HydrophobicContact CB-CD1 4.14Å; A242-L282 HydrophobicContact CB-CD2 4.1Å
243	L	97.2	Very high	93.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	106.1	-173.7	-63.4	169.9	0	0	0	108.5	T197 F203 F219 I228 K230 C231 V241 V250 Y251 A253	T197-L243 HydrophobicContact CG2-CD2 4.16Å; F203-L243 HydrophobicContact CB-CD2 4.24Å; F203-L243 HydrophobicContact CD1-CD1 3.35Å; F203-L243 HydrophobicContact CD1-CD2 4.44Å; F203-L243 HydrophobicContact CE1-CD1 3.65Å; F203-L243 HydrophobicContact CG-CD1 4.03Å; F203-L243 HydrophobicContact CG-CD2 4.31Å; F203-L243 HydrophobicContact CZ-CD1 4.48Å; F219-L243 HydrophobicContact CE2-CD1 3.81Å; F219-L243 HydrophobicContact CZ-CD1 3.89Å; I228-L243 HydrophobicContact CD1-CD1 4.24Å; I228-L243 HydrophobicContact CG2-CB 3.77Å; I228-L243 HydrophobicContact CG2-CD2 4.03Å; I228-L243 HydrophobicContact CG2-CG 4.38Å; K230-L243 CarbonylContact O-C 3.52Å; K230-L243 WeakPolarHBondContact O-CA 3.21Å; C231-L243 HydrophobicContact CB-CD2 3.69Å; V241-L243 HydrophobicContact CG1-CD1 4.26Å; V241-L243 HydrophobicContact CG1-CD2 4.38Å; V241-L243 HydrophobicContact CG1-CG 4.18Å; V241-L243 HydrophobicContact CG2-CD2 3.67Å; V241-L243 HydrophobicContact CG2-CG 4.05Å; L243-V250 WeakPolarHBondContact O-CA 3.36Å; L243-Y251 PolarHBondContact N-O 2.84Å; L243-Y251 PolarHBondContact O-N 3.07Å; L243-A253 HydrophobicContact CD1-CB 4.1Å
244	G	96	Very high	93.7	Very high	5 Å²	5	24.4 Å²	24.4	5%	0.052	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	140.6	175.1	0	0	0	0	0	111	I228 T229 K230	I228-G244 CarbonylContact C-O 3.58Å; I228-G244 WeakPolarHBondContact CA-O 3.44Å; T229-G244 PolarHBondContact N-O 3.18Å; T229-G244 PolarHBondContact OG1-O 3.15Å; K230-G244 PolarHBondContact N-O 2.58Å; K230-G244 PolarHBondContact O-N 3.01Å
245	T	95.6	Very high	93.7	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.025	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	176.6	177.3	62.4	0	0	0	0	111.5	E226 T227 T229 G247 A249 Y251	E226-T245 HydrophobicContact CG-CG2 3.81Å; T227-T245 CarbonylContact O-C 3.58Å; T227-T245 WeakPolarHBondContact O-CA 3.29Å; T229-T245 PolarHBondContact OG1-O 3.44Å; T229-T245 VanDerWaalsContact OG1-O 3.12Å; T245-G247 PolarHBondContact O-N 2.85Å; T245-G247 PolarHBondContact OG1-N 3.28Å; T245-A249 WeakPolarHBondContact CB-O 3.21Å; T245-A249 HydrophobicContact CG2-CB 4.19Å; T245-A249 WeakPolarHBondContact CG2-O 3.3Å; T245-A249 PolarHBondContact N-O 3.38Å; T245-A249 VanDerWaalsContact N-O 3.17Å; T245-A249 PolarHBondContact OG1-N 2.81Å; T245-A249 PolarHBondContact OG1-O 2.87Å; T245-Y251 HydrophobicContact CG2-CD2 3.89Å; T245-Y251 HydrophobicContact CG2-CE2 3.58Å
246	N	92.9	Very high	93.8	Very high	86 Å²	86	31.4 Å²	31.4	46%	0.46	17%	0.17	S	C	.	.	S	Bend	trans	-70.1	-6	165.2	58.6	-25.2	0	0	0	113.6	D225 T227 T229	D225-N246 PolarHBondContact O-ND2 3.39Å; T227-N246 PolarHBondContact N-OD1 3.02Å; T227-N246 PolarHBondContact O-N 2.98Å; T227-N246 PolarHBondContact O-OD1 3.34Å; T229-N246 HydrophobicContact CG2-CB 3.88Å
247	G	90.7	Very high	94.1	Very high	23 Å²	23	32.2 Å²	32.2	24%	0.237	17%	0.174	C	C	.	.	S	Bend	trans	-111.8	-145.5	178.4	0	0	0	0	0	113.1	T245 T270	T245-G247 PolarHBondContact O-N 2.85Å; T245-G247 PolarHBondContact OG1-N 3.28Å; G247-T270 PolarHBondContact O-N 2.82Å
248	S	90.8	Very high	94.2	Very high	38 Å²	38	29.8 Å²	29.8	27%	0.266	16%	0.163	S	C	.	.	S	Bend	trans	-91.8	-5.3	178.1	67.8	0	0	0	0	114.1	A266 G268	S248-A266 WeakPolarHBondContact CB-O 3.37Å; S248-A266 PolarHBondContact O-N 3.01Å; S248-G268 WeakPolarHBondContact CB-O 3.34Å
249	A	93.7	Very high	94.4	Very high	3 Å²	3	33.3 Å²	33.3	3%	0.025	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.1	-173.7	0	0	0	0	0	111.3	T245 Y251 V263 M264 R265	T245-A249 WeakPolarHBondContact CB-O 3.21Å; T245-A249 HydrophobicContact CG2-CB 4.19Å; T245-A249 WeakPolarHBondContact CG2-O 3.3Å; T245-A249 PolarHBondContact N-O 3.38Å; T245-A249 VanDerWaalsContact N-O 3.17Å; T245-A249 PolarHBondContact OG1-N 2.81Å; T245-A249 PolarHBondContact OG1-O 2.87Å; A249-Y251 HydrophobicContact CB-CE2 4.37Å; A249-V263 HydrophobicContact CB-CG2 4.25Å; A249-M264 WeakPolarHBondContact CA-O 3.02Å; A249-R265 HydrophobicContact CB-CG 4.33Å
250	V	95.4	Very high	94.4	Very high	1 Å²	1	34 Å²	34	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.5	168.7	-178.5	0	0	0	0	108.2	A242 L243 M264 T270 I273 L282 T284	A242-V250 HydrophobicContact CB-CG1 4.21Å; L243-V250 WeakPolarHBondContact O-CA 3.36Å; V250-M264 HydrophobicContact CB-CB 4.37Å; V250-M264 HydrophobicContact CB-CE 3.92Å; V250-M264 HydrophobicContact CG1-CE 3.56Å; V250-M264 PolarHBondContact N-O 2.93Å; V250-M264 PolarHBondContact O-N 2.71Å; V250-T270 HydrophobicContact CG2-CG2 4.09Å; V250-I273 HydrophobicContact CB-CD1 4.17Å; V250-I273 HydrophobicContact CG1-CD1 3.61Å; V250-I273 HydrophobicContact CG2-CD1 3.47Å; V250-I273 VanDerWaalsContact CG2-CD1 3.47Å; V250-I273 HydrophobicContact CG2-CG1 4.11Å; V250-L282 HydrophobicContact CG1-CD2 4.05Å; V250-T284 HydrophobicContact CG2-CG2 3.93Å
251	Y	95.3	Very high	94.3	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138.5	175.6	-63.5	-80.9	0	0	0	110.9	F219 S222 E226 A242 L243 T245 A249 K260 V263	F219-Y251 HydrophobicContact CB-CE1 4.34Å; F219-Y251 AromaticContact CD2-CD1 3.64Å; F219-Y251 HydrophobicContact CD2-CD1 3.64Å; F219-Y251 AromaticContact CD2-CD2 3.89Å; F219-Y251 HydrophobicContact CD2-CD2 3.89Å; F219-Y251 HydrophobicContact CD2-CE1 4.08Å; F219-Y251 HydrophobicContact CD2-CE2 4.3Å; F219-Y251 AromaticContact CD2-CG 3.53Å; F219-Y251 HydrophobicContact CD2-CG 3.53Å; F219-Y251 HydrophobicContact CE2-CD1 4.2Å; F219-Y251 HydrophobicContact CE2-CD2 4.18Å; F219-Y251 AromaticContact CE2-CG 3.74Å; F219-Y251 HydrophobicContact CE2-CG 3.74Å; F219-Y251 HydrophobicContact CG-CD1 4.41Å; S222-Y251 WeakPolarHBondContact CB-OH 3.27Å; E226-Y251 WeakPolarHBondContact OE1-CE2 2.93Å; E226-Y251 VanDerWaalsContact OE1-CZ 3.25Å; E226-Y251 PolarHBondContact OE1-OH 3.03Å; A242-Y251 CarbonylContact C-O 3.59Å; A242-Y251 WeakPolarHBondContact CA-O 3.34Å; L243-Y251 PolarHBondContact N-O 2.84Å; L243-Y251 PolarHBondContact O-N 3.07Å; T245-Y251 HydrophobicContact CG2-CD2 3.89Å; T245-Y251 HydrophobicContact CG2-CE2 3.58Å; A249-Y251 HydrophobicContact CB-CE2 4.37Å; Y251-K260 HydrophobicContact CD1-CD 3.55Å; Y251-K260 HydrophobicContact CD1-CG 3.99Å; Y251-K260 HydrophobicContact CE1-CD 3.8Å; Y251-V263 HydrophobicContact CD1-CB 3.83Å; Y251-V263 HydrophobicContact CD1-CG2 3.79Å; Y251-V263 HydrophobicContact CE1-CB 3.84Å; Y251-V263 HydrophobicContact CE1-CG2 3.55Å
252	L	94.9	Very high	94.2	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.2	161.1	-65.7	-179.6	0	0	0	108.8	L240 V241 A242 I261 S262 M264 L282 L296 A301	L240-L252 HydrophobicContact CD1-CB 4.23Å; L240-L252 HydrophobicContact CD1-CD2 4.46Å; V241-L252 WeakPolarHBondContact O-CA 3.39Å; A242-L252 HydrophobicContact CB-CD2 3.8Å; L252-I261 HydrophobicContact CB-CB 4.32Å; L252-I261 PolarHBondContact O-N 3.32Å; L252-S262 WeakPolarHBondContact CD1-OG 3.4Å; L252-S262 PolarHBondContact N-O 3.05Å; L252-S262 PolarHBondContact O-N 3.27Å; L252-M264 HydrophobicContact CD1-CE 3.94Å; L252-M264 HydrophobicContact CD1-SD 4.11Å; L252-M264 HydrophobicContact CD2-CE 3.78Å; L252-M264 HydrophobicContact CG-CE 3.52Å; L252-M264 HydrophobicContact CG-SD 4.34Å; L252-L282 HydrophobicContact CD2-CD2 4.39Å; L252-L296 HydrophobicContact CD1-CD2 3.48Å; L252-L296 VanDerWaalsContact CD1-CD2 3.48Å; L252-A301 HydrophobicContact CD1-CB 4.23Å
253	A	95.2	Very high	94	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.2	178.9	0	0	0	0	0	111.8	F203 F219 V241 L243 E259	F203-A253 HydrophobicContact CE1-CB 4.2Å; F203-A253 HydrophobicContact CZ-CB 4.3Å; F219-A253 HydrophobicContact CE1-CB 4.31Å; F219-A253 HydrophobicContact CZ-CB 3.65Å; V241-A253 HydrophobicContact CG1-CB 3.9Å; V241-A253 PolarHBondContact N-O 2.81Å; V241-A253 VanDerWaalsContact N-O 3.11Å; V241-A253 PolarHBondContact O-N 3.36Å; L243-A253 HydrophobicContact CD1-CB 4.1Å; A253-E259 VanDerWaalsContact CA-O 3.25Å; A253-E259 WeakPolarHBondContact CA-O 3.34Å; A253-E259 WeakPolarHBondContact CB-O 3.49Å
254	D	94.4	Very high	93.8	Very high	23 Å²	23	39.8 Å²	39.8	12%	0.123	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129	172.3	-168	-60.6	0	0	0	109.2	N239 R256 L258 E259 I261	N239-D254 CarbonylContact O-C 3.53Å; N239-D254 WeakPolarHBondContact O-CA 3.39Å; D254-R256 VanDerWaalsContact C-N 3.28Å; D254-R256 PolarHBondContact O-N 2.79Å; D254-R256 WeakPolarHBondContact OD1-CA 3.31Å; D254-R256 WeakPolarHBondContact OD1-CB 3.33Å; D254-R256 WeakPolarHBondContact OD1-CG 3.44Å; D254-R256 IonicContact OD1-CZ 3.93Å; D254-R256 PolarHBondContact OD1-N 3.1Å; D254-R256 IonicContact OD1-NE 2.68Å; D254-R256 PolarHBondContact OD1-NE 2.83Å; D254-R256 IonicContact OD1-NH2 3.91Å; D254-R256 IonicContact OD2-CZ 3.44Å; D254-R256 IonicContact OD2-NE 3.38Å; D254-R256 PolarHBondContact OD2-NE 2.92Å; D254-R256 IonicContact OD2-NH2 2.71Å; D254-R256 PolarHBondContact OD2-NH2 3.07Å; D254-L258 WeakPolarHBondContact O-CA 3.48Å; D254-L258 PolarHBondContact O-N 2.79Å; D254-E259 PolarHBondContact N-O 3.42Å; D254-E259 VanDerWaalsContact N-O 3.07Å; D254-I261 HydrophobicContact CB-CD1 3.99Å; D254-I261 HydrophobicContact CB-CG1 4.19Å
255	L	94.6	Very high	93.6	Very high	17 Å²	17	45.3 Å²	45.3	9%	0.089	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-11.9	-177.1	-65.9	172.7	0	0	0	113.9	T188 I195 F203 I205 N239 V241 L258	T188-L255 HydrophobicContact CG2-CD1 4.21Å; I195-L255 HydrophobicContact CD1-CD1 3.42Å; I195-L255 VanDerWaalsContact CD1-CD1 3.42Å; I195-L255 HydrophobicContact CD1-CD2 3.31Å; I195-L255 HydrophobicContact CD1-CG 3.99Å; I195-L255 HydrophobicContact CG1-CD2 3.66Å; F203-L255 HydrophobicContact CE2-CD2 4.16Å; I205-L255 HydrophobicContact CD1-CB 4.37Å; I205-L255 HydrophobicContact CD1-CD2 3.76Å; N239-L255 WeakPolarHBondContact O-CB 3.36Å; N239-L255 WeakPolarHBondContact O-CG 3.13Å; N239-L255 PolarHBondContact O-N 3.11Å; V241-L255 HydrophobicContact CB-CD1 4.46Å; V241-L255 HydrophobicContact CB-CD2 3.95Å; V241-L255 HydrophobicContact CB-CG 4.29Å; V241-L255 HydrophobicContact CG1-CD2 3.52Å; V241-L255 HydrophobicContact CG1-CG 4.09Å; L255-L258 WeakPolarHBondContact O-CD2 3.37Å
256	R	93.3	Very high	93.3	Very high	181 Å²	181	45.6 Å²	45.6	68%	0.683	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-46.2	176.4	-54.5	168.8	-69.2	176.9	-0.2	111	N239 D254	N239-R256 HydrophobicContact CB-CG 4.15Å; N239-R256 WeakPolarHBondContact OD1-CG 3.06Å; D254-R256 VanDerWaalsContact C-N 3.28Å; D254-R256 PolarHBondContact O-N 2.79Å; D254-R256 WeakPolarHBondContact OD1-CA 3.31Å; D254-R256 WeakPolarHBondContact OD1-CB 3.33Å; D254-R256 WeakPolarHBondContact OD1-CG 3.44Å; D254-R256 IonicContact OD1-CZ 3.93Å; D254-R256 PolarHBondContact OD1-N 3.1Å; D254-R256 IonicContact OD1-NE 2.68Å; D254-R256 PolarHBondContact OD1-NE 2.83Å; D254-R256 IonicContact OD1-NH2 3.91Å; D254-R256 IonicContact OD2-CZ 3.44Å; D254-R256 IonicContact OD2-NE 3.38Å; D254-R256 PolarHBondContact OD2-NE 2.92Å; D254-R256 IonicContact OD2-NH2 2.71Å; D254-R256 PolarHBondContact OD2-NH2 3.07Å
257	S	94.6	Very high	93.1	Very high	61 Å²	61	45.6 Å²	45.6	43%	0.427	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-19.1	179.4	65.2	0	0	0	0	113.5	E259	S257-E259 PolarHBondContact O-N 3.14Å; S257-E259 PolarHBondContact OG-N 3Å
258	L	95.2	Very high	93.1	Very high	33 Å²	33	46.2 Å²	46.2	17%	0.173	24%	0.243	C	C	.	.			trans	61.7	20.6	-171.2	-47	-178.4	0	0	0	113.6	F203 I205 A216 D254 L255	F203-L258 HydrophobicContact CE2-CD2 3.99Å; F203-L258 HydrophobicContact CZ-CB 4.3Å; F203-L258 HydrophobicContact CZ-CD2 4.05Å; I205-L258 HydrophobicContact CD1-CD2 3.31Å; I205-L258 HydrophobicContact CG1-CD2 4.06Å; A216-L258 HydrophobicContact CB-CB 4.01Å; D254-L258 WeakPolarHBondContact O-CA 3.48Å; D254-L258 PolarHBondContact O-N 2.79Å; L255-L258 WeakPolarHBondContact O-CD2 3.37Å
259	E	93.9	Very high	93.2	Very high	131 Å²	131	49.2 Å²	49.2	61%	0.612	26%	0.256	S	S	*	.			trans	-99.2	153	-178.2	-62.3	-171.3	144.1	0	0	112.1	A253 D254 S257 I261	A253-E259 VanDerWaalsContact CA-O 3.25Å; A253-E259 WeakPolarHBondContact CA-O 3.34Å; A253-E259 WeakPolarHBondContact CB-O 3.49Å; D254-E259 PolarHBondContact N-O 3.42Å; D254-E259 VanDerWaalsContact N-O 3.07Å; S257-E259 PolarHBondContact O-N 3.14Å; S257-E259 PolarHBondContact OG-N 3Å; E259-I261 PolarHBondContact O-N 3.05Å
260	K	93.2	Very high	93.2	Very high	76 Å²	76	49.8 Å²	49.8	33%	0.33	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.5	174.6	179.1	-175.7	65.9	178.1	0	109.7	F219 I220 Y251 V263	F219-K260 HydrophobicContact CB-CB 4.3Å; F219-K260 HydrophobicContact CB-CD 4.19Å; F219-K260 HydrophobicContact CD1-CB 3.58Å; F219-K260 HydrophobicContact CD2-CB 4.38Å; F219-K260 HydrophobicContact CE1-CB 3.88Å; F219-K260 HydrophobicContact CG-CB 3.85Å; F219-K260 HydrophobicContact CG-CD 4.4Å; F219-K260 HydrophobicContact CG-CG 4.44Å; F219-K260 HydrophobicContact CZ-CB 4.39Å; I220-K260 PolarHBondContact O-NZ 3.14Å; Y251-K260 HydrophobicContact CD1-CD 3.55Å; Y251-K260 HydrophobicContact CD1-CG 3.99Å; Y251-K260 HydrophobicContact CE1-CD 3.8Å; K260-V263 HydrophobicContact CD-CB 4.48Å
261	I	92.5	Very high	93.2	Very high	77 Å²	77	52 Å²	52	40%	0.395	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-51.9	170	-59.3	168.1	0	0	0	109.4	L240 L252 D254 E259	L240-I261 HydrophobicContact CD1-CD1 3.49Å; L240-I261 VanDerWaalsContact CD1-CD1 3.49Å; L252-I261 HydrophobicContact CB-CB 4.32Å; L252-I261 PolarHBondContact O-N 3.32Å; D254-I261 HydrophobicContact CB-CD1 3.99Å; D254-I261 HydrophobicContact CB-CG1 4.19Å; E259-I261 PolarHBondContact O-N 3.05Å
262	S	92.1	Very high	93.2	Very high	15 Å²	15	52.3 Å²	52.3	11%	0.105	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	167.6	-178.2	72.9	0	0	0	0	111.8	L252	L252-S262 WeakPolarHBondContact CD1-OG 3.4Å; L252-S262 PolarHBondContact N-O 3.05Å; L252-S262 PolarHBondContact O-N 3.27Å
263	V	92.8	Very high	93.3	Very high	48 Å²	48	52.1 Å²	52.1	29%	0.291	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.8	172.3	60.4	0	0	0	0	108.8	A249 Y251 K260	A249-V263 HydrophobicContact CB-CG2 4.25Å; Y251-V263 HydrophobicContact CD1-CB 3.83Å; Y251-V263 HydrophobicContact CD1-CG2 3.79Å; Y251-V263 HydrophobicContact CE1-CB 3.84Å; Y251-V263 HydrophobicContact CE1-CG2 3.55Å; K260-V263 HydrophobicContact CD-CB 4.48Å
264	M	92.3	Very high	93.3	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.015	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.7	177.8	-67	166	-57.3	0	0	107.9	A249 V250 L252 L282 F294 L296 A301	A249-M264 WeakPolarHBondContact CA-O 3.02Å; V250-M264 HydrophobicContact CB-CB 4.37Å; V250-M264 HydrophobicContact CB-CE 3.92Å; V250-M264 HydrophobicContact CG1-CE 3.56Å; V250-M264 PolarHBondContact N-O 2.93Å; V250-M264 PolarHBondContact O-N 2.71Å; L252-M264 HydrophobicContact CD1-CE 3.94Å; L252-M264 HydrophobicContact CD1-SD 4.11Å; L252-M264 HydrophobicContact CD2-CE 3.78Å; L252-M264 HydrophobicContact CG-CE 3.52Å; L252-M264 HydrophobicContact CG-SD 4.34Å; M264-L282 HydrophobicContact CE-CD2 3.24Å; M264-L282 HydrophobicContact SD-CD2 3.89Å; M264-F294 HydrophobicContact CB-CD1 3.76Å; M264-F294 HydrophobicContact CB-CE1 3.48Å; M264-F294 VanDerWaalsContact CB-CE1 3.48Å; M264-F294 HydrophobicContact CB-CE2 4.3Å; M264-F294 HydrophobicContact CB-CG 4.28Å; M264-F294 HydrophobicContact CB-CZ 3.79Å; M264-F294 HydrophobicContact CG-CD1 3.51Å; M264-F294 HydrophobicContact CG-CE1 3.78Å; M264-F294 HydrophobicContact CG-CG 3.99Å; M264-F294 HydrophobicContact CG-CZ 4.47Å; M264-F294 HydrophobicContact SD-CB 3.65Å; M264-F294 HydrophobicContact SD-CD1 3.75Å; M264-F294 HydrophobicContact SD-CD2 4.15Å; M264-F294 HydrophobicContact SD-CE1 4.45Å; M264-F294 HydrophobicContact SD-CG 3.58Å; M264-F294 VanDerWaalsContact SD-CG 3.58Å; M264-L296 HydrophobicContact SD-CD2 4.39Å; M264-A301 HydrophobicContact CG-CB 3.74Å; M264-A301 HydrophobicContact SD-CB 3.61Å
265	R	91.3	Very high	93.4	Very high	121 Å²	121	52.5 Å²	52.5	46%	0.457	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	120.3	177.8	-73	-175.8	165.8	84.3	3.9	108.9	A249	A249-R265 HydrophobicContact CB-CG 4.33Å
266	A	89.5	Confident	93.3	Very high	11 Å²	11	51.7 Å²	51.7	9%	0.091	27%	0.271	C	S	.	.			trans	-84.9	161.9	166.8	0	0	0	0	0	110	S248 Y292	S248-A266 WeakPolarHBondContact CB-O 3.37Å; S248-A266 PolarHBondContact O-N 3.01Å; A266-Y292 HydrophobicContact CB-CD2 3.48Å; A266-Y292 VanDerWaalsContact CB-CD2 3.48Å; A266-Y292 HydrophobicContact CB-CE2 3.82Å; A266-Y292 HydrophobicContact CB-CG 4.01Å
267	S	89.6	Confident	93.2	Very high	85 Å²	85	47.5 Å²	47.5	59%	0.594	26%	0.259	S	S	*	.	S	Bend	trans	-75.1	128.3	167	-167.9	0	0	0	0	108.9	Y292	S267-Y292 WeakPolarHBondContact CB-OH 3.38Å
268	G	89.9	Confident	92.9	Very high	37 Å²	37	48.9 Å²	48.9	38%	0.381	26%	0.261	S	S	.	.	S	Bend	trans	78.4	-178.4	-177.8	0	0	0	0	0	114.3	S248	S248-G268 WeakPolarHBondContact CB-O 3.34Å
269	L	92.7	Very high	92.5	Very high	101 Å²	101	47.4 Å²	47.4	53%	0.529	25%	0.254	S	S	.	.			trans	-67.8	138	-176.6	-63.6	175.9	0	0	0	111	G286 A287	L269-G286 WeakPolarHBondContact O-CA 3.49Å; L269-A287 PolarHBondContact O-N 3.16Å
270	T	95	Very high	92.4	Very high	15 Å²	15	42.3 Å²	42.3	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.3	174.2	-63.2	0	0	0	0	109.2	G247 V250 I273 T284	G247-T270 PolarHBondContact O-N 2.82Å; V250-T270 HydrophobicContact CG2-CG2 4.09Å; T270-I273 HydrophobicContact CG2-CG1 3.96Å; T270-T284 HydrophobicContact CG2-CG2 4.19Å
271	N	95.1	Very high	92.5	Very high	47 Å²	47	40 Å²	40	25%	0.251	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-32	-176	-66	-39.3	0	0	0	112.3	K230 Y285 N314 G315	K230-N271 PolarHBondContact NZ-O 2.84Å; N271-Y285 PolarHBondContact N-O 3.48Å; N271-N314 PolarHBondContact ND2-OD1 3.41Å; N271-N314 VanDerWaalsContact ND2-OD1 3.12Å; N271-G315 WeakPolarHBondContact CB-O 3.26Å; N271-G315 PolarHBondContact ND2-O 3.01Å
272	S	96	Very high	92.7	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.063	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155	-178.4	-162.7	0	0	0	0	112	Y285 I318	S272-Y285 PolarHBondContact N-O 3.43Å; S272-Y285 PolarHBondContact O-N 3.13Å; S272-I318 PolarHBondContact OG-N 3.37Å; S272-I318 VanDerWaalsContact OG-N 3.17Å
273	I	96.1	Very high	92.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144	-175	-52.6	166.8	0	0	0	107.3	F232 V250 T270 L282 N283 T284	F232-I273 WeakPolarHBondContact CD1-O 3.35Å; F232-I273 HydrophobicContact CD2-CB 3.86Å; F232-I273 HydrophobicContact CD2-CD1 4.06Å; F232-I273 HydrophobicContact CD2-CG1 4.43Å; F232-I273 HydrophobicContact CD2-CG2 4.46Å; F232-I273 WeakPolarHBondContact CE1-O 3.42Å; F232-I273 HydrophobicContact CE2-CB 3.71Å; F232-I273 HydrophobicContact CE2-CD1 3.88Å; F232-I273 HydrophobicContact CE2-CG1 4.05Å; F232-I273 HydrophobicContact CG-CB 4.41Å; F232-I273 HydrophobicContact CZ-CB 4.15Å; V250-I273 HydrophobicContact CB-CD1 4.17Å; V250-I273 HydrophobicContact CG1-CD1 3.61Å; V250-I273 HydrophobicContact CG2-CD1 3.47Å; V250-I273 VanDerWaalsContact CG2-CD1 3.47Å; V250-I273 HydrophobicContact CG2-CG1 4.11Å; T270-I273 HydrophobicContact CG2-CG1 3.96Å; I273-L282 HydrophobicContact CG2-CD1 3.43Å; I273-L282 VanDerWaalsContact CG2-CD1 3.43Å; I273-L282 HydrophobicContact CG2-CD2 3.81Å; I273-L282 HydrophobicContact CG2-CG 3.6Å; I273-N283 CarbonylContact C-O 3.51Å; I273-N283 VanDerWaalsContact CA-O 3.23Å; I273-N283 WeakPolarHBondContact CA-O 3.29Å; I273-N283 WeakPolarHBondContact CG2-O 3.43Å; I273-T284 HydrophobicContact CG1-CG2 4.32Å; I273-T284 HydrophobicContact CG2-CG2 4.4Å
274	C	95.7	Very high	93.1	Very high	16 Å²	16	33.4 Å²	33.4	11%	0.108	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	133.9	174.1	-174.7	0	0	0	0	111.5	N283 I318 S320	C274-N283 PolarHBondContact N-O 3.49Å; C274-N283 PolarHBondContact O-N 3.05Å; C274-I318 HydrophobicContact CB-CG2 3.9Å; C274-S320 VanDerWaalsContact SG-CB 3.56Å; C274-S320 PolarHBondContact SG-N 2.81Å
275	F	95.4	Very high	93.3	Very high	14 Å²	14	33.3 Å²	33.3	6%	0.061	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	149.2	169.8	-71.1	-91.1	0	0	0	110.6	F232 P235 L240 A242 F281 L282 L296	F232-F275 HydrophobicContact CB-CD2 4.22Å; F232-F275 HydrophobicContact CB-CE2 3.84Å; F232-F275 WeakPolarHBondContact O-CE2 3.44Å; P235-F275 HydrophobicContact CG-CB 4.33Å; L240-F275 HydrophobicContact CD2-CE1 4.33Å; A242-F275 HydrophobicContact CB-CE2 3.62Å; A242-F275 HydrophobicContact CB-CZ 3.47Å; A242-F275 VanDerWaalsContact CB-CZ 3.47Å; F275-F281 WeakPolarHBondContact CA-O 3.31Å; F275-L282 HydrophobicContact CB-CD1 4.47Å; F275-L282 HydrophobicContact CD1-CD1 3.54Å; F275-L282 HydrophobicContact CD2-CD1 3.69Å; F275-L282 HydrophobicContact CE1-CD1 3.56Å; F275-L282 HydrophobicContact CE2-CD1 3.69Å; F275-L282 HydrophobicContact CG-CD1 3.61Å; F275-L282 HydrophobicContact CZ-CD1 3.64Å; F275-L296 HydrophobicContact CD1-CD1 3.76Å; F275-L296 HydrophobicContact CE1-CD1 3.57Å
276	T	93.2	Very high	93.4	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	16%	0.163	C	C	.	.			trans	-73.2	150.4	157.3	55.1	0	0	0	0	109.7	D278 G279 F281 W341	T276-D278 VanDerWaalsContact C-N 3.25Å; T276-D278 WeakPolarHBondContact CB-OD1 3.43Å; T276-D278 PolarHBondContact O-N 2.63Å; T276-D278 PolarHBondContact OG1-OD1 2.77Å; T276-G279 PolarHBondContact O-N 3.35Å; T276-F281 HydrophobicContact CG2-CB 3.88Å; T276-F281 HydrophobicContact CG2-CD2 4.28Å; T276-F281 PolarHBondContact N-O 3.17Å; T276-F281 PolarHBondContact OG1-N 3.43Å; T276-F281 PolarHBondContact OG1-O 3.22Å; T276-W341 HydrophobicContact CG2-CD2 4.48Å; T276-W341 HydrophobicContact CG2-CH2 4.23Å; T276-W341 HydrophobicContact CG2-CZ2 3.72Å
277	Q	90.5	Very high	93.6	Very high	93 Å²	93	28.4 Å²	28.4	44%	0.435	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-32.6	-173.4	-172.2	68.2	2.6	0	0	112.6	G279 P322 S324	Q277-G279 PolarHBondContact O-N 3.24Å; Q277-P322 VanDerWaalsContact CB-O 3.31Å; Q277-P322 WeakPolarHBondContact CB-O 3.42Å; Q277-P322 WeakPolarHBondContact CG-O 3.17Å; Q277-S324 WeakPolarHBondContact CB-OG 3.5Å; Q277-S324 PolarHBondContact N-OG 3.11Å
278	D	88.9	Confident	93.8	Very high	90 Å²	90	31.2 Å²	31.2	48%	0.481	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.3	174.9	69.4	-16.1	0	0	0	113.4	A236 T276 T280	A236-D278 WeakPolarHBondContact CB-O 3.37Å; T276-D278 VanDerWaalsContact C-N 3.25Å; T276-D278 WeakPolarHBondContact CB-OD1 3.43Å; T276-D278 PolarHBondContact O-N 2.63Å; T276-D278 PolarHBondContact OG1-OD1 2.77Å; D278-T280 PolarHBondContact O-N 3.48Å; D278-T280 PolarHBondContact OD1-N 2.68Å; D278-T280 PolarHBondContact OD1-OG1 3.48Å; D278-T280 WeakPolarHBondContact OD2-CB 3.18Å; D278-T280 PolarHBondContact OD2-OG1 3.05Å
279	G	87.9	Confident	94	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	72	8.4	-177.8	0	0	0	0	0	114.5	T276 Q277 L296	T276-G279 PolarHBondContact O-N 3.35Å; Q277-G279 PolarHBondContact O-N 3.24Å; G279-L296 WeakPolarHBondContact O-CD1 3.44Å
280	T	91.6	Very high	94.1	Very high	24 Å²	24	24.9 Å²	24.9	15%	0.147	13%	0.132	C	C	.	.	S	Bend	trans	-74.2	-40.3	-177.1	-58.4	0	0	0	0	111.8	D278 L296 R297	D278-T280 PolarHBondContact O-N 3.48Å; D278-T280 PolarHBondContact OD1-N 2.68Å; D278-T280 PolarHBondContact OD1-OG1 3.48Å; D278-T280 WeakPolarHBondContact OD2-CB 3.18Å; D278-T280 PolarHBondContact OD2-OG1 3.05Å; T280-L296 WeakPolarHBondContact O-CB 3.44Å; T280-L296 PolarHBondContact O-N 2.76Å; T280-R297 HydrophobicContact CG2-CG 4.02Å
281	F	94.6	Very high	94.3	Very high	27 Å²	27	24.2 Å²	24.2	12%	0.118	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.7	-172.3	-55.8	-61.9	0	0	0	112.7	F275 T276 V293 F294 D295 I304 W341	F275-F281 WeakPolarHBondContact CA-O 3.31Å; T276-F281 HydrophobicContact CG2-CB 3.88Å; T276-F281 HydrophobicContact CG2-CD2 4.28Å; T276-F281 PolarHBondContact N-O 3.17Å; T276-F281 PolarHBondContact OG1-N 3.43Å; T276-F281 PolarHBondContact OG1-O 3.22Å; F281-V293 HydrophobicContact CB-CG1 3.92Å; F281-V293 HydrophobicContact CD1-CG1 4.02Å; F281-V293 HydrophobicContact CG-CG1 4.03Å; F281-F294 CarbonylContact C-O 3.57Å; F281-F294 VanDerWaalsContact CA-O 3.26Å; F281-F294 WeakPolarHBondContact CA-O 3.19Å; F281-D295 HydrophobicContact CD1-CB 4.34Å; F281-D295 HydrophobicContact CE1-CB 4.24Å; F281-I304 HydrophobicContact CD1-CD1 3.72Å; F281-I304 HydrophobicContact CE1-CD1 3.27Å; F281-I304 HydrophobicContact CE1-CG1 4.5Å; F281-I304 HydrophobicContact CZ-CD1 4.07Å; F281-W341 HydrophobicContact CB-CZ2 4.32Å; F281-W341 AromaticContact CD2-CZ2 3.77Å; F281-W341 HydrophobicContact CD2-CZ2 3.77Å; F281-W341 HydrophobicContact CE2-CZ2 4.48Å; F281-W341 HydrophobicContact CG-CZ2 4.28Å
282	L	95.6	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.2	166.9	-169.1	75.7	0	0	0	109.3	A242 V250 L252 M264 I273 F275 F294 L296	A242-L282 HydrophobicContact CB-CD1 4.14Å; A242-L282 HydrophobicContact CB-CD2 4.1Å; V250-L282 HydrophobicContact CG1-CD2 4.05Å; L252-L282 HydrophobicContact CD2-CD2 4.39Å; M264-L282 HydrophobicContact CE-CD2 3.24Å; M264-L282 HydrophobicContact SD-CD2 3.89Å; I273-L282 HydrophobicContact CG2-CD1 3.43Å; I273-L282 VanDerWaalsContact CG2-CD1 3.43Å; I273-L282 HydrophobicContact CG2-CD2 3.81Å; I273-L282 HydrophobicContact CG2-CG 3.6Å; F275-L282 HydrophobicContact CB-CD1 4.47Å; F275-L282 HydrophobicContact CD1-CD1 3.54Å; F275-L282 HydrophobicContact CD2-CD1 3.69Å; F275-L282 HydrophobicContact CE1-CD1 3.56Å; F275-L282 HydrophobicContact CE2-CD1 3.69Å; F275-L282 HydrophobicContact CG-CD1 3.61Å; F275-L282 HydrophobicContact CZ-CD1 3.64Å; L282-F294 HydrophobicContact CB-CB 4.31Å; L282-F294 PolarHBondContact N-O 2.96Å; L282-F294 PolarHBondContact O-N 2.96Å; L282-L296 HydrophobicContact CB-CD1 4.23Å; L282-L296 HydrophobicContact CB-CD2 4.14Å; L282-L296 HydrophobicContact CB-CG 4.34Å
283	N	96.5	Very high	94.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.8	174.6	-64.7	-77.7	0	0	0	109.3	I273 C274 I291 Y292 V293 I318 I327 W341	I273-N283 CarbonylContact C-O 3.51Å; I273-N283 VanDerWaalsContact CA-O 3.23Å; I273-N283 WeakPolarHBondContact CA-O 3.29Å; I273-N283 WeakPolarHBondContact CG2-O 3.43Å; C274-N283 PolarHBondContact N-O 3.49Å; C274-N283 PolarHBondContact O-N 3.05Å; N283-I291 HydrophobicContact CB-CG2 4.01Å; N283-Y292 WeakPolarHBondContact CA-O 3.49Å; N283-V293 WeakPolarHBondContact OD1-CG2 3.16Å; N283-I318 HydrophobicContact CB-CD1 4.17Å; N283-I327 HydrophobicContact CB-CD1 4.41Å; N283-W341 WeakPolarHBondContact ND2-CH2 3.37Å; N283-W341 WeakPolarHBondContact OD1-CH2 3.2Å; N283-W341 VanDerWaalsContact OD1-CZ3 3.24Å; N283-W341 WeakPolarHBondContact OD1-CZ3 3.47Å
284	T	97	Very high	94.4	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.5	170	62.8	0	0	0	0	108.9	V250 T270 I273 I291 Y292 F294	V250-T284 HydrophobicContact CG2-CG2 3.93Å; T270-T284 HydrophobicContact CG2-CG2 4.19Å; I273-T284 HydrophobicContact CG1-CG2 4.32Å; I273-T284 HydrophobicContact CG2-CG2 4.4Å; T284-I291 CarbonylContact O-C 3.55Å; T284-I291 WeakPolarHBondContact O-CA 3.01Å; T284-Y292 PolarHBondContact N-O 2.7Å; T284-Y292 PolarHBondContact O-N 3.33Å; T284-Y292 WeakPolarHBondContact OG1-CB 3.34Å; T284-Y292 PolarHBondContact OG1-O 3.38Å; T284-F294 HydrophobicContact CG2-CD2 4.05Å; T284-F294 HydrophobicContact CG2-CE2 3.63Å
285	Y	97.1	Very high	94.2	Very high	1 Å²	1	22 Å²	22	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.8	-175.5	-177.1	-135.5	0	0	0	110.4	N271 S272 I291 D309 S312 G315 S317 I318 C329 G330	N271-Y285 PolarHBondContact N-O 3.48Å; S272-Y285 PolarHBondContact N-O 3.43Å; S272-Y285 PolarHBondContact O-N 3.13Å; Y285-I291 HydrophobicContact CD2-CD1 3.46Å; Y285-I291 VanDerWaalsContact CD2-CD1 3.46Å; Y285-I291 HydrophobicContact CD2-CG1 3.56Å; Y285-I291 HydrophobicContact CE2-CD1 3.58Å; Y285-I291 HydrophobicContact CE2-CG1 4.2Å; Y285-I291 HydrophobicContact CG-CD1 4.48Å; Y285-I291 HydrophobicContact CG-CG1 4.21Å; Y285-D309 HydrophobicContact CE2-CB 3.83Å; Y285-D309 PolarHBondContact OH-OD2 2.72Å; Y285-S312 PolarHBondContact OH-OG 2.85Å; Y285-G315 VanDerWaalsContact OH-CA 3.28Å; Y285-G315 WeakPolarHBondContact OH-CA 3.41Å; Y285-S317 VanDerWaalsContact CD1-O 3.22Å; Y285-S317 WeakPolarHBondContact CD1-O 3.26Å; Y285-S317 VanDerWaalsContact CE1-O 3.26Å; Y285-S317 WeakPolarHBondContact CE1-O 3.4Å; Y285-I318 HydrophobicContact CD1-CB 3.91Å; Y285-I318 HydrophobicContact CG-CB 4.19Å; Y285-I318 HydrophobicContact CG-CD1 4.37Å; Y285-C329 HydrophobicContact CE1-CB 3.93Å; Y285-C329 HydrophobicContact CE2-CB 4.45Å; Y285-G330 WeakPolarHBondContact CE1-O 3.46Å
286	G	93.8	Very high	94	Very high	2 Å²	2	22.6 Å²	22.6	2%	0.021	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179	-125.2	-175.8	0	0	0	0	0	114.1	L269 G289 S290 G315	L269-G286 WeakPolarHBondContact O-CA 3.49Å; G286-G289 PolarHBondContact O-N 3.5Å; G286-S290 PolarHBondContact N-O 2.62Å; G286-G315 PolarHBondContact O-N 2.8Å
287	A	93.4	Very high	93.8	Very high	28 Å²	28	30.9 Å²	30.9	23%	0.231	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-55.9	143	-172.5	0	0	0	0	0	113.1	L269 G289 S290	L269-A287 PolarHBondContact O-N 3.16Å; A287-G289 PolarHBondContact O-N 2.76Å; A287-G289 VanDerWaalsContact O-N 3.15Å; A287-S290 WeakPolarHBondContact O-CB 3.44Å; A287-S290 PolarHBondContact O-N 3.44Å; A287-S290 VanDerWaalsContact O-N 3.1Å; A287-S290 PolarHBondContact O-OG 2.65Å
288	E	93	Very high	93.3	Very high	144 Å²	144	29 Å²	29	67%	0.673	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.2	178.5	-52.9	-176.5	160.1	0	0	113.8	S290 T313	E288-S290 PolarHBondContact O-N 3.23Å; E288-S290 VanDerWaalsContact O-N 3.1Å; E288-T313 WeakPolarHBondContact CA-O 3.45Å; E288-T313 PolarHBondContact N-O 2.97Å
289	G	94	Very high	92.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	20.5	-176.5	0	0	0	0	0	113.3	G286 A287 I291 D309 S312 T313	G286-G289 PolarHBondContact O-N 3.5Å; A287-G289 PolarHBondContact O-N 2.76Å; A287-G289 VanDerWaalsContact O-N 3.15Å; G289-I291 WeakPolarHBondContact O-CD1 3.11Å; G289-D309 PolarHBondContact O-N 3.4Å; G289-S312 WeakPolarHBondContact CA-O 3.28Å; G289-T313 PolarHBondContact N-O 2.82Å
290	S	96.4	Very high	92.2	Very high	5 Å²	5	40 Å²	40	4%	0.035	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	131.4	-176.8	-67.1	0	0	0	0	111.3	G286 A287 E288 F308	G286-S290 PolarHBondContact N-O 2.62Å; A287-S290 WeakPolarHBondContact O-CB 3.44Å; A287-S290 PolarHBondContact O-N 3.44Å; A287-S290 VanDerWaalsContact O-N 3.1Å; A287-S290 PolarHBondContact O-OG 2.65Å; E288-S290 PolarHBondContact O-N 3.23Å; E288-S290 VanDerWaalsContact O-N 3.1Å; S290-F308 WeakPolarHBondContact OG-CE1 3.27Å
291	I	97.7	Very high	91.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.5	167	-60.6	76.8	0	0	0	109	N283 T284 Y285 G289 R306 W307 D309 I318	N283-I291 HydrophobicContact CB-CG2 4.01Å; T284-I291 CarbonylContact O-C 3.55Å; T284-I291 WeakPolarHBondContact O-CA 3.01Å; Y285-I291 HydrophobicContact CD2-CD1 3.46Å; Y285-I291 VanDerWaalsContact CD2-CD1 3.46Å; Y285-I291 HydrophobicContact CD2-CG1 3.56Å; Y285-I291 HydrophobicContact CE2-CD1 3.58Å; Y285-I291 HydrophobicContact CE2-CG1 4.2Å; Y285-I291 HydrophobicContact CG-CD1 4.48Å; Y285-I291 HydrophobicContact CG-CG1 4.21Å; G289-I291 WeakPolarHBondContact O-CD1 3.11Å; I291-R306 VanDerWaalsContact O-CA 3.31Å; I291-R306 WeakPolarHBondContact O-CA 3.4Å; I291-W307 HydrophobicContact CB-CD2 3.95Å; I291-W307 HydrophobicContact CB-CG 4.27Å; I291-W307 HydrophobicContact CB-CZ2 3.85Å; I291-W307 HydrophobicContact CD1-CD2 4.12Å; I291-W307 HydrophobicContact CD1-CE3 3.91Å; I291-W307 HydrophobicContact CD1-CH2 3.79Å; I291-W307 HydrophobicContact CD1-CZ2 3.99Å; I291-W307 HydrophobicContact CD1-CZ3 3.74Å; I291-W307 HydrophobicContact CG1-CD2 4.26Å; I291-W307 HydrophobicContact CG1-CE3 4.48Å; I291-W307 HydrophobicContact CG1-CH2 3.91Å; I291-W307 HydrophobicContact CG1-CZ2 3.63Å; I291-W307 HydrophobicContact CG1-CZ3 4.33Å; I291-W307 HydrophobicContact CG2-CZ2 3.88Å; I291-W307 PolarHBondContact N-O 3.17Å; I291-W307 PolarHBondContact O-N 2.59Å; I291-D309 HydrophobicContact CD1-CB 3.82Å; I291-I318 HydrophobicContact CG1-CD1 3.87Å; I291-I318 HydrophobicContact CG2-CD1 4.11Å
292	Y	97	Very high	91.4	Very high	21 Å²	21	45.1 Å²	45.1	8%	0.082	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131	170.5	-68.3	-96.4	0	0	0	110.4	A266 S267 N283 T284 I303 R306	A266-Y292 HydrophobicContact CB-CD2 3.48Å; A266-Y292 VanDerWaalsContact CB-CD2 3.48Å; A266-Y292 HydrophobicContact CB-CE2 3.82Å; A266-Y292 HydrophobicContact CB-CG 4.01Å; S267-Y292 WeakPolarHBondContact CB-OH 3.38Å; N283-Y292 WeakPolarHBondContact CA-O 3.49Å; T284-Y292 PolarHBondContact N-O 2.7Å; T284-Y292 PolarHBondContact O-N 3.33Å; T284-Y292 WeakPolarHBondContact OG1-CB 3.34Å; T284-Y292 PolarHBondContact OG1-O 3.38Å; Y292-I303 HydrophobicContact CD1-CD1 3.67Å; Y292-I303 HydrophobicContact CD1-CG1 4.11Å; Y292-I303 HydrophobicContact CD1-CG2 3.87Å; Y292-I303 HydrophobicContact CE1-CD1 4.01Å; Y292-R306 HydrophobicContact CD1-CB 4.19Å; Y292-R306 HydrophobicContact CD1-CG 4.18Å; Y292-R306 HydrophobicContact CE1-CB 4.26Å; Y292-R306 HydrophobicContact CE1-CG 4.04Å; Y292-R306 HydrophobicContact CG-CG 4.49Å; Y292-R306 VanDerWaalsContact CZ-CD 3.44Å; Y292-R306 WeakPolarHBondContact OH-CD 3.33Å
293	V	96.5	Very high	91.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.5	178.8	-168.9	0	0	0	0	109.3	F281 N283 I303 I304 H305 W341 M345	F281-V293 HydrophobicContact CB-CG1 3.92Å; F281-V293 HydrophobicContact CD1-CG1 4.02Å; F281-V293 HydrophobicContact CG-CG1 4.03Å; N283-V293 WeakPolarHBondContact OD1-CG2 3.16Å; V293-I303 WeakPolarHBondContact O-CA 3.46Å; V293-I304 HydrophobicContact CB-CG1 4.23Å; V293-I304 HydrophobicContact CG1-CD1 4.16Å; V293-I304 HydrophobicContact CG1-CG1 4.1Å; V293-I304 WeakPolarHBondContact O-CG1 3.27Å; V293-I304 PolarHBondContact O-N 3.2Å; V293-H305 HydrophobicContact CB-CB 4.11Å; V293-H305 HydrophobicContact CG2-CB 4.12Å; V293-H305 PolarHBondContact N-O 3.11Å; V293-W341 HydrophobicContact CG1-CH2 4.01Å; V293-W341 HydrophobicContact CG2-CH2 4.28Å; V293-M345 HydrophobicContact CG1-CE 4.3Å; V293-M345 HydrophobicContact CG1-SD 4.09Å; V293-M345 HydrophobicContact CG2-SD 4.09Å
294	F	95.5	Very high	91.1	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	177	-62.4	-92.8	0	0	0	110.7	M264 F281 L282 T284 R302 I303	M264-F294 HydrophobicContact CB-CD1 3.76Å; M264-F294 HydrophobicContact CB-CE1 3.48Å; M264-F294 VanDerWaalsContact CB-CE1 3.48Å; M264-F294 HydrophobicContact CB-CE2 4.3Å; M264-F294 HydrophobicContact CB-CG 4.28Å; M264-F294 HydrophobicContact CB-CZ 3.79Å; M264-F294 HydrophobicContact CG-CD1 3.51Å; M264-F294 HydrophobicContact CG-CE1 3.78Å; M264-F294 HydrophobicContact CG-CG 3.99Å; M264-F294 HydrophobicContact CG-CZ 4.47Å; M264-F294 HydrophobicContact SD-CB 3.65Å; M264-F294 HydrophobicContact SD-CD1 3.75Å; M264-F294 HydrophobicContact SD-CD2 4.15Å; M264-F294 HydrophobicContact SD-CE1 4.45Å; M264-F294 HydrophobicContact SD-CG 3.58Å; M264-F294 VanDerWaalsContact SD-CG 3.58Å; F281-F294 CarbonylContact C-O 3.57Å; F281-F294 VanDerWaalsContact CA-O 3.26Å; F281-F294 WeakPolarHBondContact CA-O 3.19Å; L282-F294 HydrophobicContact CB-CB 4.31Å; L282-F294 PolarHBondContact N-O 2.96Å; L282-F294 PolarHBondContact O-N 2.96Å; T284-F294 HydrophobicContact CG2-CD2 4.05Å; T284-F294 HydrophobicContact CG2-CE2 3.63Å; F294-R302 WeakPolarHBondContact CA-O 3.08Å; F294-I303 HydrophobicContact CD1-CG1 3.9Å; F294-I303 HydrophobicContact CE1-CB 4.46Å; F294-I303 HydrophobicContact CE1-CD1 4.13Å; F294-I303 HydrophobicContact CE1-CG1 3.28Å; F294-I303 HydrophobicContact CZ-CD1 4.25Å; F294-I303 HydrophobicContact CZ-CG1 3.66Å
295	D	93.4	Very high	91	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.027	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121.5	173.9	-171.6	-13.6	0	0	0	110.3	F281 R297 V298 A301 R302 I304	F281-D295 HydrophobicContact CD1-CB 4.34Å; F281-D295 HydrophobicContact CE1-CB 4.24Å; D295-R297 VanDerWaalsContact OD1-CB 3.32Å; D295-R297 WeakPolarHBondContact OD1-CB 3.41Å; D295-R297 WeakPolarHBondContact OD1-CG 3.36Å; D295-R297 IonicContact OD1-CZ 3.76Å; D295-R297 PolarHBondContact OD1-N 3.16Å; D295-R297 IonicContact OD1-NE 2.92Å; D295-R297 PolarHBondContact OD1-NE 3.12Å; D295-R297 IonicContact OD1-NH2 3.75Å; D295-R297 IonicContact OD2-CZ 3.44Å; D295-R297 IonicContact OD2-NE 3.32Å; D295-R297 PolarHBondContact OD2-NE 3.37Å; D295-R297 IonicContact OD2-NH2 2.71Å; D295-R297 PolarHBondContact OD2-NH2 3.32Å; D295-V298 WeakPolarHBondContact O-CG2 3.43Å; D295-A301 WeakPolarHBondContact O-CA 3.47Å; D295-R302 PolarHBondContact N-O 3.01Å; D295-R302 VanDerWaalsContact N-O 3.15Å; D295-I304 HydrophobicContact CB-CD1 4.3Å; D295-I304 HydrophobicContact CB-CG1 4.36Å; D295-I304 HydrophobicContact CB-CG2 3.59Å
296	L	91.3	Very high	90.9	Very high	26 Å²	26	57.2 Å²	57.2	14%	0.136	27%	0.267	C	S	.	.	S	Bend	trans	-91	-8.6	-176.6	-58.7	-174.8	0	0	0	113.5	L240 L252 M264 F275 G279 T280 L282 V298 A301	L240-L296 HydrophobicContact CD2-CD1 4.38Å; L252-L296 HydrophobicContact CD1-CD2 3.48Å; L252-L296 VanDerWaalsContact CD1-CD2 3.48Å; M264-L296 HydrophobicContact SD-CD2 4.39Å; F275-L296 HydrophobicContact CD1-CD1 3.76Å; F275-L296 HydrophobicContact CE1-CD1 3.57Å; G279-L296 WeakPolarHBondContact O-CD1 3.44Å; T280-L296 WeakPolarHBondContact O-CB 3.44Å; T280-L296 PolarHBondContact O-N 2.76Å; L282-L296 HydrophobicContact CB-CD1 4.23Å; L282-L296 HydrophobicContact CB-CD2 4.14Å; L282-L296 HydrophobicContact CB-CG 4.34Å; L296-V298 VanDerWaalsContact C-N 3.25Å; L296-V298 PolarHBondContact O-N 3.41Å; L296-A301 HydrophobicContact CD2-CB 4.24Å
297	R	87.3	Confident	91.1	Very high	175 Å²	175	57.1 Å²	57.1	66%	0.66	27%	0.266	S	S	*	.	S	Bend	trans	-73	-21.8	-180	-59.4	172.6	-66.4	-179.8	4.9	112.7	T280 D295	T280-R297 HydrophobicContact CG2-CG 4.02Å; D295-R297 VanDerWaalsContact OD1-CB 3.32Å; D295-R297 WeakPolarHBondContact OD1-CB 3.41Å; D295-R297 WeakPolarHBondContact OD1-CG 3.36Å; D295-R297 IonicContact OD1-CZ 3.76Å; D295-R297 PolarHBondContact OD1-N 3.16Å; D295-R297 IonicContact OD1-NE 2.92Å; D295-R297 PolarHBondContact OD1-NE 3.12Å; D295-R297 IonicContact OD1-NH2 3.75Å; D295-R297 IonicContact OD2-CZ 3.44Å; D295-R297 IonicContact OD2-NE 3.32Å; D295-R297 PolarHBondContact OD2-NE 3.37Å; D295-R297 IonicContact OD2-NH2 2.71Å; D295-R297 PolarHBondContact OD2-NH2 3.32Å
298	V	81.6	Confident	91.3	Very high	53 Å²	53	58.1 Å²	58.1	32%	0.321	27%	0.265	S	S	.	.	S	Bend	trans	-92.1	140.4	178.2	-67.8	0	0	0	0	110.4	D295 L296 K300 R302	D295-V298 WeakPolarHBondContact O-CG2 3.43Å; L296-V298 VanDerWaalsContact C-N 3.25Å; L296-V298 PolarHBondContact O-N 3.41Å; V298-K300 VanDerWaalsContact CG2-O 3.28Å; V298-K300 WeakPolarHBondContact CG2-O 3.44Å; V298-K300 PolarHBondContact O-N 2.68Å; V298-K300 VanDerWaalsContact O-N 3.08Å; V298-R302 HydrophobicContact CG2-CG 4.26Å
299	N	71.5	Confident	91.6	Very high	147 Å²	147	51.5 Å²	51.5	79%	0.786	23%	0.234	S	C	*	.	S	Bend	trans	-56.2	-32.4	-176	-164.9	17.9	0	0	0	113.1
300	K	80.4	Confident	91.6	Very high	177 Å²	177	55.8 Å²	55.8	77%	0.77	25%	0.254	S	S	*	.	S	Bend	trans	-109.7	99.7	170	-66.6	-177.6	-179.5	178	0	108.8	V298 R302	V298-K300 VanDerWaalsContact CG2-O 3.28Å; V298-K300 WeakPolarHBondContact CG2-O 3.44Å; V298-K300 PolarHBondContact O-N 2.68Å; V298-K300 VanDerWaalsContact O-N 3.08Å; K300-R302 PolarHBondContact O-N 2.92Å
301	A	84.2	Confident	91.3	Very high	16 Å²	16	60.2 Å²	60.2	13%	0.132	29%	0.291	C	S	.	.			trans	-51.4	125	176.7	0	0	0	0	0	110.3	L252 M264 D295 L296	L252-A301 HydrophobicContact CD1-CB 4.23Å; M264-A301 HydrophobicContact CG-CB 3.74Å; M264-A301 HydrophobicContact SD-CB 3.61Å; D295-A301 WeakPolarHBondContact O-CA 3.47Å; L296-A301 HydrophobicContact CD2-CB 4.24Å
302	R	85.9	Confident	91	Very high	141 Å²	141	60.8 Å²	60.8	53%	0.532	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	151.7	-176.9	68.4	-175.8	174	98.1	1	109.9	F294 D295 V298 K300 I304	F294-R302 WeakPolarHBondContact CA-O 3.08Å; D295-R302 PolarHBondContact N-O 3.01Å; D295-R302 VanDerWaalsContact N-O 3.15Å; V298-R302 HydrophobicContact CG2-CG 4.26Å; K300-R302 PolarHBondContact O-N 2.92Å; R302-I304 HydrophobicContact CG-CG2 4.13Å; R302-I304 PolarHBondContact O-N 3.34Å
303	I	90.9	Very high	90.7	Very high	73 Å²	73	64.5 Å²	64.5	37%	0.374	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	124.3	169.6	-59.5	165.7	0	0	0	107.3	Y292 V293 F294	Y292-I303 HydrophobicContact CD1-CD1 3.67Å; Y292-I303 HydrophobicContact CD1-CG1 4.11Å; Y292-I303 HydrophobicContact CD1-CG2 3.87Å; Y292-I303 HydrophobicContact CE1-CD1 4.01Å; V293-I303 WeakPolarHBondContact O-CA 3.46Å; F294-I303 HydrophobicContact CD1-CG1 3.9Å; F294-I303 HydrophobicContact CE1-CB 4.46Å; F294-I303 HydrophobicContact CE1-CD1 4.13Å; F294-I303 HydrophobicContact CE1-CG1 3.28Å; F294-I303 HydrophobicContact CZ-CD1 4.25Å; F294-I303 HydrophobicContact CZ-CG1 3.66Å
304	I	93.9	Very high	90.6	Very high	55 Å²	55	66.8 Å²	66.8	28%	0.282	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-23.4	173.9	57.2	154.5	0	0	0	112.5	F281 V293 D295 R302 M345	F281-I304 HydrophobicContact CD1-CD1 3.72Å; F281-I304 HydrophobicContact CE1-CD1 3.27Å; F281-I304 HydrophobicContact CE1-CG1 4.5Å; F281-I304 HydrophobicContact CZ-CD1 4.07Å; V293-I304 HydrophobicContact CB-CG1 4.23Å; V293-I304 HydrophobicContact CG1-CD1 4.16Å; V293-I304 HydrophobicContact CG1-CG1 4.1Å; V293-I304 WeakPolarHBondContact O-CG1 3.27Å; V293-I304 PolarHBondContact O-N 3.2Å; D295-I304 HydrophobicContact CB-CD1 4.3Å; D295-I304 HydrophobicContact CB-CG1 4.36Å; D295-I304 HydrophobicContact CB-CG2 3.59Å; R302-I304 HydrophobicContact CG-CG2 4.13Å; R302-I304 PolarHBondContact O-N 3.34Å; I304-M345 HydrophobicContact CD1-CE 3.97Å
305	H	95.5	Very high	90.6	Very high	38 Å²	38	66.6 Å²	66.6	18%	0.176	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	151.8	-176.7	-163.4	-75.5	0	0	0	109.4	V293 W307 M345 T347	V293-H305 HydrophobicContact CB-CB 4.11Å; V293-H305 HydrophobicContact CG2-CB 4.12Å; V293-H305 PolarHBondContact N-O 3.11Å; H305-W307 AromaticContact ND1-CD1 3.96Å; H305-M345 HydrophobicContact CB-CE 4.46Å; H305-T347 PolarHBondContact CE1-O 2.88Å
306	R	96.2	Very high	90.8	Very high	91 Å²	91	67.9 Å²	67.9	34%	0.343	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.9	167.2	179.8	-177.1	65.8	168.2	-0.8	108.4	I291 Y292 E348	I291-R306 VanDerWaalsContact O-CA 3.31Å; I291-R306 WeakPolarHBondContact O-CA 3.4Å; Y292-R306 HydrophobicContact CD1-CB 4.19Å; Y292-R306 HydrophobicContact CD1-CG 4.18Å; Y292-R306 HydrophobicContact CE1-CB 4.26Å; Y292-R306 HydrophobicContact CE1-CG 4.04Å; Y292-R306 HydrophobicContact CG-CG 4.49Å; Y292-R306 VanDerWaalsContact CZ-CD 3.44Å; Y292-R306 WeakPolarHBondContact OH-CD 3.33Å; R306-E348 WeakPolarHBondContact O-CG 3.37Å
307	W	97.7	Very high	91.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	164.2	173.8	62	-85.3	0	0	0	110.2	I291 H305 I327 Y339 T344 E348 P350	I291-W307 HydrophobicContact CB-CD2 3.95Å; I291-W307 HydrophobicContact CB-CG 4.27Å; I291-W307 HydrophobicContact CB-CZ2 3.85Å; I291-W307 HydrophobicContact CD1-CD2 4.12Å; I291-W307 HydrophobicContact CD1-CE3 3.91Å; I291-W307 HydrophobicContact CD1-CH2 3.79Å; I291-W307 HydrophobicContact CD1-CZ2 3.99Å; I291-W307 HydrophobicContact CD1-CZ3 3.74Å; I291-W307 HydrophobicContact CG1-CD2 4.26Å; I291-W307 HydrophobicContact CG1-CE3 4.48Å; I291-W307 HydrophobicContact CG1-CH2 3.91Å; I291-W307 HydrophobicContact CG1-CZ2 3.63Å; I291-W307 HydrophobicContact CG1-CZ3 4.33Å; I291-W307 HydrophobicContact CG2-CZ2 3.88Å; I291-W307 PolarHBondContact N-O 3.17Å; I291-W307 PolarHBondContact O-N 2.59Å; H305-W307 AromaticContact ND1-CD1 3.96Å; W307-I327 HydrophobicContact CH2-CG2 4.18Å; W307-I327 HydrophobicContact CZ2-CD1 4.28Å; W307-I327 HydrophobicContact CZ2-CG2 4.18Å; W307-Y339 AromaticContact CH2-CD2 3.94Å; W307-Y339 HydrophobicContact CH2-CD2 3.94Å; W307-Y339 HydrophobicContact CH2-CE2 4.21Å; W307-Y339 HydrophobicContact CH2-CG 4.37Å; W307-Y339 AromaticContact CZ3-CD2 3.98Å; W307-Y339 HydrophobicContact CZ3-CD2 3.98Å; W307-Y339 HydrophobicContact CZ3-CE1 4.41Å; W307-Y339 AromaticContact CZ3-CE2 3.89Å; W307-Y339 HydrophobicContact CZ3-CE2 3.89Å; W307-Y339 HydrophobicContact CZ3-CG 4.3Å; W307-T344 HydrophobicContact CD2-CG2 4.15Å; W307-T344 HydrophobicContact CE3-CG2 4.1Å; W307-T344 HydrophobicContact CH2-CG2 3.67Å; W307-T344 HydrophobicContact CZ2-CG2 3.73Å; W307-T344 HydrophobicContact CZ3-CG2 3.86Å; W307-E348 CarbonylContact C-O 3.48Å; W307-E348 WeakPolarHBondContact CA-O 3.14Å; W307-E348 WeakPolarHBondContact CB-O 3.4Å; W307-P350 HydrophobicContact CD2-CG 4.3Å; W307-P350 HydrophobicContact CE3-CG 3.52Å; W307-P350 HydrophobicContact CZ3-CG 3.98Å
308	F	97.6	Very high	91.6	Very high	49 Å²	49	58.9 Å²	58.9	22%	0.215	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133	-173.6	-61.7	-87.2	0	0	0	111	S290 E348	S290-F308 WeakPolarHBondContact OG-CE1 3.27Å; F308-E348 PolarHBondContact N-O 2.89Å
309	D	97.9	Very high	92.3	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.027	29%	0.294	C	S	.	.			trans	-71.7	126.1	169.8	-177.5	21.6	0	0	0	110	Y285 G289 I291 A311 S312 C329 N337 Y339	Y285-D309 HydrophobicContact CE2-CB 3.83Å; Y285-D309 PolarHBondContact OH-OD2 2.72Å; G289-D309 PolarHBondContact O-N 3.4Å; I291-D309 HydrophobicContact CD1-CB 3.82Å; D309-A311 PolarHBondContact O-N 2.79Å; D309-S312 PolarHBondContact O-N 3.02Å; D309-S312 VanDerWaalsContact OD2-CB 3.23Å; D309-S312 WeakPolarHBondContact OD2-CB 3.45Å; D309-C329 HydrophobicContact CB-CB 4.31Å; D309-C329 VanDerWaalsContact OD2-CB 3.28Å; D309-C329 WeakPolarHBondContact OD2-CB 3.45Å; D309-N337 VanDerWaalsContact OD1-CB 3.27Å; D309-N337 WeakPolarHBondContact OD1-CB 3.41Å; D309-N337 PolarHBondContact OD1-ND2 3.17Å; D309-Y339 VanDerWaalsContact OD1-CE2 3.32Å; D309-Y339 WeakPolarHBondContact OD1-CE2 3.46Å; D309-Y339 PolarHBondContact OD1-OH 2.88Å
310	Q	95.2	Very high	93.5	Very high	90 Å²	90	50.8 Å²	50.8	42%	0.421	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	125.1	-168.9	179.7	174.9	-33.4	0	0	110.7	S312 N337 Y339 P352	Q310-S312 PolarHBondContact O-N 2.84Å; Q310-S312 VanDerWaalsContact O-N 3.12Å; Q310-N337 PolarHBondContact O-ND2 2.84Å; Q310-Y339 WeakPolarHBondContact CB-OH 3.42Å; Q310-Y339 PolarHBondContact N-OH 2.98Å; Q310-P352 HydrophobicContact CB-CG 4.41Å
311	A	90.6	Very high	94.2	Very high	99 Å²	99	42.4 Å²	42.4	82%	0.818	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	19.8	-180	0	0	0	0	0	114.5	D309	D309-A311 PolarHBondContact O-N 2.79Å
312	S	91.4	Very high	94.6	Very high	12 Å²	12	43.7 Å²	43.7	8%	0.084	23%	0.232	C	C	.	.			trans	-92.6	124.7	171	-177	0	0	0	0	110.2	Y285 G289 D309 Q310 A331	Y285-S312 PolarHBondContact OH-OG 2.85Å; G289-S312 WeakPolarHBondContact CA-O 3.28Å; D309-S312 PolarHBondContact O-N 3.02Å; D309-S312 VanDerWaalsContact OD2-CB 3.23Å; D309-S312 WeakPolarHBondContact OD2-CB 3.45Å; Q310-S312 PolarHBondContact O-N 2.84Å; Q310-S312 VanDerWaalsContact O-N 3.12Å; S312-A331 WeakPolarHBondContact OG-CB 3.17Å
313	T	90.1	Very high	94.9	Very high	98 Å²	98	40 Å²	40	60%	0.601	22%	0.222	S	C	*	.	S	Bend	trans	-89.6	-32.2	174.8	42.2	0	0	0	0	112.2	E288 G289 D332	E288-T313 WeakPolarHBondContact CA-O 3.45Å; E288-T313 PolarHBondContact N-O 2.97Å; G289-T313 PolarHBondContact N-O 2.82Å; T313-D332 PolarHBondContact OG1-OD1 2.93Å
314	N	94.2	Very high	94.9	Very high	48 Å²	48	37.7 Å²	37.7	26%	0.257	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-148.8	115.1	179.1	-179.3	48.2	0	0	0	110.5	N271 D332	N271-N314 PolarHBondContact ND2-OD1 3.41Å; N271-N314 VanDerWaalsContact ND2-OD1 3.12Å; N314-D332 HydrophobicContact CB-CB 4.37Å; N314-D332 WeakPolarHBondContact CB-OD2 3.2Å; N314-D332 PolarHBondContact O-N 2.76Å; N314-D332 VanDerWaalsContact O-N 3.09Å
315	G	96.1	Very high	94.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.7	178.5	0	0	0	0	0	112.8	N271 Y285 G286	N271-G315 WeakPolarHBondContact CB-O 3.26Å; N271-G315 PolarHBondContact ND2-O 3.01Å; Y285-G315 VanDerWaalsContact OH-CA 3.28Å; Y285-G315 WeakPolarHBondContact OH-CA 3.41Å; G286-G315 PolarHBondContact O-N 2.8Å
316	L	96.9	Very high	94.9	Very high	32 Å²	32	40.5 Å²	40.5	17%	0.168	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-34.2	-177.6	-69.9	-176.3	0	0	0	113.4	G330 D332 V363	L316-G330 PolarHBondContact N-O 3.39Å; L316-D332 HydrophobicContact CD1-CB 3.96Å; L316-D332 HydrophobicContact CG-CB 4.17Å; L316-V363 WeakPolarHBondContact CB-O 3.1Å
317	S	97.5	Very high	94.9	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.028	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	144.4	-178.7	55.9	0	0	0	0	111.3	Y285 G330 V363 L366	Y285-S317 VanDerWaalsContact CD1-O 3.22Å; Y285-S317 WeakPolarHBondContact CD1-O 3.26Å; Y285-S317 VanDerWaalsContact CE1-O 3.26Å; Y285-S317 WeakPolarHBondContact CE1-O 3.4Å; S317-G330 PolarHBondContact N-O 2.92Å; S317-G330 PolarHBondContact O-N 3.39Å; S317-V363 WeakPolarHBondContact CB-O 3.31Å; S317-V363 PolarHBondContact OG-O 2.99Å; S317-L366 WeakPolarHBondContact OG-CD1 3.41Å; S317-L366 VanDerWaalsContact OG-CG 3.31Å; S317-L366 WeakPolarHBondContact OG-CG 3.47Å
318	I	97.7	Very high	95	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.046	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.5	174.6	-168.9	166.6	0	0	0	108.7	S272 C274 N283 Y285 I291 I327 A328	S272-I318 PolarHBondContact OG-N 3.37Å; S272-I318 VanDerWaalsContact OG-N 3.17Å; C274-I318 HydrophobicContact CB-CG2 3.9Å; N283-I318 HydrophobicContact CB-CD1 4.17Å; Y285-I318 HydrophobicContact CD1-CB 3.91Å; Y285-I318 HydrophobicContact CG-CB 4.19Å; Y285-I318 HydrophobicContact CG-CD1 4.37Å; I291-I318 HydrophobicContact CG1-CD1 3.87Å; I291-I318 HydrophobicContact CG2-CD1 4.11Å; I318-I327 HydrophobicContact CD1-CD1 3.73Å; I318-I327 HydrophobicContact CD1-CG1 4.05Å; I318-I327 HydrophobicContact CG1-CD1 4.06Å; I318-I327 HydrophobicContact CG1-CG1 3.92Å; I318-A328 WeakPolarHBondContact CA-O 3.43Å
319	S	97.2	Very high	95	Very high	17 Å²	17	33.8 Å²	33.8	12%	0.119	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.1	176.1	-168.1	0	0	0	0	109.9	I327 A328 F368	S319-I327 WeakPolarHBondContact O-CA 3.48Å; S319-A328 PolarHBondContact N-O 3.39Å; S319-A328 PolarHBondContact O-N 3.47Å; S319-F368 WeakPolarHBondContact O-CE2 3.46Å
320	S	96.2	Very high	95	Very high	13 Å²	13	33.6 Å²	33.6	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	149.1	169.8	-171.4	0	0	0	0	109.3	C274 W326 F368	C274-S320 VanDerWaalsContact SG-CB 3.56Å; C274-S320 PolarHBondContact SG-N 2.81Å; S320-W326 WeakPolarHBondContact CA-O 3.37Å; S320-W326 PolarHBondContact OG-O 3.15Å; S320-F368 VanDerWaalsContact C-CD2 3.45Å; S320-F368 WeakPolarHBondContact O-CD2 3.13Å
321	S	95.6	Very high	95.1	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	18%	0.177	C	C	.	.			trans	-71.7	149.7	172.2	61.2	0	0	0	0	111	N323 S324 Q325 W326	S321-N323 WeakPolarHBondContact CB-OD1 3.38Å; S321-N323 PolarHBondContact O-N 2.84Å; S321-N323 VanDerWaalsContact O-N 3.11Å; S321-N323 PolarHBondContact OG-OD1 3.02Å; S321-S324 WeakPolarHBondContact O-CA 3.36Å; S321-S324 PolarHBondContact O-N 2.82Å; S321-Q325 PolarHBondContact OG-N 2.84Å; S321-W326 PolarHBondContact N-O 2.76Å; S321-W326 PolarHBondContact OG-N 3.38Å; S321-W326 PolarHBondContact OG-O 3.17Å
322	P	93	Very high	95.4	Very high	43 Å²	43	27.7 Å²	27.7	28%	0.279	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-32.3	176.4	-27.5	30.1	0	0	0	114.8	Q277 S324 N372	Q277-P322 VanDerWaalsContact CB-O 3.31Å; Q277-P322 WeakPolarHBondContact CB-O 3.42Å; Q277-P322 WeakPolarHBondContact CG-O 3.17Å; P322-S324 VanDerWaalsContact C-N 3.31Å; P322-N372 WeakPolarHBondContact CB-OD1 3.24Å; P322-N372 WeakPolarHBondContact CD-OD1 3.19Å; P322-N372 VanDerWaalsContact N-OD1 3.16Å
323	N	91.9	Very high	95.6	Very high	62 Å²	62	29.9 Å²	29.9	33%	0.332	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.9	176.5	69	2.6	0	0	0	114.3	S321 Q325 N372	S321-N323 WeakPolarHBondContact CB-OD1 3.38Å; S321-N323 PolarHBondContact O-N 2.84Å; S321-N323 VanDerWaalsContact O-N 3.11Å; S321-N323 PolarHBondContact OG-OD1 3.02Å; N323-Q325 HydrophobicContact CB-CG 4.36Å; N323-Q325 VanDerWaalsContact ND2-CD 3.25Å; N323-Q325 PolarHBondContact ND2-OE1 3.23Å; N323-Q325 PolarHBondContact O-N 2.84Å; N323-Q325 VanDerWaalsContact O-N 3.07Å; N323-Q325 WeakPolarHBondContact OD1-CB 3.06Å; N323-Q325 PolarHBondContact OD1-N 3.23Å; N323-N372 WeakPolarHBondContact CB-OD1 3.22Å; N323-N372 PolarHBondContact N-OD1 3.27Å; N323-N372 PolarHBondContact OD1-OD1 3.21Å
324	S	90.9	Very high	95.9	Very high	26 Å²	26	25.2 Å²	25.2	18%	0.182	14%	0.14	C	C	.	.	S	Bend	trans	54.2	20.7	-176	-59.2	0	0	0	0	115.4	Q277 S321 P322 W341	Q277-S324 WeakPolarHBondContact CB-OG 3.5Å; Q277-S324 PolarHBondContact N-OG 3.11Å; S321-S324 WeakPolarHBondContact O-CA 3.36Å; S321-S324 PolarHBondContact O-N 2.82Å; P322-S324 VanDerWaalsContact C-N 3.31Å; S324-W341 WeakPolarHBondContact O-CB 3.44Å
325	Q	93.1	Very high	96	Very high	115 Å²	115	28.9 Å²	28.9	54%	0.537	15%	0.151	S	C	.	.	S	Bend	trans	-83.7	-33.1	175.6	-66.9	-178.4	-8.3	0	0	112	S321 N323 K340 W341	S321-Q325 PolarHBondContact OG-N 2.84Å; N323-Q325 HydrophobicContact CB-CG 4.36Å; N323-Q325 VanDerWaalsContact ND2-CD 3.25Å; N323-Q325 PolarHBondContact ND2-OE1 3.23Å; N323-Q325 PolarHBondContact O-N 2.84Å; N323-Q325 VanDerWaalsContact O-N 3.07Å; N323-Q325 WeakPolarHBondContact OD1-CB 3.06Å; N323-Q325 PolarHBondContact OD1-N 3.23Å; Q325-K340 CarbonylContact O-C 3.57Å; Q325-K340 WeakPolarHBondContact O-CA 3.42Å; Q325-W341 PolarHBondContact O-N 2.84Å
326	W	95.8	Very high	96.1	Very high	36 Å²	36	28.9 Å²	28.9	14%	0.136	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148.2	-173.7	-56.2	104.4	0	0	0	111.6	S320 S321 V338 Y339 K340 D353 F368 V391	S320-W326 WeakPolarHBondContact CA-O 3.37Å; S320-W326 PolarHBondContact OG-O 3.15Å; S321-W326 PolarHBondContact N-O 2.76Å; S321-W326 PolarHBondContact OG-N 3.38Å; S321-W326 PolarHBondContact OG-O 3.17Å; W326-V338 HydrophobicContact CD2-CG1 4.44Å; W326-V338 HydrophobicContact CE3-CG1 3.83Å; W326-V338 HydrophobicContact CZ3-CG1 4.41Å; W326-Y339 CarbonylContact C-O 3.56Å; W326-Y339 VanDerWaalsContact CA-O 3.31Å; W326-Y339 WeakPolarHBondContact CA-O 3.36Å; W326-K340 HydrophobicContact CE3-CG 3.91Å; W326-K340 HydrophobicContact CH2-CD 4.4Å; W326-K340 HydrophobicContact CH2-CG 3.86Å; W326-K340 HydrophobicContact CZ3-CD 4.36Å; W326-K340 HydrophobicContact CZ3-CG 3.43Å; W326-K340 VanDerWaalsContact CZ3-CG 3.43Å; W326-D353 HydrophobicContact CZ3-CB 3.85Å; W326-F368 HydrophobicContact CB-CE1 4.18Å; W326-F368 HydrophobicContact CB-CZ 3.9Å; W326-V391 HydrophobicContact CD2-CG1 4.39Å; W326-V391 HydrophobicContact CG-CG1 4.36Å
327	I	97.1	Very high	96.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.1	168.1	-166.9	161.3	0	0	0	108.7	N283 W307 I318 S319 Y339 W341 T344	N283-I327 HydrophobicContact CB-CD1 4.41Å; W307-I327 HydrophobicContact CH2-CG2 4.18Å; W307-I327 HydrophobicContact CZ2-CD1 4.28Å; W307-I327 HydrophobicContact CZ2-CG2 4.18Å; I318-I327 HydrophobicContact CD1-CD1 3.73Å; I318-I327 HydrophobicContact CD1-CG1 4.05Å; I318-I327 HydrophobicContact CG1-CD1 4.06Å; I318-I327 HydrophobicContact CG1-CG1 3.92Å; S319-I327 WeakPolarHBondContact O-CA 3.48Å; I327-Y339 PolarHBondContact N-O 3.27Å; I327-Y339 PolarHBondContact O-N 3.37Å; I327-W341 HydrophobicContact CB-CE3 4.46Å; I327-W341 HydrophobicContact CD1-CE3 3.91Å; I327-W341 HydrophobicContact CD1-CZ3 3.88Å; I327-W341 HydrophobicContact CG2-CE3 4.27Å; I327-T344 HydrophobicContact CG2-CG2 3.95Å
328	A	98.3	Very high	96.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.4	-180	0	0	0	0	0	109.9	I318 S319 V336 N337 V338 L366 F368 L375	I318-A328 WeakPolarHBondContact CA-O 3.43Å; S319-A328 PolarHBondContact N-O 3.39Å; S319-A328 PolarHBondContact O-N 3.47Å; A328-V336 HydrophobicContact CB-CG1 4.27Å; A328-N337 CarbonylContact C-O 3.6Å; A328-N337 VanDerWaalsContact CA-O 3.32Å; A328-N337 WeakPolarHBondContact CA-O 3.44Å; A328-V338 HydrophobicContact CB-CG2 4.33Å; A328-L366 HydrophobicContact CB-CD1 4.13Å; A328-L366 WeakPolarHBondContact O-CD1 3.36Å; A328-F368 HydrophobicContact CB-CE2 3.67Å; A328-F368 HydrophobicContact CB-CZ 3.8Å; A328-L375 HydrophobicContact CB-CD1 4.23Å; A328-L375 HydrophobicContact CB-CD2 3.57Å
329	C	98.5	Very high	96.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.9	-178.6	-59.7	0	0	0	0	109.3	Y285 D309 V336 N337	Y285-C329 HydrophobicContact CE1-CB 3.93Å; Y285-C329 HydrophobicContact CE2-CB 4.45Å; D309-C329 HydrophobicContact CB-CB 4.31Å; D309-C329 VanDerWaalsContact OD2-CB 3.28Å; D309-C329 WeakPolarHBondContact OD2-CB 3.45Å; C329-V336 CarbonylContact O-C 3.57Å; C329-V336 VanDerWaalsContact O-CA 3.25Å; C329-V336 WeakPolarHBondContact O-CA 3.19Å; C329-N337 PolarHBondContact N-O 2.73Å; C329-N337 PolarHBondContact O-N 3.19Å
330	G	98.2	Very high	96.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.7	-179.2	0	0	0	0	0	111.2	Y285 L316 S317	Y285-G330 WeakPolarHBondContact CE1-O 3.46Å; L316-G330 PolarHBondContact N-O 3.39Å; S317-G330 PolarHBondContact N-O 2.92Å; S317-G330 PolarHBondContact O-N 3.39Å
331	A	97.6	Very high	96.1	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.025	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	166.2	-176.1	0	0	0	0	0	112.7	S312 S333 G334 Y335 G362 V363	S312-A331 WeakPolarHBondContact OG-CB 3.17Å; A331-S333 VanDerWaalsContact C-N 3.27Å; A331-S333 PolarHBondContact O-N 3.2Å; A331-G334 PolarHBondContact O-N 3.5Å; A331-Y335 PolarHBondContact N-O 2.85Å; A331-G362 WeakPolarHBondContact O-CA 3.46Å; A331-V363 PolarHBondContact O-N 3.42Å
332	D	96.1	Very high	96	Very high	63 Å²	63	34.8 Å²	34.8	34%	0.337	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-25.8	170.7	65.7	-18.4	0	0	0	114.2	T313 N314 L316 G334 G362	T313-D332 PolarHBondContact OG1-OD1 2.93Å; N314-D332 HydrophobicContact CB-CB 4.37Å; N314-D332 WeakPolarHBondContact CB-OD2 3.2Å; N314-D332 PolarHBondContact O-N 2.76Å; N314-D332 VanDerWaalsContact O-N 3.09Å; L316-D332 HydrophobicContact CD1-CB 3.96Å; L316-D332 HydrophobicContact CG-CB 4.17Å; D332-G334 PolarHBondContact O-N 3.09Å; D332-G362 WeakPolarHBondContact O-CA 3.5Å; D332-G362 PolarHBondContact O-N 2.96Å
333	S	95.8	Very high	96.1	Very high	57 Å²	57	35.1 Å²	35.1	40%	0.399	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12	175.3	64.3	0	0	0	0	114.4	A331 Y335	A331-S333 VanDerWaalsContact C-N 3.27Å; A331-S333 PolarHBondContact O-N 3.2Å; S333-Y335 PolarHBondContact OG-N 2.76Å
334	G	95.7	Very high	96.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	92.1	-6	-174.6	0	0	0	0	0	114.6	A331 D332 L359 T361 V363	A331-G334 PolarHBondContact O-N 3.5Å; D332-G334 PolarHBondContact O-N 3.09Å; G334-L359 CarbonylContact C-O 3.55Å; G334-L359 WeakPolarHBondContact CA-O 3.5Å; G334-L359 VanDerWaalsContact O-O 3.13Å; G334-T361 VanDerWaalsContact CA-O 3.24Å; G334-T361 WeakPolarHBondContact CA-O 3.43Å; G334-V363 WeakPolarHBondContact O-CG2 3.12Å
335	Y	97.5	Very high	96.5	Very high	125 Å²	125	33 Å²	33	49%	0.49	17%	0.169	S	C	.	.			trans	-76	145.5	173.1	-79.6	-98.3	0	0	0	111.9	A331 S333 I356	A331-Y335 PolarHBondContact N-O 2.85Å; S333-Y335 PolarHBondContact OG-N 2.76Å; Y335-I356 CarbonylContact C-O 3.5Å; Y335-I356 WeakPolarHBondContact CA-O 3.21Å
336	V	98.3	Very high	96.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118	169	-175.1	0	0	0	0	109.3	A328 C329 I356 V363 L366 L375 L377	A328-V336 HydrophobicContact CB-CG1 4.27Å; C329-V336 CarbonylContact O-C 3.57Å; C329-V336 VanDerWaalsContact O-CA 3.25Å; C329-V336 WeakPolarHBondContact O-CA 3.19Å; V336-I356 HydrophobicContact CB-CB 4.27Å; V336-I356 HydrophobicContact CB-CD1 4.49Å; V336-I356 PolarHBondContact N-O 2.84Å; V336-I356 WeakPolarHBondContact O-CB 3.35Å; V336-I356 PolarHBondContact O-N 3.06Å; V336-V363 HydrophobicContact CG2-CB 4.05Å; V336-V363 HydrophobicContact CG2-CG1 3.79Å; V336-V363 HydrophobicContact CG2-CG2 3.68Å; V336-L366 HydrophobicContact CG1-CD1 4.14Å; V336-L366 HydrophobicContact CG1-CD2 3.82Å; V336-L366 HydrophobicContact CG2-CD2 4.14Å; V336-L375 HydrophobicContact CG1-CD2 4.47Å; V336-L377 HydrophobicContact CB-CD1 4.31Å; V336-L377 HydrophobicContact CB-CD2 4.24Å; V336-L377 HydrophobicContact CG1-CD2 3.9Å; V336-L377 HydrophobicContact CG2-CD1 4.03Å; V336-L377 HydrophobicContact CG2-CD2 4.04Å; V336-L377 HydrophobicContact CG2-CG 4.46Å
337	N	98.2	Very high	96.6	Very high	10 Å²	10	35.2 Å²	35.2	5%	0.053	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.1	175.9	-72.6	-25.6	0	0	0	110.1	D309 Q310 A328 C329 Y339 P352 K354 A355	D309-N337 VanDerWaalsContact OD1-CB 3.27Å; D309-N337 WeakPolarHBondContact OD1-CB 3.41Å; D309-N337 PolarHBondContact OD1-ND2 3.17Å; Q310-N337 PolarHBondContact O-ND2 2.84Å; A328-N337 CarbonylContact C-O 3.6Å; A328-N337 VanDerWaalsContact CA-O 3.32Å; A328-N337 WeakPolarHBondContact CA-O 3.44Å; C329-N337 PolarHBondContact N-O 2.73Å; C329-N337 PolarHBondContact O-N 3.19Å; N337-Y339 HydrophobicContact CB-CD2 4.29Å; N337-Y339 HydrophobicContact CB-CE2 3.42Å; N337-Y339 VanDerWaalsContact CB-CE2 3.42Å; N337-P352 HydrophobicContact CB-CB 4Å; N337-K354 WeakPolarHBondContact CA-O 3.37Å; N337-A355 VanDerWaalsContact OD1-CB 3.26Å; N337-A355 WeakPolarHBondContact OD1-CB 3.38Å
338	V	97.5	Very high	96.6	Very high	2 Å²	2	40 Å²	40	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.4	177.5	-176.3	0	0	0	0	108.7	W326 A328 D353 K354 I356 L375 Y389	W326-V338 HydrophobicContact CD2-CG1 4.44Å; W326-V338 HydrophobicContact CE3-CG1 3.83Å; W326-V338 HydrophobicContact CZ3-CG1 4.41Å; A328-V338 HydrophobicContact CB-CG2 4.33Å; V338-D353 PolarHBondContact O-N 2.89Å; V338-K354 PolarHBondContact N-O 2.83Å; V338-K354 PolarHBondContact O-N 2.88Å; V338-I356 HydrophobicContact CG2-CD1 3.84Å; V338-L375 HydrophobicContact CG2-CD2 3.99Å; V338-Y389 HydrophobicContact CG2-CE1 4.35Å
339	Y	97.5	Very high	96.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.2	-177.6	-62.2	-90.4	0	0	0	111	W307 D309 Q310 W326 I327 N337 W341 T344 P350 P352	W307-Y339 AromaticContact CH2-CD2 3.94Å; W307-Y339 HydrophobicContact CH2-CD2 3.94Å; W307-Y339 HydrophobicContact CH2-CE2 4.21Å; W307-Y339 HydrophobicContact CH2-CG 4.37Å; W307-Y339 AromaticContact CZ3-CD2 3.98Å; W307-Y339 HydrophobicContact CZ3-CD2 3.98Å; W307-Y339 HydrophobicContact CZ3-CE1 4.41Å; W307-Y339 AromaticContact CZ3-CE2 3.89Å; W307-Y339 HydrophobicContact CZ3-CE2 3.89Å; W307-Y339 HydrophobicContact CZ3-CG 4.3Å; D309-Y339 VanDerWaalsContact OD1-CE2 3.32Å; D309-Y339 WeakPolarHBondContact OD1-CE2 3.46Å; D309-Y339 PolarHBondContact OD1-OH 2.88Å; Q310-Y339 WeakPolarHBondContact CB-OH 3.42Å; Q310-Y339 PolarHBondContact N-OH 2.98Å; W326-Y339 CarbonylContact C-O 3.56Å; W326-Y339 VanDerWaalsContact CA-O 3.31Å; W326-Y339 WeakPolarHBondContact CA-O 3.36Å; I327-Y339 PolarHBondContact N-O 3.27Å; I327-Y339 PolarHBondContact O-N 3.37Å; N337-Y339 HydrophobicContact CB-CD2 4.29Å; N337-Y339 HydrophobicContact CB-CE2 3.42Å; N337-Y339 VanDerWaalsContact CB-CE2 3.42Å; Y339-W341 PolarHBondContact O-N 3.01Å; Y339-T344 HydrophobicContact CD1-CG2 4.14Å; Y339-T344 HydrophobicContact CG-CG2 3.89Å; Y339-P350 HydrophobicContact CD1-CB 3.99Å; Y339-P350 HydrophobicContact CD1-CG 4Å; Y339-P350 HydrophobicContact CE1-CB 4.09Å; Y339-P350 HydrophobicContact CE1-CG 3.88Å; Y339-P350 WeakPolarHBondContact CE1-O 3.31Å; Y339-P352 HydrophobicContact CD1-CB 4.23Å; Y339-P352 HydrophobicContact CE1-CB 3.72Å; Y339-P352 HydrophobicContact CE1-CG 4.39Å; Y339-P352 VanDerWaalsContact CE1-N 3.28Å; Y339-P352 HydrophobicContact CE2-CB 4.38Å
340	K	95.9	Very high	96.5	Very high	86 Å²	86	45.4 Å²	45.4	37%	0.374	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	125.9	159.6	-69.1	173.6	176.1	130.2	0	108.7	Q325 W326 S342 S343 T344 D353	Q325-K340 CarbonylContact O-C 3.57Å; Q325-K340 WeakPolarHBondContact O-CA 3.42Å; W326-K340 HydrophobicContact CE3-CG 3.91Å; W326-K340 HydrophobicContact CH2-CD 4.4Å; W326-K340 HydrophobicContact CH2-CG 3.86Å; W326-K340 HydrophobicContact CZ3-CD 4.36Å; W326-K340 HydrophobicContact CZ3-CG 3.43Å; W326-K340 VanDerWaalsContact CZ3-CG 3.43Å; K340-S342 PolarHBondContact O-N 2.83Å; K340-S343 WeakPolarHBondContact O-CB 3.47Å; K340-S343 PolarHBondContact O-N 2.86Å; K340-T344 PolarHBondContact O-N 3.33Å; K340-D353 IonicContact NZ-OD1 2.76Å; K340-D353 PolarHBondContact NZ-OD1 3.27Å
341	W	95.4	Very high	96.4	Very high	28 Å²	28	52 Å²	52	11%	0.106	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-37.5	-180	172.3	-117.6	0	0	0	112.5	T276 F281 N283 V293 S324 Q325 I327 Y339 S343 T344 M345	T276-W341 HydrophobicContact CG2-CD2 4.48Å; T276-W341 HydrophobicContact CG2-CH2 4.23Å; T276-W341 HydrophobicContact CG2-CZ2 3.72Å; F281-W341 HydrophobicContact CB-CZ2 4.32Å; F281-W341 AromaticContact CD2-CZ2 3.77Å; F281-W341 HydrophobicContact CD2-CZ2 3.77Å; F281-W341 HydrophobicContact CE2-CZ2 4.48Å; F281-W341 HydrophobicContact CG-CZ2 4.28Å; N283-W341 WeakPolarHBondContact ND2-CH2 3.37Å; N283-W341 WeakPolarHBondContact OD1-CH2 3.2Å; N283-W341 VanDerWaalsContact OD1-CZ3 3.24Å; N283-W341 WeakPolarHBondContact OD1-CZ3 3.47Å; V293-W341 HydrophobicContact CG1-CH2 4.01Å; V293-W341 HydrophobicContact CG2-CH2 4.28Å; S324-W341 WeakPolarHBondContact O-CB 3.44Å; Q325-W341 PolarHBondContact O-N 2.84Å; I327-W341 HydrophobicContact CB-CE3 4.46Å; I327-W341 HydrophobicContact CD1-CE3 3.91Å; I327-W341 HydrophobicContact CD1-CZ3 3.88Å; I327-W341 HydrophobicContact CG2-CE3 4.27Å; Y339-W341 PolarHBondContact O-N 3.01Å; W341-S343 VanDerWaalsContact C-N 3.32Å; W341-S343 PolarHBondContact O-N 3.2Å; W341-T344 VanDerWaalsContact CE3-OG1 3.29Å; W341-T344 PolarHBondContact O-N 3.23Å; W341-T344 PolarHBondContact O-OG1 2.8Å; W341-M345 HydrophobicContact CD2-CG 4.3Å; W341-M345 HydrophobicContact CH2-CG 4.06Å; W341-M345 HydrophobicContact CH2-SD 3.53Å; W341-M345 VanDerWaalsContact CH2-SD 3.53Å; W341-M345 HydrophobicContact CZ2-CG 3.7Å; W341-M345 HydrophobicContact CZ2-SD 3.55Å; W341-M345 VanDerWaalsContact CZ2-SD 3.55Å; W341-M345 HydrophobicContact CZ3-SD 4.28Å; W341-M345 PolarHBondContact O-N 2.94Å
342	S	94.7	Very high	96.4	Very high	73 Å²	73	53.2 Å²	53.2	51%	0.51	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-38.6	175.8	53.2	0	0	0	0	112.5	K340 M345 N346	K340-S342 PolarHBondContact O-N 2.83Å; S342-M345 PolarHBondContact O-N 3.28Å; S342-N346 PolarHBondContact O-ND2 2.83Å; S342-N346 VanDerWaalsContact O-ND2 3.08Å
343	S	95	Very high	96.3	Very high	50 Å²	50	54 Å²	54	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-36.8	178	-60.7	0	0	0	0	112.2	K340 W341 M345 N346 T347	K340-S343 WeakPolarHBondContact O-CB 3.47Å; K340-S343 PolarHBondContact O-N 2.86Å; W341-S343 VanDerWaalsContact C-N 3.32Å; W341-S343 PolarHBondContact O-N 3.2Å; S343-M345 VanDerWaalsContact C-N 3.26Å; S343-M345 PolarHBondContact O-N 2.98Å; S343-N346 PolarHBondContact O-N 3.08Å; S343-T347 WeakPolarHBondContact O-CG2 3.26Å
344	T	96.3	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-23.4	-179.9	63.1	0	0	0	0	113	W307 I327 Y339 K340 W341 P350	W307-T344 HydrophobicContact CD2-CG2 4.15Å; W307-T344 HydrophobicContact CE3-CG2 4.1Å; W307-T344 HydrophobicContact CH2-CG2 3.67Å; W307-T344 HydrophobicContact CZ2-CG2 3.73Å; W307-T344 HydrophobicContact CZ3-CG2 3.86Å; I327-T344 HydrophobicContact CG2-CG2 3.95Å; Y339-T344 HydrophobicContact CD1-CG2 4.14Å; Y339-T344 HydrophobicContact CG-CG2 3.89Å; K340-T344 PolarHBondContact O-N 3.33Å; W341-T344 VanDerWaalsContact CE3-OG1 3.29Å; W341-T344 PolarHBondContact O-N 3.23Å; W341-T344 PolarHBondContact O-OG1 2.8Å; T344-P350 HydrophobicContact CG2-CB 4.36Å; T344-P350 HydrophobicContact CG2-CG 4.03Å
345	M	95	Very high	96.3	Very high	45 Å²	45	57.6 Å²	57.6	22%	0.222	31%	0.306	C	S	.	.	H	α-helix	trans	-86.1	-13.5	177.7	-68.8	-59.7	-66.7	0	0	113.8	V293 I304 H305 W341 S342 S343	V293-M345 HydrophobicContact CG1-CE 4.3Å; V293-M345 HydrophobicContact CG1-SD 4.09Å; V293-M345 HydrophobicContact CG2-SD 4.09Å; I304-M345 HydrophobicContact CD1-CE 3.97Å; H305-M345 HydrophobicContact CB-CE 4.46Å; W341-M345 HydrophobicContact CD2-CG 4.3Å; W341-M345 HydrophobicContact CH2-CG 4.06Å; W341-M345 HydrophobicContact CH2-SD 3.53Å; W341-M345 VanDerWaalsContact CH2-SD 3.53Å; W341-M345 HydrophobicContact CZ2-CG 3.7Å; W341-M345 HydrophobicContact CZ2-SD 3.55Å; W341-M345 VanDerWaalsContact CZ2-SD 3.55Å; W341-M345 HydrophobicContact CZ3-SD 4.28Å; W341-M345 PolarHBondContact O-N 2.94Å; S342-M345 PolarHBondContact O-N 3.28Å; S343-M345 VanDerWaalsContact C-N 3.26Å; S343-M345 PolarHBondContact O-N 2.98Å
346	N	94.9	Very high	96.3	Very high	137 Å²	137	51.9 Å²	51.9	73%	0.733	28%	0.284	S	S	*	.	H	α-helix	trans	-96.2	-16.1	-177.5	-69.5	-28.9	0	0	0	113.4	S342 S343	S342-N346 PolarHBondContact O-ND2 2.83Å; S342-N346 VanDerWaalsContact O-ND2 3.08Å; S343-N346 PolarHBondContact O-N 3.08Å
347	T	96.1	Very high	96.1	Very high	59 Å²	59	53.7 Å²	53.7	36%	0.362	30%	0.302	S	S	.	.			trans	-149.3	148.4	-176.8	176.4	0	0	0	0	111	H305 S343 N349 P350	H305-T347 PolarHBondContact CE1-O 2.88Å; S343-T347 WeakPolarHBondContact O-CG2 3.26Å; T347-N349 VanDerWaalsContact C-N 3.27Å; T347-N349 PolarHBondContact OG1-N 2.93Å; T347-P350 HydrophobicContact CG2-CB 3.87Å
348	E	96.6	Very high	95.9	Very high	101 Å²	101	57 Å²	57	47%	0.472	32%	0.32	S	S	.	.	S	Bend	trans	-73.1	-21	173.2	-57.7	-170	169.5	0	0	112.6	R306 W307 F308 P350	R306-E348 WeakPolarHBondContact O-CG 3.37Å; W307-E348 CarbonylContact C-O 3.48Å; W307-E348 WeakPolarHBondContact CA-O 3.14Å; W307-E348 WeakPolarHBondContact CB-O 3.4Å; F308-E348 PolarHBondContact N-O 2.89Å; E348-P350 WeakPolarHBondContact O-CD 3.5Å
349	N	96.6	Very high	95.8	Very high	109 Å²	109	57.3 Å²	57.3	58%	0.583	32%	0.322	S	S	*	.	S	Bend	trans	-128.2	70.1	-177.1	-58.6	-76.9	0	0	0	110.4	T347	T347-N349 VanDerWaalsContact C-N 3.27Å; T347-N349 PolarHBondContact OG1-N 2.93Å
350	P	97.3	Very high	95.6	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.032	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-69.7	146.8	178.3	30	-34.4	0	0	0	111.1	W307 Y339 T344 T347 E348	W307-P350 HydrophobicContact CD2-CG 4.3Å; W307-P350 HydrophobicContact CE3-CG 3.52Å; W307-P350 HydrophobicContact CZ3-CG 3.98Å; Y339-P350 HydrophobicContact CD1-CB 3.99Å; Y339-P350 HydrophobicContact CD1-CG 4Å; Y339-P350 HydrophobicContact CE1-CB 4.09Å; Y339-P350 HydrophobicContact CE1-CG 3.88Å; Y339-P350 WeakPolarHBondContact CE1-O 3.31Å; T344-P350 HydrophobicContact CG2-CB 4.36Å; T344-P350 HydrophobicContact CG2-CG 4.03Å; T347-P350 HydrophobicContact CG2-CB 3.87Å; E348-P350 WeakPolarHBondContact O-CD 3.5Å
351	L	96.6	Very high	95.7	Very high	138 Å²	138	60 Å²	60	72%	0.723	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-82.7	134.9	167.5	-64.3	174.6	0	0	0	109.1
352	P	96.7	Very high	95.7	Very high	28 Å²	28	58.7 Å²	58.7	18%	0.182	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-66.7	140.3	174.5	28.3	-31.4	0	0	0	109.4	Q310 N337 Y339 K354	Q310-P352 HydrophobicContact CB-CG 4.41Å; N337-P352 HydrophobicContact CB-CB 4Å; Y339-P352 HydrophobicContact CD1-CB 4.23Å; Y339-P352 HydrophobicContact CE1-CB 3.72Å; Y339-P352 HydrophobicContact CE1-CG 4.39Å; Y339-P352 VanDerWaalsContact CE1-N 3.28Å; Y339-P352 HydrophobicContact CE2-CB 4.38Å; P352-K354 VanDerWaalsContact C-N 3.27Å
353	D	94.9	Very high	95.9	Very high	79 Å²	79	55.2 Å²	55.2	42%	0.422	32%	0.316	S	S	.	.	S	Bend	trans	-67.2	-37.8	171.2	-164.5	91.4	0	0	0	109.4	W326 V338 K340	W326-D353 HydrophobicContact CZ3-CB 3.85Å; V338-D353 PolarHBondContact O-N 2.89Å; K340-D353 IonicContact NZ-OD1 2.76Å; K340-D353 PolarHBondContact NZ-OD1 3.27Å
354	K	95.3	Very high	95.9	Very high	80 Å²	80	54.7 Å²	54.7	35%	0.348	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139	170.2	-165.1	75.1	169.9	-161.3	0	112.2	N337 V338 P352 I356 Y389 S394	N337-K354 WeakPolarHBondContact CA-O 3.37Å; V338-K354 PolarHBondContact N-O 2.83Å; V338-K354 PolarHBondContact O-N 2.88Å; P352-K354 VanDerWaalsContact C-N 3.27Å; K354-I356 HydrophobicContact CG-CG1 4.11Å; K354-Y389 WeakPolarHBondContact CB-OH 3.31Å; K354-Y389 HydrophobicContact CG-CE2 4.24Å; K354-Y389 WeakPolarHBondContact CG-OH 3.21Å; K354-S394 WeakPolarHBondContact CE-O 3.49Å; K354-S394 PolarHBondContact NZ-O 3.22Å
355	A	96	Very high	96	Very high	53 Å²	53	55.8 Å²	55.8	44%	0.438	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.4	163.6	0	0	0	0	0	109.6	N337	N337-A355 VanDerWaalsContact OD1-CB 3.26Å; N337-A355 WeakPolarHBondContact OD1-CB 3.38Å
356	I	96.4	Very high	96.1	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.6	-176.3	-53	166	0	0	0	108.5	Y335 V336 V338 K354 N358 L377 Y389 I396	Y335-I356 CarbonylContact C-O 3.5Å; Y335-I356 WeakPolarHBondContact CA-O 3.21Å; V336-I356 HydrophobicContact CB-CB 4.27Å; V336-I356 HydrophobicContact CB-CD1 4.49Å; V336-I356 PolarHBondContact N-O 2.84Å; V336-I356 WeakPolarHBondContact O-CB 3.35Å; V336-I356 PolarHBondContact O-N 3.06Å; V338-I356 HydrophobicContact CG2-CD1 3.84Å; K354-I356 HydrophobicContact CG-CG1 4.11Å; I356-N358 HydrophobicContact CG2-CB 4.28Å; I356-N358 WeakPolarHBondContact CG2-OD1 3.25Å; I356-L377 HydrophobicContact CB-CD1 4.42Å; I356-L377 HydrophobicContact CD1-CD1 4.17Å; I356-L377 HydrophobicContact CG2-CD1 3.77Å; I356-Y389 HydrophobicContact CD1-CD1 3.8Å; I356-Y389 HydrophobicContact CD1-CD2 3.49Å; I356-Y389 VanDerWaalsContact CD1-CD2 3.49Å; I356-Y389 HydrophobicContact CD1-CE1 3.98Å; I356-Y389 HydrophobicContact CD1-CE2 3.68Å; I356-Y389 HydrophobicContact CD1-CG 3.54Å; I356-Y389 HydrophobicContact CG1-CD2 3.99Å; I356-Y389 HydrophobicContact CG1-CE2 3.88Å; I356-I396 HydrophobicContact CG2-CD1 3.83Å; I356-I396 HydrophobicContact CG2-CG1 4.18Å
357	G	94.7	Very high	96.2	Very high	39 Å²	39	49.5 Å²	49.5	40%	0.402	29%	0.286	S	S	.	.			trans	-111.6	35.2	-177.2	0	0	0	0	0	113.8
358	N	93.9	Very high	96.3	Very high	79 Å²	79	47.2 Å²	47.2	42%	0.422	27%	0.271	S	S	.	.			trans	-94	-1.5	-172.7	-65.2	78.8	0	0	0	114.1	I356 R387 I396	I356-N358 HydrophobicContact CG2-CB 4.28Å; I356-N358 WeakPolarHBondContact CG2-OD1 3.25Å; N358-R387 HydrophobicContact CB-CG 4.32Å; N358-I396 HydrophobicContact CB-CD1 4.47Å; N358-I396 HydrophobicContact CB-CG1 4.25Å
359	L	94.9	Very high	96.3	Very high	9 Å²	9	42.4 Å²	42.4	5%	0.047	25%	0.248	C	C	.	.			trans	-115	138.2	169.3	-64.6	175.8	0	0	0	108.2	G334 V363 L377 A385 R387	G334-L359 CarbonylContact C-O 3.55Å; G334-L359 WeakPolarHBondContact CA-O 3.5Å; G334-L359 VanDerWaalsContact O-O 3.13Å; L359-V363 HydrophobicContact CB-CG2 4.26Å; L359-V363 HydrophobicContact CD1-CG1 4.23Å; L359-V363 HydrophobicContact CD1-CG2 3.75Å; L359-L377 HydrophobicContact CD1-CB 3.86Å; L359-A385 HydrophobicContact CD2-CB 4.14Å; L359-R387 HydrophobicContact CD2-CG 3.99Å; L359-R387 HydrophobicContact CG-CG 4.4Å
360	V	94.6	Very high	96.2	Very high	117 Å²	117	39.2 Å²	39.2	71%	0.709	23%	0.234	S	C	*	.	S	Bend	trans	-100.8	0.8	-178.7	-63.2	0	0	0	0	112.9
361	T	96.7	Very high	96	Very high	27 Å²	27	41 Å²	41	17%	0.166	25%	0.247	C	C	.	.	S	Bend	trans	-133.4	157.2	-177	49	0	0	0	0	109.9	G334 V363 S379 Q381 R382	G334-T361 VanDerWaalsContact CA-O 3.24Å; G334-T361 WeakPolarHBondContact CA-O 3.43Å; T361-V363 PolarHBondContact O-N 3.38Å; T361-S379 WeakPolarHBondContact CB-OG 3.4Å; T361-S379 PolarHBondContact O-OG 3.03Å; T361-S379 WeakPolarHBondContact OG1-CB 3.38Å; T361-S379 PolarHBondContact OG1-OG 2.84Å; T361-Q381 VanDerWaalsContact CB-OE1 3.28Å; T361-Q381 HydrophobicContact CG2-CB 4.12Å; T361-R382 HydrophobicContact CG2-CB 4.47Å
362	G	96.2	Very high	95.8	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.22	C	C	.	.			trans	-54	132.5	-170.7	0	0	0	0	0	114	A331 D332 N364 S379	A331-G362 WeakPolarHBondContact O-CA 3.46Å; D332-G362 WeakPolarHBondContact O-CA 3.5Å; D332-G362 PolarHBondContact O-N 2.96Å; G362-N364 PolarHBondContact O-N 3.06Å; G362-N364 PolarHBondContact O-ND2 2.94Å; G362-N364 VanDerWaalsContact O-ND2 3.16Å; G362-S379 WeakPolarHBondContact O-CB 3.16Å; G362-S379 PolarHBondContact O-OG 3.12Å
363	V	98.2	Very high	95.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.219	C	C	.	.			trans	-89.9	101.7	-175	-171.3	0	0	0	0	109.7	L316 S317 A331 G334 V336 L359 T361 L366	L316-V363 WeakPolarHBondContact CB-O 3.1Å; S317-V363 WeakPolarHBondContact CB-O 3.31Å; S317-V363 PolarHBondContact OG-O 2.99Å; A331-V363 PolarHBondContact O-N 3.42Å; G334-V363 WeakPolarHBondContact O-CG2 3.12Å; V336-V363 HydrophobicContact CG2-CB 4.05Å; V336-V363 HydrophobicContact CG2-CG1 3.79Å; V336-V363 HydrophobicContact CG2-CG2 3.68Å; L359-V363 HydrophobicContact CB-CG2 4.26Å; L359-V363 HydrophobicContact CD1-CG1 4.23Å; L359-V363 HydrophobicContact CD1-CG2 3.75Å; T361-V363 PolarHBondContact O-N 3.38Å; V363-L366 HydrophobicContact CG1-CD2 3.9Å; V363-L366 HydrophobicContact CG1-CG 4.18Å
364	N	96.5	Very high	95.7	Very high	39 Å²	39	32.4 Å²	32.4	21%	0.209	20%	0.199	C	C	.	.			trans	-104.6	-4.8	-173.7	26.4	59.5	0	0	0	113.5	G362 A378 S379 S380	G362-N364 PolarHBondContact O-N 3.06Å; G362-N364 PolarHBondContact O-ND2 2.94Å; G362-N364 VanDerWaalsContact O-ND2 3.16Å; N364-A378 PolarHBondContact N-O 3.33Å; N364-A378 VanDerWaalsContact N-O 3.16Å; N364-S379 WeakPolarHBondContact OD1-CA 3.46Å; N364-S380 PolarHBondContact ND2-OG 2.85Å; N364-S380 WeakPolarHBondContact OD1-CB 3.43Å; N364-S380 PolarHBondContact OD1-N 3.49Å; N364-S380 PolarHBondContact OD1-OG 3.34Å
365	S	97.5	Very high	95.8	Very high	22 Å²	22	28.6 Å²	28.6	15%	0.154	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127.5	171.7	-70.2	0	0	0	0	111.1	A378	S365-A378 PolarHBondContact N-O 2.95Å; S365-A378 PolarHBondContact O-N 2.55Å
366	L	98	Very high	95.9	Very high	20 Å²	20	26 Å²	26	11%	0.105	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.8	172.3	-71.4	174.9	0	0	0	108.5	S317 A328 V336 V363 L375 C376 L377	S317-L366 WeakPolarHBondContact OG-CD1 3.41Å; S317-L366 VanDerWaalsContact OG-CG 3.31Å; S317-L366 WeakPolarHBondContact OG-CG 3.47Å; A328-L366 HydrophobicContact CB-CD1 4.13Å; A328-L366 WeakPolarHBondContact O-CD1 3.36Å; V336-L366 HydrophobicContact CG1-CD1 4.14Å; V336-L366 HydrophobicContact CG1-CD2 3.82Å; V336-L366 HydrophobicContact CG2-CD2 4.14Å; V363-L366 HydrophobicContact CG1-CD2 3.9Å; V363-L366 HydrophobicContact CG1-CG 4.18Å; L366-L375 HydrophobicContact CD2-CD1 4.45Å; L366-C376 WeakPolarHBondContact CA-O 3.46Å; L366-L377 HydrophobicContact CD2-CB 4.26Å; L366-L377 HydrophobicContact CD2-CD2 3.15Å; L366-L377 HydrophobicContact CD2-CG 4.29Å
367	C	97.1	Very high	96	Very high	30 Å²	30	25.9 Å²	25.9	20%	0.203	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	117.8	176.7	-173.6	0	0	0	0	109.7	C376 I413 F415	C367-C376 PolarHBondContact N-O 3.5Å; C367-C376 PolarHBondContact O-N 3.29Å; C367-I413 HydrophobicContact CB-CD1 3.67Å; C367-I413 HydrophobicContact CB-CG1 3.79Å; C367-F415 HydrophobicContact CB-CD2 4.47Å
368	F	97.6	Very high	96.2	Very high	11 Å²	11	24 Å²	24	5%	0.048	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	141.6	168.8	-80	-85	0	0	0	110.2	S319 S320 W326 A328 L375 V391	S319-F368 WeakPolarHBondContact O-CE2 3.46Å; S320-F368 VanDerWaalsContact C-CD2 3.45Å; S320-F368 WeakPolarHBondContact O-CD2 3.13Å; W326-F368 HydrophobicContact CB-CE1 4.18Å; W326-F368 HydrophobicContact CB-CZ 3.9Å; A328-F368 HydrophobicContact CB-CE2 3.67Å; A328-F368 HydrophobicContact CB-CZ 3.8Å; F368-L375 HydrophobicContact CD1-CB 4.03Å; F368-L375 HydrophobicContact CD1-CD1 4Å; F368-L375 HydrophobicContact CD2-CD1 3.75Å; F368-L375 HydrophobicContact CE1-CB 3.94Å; F368-L375 HydrophobicContact CE1-CD1 4.04Å; F368-L375 HydrophobicContact CE1-CD2 4.28Å; F368-L375 HydrophobicContact CE1-CG 4.29Å; F368-L375 HydrophobicContact CE2-CD1 3.8Å; F368-L375 HydrophobicContact CG-CD1 3.86Å; F368-L375 HydrophobicContact CZ-CD1 3.95Å; F368-L375 HydrophobicContact CZ-CD2 4.07Å; F368-L375 HydrophobicContact CZ-CG 4.39Å; F368-V391 HydrophobicContact CD1-CG2 4.35Å; F368-V391 HydrophobicContact CE1-CG2 3.98Å
369	H	96.7	Very high	96.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.121	C	C	.	.			trans	-68	145	169.7	-173.1	-92.4	0	0	0	110.3	S371 N372 I374 F415 G419 Y439	H369-S371 PolarHBondContact CE1-OG 2.65Å; H369-S371 WeakPolarHBondContact ND1-CB 3.21Å; H369-S371 PolarHBondContact ND1-N 3.07Å; H369-S371 VanDerWaalsContact ND1-N 3.13Å; H369-S371 PolarHBondContact ND1-OG 3.07Å; H369-S371 PolarHBondContact O-N 2.95Å; H369-S371 VanDerWaalsContact O-N 3.14Å; H369-N372 PolarHBondContact O-N 3.32Å; H369-I374 HydrophobicContact CB-CB 3.71Å; H369-I374 WeakPolarHBondContact CB-O 3.44Å; H369-I374 PolarHBondContact N-O 2.96Å; H369-F415 HydrophobicContact CB-CD2 4.35Å; H369-F415 HydrophobicContact CB-CE2 4.21Å; H369-F415 HydrophobicContact CB-CZ 4.44Å; H369-F415 AromaticContact CD2-CD1 3.61Å; H369-F415 AromaticContact CD2-CE1 3.71Å; H369-F415 AromaticContact CD2-CG 3.96Å; H369-G419 WeakPolarHBondContact NE2-CA 3.43Å; H369-G419 PolarHBondContact NE2-O 3.04Å; H369-Y439 AromaticContact CE1-CD1 3.58Å; H369-Y439 AromaticContact CE1-CD2 3.52Å; H369-Y439 AromaticContact CE1-CE1 3.4Å; H369-Y439 VanDerWaalsContact CE1-CE1 3.4Å; H369-Y439 WeakPolarHBondContact CE1-CE1 3.36Å; H369-Y439 AromaticContact CE1-CE2 3.35Å; H369-Y439 WeakPolarHBondContact CE1-CE2 3.5Å; H369-Y439 AromaticContact CE1-CG 3.64Å; H369-Y439 AromaticContact CE1-CZ 3.29Å; H369-Y439 AromaticContact ND1-CZ 3.73Å; H369-Y439 AromaticContact NE2-CD2 3.34Å; H369-Y439 VanDerWaalsContact NE2-CD2 3.34Å; H369-Y439 WeakPolarHBondContact NE2-CD2 3.44Å; H369-Y439 AromaticContact NE2-CE2 3.38Å; H369-Y439 WeakPolarHBondContact NE2-CE2 3.35Å; H369-Y439 AromaticContact NE2-CG 3.78Å; H369-Y439 AromaticContact NE2-CZ 3.84Å
370	P	94.5	Very high	96.5	Very high	42 Å²	42	21.7 Å²	21.7	27%	0.273	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.9	-179.6	21	-35	0	0	0	114.4	N372 P417	P370-N372 PolarHBondContact O-N 2.62Å; P370-P417 WeakPolarHBondContact CB-O 3.46Å; P370-P417 VanDerWaalsContact CG-O 3.31Å; P370-P417 WeakPolarHBondContact CG-O 3.46Å
371	S	93.2	Very high	96.6	Very high	44 Å²	44	21.1 Å²	21.1	31%	0.308	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-10.8	175.5	74.7	0	0	0	0	114.4	H369 E373 Y439	H369-S371 PolarHBondContact CE1-OG 2.65Å; H369-S371 WeakPolarHBondContact ND1-CB 3.21Å; H369-S371 PolarHBondContact ND1-N 3.07Å; H369-S371 VanDerWaalsContact ND1-N 3.13Å; H369-S371 PolarHBondContact ND1-OG 3.07Å; H369-S371 PolarHBondContact O-N 2.95Å; H369-S371 VanDerWaalsContact O-N 3.14Å; S371-E373 WeakPolarHBondContact CB-OE2 3.5Å; S371-E373 PolarHBondContact O-N 2.86Å; S371-E373 WeakPolarHBondContact OG-CB 3.38Å; S371-E373 WeakPolarHBondContact OG-CG 3.48Å; S371-E373 PolarHBondContact OG-N 3.13Å; S371-E373 PolarHBondContact OG-OE2 2.71Å; S371-Y439 PolarHBondContact OG-OH 3.19Å
372	N	92.9	Very high	96.5	Very high	31 Å²	31	26.8 Å²	26.8	17%	0.166	14%	0.14	C	C	.	.	S	Bend	trans	70.4	0	-171.4	-47.8	-90.9	0	0	0	115.6	P322 N323 H369 P370	P322-N372 WeakPolarHBondContact CB-OD1 3.24Å; P322-N372 WeakPolarHBondContact CD-OD1 3.19Å; P322-N372 VanDerWaalsContact N-OD1 3.16Å; N323-N372 WeakPolarHBondContact CB-OD1 3.22Å; N323-N372 PolarHBondContact N-OD1 3.27Å; N323-N372 PolarHBondContact OD1-OD1 3.21Å; H369-N372 PolarHBondContact O-N 3.32Å; P370-N372 PolarHBondContact O-N 2.62Å
373	E	92.9	Very high	96.5	Very high	32 Å²	32	29.6 Å²	29.6	15%	0.15	16%	0.158	C	C	.	.	S	Bend	trans	-85.2	-22.9	-176.4	-59.1	167.6	131.5	0	0	113	L114 S371 V391 Y439	L114-E373 HydrophobicContact CD1-CB 3.83Å; S371-E373 WeakPolarHBondContact CB-OE2 3.5Å; S371-E373 PolarHBondContact O-N 2.86Å; S371-E373 WeakPolarHBondContact OG-CB 3.38Å; S371-E373 WeakPolarHBondContact OG-CG 3.48Å; S371-E373 PolarHBondContact OG-N 3.13Å; S371-E373 PolarHBondContact OG-OE2 2.71Å; E373-V391 PolarHBondContact O-N 2.85Å; E373-Y439 VanDerWaalsContact OE2-CE1 3.26Å; E373-Y439 WeakPolarHBondContact OE2-CE1 3.41Å; E373-Y439 PolarHBondContact OE2-OH 3.37Å
374	I	96	Very high	96.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.2	-176.1	-57.7	176.1	0	0	0	110.4	L114 I120 H369 L388 Y389 F397 F415 L436 Y439	L114-I374 HydrophobicContact CD1-CD1 4.03Å; L114-I374 HydrophobicContact CD1-CG1 3.71Å; L114-I374 HydrophobicContact CD2-CD1 4.4Å; I120-I374 HydrophobicContact CD1-CD1 3.41Å; I120-I374 VanDerWaalsContact CD1-CD1 3.41Å; H369-I374 HydrophobicContact CB-CB 3.71Å; H369-I374 WeakPolarHBondContact CB-O 3.44Å; H369-I374 PolarHBondContact N-O 2.96Å; I374-L388 HydrophobicContact CG2-CB 4.08Å; I374-L388 HydrophobicContact CG2-CD2 3.88Å; I374-L388 HydrophobicContact CG2-CG 4.45Å; I374-Y389 CarbonylContact C-O 3.44Å; I374-Y389 VanDerWaalsContact CA-O 3.26Å; I374-Y389 WeakPolarHBondContact CA-O 3.4Å; I374-F397 HydrophobicContact CD1-CE2 4.42Å; I374-F397 HydrophobicContact CG1-CE2 4.35Å; I374-F415 HydrophobicContact CG2-CZ 4.48Å; I374-L436 HydrophobicContact CD1-CD1 4.28Å; I374-Y439 HydrophobicContact CD1-CE2 3.75Å
375	L	97.6	Very high	96.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.2	166.2	173.4	64.2	0	0	0	109.2	A328 V336 V338 L366 F368 L377 Y389 V391	A328-L375 HydrophobicContact CB-CD1 4.23Å; A328-L375 HydrophobicContact CB-CD2 3.57Å; V336-L375 HydrophobicContact CG1-CD2 4.47Å; V338-L375 HydrophobicContact CG2-CD2 3.99Å; L366-L375 HydrophobicContact CD2-CD1 4.45Å; F368-L375 HydrophobicContact CD1-CB 4.03Å; F368-L375 HydrophobicContact CD1-CD1 4Å; F368-L375 HydrophobicContact CD2-CD1 3.75Å; F368-L375 HydrophobicContact CE1-CB 3.94Å; F368-L375 HydrophobicContact CE1-CD1 4.04Å; F368-L375 HydrophobicContact CE1-CD2 4.28Å; F368-L375 HydrophobicContact CE1-CG 4.29Å; F368-L375 HydrophobicContact CE2-CD1 3.8Å; F368-L375 HydrophobicContact CG-CD1 3.86Å; F368-L375 HydrophobicContact CZ-CD1 3.95Å; F368-L375 HydrophobicContact CZ-CD2 4.07Å; F368-L375 HydrophobicContact CZ-CG 4.39Å; L375-L377 HydrophobicContact CD1-CD2 4.29Å; L375-L377 HydrophobicContact CD2-CD2 3.57Å; L375-L377 HydrophobicContact CG-CD2 3.52Å; L375-Y389 HydrophobicContact CB-CD1 4.07Å; L375-Y389 HydrophobicContact CD2-CD1 4.42Å; L375-Y389 PolarHBondContact N-O 2.78Å; L375-Y389 PolarHBondContact O-N 2.94Å; L375-V391 HydrophobicContact CB-CG2 4.19Å
376	C	98.3	Very high	96.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.3	173.7	-172.7	0	0	0	0	110.3	L366 C367 V386 R387 L388 I413 F415	L366-C376 WeakPolarHBondContact CA-O 3.46Å; C367-C376 PolarHBondContact N-O 3.5Å; C367-C376 PolarHBondContact O-N 3.29Å; C376-V386 VanDerWaalsContact SG-CG1 3.59Å; C376-R387 WeakPolarHBondContact CA-O 3.47Å; C376-L388 HydrophobicContact CB-CD2 3.73Å; C376-I413 HydrophobicContact CB-CD1 4.06Å; C376-F415 HydrophobicContact CB-CE2 3.56Å; C376-F415 HydrophobicContact CB-CZ 3.73Å
377	L	98.2	Very high	96.1	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.1	180	-39.6	177.8	0	0	0	108.5	V336 I356 L359 L366 L375 V386 R387 I396	V336-L377 HydrophobicContact CB-CD1 4.31Å; V336-L377 HydrophobicContact CB-CD2 4.24Å; V336-L377 HydrophobicContact CG1-CD2 3.9Å; V336-L377 HydrophobicContact CG2-CD1 4.03Å; V336-L377 HydrophobicContact CG2-CD2 4.04Å; V336-L377 HydrophobicContact CG2-CG 4.46Å; I356-L377 HydrophobicContact CB-CD1 4.42Å; I356-L377 HydrophobicContact CD1-CD1 4.17Å; I356-L377 HydrophobicContact CG2-CD1 3.77Å; L359-L377 HydrophobicContact CD1-CB 3.86Å; L366-L377 HydrophobicContact CD2-CB 4.26Å; L366-L377 HydrophobicContact CD2-CD2 3.15Å; L366-L377 HydrophobicContact CD2-CG 4.29Å; L375-L377 HydrophobicContact CD1-CD2 4.29Å; L375-L377 HydrophobicContact CD2-CD2 3.57Å; L375-L377 HydrophobicContact CG-CD2 3.52Å; L377-V386 CarbonylContact O-C 3.5Å; L377-V386 WeakPolarHBondContact O-CA 3.3Å; L377-V386 WeakPolarHBondContact O-CG1 3.41Å; L377-R387 HydrophobicContact CD1-CB 4.5Å; L377-R387 PolarHBondContact N-O 2.87Å; L377-R387 PolarHBondContact O-N 2.84Å; L377-I396 HydrophobicContact CD1-CD1 4.34Å
378	A	98.2	Very high	96.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.5	174.7	0	0	0	0	0	114.1	N364 S365 A385 V386 P410 I413	N364-A378 PolarHBondContact N-O 3.33Å; N364-A378 VanDerWaalsContact N-O 3.16Å; S365-A378 PolarHBondContact N-O 2.95Å; S365-A378 PolarHBondContact O-N 2.55Å; A378-A385 CarbonylContact C-O 3.55Å; A378-A385 VanDerWaalsContact CA-O 3.27Å; A378-A385 WeakPolarHBondContact CA-O 3.42Å; A378-V386 HydrophobicContact CB-CB 4.49Å; A378-V386 HydrophobicContact CB-CG1 4.27Å; A378-V386 HydrophobicContact CB-CG2 4.04Å; A378-P410 HydrophobicContact CB-CB 4.18Å; A378-P410 HydrophobicContact CB-CG 4.03Å; A378-I413 HydrophobicContact CB-CD1 4.42Å; A378-I413 HydrophobicContact CB-CG2 3.82Å
379	S	98.2	Very high	96	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.			trans	-124.5	119.9	174.9	-177.2	0	0	0	0	111.2	T361 G362 N364 Q381 A385 P410	T361-S379 WeakPolarHBondContact CB-OG 3.4Å; T361-S379 PolarHBondContact O-OG 3.03Å; T361-S379 WeakPolarHBondContact OG1-CB 3.38Å; T361-S379 PolarHBondContact OG1-OG 2.84Å; G362-S379 WeakPolarHBondContact O-CB 3.16Å; G362-S379 PolarHBondContact O-OG 3.12Å; N364-S379 WeakPolarHBondContact OD1-CA 3.46Å; S379-Q381 PolarHBondContact O-N 2.86Å; S379-A385 PolarHBondContact N-O 3.46Å; S379-A385 WeakPolarHBondContact O-CB 3.45Å; S379-P410 VanDerWaalsContact O-CD 3.27Å; S379-P410 WeakPolarHBondContact O-CD 3.26Å; S379-P410 VanDerWaalsContact O-CG 3.28Å; S379-P410 WeakPolarHBondContact O-CG 3.25Å
380	S	97	Very high	95.9	Very high	40 Å²	40	30.7 Å²	30.7	28%	0.28	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	1.5	178.2	60.1	0	0	0	0	115.3	N364 K409 P410	N364-S380 PolarHBondContact ND2-OG 2.85Å; N364-S380 WeakPolarHBondContact OD1-CB 3.43Å; N364-S380 PolarHBondContact OD1-N 3.49Å; N364-S380 PolarHBondContact OD1-OG 3.34Å; S380-K409 WeakPolarHBondContact O-CB 3.48Å; S380-K409 WeakPolarHBondContact O-CD 3.43Å; S380-P410 WeakPolarHBondContact CA-O 3.44Å; S380-P410 WeakPolarHBondContact CB-O 3.23Å; S380-P410 PolarHBondContact N-O 3.02Å
381	Q	96.7	Very high	95.8	Very high	104 Å²	104	29 Å²	29	49%	0.486	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-28.7	-175.8	-66.9	-179.8	-15.1	0	0	112.8	T361 S379 K409	T361-Q381 VanDerWaalsContact CB-OE1 3.28Å; T361-Q381 HydrophobicContact CG2-CB 4.12Å; S379-Q381 PolarHBondContact O-N 2.86Å; Q381-K409 WeakPolarHBondContact O-CD 3.47Å; Q381-K409 VanDerWaalsContact O-CE 3.28Å; Q381-K409 WeakPolarHBondContact O-CE 3.28Å; Q381-K409 PolarHBondContact O-NZ 3.1Å; Q381-K409 VanDerWaalsContact O-NZ 3.09Å
382	R	95.7	Very high	95.7	Very high	147 Å²	147	31.1 Å²	31.1	56%	0.555	15%	0.153	S	C	*	.	S	Bend	trans	-129.6	143.9	-173.2	-168.5	-177.3	-180	91	3.1	111.2	T361 A385 P410	T361-R382 HydrophobicContact CG2-CB 4.47Å; R382-A385 HydrophobicContact CB-CB 4.04Å; R382-A385 VanDerWaalsContact O-CB 3.26Å; R382-A385 WeakPolarHBondContact O-CB 3.35Å; R382-P410 WeakPolarHBondContact O-CD 3.33Å
383	P	95.4	Very high	95.4	Very high	59 Å²	59	32.5 Å²	32.5	38%	0.383	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	155.6	169.9	27.4	-36.6	0	0	0	111.4	A385 L407	P383-A385 PolarHBondContact O-N 3.43Å; P383-L407 WeakPolarHBondContact CB-O 3.27Å
384	D	93.5	Very high	95.3	Very high	60 Å²	60	32.4 Å²	32.4	32%	0.321	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	18.6	179.9	-56.8	-52.1	0	0	0	115.1	V386 R387 P401 L407	D384-V386 PolarHBondContact O-N 2.52Å; D384-V386 VanDerWaalsContact O-N 3.07Å; D384-R387 PolarHBondContact O-NH1 2.73Å; D384-P401 HydrophobicContact CB-CG 3.99Å; D384-P401 WeakPolarHBondContact O-CG 3.39Å; D384-L407 PolarHBondContact N-O 3.49Å; D384-L407 WeakPolarHBondContact OD1-CA 3.32Å; D384-L407 VanDerWaalsContact OD1-CB 3.27Å; D384-L407 WeakPolarHBondContact OD1-CB 3.41Å; D384-L407 PolarHBondContact OD1-N 2.98Å; D384-L407 VanDerWaalsContact OD1-O 3.13Å
385	A	95.8	Very high	95.1	Very high	5 Å²	5	34.9 Å²	34.9	4%	0.041	17%	0.174	C	C	.	.			trans	-89.2	55.5	-177.8	0	0	0	0	0	111.4	L359 A378 S379 R382 P383	L359-A385 HydrophobicContact CD2-CB 4.14Å; A378-A385 CarbonylContact C-O 3.55Å; A378-A385 VanDerWaalsContact CA-O 3.27Å; A378-A385 WeakPolarHBondContact CA-O 3.42Å; S379-A385 PolarHBondContact N-O 3.46Å; S379-A385 WeakPolarHBondContact O-CB 3.45Å; R382-A385 HydrophobicContact CB-CB 4.04Å; R382-A385 VanDerWaalsContact O-CB 3.26Å; R382-A385 WeakPolarHBondContact O-CB 3.35Å; P383-A385 PolarHBondContact O-N 3.43Å
386	V	97	Very high	94.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142	170	-168.7	0	0	0	0	108.3	C376 L377 A378 D384 F400 P401 L407 P410 V424	C376-V386 VanDerWaalsContact SG-CG1 3.59Å; L377-V386 CarbonylContact O-C 3.5Å; L377-V386 WeakPolarHBondContact O-CA 3.3Å; L377-V386 WeakPolarHBondContact O-CG1 3.41Å; A378-V386 HydrophobicContact CB-CB 4.49Å; A378-V386 HydrophobicContact CB-CG1 4.27Å; A378-V386 HydrophobicContact CB-CG2 4.04Å; D384-V386 PolarHBondContact O-N 2.52Å; D384-V386 VanDerWaalsContact O-N 3.07Å; V386-F400 HydrophobicContact CB-CE1 4.05Å; V386-F400 HydrophobicContact CG1-CE1 3.65Å; V386-F400 HydrophobicContact CG1-CZ 4.3Å; V386-P401 WeakPolarHBondContact O-CD 3.24Å; V386-L407 HydrophobicContact CB-CD2 4.49Å; V386-L407 HydrophobicContact CG2-CD2 3.56Å; V386-P410 HydrophobicContact CG2-CB 3.52Å; V386-P410 HydrophobicContact CG2-CG 3.53Å; V386-V424 HydrophobicContact CG2-CG1 4.17Å
387	R	96.5	Very high	94.6	Very high	70 Å²	70	35.8 Å²	35.8	26%	0.264	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147.1	173.6	-64	-66	179.8	-89.3	1.6	109.9	N358 L359 C376 L377 D384 I396	N358-R387 HydrophobicContact CB-CG 4.32Å; L359-R387 HydrophobicContact CD2-CG 3.99Å; L359-R387 HydrophobicContact CG-CG 4.4Å; C376-R387 WeakPolarHBondContact CA-O 3.47Å; L377-R387 HydrophobicContact CD1-CB 4.5Å; L377-R387 PolarHBondContact N-O 2.87Å; L377-R387 PolarHBondContact O-N 2.84Å; D384-R387 PolarHBondContact O-NH1 2.73Å; R387-I396 HydrophobicContact CB-CD1 4.14Å; R387-I396 HydrophobicContact CB-CG2 4.34Å
388	L	96.5	Very high	94.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.9	168.7	-63.6	177.9	0	0	0	108.3	I120 I374 C376 F397 F400 F415 L422 L436	I120-L388 HydrophobicContact CD1-CD1 4.37Å; I120-L388 HydrophobicContact CG2-CD1 4.32Å; I374-L388 HydrophobicContact CG2-CB 4.08Å; I374-L388 HydrophobicContact CG2-CD2 3.88Å; I374-L388 HydrophobicContact CG2-CG 4.45Å; C376-L388 HydrophobicContact CB-CD2 3.73Å; L388-F397 HydrophobicContact CB-CB 4.46Å; L388-F397 HydrophobicContact CB-CD2 3.71Å; L388-F397 WeakPolarHBondContact O-CD2 3.28Å; L388-F397 PolarHBondContact O-N 2.84Å; L388-F400 HydrophobicContact CB-CD1 4.39Å; L388-F400 HydrophobicContact CD1-CB 4.35Å; L388-F400 HydrophobicContact CD1-CD1 3.82Å; L388-F400 HydrophobicContact CD1-CD2 4.44Å; L388-F400 HydrophobicContact CD1-CE1 4.18Å; L388-F400 HydrophobicContact CD1-CG 3.94Å; L388-F400 HydrophobicContact CD2-CE1 4.39Å; L388-F400 HydrophobicContact CG-CD1 3.56Å; L388-F400 HydrophobicContact CG-CE1 3.86Å; L388-F400 HydrophobicContact CG-CG 4.18Å; L388-F415 HydrophobicContact CD2-CZ 4.01Å; L388-L422 HydrophobicContact CD2-CD2 4.1Å; L388-L436 HydrophobicContact CD1-CD2 4.18Å
389	Y	95.9	Very high	93.7	Very high	5 Å²	5	43.6 Å²	43.6	2%	0.02	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.6	178.6	173	-104.4	0	0	0	109.5	V338 K354 I356 I374 L375 V391 S394 I395 I396	V338-Y389 HydrophobicContact CG2-CE1 4.35Å; K354-Y389 WeakPolarHBondContact CB-OH 3.31Å; K354-Y389 HydrophobicContact CG-CE2 4.24Å; K354-Y389 WeakPolarHBondContact CG-OH 3.21Å; I356-Y389 HydrophobicContact CD1-CD1 3.8Å; I356-Y389 HydrophobicContact CD1-CD2 3.49Å; I356-Y389 VanDerWaalsContact CD1-CD2 3.49Å; I356-Y389 HydrophobicContact CD1-CE1 3.98Å; I356-Y389 HydrophobicContact CD1-CE2 3.68Å; I356-Y389 HydrophobicContact CD1-CG 3.54Å; I356-Y389 HydrophobicContact CG1-CD2 3.99Å; I356-Y389 HydrophobicContact CG1-CE2 3.88Å; I374-Y389 CarbonylContact C-O 3.44Å; I374-Y389 VanDerWaalsContact CA-O 3.26Å; I374-Y389 WeakPolarHBondContact CA-O 3.4Å; L375-Y389 HydrophobicContact CB-CD1 4.07Å; L375-Y389 HydrophobicContact CD2-CD1 4.42Å; L375-Y389 PolarHBondContact N-O 2.78Å; L375-Y389 PolarHBondContact O-N 2.94Å; Y389-V391 HydrophobicContact CD1-CG2 4.07Å; Y389-V391 HydrophobicContact CE1-CB 4.45Å; Y389-V391 HydrophobicContact CE1-CG2 4.2Å; Y389-S394 VanDerWaalsContact OH-CA 3.24Å; Y389-S394 WeakPolarHBondContact OH-CA 3.17Å; Y389-S394 VanDerWaalsContact OH-CB 3.3Å; Y389-S394 WeakPolarHBondContact OH-CB 3.49Å; Y389-S394 PolarHBondContact OH-OG 3.49Å; Y389-I395 WeakPolarHBondContact CA-O 3.5Å; Y389-I395 WeakPolarHBondContact CD2-O 2.96Å; Y389-I396 HydrophobicContact CD2-CD1 3.88Å; Y389-I396 HydrophobicContact CD2-CG1 4.23Å; Y389-I396 HydrophobicContact CG-CD1 4.26Å
390	D	94.5	Very high	93.4	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	117.6	169	-169	-40.1	0	0	0	109.2	N392 E393 S394 I395 F397	D390-N392 WeakPolarHBondContact OD1-CA 3.46Å; D390-N392 WeakPolarHBondContact OD1-CB 3.16Å; D390-N392 PolarHBondContact OD1-N 2.92Å; D390-E393 HydrophobicContact CB-CB 4.3Å; D390-E393 PolarHBondContact OD1-N 2.85Å; D390-S394 WeakPolarHBondContact O-CA 3.01Å; D390-S394 PolarHBondContact O-N 2.83Å; D390-I395 HydrophobicContact CB-CG1 3.94Å; D390-I395 PolarHBondContact N-O 2.84Å; D390-F397 HydrophobicContact CB-CE2 3.91Å; D390-F397 HydrophobicContact CB-CZ 3.78Å
391	V	92.8	Very high	93	Very high	8 Å²	8	42 Å²	42	5%	0.048	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-32.3	-178.1	179.7	0	0	0	0	111.6	W326 F368 E373 L375 Y389	W326-V391 HydrophobicContact CD2-CG1 4.39Å; W326-V391 HydrophobicContact CG-CG1 4.36Å; F368-V391 HydrophobicContact CD1-CG2 4.35Å; F368-V391 HydrophobicContact CE1-CG2 3.98Å; E373-V391 PolarHBondContact O-N 2.85Å; L375-V391 HydrophobicContact CB-CG2 4.19Å; Y389-V391 HydrophobicContact CD1-CG2 4.07Å; Y389-V391 HydrophobicContact CE1-CB 4.45Å; Y389-V391 HydrophobicContact CE1-CG2 4.2Å
392	N	89.7	Confident	92.3	Very high	87 Å²	87	40.2 Å²	40.2	47%	0.465	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-50.9	-177.2	-63.2	-35.9	0	0	0	110.8	D390 S394	D390-N392 WeakPolarHBondContact OD1-CA 3.46Å; D390-N392 WeakPolarHBondContact OD1-CB 3.16Å; D390-N392 PolarHBondContact OD1-N 2.92Å; N392-S394 VanDerWaalsContact C-N 3.32Å
393	E	87.1	Confident	91.3	Very high	61 Å²	61	37.2 Å²	37.2	29%	0.285	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-11.2	-176.9	-67	-57.1	137.5	0	0	112.9	Y116 D390 I395	Y116-E393 HydrophobicContact CE1-CG 4.32Å; Y116-E393 WeakPolarHBondContact CE1-OE1 3.45Å; Y116-E393 WeakPolarHBondContact CE1-OE2 3.34Å; Y116-E393 PolarHBondContact OH-OE1 3.32Å; D390-E393 HydrophobicContact CB-CB 4.3Å; D390-E393 PolarHBondContact OD1-N 2.85Å; E393-I395 VanDerWaalsContact C-N 3.27Å; E393-I395 HydrophobicContact CB-CD1 4.08Å; E393-I395 HydrophobicContact CB-CG1 3.84Å; E393-I395 PolarHBondContact O-N 3.15Å
394	S	90.3	Very high	90.7	Very high	30 Å²	30	35.2 Å²	35.2	21%	0.21	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	38.2	-179	-61.4	0	0	0	0	114	K354 Y389 D390 N392	K354-S394 WeakPolarHBondContact CE-O 3.49Å; K354-S394 PolarHBondContact NZ-O 3.22Å; Y389-S394 VanDerWaalsContact OH-CA 3.24Å; Y389-S394 WeakPolarHBondContact OH-CA 3.17Å; Y389-S394 VanDerWaalsContact OH-CB 3.3Å; Y389-S394 WeakPolarHBondContact OH-CB 3.49Å; Y389-S394 PolarHBondContact OH-OG 3.49Å; D390-S394 WeakPolarHBondContact O-CA 3.01Å; D390-S394 PolarHBondContact O-N 2.83Å; N392-S394 VanDerWaalsContact C-N 3.32Å
395	I	91.9	Very high	90.1	Very high	51 Å²	51	34.5 Å²	34.5	26%	0.262	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	159.4	179.6	61.9	174.5	0	0	0	111.8	G117 Y389 D390 E393	G117-I395 WeakPolarHBondContact O-CD1 3.39Å; Y389-I395 WeakPolarHBondContact CA-O 3.5Å; Y389-I395 WeakPolarHBondContact CD2-O 2.96Å; D390-I395 HydrophobicContact CB-CG1 3.94Å; D390-I395 PolarHBondContact N-O 2.84Å; E393-I395 VanDerWaalsContact C-N 3.27Å; E393-I395 HydrophobicContact CB-CD1 4.08Å; E393-I395 HydrophobicContact CB-CG1 3.84Å; E393-I395 PolarHBondContact O-N 3.15Å
396	I	92.9	Very high	89.7	Confident	18 Å²	18	40.3 Å²	40.3	9%	0.092	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.9	172.3	-67.9	-78.7	0	0	0	108.8	I356 N358 L377 R387 Y389 E398	I356-I396 HydrophobicContact CG2-CD1 3.83Å; I356-I396 HydrophobicContact CG2-CG1 4.18Å; N358-I396 HydrophobicContact CB-CD1 4.47Å; N358-I396 HydrophobicContact CB-CG1 4.25Å; L377-I396 HydrophobicContact CD1-CD1 4.34Å; R387-I396 HydrophobicContact CB-CD1 4.14Å; R387-I396 HydrophobicContact CB-CG2 4.34Å; Y389-I396 HydrophobicContact CD2-CD1 3.88Å; Y389-I396 HydrophobicContact CD2-CG1 4.23Å; Y389-I396 HydrophobicContact CG-CD1 4.26Å; I396-E398 PolarHBondContact O-N 3.08Å
397	F	92.8	Very high	89.5	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	25%	0.252	C	S	.	.			trans	-73.5	114.7	171.4	-63.4	-68.3	0	0	0	110.2	L114 K118 I120 I374 L388 D390 N399	L114-F397 HydrophobicContact CD1-CZ 4.11Å; K118-F397 WeakPolarHBondContact O-CA 3.32Å; I120-F397 HydrophobicContact CB-CB 4.34Å; I120-F397 HydrophobicContact CB-CD1 3.57Å; I120-F397 HydrophobicContact CB-CD2 4.11Å; I120-F397 HydrophobicContact CB-CE1 3.81Å; I120-F397 HydrophobicContact CB-CE2 4.31Å; I120-F397 HydrophobicContact CB-CG 3.74Å; I120-F397 HydrophobicContact CB-CZ 4.18Å; I120-F397 HydrophobicContact CD1-CD2 4.25Å; I120-F397 HydrophobicContact CD1-CE2 4.02Å; I120-F397 HydrophobicContact CD1-CZ 4.3Å; I120-F397 HydrophobicContact CG2-CB 3.53Å; I120-F397 HydrophobicContact CG2-CD1 3.76Å; I120-F397 HydrophobicContact CG2-CD2 3.83Å; I120-F397 HydrophobicContact CG2-CE1 4.43Å; I120-F397 HydrophobicContact CG2-CE2 4.49Å; I120-F397 HydrophobicContact CG2-CG 3.41Å; I120-F397 VanDerWaalsContact CG2-CG 3.41Å; I374-F397 HydrophobicContact CD1-CE2 4.42Å; I374-F397 HydrophobicContact CG1-CE2 4.35Å; L388-F397 HydrophobicContact CB-CB 4.46Å; L388-F397 HydrophobicContact CB-CD2 3.71Å; L388-F397 WeakPolarHBondContact O-CD2 3.28Å; L388-F397 PolarHBondContact O-N 2.84Å; D390-F397 HydrophobicContact CB-CE2 3.91Å; D390-F397 HydrophobicContact CB-CZ 3.78Å; F397-N399 VanDerWaalsContact C-N 3.34Å
398	E	89	Confident	89.4	Confident	122 Å²	122	40.2 Å²	40.2	57%	0.57	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-22.5	-173.4	-69.9	-179.6	180	0	0	112.5	K118 I396 F400	K118-E398 HydrophobicContact CB-CG 4.47Å; K118-E398 HydrophobicContact CD-CG 4.39Å; K118-E398 WeakPolarHBondContact CD-OE1 3.49Å; K118-E398 WeakPolarHBondContact CE-OE1 3.23Å; K118-E398 IonicContact NZ-OE1 2.72Å; K118-E398 PolarHBondContact NZ-OE1 2.99Å; K118-E398 IonicContact NZ-OE2 3.97Å; K118-E398 PolarHBondContact O-N 3.5Å; I396-E398 PolarHBondContact O-N 3.08Å; E398-F400 VanDerWaalsContact C-N 3.26Å; E398-F400 PolarHBondContact O-N 3.26Å
399	N	89.4	Confident	89.5	Confident	43 Å²	43	44.2 Å²	44.2	23%	0.23	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	13.1	179.4	75.9	-50	0	0	0	113.9	Q119 I120 F397 A402 V404	Q119-N399 WeakPolarHBondContact CA-OD1 3.19Å; I120-N399 PolarHBondContact N-OD1 2.92Å; I120-N399 PolarHBondContact O-ND2 2.91Å; F397-N399 VanDerWaalsContact C-N 3.34Å; N399-A402 CarbonylContact C-O 3.54Å; N399-A402 WeakPolarHBondContact CA-O 3.28Å; N399-V404 WeakPolarHBondContact O-CG2 3.32Å
400	F	91.3	Very high	89.6	Confident	2 Å²	2	44 Å²	44	1%	0.009	27%	0.273	C	S	.	.	S	Bend	trans	-135.6	130.1	173.8	-177.7	-92.2	0	0	0	111.7	V122 V386 L388 E398 A402 V404 L422 Y434	V122-F400 HydrophobicContact CB-CD2 4.41Å; V122-F400 HydrophobicContact CG1-CD2 3.96Å; V122-F400 HydrophobicContact CG1-CE2 4.17Å; V122-F400 HydrophobicContact CG2-CD2 4.22Å; V386-F400 HydrophobicContact CB-CE1 4.05Å; V386-F400 HydrophobicContact CG1-CE1 3.65Å; V386-F400 HydrophobicContact CG1-CZ 4.3Å; L388-F400 HydrophobicContact CB-CD1 4.39Å; L388-F400 HydrophobicContact CD1-CB 4.35Å; L388-F400 HydrophobicContact CD1-CD1 3.82Å; L388-F400 HydrophobicContact CD1-CD2 4.44Å; L388-F400 HydrophobicContact CD1-CE1 4.18Å; L388-F400 HydrophobicContact CD1-CG 3.94Å; L388-F400 HydrophobicContact CD2-CE1 4.39Å; L388-F400 HydrophobicContact CG-CD1 3.56Å; L388-F400 HydrophobicContact CG-CE1 3.86Å; L388-F400 HydrophobicContact CG-CG 4.18Å; E398-F400 VanDerWaalsContact C-N 3.26Å; E398-F400 PolarHBondContact O-N 3.26Å; F400-A402 VanDerWaalsContact C-N 3.26Å; F400-V404 HydrophobicContact CD2-CG2 4.4Å; F400-L422 HydrophobicContact CE1-CD2 4.17Å; F400-L422 HydrophobicContact CE2-CD2 4.36Å; F400-L422 HydrophobicContact CZ-CD2 3.67Å; F400-Y434 AromaticContact CE2-CD1 3.85Å; F400-Y434 HydrophobicContact CE2-CD1 3.85Å; F400-Y434 HydrophobicContact CE2-CD2 4.26Å; F400-Y434 AromaticContact CE2-CE1 3.85Å; F400-Y434 HydrophobicContact CE2-CE1 3.85Å; F400-Y434 HydrophobicContact CE2-CE2 4.3Å; F400-Y434 HydrophobicContact CE2-CG 4.05Å; F400-Y434 HydrophobicContact CZ-CD2 4.48Å; F400-Y434 HydrophobicContact CZ-CE2 4.42Å
401	P	88.6	Confident	89.7	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.026	28%	0.28	C	S	.	.	S	Bend	cis	-78.1	-6.3	-2.8	32.6	-37.7	0	0	0	113.1	D384 V386 G403 V404	D384-P401 HydrophobicContact CB-CG 3.99Å; D384-P401 WeakPolarHBondContact O-CG 3.39Å; V386-P401 WeakPolarHBondContact O-CD 3.24Å; P401-G403 PolarHBondContact O-N 3.45Å; P401-V404 PolarHBondContact O-N 3.01Å; P401-V404 VanDerWaalsContact O-N 3.07Å
402	A	81.9	Confident	89.9	Confident	67 Å²	67	45.1 Å²	45.1	55%	0.554	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	119.4	-176.4	0	0	0	0	0	111.7	N399 F400	N399-A402 CarbonylContact C-O 3.54Å; N399-A402 WeakPolarHBondContact CA-O 3.28Å; F400-A402 VanDerWaalsContact C-N 3.26Å
403	G	74.5	Confident	90.3	Very high	84 Å²	84	41.8 Å²	41.8	87%	0.866	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.1	-7.4	-178.8	0	0	0	0	0	114.8	P401	P401-G403 PolarHBondContact O-N 3.45Å
404	V	83.5	Confident	90.8	Very high	17 Å²	17	39.3 Å²	39.3	10%	0.103	25%	0.252	C	S	.	.	S	Bend	trans	-108.1	13.1	179.2	-157.6	0	0	0	0	111.9	V122 R124 N399 F400 P401 Y434	V122-V404 HydrophobicContact CB-CG2 4.22Å; V122-V404 HydrophobicContact CG1-CG1 4.14Å; V122-V404 HydrophobicContact CG1-CG2 4.45Å; R124-V404 HydrophobicContact CB-CG1 3.74Å; R124-V404 WeakPolarHBondContact CB-O 3.27Å; R124-V404 WeakPolarHBondContact CD-O 3.42Å; R124-V404 WeakPolarHBondContact CG-O 3.38Å; R124-V404 VanDerWaalsContact N-CG1 3.28Å; N399-V404 WeakPolarHBondContact O-CG2 3.32Å; F400-V404 HydrophobicContact CD2-CG2 4.4Å; P401-V404 PolarHBondContact O-N 3.01Å; P401-V404 VanDerWaalsContact O-N 3.07Å; V404-Y434 HydrophobicContact CB-CD1 4.46Å; V404-Y434 HydrophobicContact CB-CE1 4.08Å; V404-Y434 HydrophobicContact CG1-CD1 3.67Å; V404-Y434 HydrophobicContact CG1-CE1 3.68Å
405	G	79.9	Confident	91.1	Very high	45 Å²	45	38.9 Å²	38.9	46%	0.464	25%	0.247	S	C	.	.			trans	102.2	173.5	-178.1	0	0	0	0	0	113.4
406	T	87.8	Confident	91.4	Very high	128 Å²	128	36.5 Å²	36.5	79%	0.785	23%	0.234	S	C	*	.			trans	-84.6	141.5	-178.3	54.9	0	0	0	0	111.6
407	L	92.9	Very high	91.4	Very high	4 Å²	4	38 Å²	38	2%	0.021	25%	0.246	C	C	.	.			trans	-128.5	130	179.8	-172.1	73.9	0	0	0	109.8	P383 D384 V386 V424 Q426 A432	P383-L407 WeakPolarHBondContact CB-O 3.27Å; D384-L407 PolarHBondContact N-O 3.49Å; D384-L407 WeakPolarHBondContact OD1-CA 3.32Å; D384-L407 VanDerWaalsContact OD1-CB 3.27Å; D384-L407 WeakPolarHBondContact OD1-CB 3.41Å; D384-L407 PolarHBondContact OD1-N 2.98Å; D384-L407 VanDerWaalsContact OD1-O 3.13Å; V386-L407 HydrophobicContact CB-CD2 4.49Å; V386-L407 HydrophobicContact CG2-CD2 3.56Å; L407-V424 HydrophobicContact CD1-CB 4.47Å; L407-V424 HydrophobicContact CD1-CG1 4.37Å; L407-V424 HydrophobicContact CD2-CG1 3.96Å; L407-Q426 VanDerWaalsContact CD1-CD 3.49Å; L407-Q426 HydrophobicContact CD1-CG 3.86Å; L407-Q426 HydrophobicContact CG-CG 4.44Å; L407-A432 HydrophobicContact CD1-CB 3.52Å
408	N	95.1	Very high	91.4	Very high	64 Å²	64	39.4 Å²	39.4	34%	0.342	26%	0.26	S	S	.	.			trans	-72.5	-173.6	172.3	-147.3	-64.6	0	0	0	110.6	P410 Q426 C427	N408-P410 VanDerWaalsContact O-CD 3.3Å; N408-P410 WeakPolarHBondContact O-CD 3.26Å; N408-P410 VanDerWaalsContact O-N 3.15Å; N408-Q426 HydrophobicContact CB-CB 4.35Å; N408-Q426 HydrophobicContact CB-CG 4.44Å; N408-C427 PolarHBondContact OD1-SG 3.02Å
409	K	97.1	Very high	91.6	Very high	84 Å²	84	33.6 Å²	33.6	37%	0.365	23%	0.233	S	C	.	.			trans	-61.5	119.4	-176.9	-52.2	-176.7	-179.6	-165.7	0	110.4	S380 Q381 Q426 C427	S380-K409 WeakPolarHBondContact O-CB 3.48Å; S380-K409 WeakPolarHBondContact O-CD 3.43Å; Q381-K409 WeakPolarHBondContact O-CD 3.47Å; Q381-K409 VanDerWaalsContact O-CE 3.28Å; Q381-K409 WeakPolarHBondContact O-CE 3.28Å; Q381-K409 PolarHBondContact O-NZ 3.1Å; Q381-K409 VanDerWaalsContact O-NZ 3.09Å; K409-Q426 VanDerWaalsContact O-CA 3.31Å; K409-Q426 WeakPolarHBondContact O-CA 3.4Å; K409-C427 HydrophobicContact CB-CB 4.24Å; K409-C427 PolarHBondContact O-N 3.32Å
410	P	97.7	Very high	91.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	123.7	-176.8	32.2	-37.1	0	0	0	110.9	A378 S379 S380 R382 V386 N408 V424 G425	A378-P410 HydrophobicContact CB-CB 4.18Å; A378-P410 HydrophobicContact CB-CG 4.03Å; S379-P410 VanDerWaalsContact O-CD 3.27Å; S379-P410 WeakPolarHBondContact O-CD 3.26Å; S379-P410 VanDerWaalsContact O-CG 3.28Å; S379-P410 WeakPolarHBondContact O-CG 3.25Å; S380-P410 WeakPolarHBondContact CA-O 3.44Å; S380-P410 WeakPolarHBondContact CB-O 3.23Å; S380-P410 PolarHBondContact N-O 3.02Å; R382-P410 WeakPolarHBondContact O-CD 3.33Å; V386-P410 HydrophobicContact CG2-CB 3.52Å; V386-P410 HydrophobicContact CG2-CG 3.53Å; N408-P410 VanDerWaalsContact O-CD 3.3Å; N408-P410 WeakPolarHBondContact O-CD 3.26Å; N408-P410 VanDerWaalsContact O-N 3.15Å; P410-V424 HydrophobicContact CB-CG1 3.49Å; P410-V424 VanDerWaalsContact CB-CG1 3.49Å; P410-G425 CarbonylContact C-O 3.51Å; P410-G425 WeakPolarHBondContact CA-O 3.21Å
411	T	97.6	Very high	92.1	Very high	28 Å²	28	37 Å²	37	17%	0.172	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-20.4	-173.9	50.3	0	0	0	0	113.2	S137 I138 G425 Q426 C427	S137-T411 WeakPolarHBondContact OG-CG2 3.3Å; I138-T411 WeakPolarHBondContact O-CB 3.4Å; I138-T411 PolarHBondContact O-OG1 3.16Å; T411-G425 PolarHBondContact N-O 3.38Å; T411-G425 PolarHBondContact OG1-O 2.82Å; T411-Q426 VanDerWaalsContact OG1-C 3.28Å; T411-C427 HydrophobicContact CG2-CB 3.82Å
412	S	97.5	Very high	92.5	Very high	7 Å²	7	36.9 Å²	36.9	5%	0.049	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	151.5	170.9	66.7	0	0	0	0	110.1	T141 V424 G425	T141-S412 VanDerWaalsContact CG2-OG 3.3Å; T141-S412 WeakPolarHBondContact CG2-OG 3.19Å; T141-S412 PolarHBondContact N-OG 3.04Å; T141-S412 PolarHBondContact OG1-OG 3.15Å; S412-V424 CarbonylContact O-C 3.48Å; S412-V424 WeakPolarHBondContact O-CA 3.26Å; S412-G425 PolarHBondContact N-O 3.26Å; S412-G425 PolarHBondContact O-N 3.39Å
413	I	97.8	Very high	93.3	Very high	18 Å²	18	33.7 Å²	33.7	9%	0.092	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	150.2	175.5	63.5	-175.7	0	0	0	109.2	C367 C376 A378 C423 V424	C367-I413 HydrophobicContact CB-CD1 3.67Å; C367-I413 HydrophobicContact CB-CG1 3.79Å; C376-I413 HydrophobicContact CB-CD1 4.06Å; A378-I413 HydrophobicContact CB-CD1 4.42Å; A378-I413 HydrophobicContact CB-CG2 3.82Å; I413-C423 CarbonylContact C-O 3.52Å; I413-C423 WeakPolarHBondContact CA-O 3.34Å; I413-V424 HydrophobicContact CG2-CG1 4.22Å; I413-V424 HydrophobicContact CG2-CG2 4.25Å
414	G	96.8	Very high	94.4	Very high	8 Å²	8	29.7 Å²	29.7	8%	0.082	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	143.4	172.4	0	0	0	0	0	111.4	F143 C423	F143-G414 WeakPolarHBondContact CE2-O 3.13Å; G414-C423 PolarHBondContact N-O 3.38Å; G414-C423 PolarHBondContact O-N 2.92Å
415	F	97.6	Very high	95.1	Very high	22 Å²	22	28.9 Å²	28.9	10%	0.096	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	149.6	168.8	-72.5	-73	0	0	0	110.5	F143 C367 H369 I374 C376 L388 F421 L422 L436	F143-F415 VanDerWaalsContact CD2-O 3.25Å; F143-F415 WeakPolarHBondContact CD2-O 3.46Å; C367-F415 HydrophobicContact CB-CD2 4.47Å; H369-F415 HydrophobicContact CB-CD2 4.35Å; H369-F415 HydrophobicContact CB-CE2 4.21Å; H369-F415 HydrophobicContact CB-CZ 4.44Å; H369-F415 AromaticContact CD2-CD1 3.61Å; H369-F415 AromaticContact CD2-CE1 3.71Å; H369-F415 AromaticContact CD2-CG 3.96Å; I374-F415 HydrophobicContact CG2-CZ 4.48Å; C376-F415 HydrophobicContact CB-CE2 3.56Å; C376-F415 HydrophobicContact CB-CZ 3.73Å; L388-F415 HydrophobicContact CD2-CZ 4.01Å; F415-F421 CarbonylContact C-O 3.51Å; F415-F421 WeakPolarHBondContact CA-O 3.32Å; F415-L422 HydrophobicContact CD1-CB 3.97Å; F415-L422 HydrophobicContact CD1-CD1 4.03Å; F415-L422 HydrophobicContact CE1-CB 3.75Å; F415-L422 HydrophobicContact CE1-CD1 3.73Å; F415-L422 HydrophobicContact CE1-CD2 4.24Å; F415-L422 HydrophobicContact CE1-CG 4.1Å; F415-L422 HydrophobicContact CE2-CD1 4.37Å; F415-L422 HydrophobicContact CG-CD1 4.48Å; F415-L422 HydrophobicContact CZ-CD1 3.92Å; F415-L422 HydrophobicContact CZ-CD2 4.48Å; F415-L436 HydrophobicContact CE1-CD1 3.92Å
416	S	96.7	Very high	96	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.			trans	-73.5	157.3	168.2	66.3	0	0	0	0	110.9	G418 G419 F421 Y442	S416-G418 VanDerWaalsContact C-N 3.34Å; S416-G418 PolarHBondContact O-N 3.18Å; S416-G419 WeakPolarHBondContact O-CA 3.21Å; S416-G419 PolarHBondContact O-N 3.12Å; S416-F421 PolarHBondContact N-O 3.1Å; S416-F421 WeakPolarHBondContact OG-CB 3.4Å; S416-F421 PolarHBondContact OG-N 2.88Å; S416-F421 PolarHBondContact OG-O 3.26Å; S416-Y442 VanDerWaalsContact C-OXT 3.25Å; S416-Y442 WeakPolarHBondContact CB-OXT 3.24Å; S416-Y442 PolarHBondContact OG-OXT 2.85Å
417	P	93.2	Very high	96.4	Very high	51 Å²	51	23.1 Å²	23.1	33%	0.331	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-37	-168.2	-25.8	35.3	0	0	0	115.4	N144 P370 Y442	N144-P417 WeakPolarHBondContact O-CG 3.28Å; P370-P417 WeakPolarHBondContact CB-O 3.46Å; P370-P417 VanDerWaalsContact CG-O 3.31Å; P370-P417 WeakPolarHBondContact CG-O 3.46Å; P417-Y442 WeakPolarHBondContact CD-OXT 3.37Å; P417-Y442 HydrophobicContact CG-CD1 4.13Å; P417-Y442 HydrophobicContact CG-CE1 3.69Å
418	G	92.4	Very high	96.5	Very high	29 Å²	29	25.9 Å²	25.9	30%	0.299	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.8	174.7	0	0	0	0	0	113.6	S416 D441 Y442	S416-G418 VanDerWaalsContact C-N 3.34Å; S416-G418 PolarHBondContact O-N 3.18Å; G418-D441 CarbonylContact C-O 3.58Å; G418-Y442 VanDerWaalsContact CA-O 3.28Å; G418-Y442 WeakPolarHBondContact CA-O 3.28Å; G418-Y442 PolarHBondContact N-O 3.11Å; G418-Y442 PolarHBondContact N-OXT 3.16Å
419	G	93.5	Very high	96.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	90.3	-5	168.1	0	0	0	0	0	116.3	H369 S416 F421 Y442	H369-G419 WeakPolarHBondContact NE2-CA 3.43Å; H369-G419 PolarHBondContact NE2-O 3.04Å; S416-G419 WeakPolarHBondContact O-CA 3.21Å; S416-G419 PolarHBondContact O-N 3.12Å; G419-F421 VanDerWaalsContact C-N 3.31Å; G419-F421 PolarHBondContact O-N 2.94Å; G419-Y442 PolarHBondContact N-OXT 3.27Å
420	R	95	Very high	96.5	Very high	106 Å²	106	23.9 Å²	23.9	40%	0.4	13%	0.126	S	C	.	.	S	Bend	trans	-61.4	-37.7	179	176.3	169.4	174.8	163	1.8	113.6	A435 L436 Y439 K440 D441	R420-A435 CarbonylContact O-C 3.55Å; R420-A435 VanDerWaalsContact O-CA 3.28Å; R420-A435 WeakPolarHBondContact O-CA 3.31Å; R420-L436 PolarHBondContact O-N 3.33Å; R420-Y439 WeakPolarHBondContact CB-O 3.47Å; R420-Y439 WeakPolarHBondContact CG-O 3.39Å; R420-K440 VanDerWaalsContact CD-O 3.26Å; R420-K440 WeakPolarHBondContact CD-O 3.49Å; R420-K440 PolarHBondContact NH1-O 2.91Å; R420-D441 WeakPolarHBondContact CB-O 3.44Å; R420-D441 PolarHBondContact N-O 2.8Å; R420-D441 VanDerWaalsContact N-O 3.11Å
421	F	96.8	Very high	96.5	Very high	12 Å²	12	23.9 Å²	23.9	5%	0.053	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.6	-173.2	-59.2	-75.7	0	0	0	111.8	L125 F143 V164 F415 S416 G419 L433 Y434 A435 Y442	L125-F421 HydrophobicContact CD1-CD1 3.9Å; L125-F421 HydrophobicContact CD1-CE1 3.63Å; F143-F421 HydrophobicContact CE1-CB 3.91Å; F143-F421 HydrophobicContact CZ-CB 3.73Å; V164-F421 HydrophobicContact CG1-CD1 4.42Å; V164-F421 HydrophobicContact CG1-CD2 3.88Å; V164-F421 HydrophobicContact CG1-CE1 4.5Å; V164-F421 HydrophobicContact CG1-CE2 3.98Å; V164-F421 HydrophobicContact CG1-CG 4.1Å; V164-F421 HydrophobicContact CG1-CZ 4.28Å; F415-F421 CarbonylContact C-O 3.51Å; F415-F421 WeakPolarHBondContact CA-O 3.32Å; S416-F421 PolarHBondContact N-O 3.1Å; S416-F421 WeakPolarHBondContact OG-CB 3.4Å; S416-F421 PolarHBondContact OG-N 2.88Å; S416-F421 PolarHBondContact OG-O 3.26Å; G419-F421 VanDerWaalsContact C-N 3.31Å; G419-F421 PolarHBondContact O-N 2.94Å; F421-L433 HydrophobicContact CB-CD1 3.99Å; F421-L433 HydrophobicContact CD1-CD1 4.21Å; F421-L433 HydrophobicContact CD1-CD2 4.17Å; F421-L433 HydrophobicContact CD1-CG 4.24Å; F421-L433 HydrophobicContact CE1-CD2 4.49Å; F421-L433 HydrophobicContact CG-CD1 4.42Å; F421-Y434 WeakPolarHBondContact CA-O 3.44Å; F421-A435 HydrophobicContact CD1-CB 4.3Å; F421-A435 HydrophobicContact CE1-CB 4.29Å; F421-Y442 HydrophobicContact CD2-CD2 4.04Å; F421-Y442 HydrophobicContact CE2-CD2 4.2Å
422	L	97.3	Very high	96.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.8	166.3	170.5	62	0	0	0	108	L388 F400 F415 V424 Y434	L388-L422 HydrophobicContact CD2-CD2 4.1Å; F400-L422 HydrophobicContact CE1-CD2 4.17Å; F400-L422 HydrophobicContact CE2-CD2 4.36Å; F400-L422 HydrophobicContact CZ-CD2 3.67Å; F415-L422 HydrophobicContact CD1-CB 3.97Å; F415-L422 HydrophobicContact CD1-CD1 4.03Å; F415-L422 HydrophobicContact CE1-CB 3.75Å; F415-L422 HydrophobicContact CE1-CD1 3.73Å; F415-L422 HydrophobicContact CE1-CD2 4.24Å; F415-L422 HydrophobicContact CE1-CG 4.1Å; F415-L422 HydrophobicContact CE2-CD1 4.37Å; F415-L422 HydrophobicContact CG-CD1 4.48Å; F415-L422 HydrophobicContact CZ-CD1 3.92Å; F415-L422 HydrophobicContact CZ-CD2 4.48Å; L422-V424 HydrophobicContact CD1-CG2 4.35Å; L422-V424 HydrophobicContact CD2-CG2 4.42Å; L422-V424 HydrophobicContact CG-CG2 4.14Å; L422-Y434 PolarHBondContact N-O 3.01Å; L422-Y434 PolarHBondContact O-N 3.33Å
423	C	98	Very high	96.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.8	170.3	-169.7	0	0	0	0	110.2	F143 L150 I413 G414 A432 L433	F143-C423 HydrophobicContact CE2-CB 3.61Å; F143-C423 HydrophobicContact CZ-CB 3.74Å; L150-C423 HydrophobicContact CD1-CB 3.44Å; L150-C423 VanDerWaalsContact CD1-CB 3.44Å; I413-C423 CarbonylContact C-O 3.52Å; I413-C423 WeakPolarHBondContact CA-O 3.34Å; G414-C423 PolarHBondContact N-O 3.38Å; G414-C423 PolarHBondContact O-N 2.92Å; C423-A432 CarbonylContact C-O 3.54Å; C423-A432 VanDerWaalsContact CA-O 3.32Å; C423-A432 WeakPolarHBondContact CA-O 3.49Å; C423-L433 HydrophobicContact CB-CD1 4.34Å
424	V	98.4	Very high	96.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	107.6	174.5	-174.5	0	0	0	0	109.5	V386 L407 P410 S412 I413 L422 A432 Y434	V386-V424 HydrophobicContact CG2-CG1 4.17Å; L407-V424 HydrophobicContact CD1-CB 4.47Å; L407-V424 HydrophobicContact CD1-CG1 4.37Å; L407-V424 HydrophobicContact CD2-CG1 3.96Å; P410-V424 HydrophobicContact CB-CG1 3.49Å; P410-V424 VanDerWaalsContact CB-CG1 3.49Å; S412-V424 CarbonylContact O-C 3.48Å; S412-V424 WeakPolarHBondContact O-CA 3.26Å; I413-V424 HydrophobicContact CG2-CG1 4.22Å; I413-V424 HydrophobicContact CG2-CG2 4.25Å; L422-V424 HydrophobicContact CD1-CG2 4.35Å; L422-V424 HydrophobicContact CD2-CG2 4.42Å; L422-V424 HydrophobicContact CG-CG2 4.14Å; V424-A432 HydrophobicContact CB-CB 4.37Å; V424-A432 PolarHBondContact N-O 3.4Å; V424-A432 PolarHBondContact O-N 3.28Å; V424-Y434 HydrophobicContact CG2-CD2 4.47Å; V424-Y434 HydrophobicContact CG2-CE2 4.2Å
425	G	98.1	Very high	96.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	143.4	169.6	0	0	0	0	0	110.5	P410 T411 S412	P410-G425 CarbonylContact C-O 3.51Å; P410-G425 WeakPolarHBondContact CA-O 3.21Å; T411-G425 PolarHBondContact N-O 3.38Å; T411-G425 PolarHBondContact OG1-O 2.82Å; S412-G425 PolarHBondContact N-O 3.26Å; S412-G425 PolarHBondContact O-N 3.39Å
426	Q	98	Very high	96.1	Very high	7 Å²	7	20.5 Å²	20.5	3%	0.033	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	158	-176	-64.2	167.1	72.8	0	0	112	I138 L407 N408 K409 T411 N428 G429 R430	I138-Q426 PolarHBondContact N-O 3.06Å; L407-Q426 VanDerWaalsContact CD1-CD 3.49Å; L407-Q426 HydrophobicContact CD1-CG 3.86Å; L407-Q426 HydrophobicContact CG-CG 4.44Å; N408-Q426 HydrophobicContact CB-CB 4.35Å; N408-Q426 HydrophobicContact CB-CG 4.44Å; K409-Q426 VanDerWaalsContact O-CA 3.31Å; K409-Q426 WeakPolarHBondContact O-CA 3.4Å; T411-Q426 VanDerWaalsContact OG1-C 3.28Å; Q426-N428 VanDerWaalsContact CB-OD1 3.25Å; Q426-N428 WeakPolarHBondContact CB-OD1 3.35Å; Q426-N428 PolarHBondContact O-N 3.26Å; Q426-G429 PolarHBondContact O-N 2.71Å; Q426-G429 VanDerWaalsContact O-N 3.09Å; Q426-R430 VanDerWaalsContact CB-O 3.3Å; Q426-R430 WeakPolarHBondContact CB-O 3.43Å; Q426-R430 PolarHBondContact N-O 3.08Å; Q426-R430 PolarHBondContact NE2-O 3.17Å
427	C	96.5	Very high	95.7	Very high	45 Å²	45	24.6 Å²	24.6	30%	0.304	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.3	178.1	69	0	0	0	0	114	S137 N408 K409 T411 G429	S137-C427 VanDerWaalsContact CA-O 3.3Å; S137-C427 WeakPolarHBondContact CA-O 3.49Å; S137-C427 PolarHBondContact N-O 2.98Å; N408-C427 PolarHBondContact OD1-SG 3.02Å; K409-C427 HydrophobicContact CB-CB 4.24Å; K409-C427 PolarHBondContact O-N 3.32Å; T411-C427 HydrophobicContact CG2-CB 3.82Å; C427-G429 VanDerWaalsContact C-N 3.27Å; C427-G429 PolarHBondContact O-N 3.32Å
428	N	95.4	Very high	95.4	Very high	63 Å²	63	25 Å²	25	34%	0.337	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	7.3	177.5	68.6	0.9	0	0	0	113.6	Q426 R430	Q426-N428 VanDerWaalsContact CB-OD1 3.25Å; Q426-N428 WeakPolarHBondContact CB-OD1 3.35Å; Q426-N428 PolarHBondContact O-N 3.26Å; N428-R430 WeakPolarHBondContact OD1-CB 3.15Å; N428-R430 PolarHBondContact OD1-N 2.76Å; N428-R430 VanDerWaalsContact OD1-N 3.11Å
429	G	95.5	Very high	95.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	82.5	9.5	178.2	0	0	0	0	0	115.5	N129 S134 A136 Q426 C427	N129-G429 PolarHBondContact ND2-O 3.42Å; S134-G429 PolarHBondContact N-O 3.24Å; A136-G429 WeakPolarHBondContact O-CA 3.13Å; Q426-G429 PolarHBondContact O-N 2.71Å; Q426-G429 VanDerWaalsContact O-N 3.09Å; C427-G429 VanDerWaalsContact C-N 3.27Å; C427-G429 PolarHBondContact O-N 3.32Å
430	R	97.2	Very high	94.9	Very high	105 Å²	105	31.6 Å²	31.6	40%	0.396	15%	0.153	S	C	.	.			trans	-94	139.5	173.7	-63.6	-175.2	-177.5	-174.7	1.2	111.9	I138 Q426 N428	I138-R430 VanDerWaalsContact CD1-C 3.46Å; I138-R430 WeakPolarHBondContact CD1-O 3.11Å; Q426-R430 VanDerWaalsContact CB-O 3.3Å; Q426-R430 WeakPolarHBondContact CB-O 3.43Å; Q426-R430 PolarHBondContact N-O 3.08Å; Q426-R430 PolarHBondContact NE2-O 3.17Å; N428-R430 WeakPolarHBondContact OD1-CB 3.15Å; N428-R430 PolarHBondContact OD1-N 2.76Å; N428-R430 VanDerWaalsContact OD1-N 3.11Å
431	A	97.4	Very high	94.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	98.7	174.3	0	0	0	0	0	110	D127 V128 N129 I138 T152 L433	D127-A431 CarbonylContact C-O 3.08Å; D127-A431 VanDerWaalsContact CA-O 3.26Å; D127-A431 WeakPolarHBondContact CA-O 3.45Å; V128-A431 HydrophobicContact CB-CB 4.28Å; V128-A431 PolarHBondContact N-O 3.5Å; N129-A431 HydrophobicContact CB-CB 4.27Å; N129-A431 PolarHBondContact OD1-N 3.27Å; I138-A431 HydrophobicContact CD1-CB 3.89Å; T152-A431 HydrophobicContact CG2-CB 4.06Å; A431-L433 PolarHBondContact O-N 3.31Å
432	A	96.6	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.1	-178.2	0	0	0	0	0	111.1	R124 L407 C423 V424 Y434	R124-A432 VanDerWaalsContact CZ-CB 3.41Å; R124-A432 VanDerWaalsContact NH1-C 3.34Å; R124-A432 VanDerWaalsContact NH1-CB 3.29Å; R124-A432 VanDerWaalsContact NH2-CB 3.29Å; L407-A432 HydrophobicContact CD1-CB 3.52Å; C423-A432 CarbonylContact C-O 3.54Å; C423-A432 VanDerWaalsContact CA-O 3.32Å; C423-A432 WeakPolarHBondContact CA-O 3.49Å; V424-A432 HydrophobicContact CB-CB 4.37Å; V424-A432 PolarHBondContact N-O 3.4Å; V424-A432 PolarHBondContact O-N 3.28Å; A432-Y434 HydrophobicContact CB-CE2 3.74Å
433	L	96.9	Very high	93.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.1	171.8	-163.2	63.2	0	0	0	112.1	R124 L125 S126 V128 F143 V164 F421 C423 A431	R124-L433 PolarHBondContact NH1-O 2.83Å; L125-L433 HydrophobicContact CB-CB 4.07Å; L125-L433 HydrophobicContact CB-CD2 4.1Å; L125-L433 HydrophobicContact CB-CG 4.19Å; L125-L433 HydrophobicContact CD1-CD2 3.81Å; L125-L433 HydrophobicContact CD1-CG 4.06Å; L125-L433 PolarHBondContact N-O 3.41Å; S126-L433 WeakPolarHBondContact O-CB 3.33Å; V128-L433 HydrophobicContact CG2-CB 3.62Å; V128-L433 HydrophobicContact CG2-CD1 3.69Å; V128-L433 HydrophobicContact CG2-CD2 4.04Å; V128-L433 HydrophobicContact CG2-CG 3.97Å; F143-L433 HydrophobicContact CE1-CD1 4.43Å; F143-L433 HydrophobicContact CZ-CD1 3.94Å; V164-L433 HydrophobicContact CG1-CD2 4.43Å; F421-L433 HydrophobicContact CB-CD1 3.99Å; F421-L433 HydrophobicContact CD1-CD1 4.21Å; F421-L433 HydrophobicContact CD1-CD2 4.17Å; F421-L433 HydrophobicContact CD1-CG 4.24Å; F421-L433 HydrophobicContact CE1-CD2 4.49Å; F421-L433 HydrophobicContact CG-CD1 4.42Å; C423-L433 HydrophobicContact CB-CD1 4.34Å; A431-L433 PolarHBondContact O-N 3.31Å
434	Y	96.1	Very high	93.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.9	172	-59.4	-92.5	0	0	0	109.5	V122 K123 R124 F400 V404 F421 L422 V424 A432	V122-Y434 HydrophobicContact CG1-CD1 3.85Å; V122-Y434 HydrophobicContact CG1-CG 4.23Å; K123-Y434 CarbonylContact O-C 3.56Å; K123-Y434 WeakPolarHBondContact O-CA 3.16Å; R124-Y434 HydrophobicContact CG-CE1 4.46Å; F400-Y434 AromaticContact CE2-CD1 3.85Å; F400-Y434 HydrophobicContact CE2-CD1 3.85Å; F400-Y434 HydrophobicContact CE2-CD2 4.26Å; F400-Y434 AromaticContact CE2-CE1 3.85Å; F400-Y434 HydrophobicContact CE2-CE1 3.85Å; F400-Y434 HydrophobicContact CE2-CE2 4.3Å; F400-Y434 HydrophobicContact CE2-CG 4.05Å; F400-Y434 HydrophobicContact CZ-CD2 4.48Å; F400-Y434 HydrophobicContact CZ-CE2 4.42Å; V404-Y434 HydrophobicContact CB-CD1 4.46Å; V404-Y434 HydrophobicContact CB-CE1 4.08Å; V404-Y434 HydrophobicContact CG1-CD1 3.67Å; V404-Y434 HydrophobicContact CG1-CE1 3.68Å; F421-Y434 WeakPolarHBondContact CA-O 3.44Å; L422-Y434 PolarHBondContact N-O 3.01Å; L422-Y434 PolarHBondContact O-N 3.33Å; V424-Y434 HydrophobicContact CG2-CD2 4.47Å; V424-Y434 HydrophobicContact CG2-CE2 4.2Å; A432-Y434 HydrophobicContact CB-CE2 3.74Å
435	A	94.8	Very high	93	Very high	12 Å²	12	38.4 Å²	38.4	10%	0.099	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.8	168.1	0	0	0	0	0	110.4	V122 K123 L125 R420 F421	V122-A435 CarbonylContact C-O 3.52Å; V122-A435 WeakPolarHBondContact CA-O 3.42Å; K123-A435 PolarHBondContact N-O 3.06Å; K123-A435 PolarHBondContact O-N 3.34Å; L125-A435 HydrophobicContact CD1-CB 3.69Å; L125-A435 HydrophobicContact CG-CB 4.2Å; R420-A435 CarbonylContact O-C 3.55Å; R420-A435 VanDerWaalsContact O-CA 3.28Å; R420-A435 WeakPolarHBondContact O-CA 3.31Å; F421-A435 HydrophobicContact CD1-CB 4.3Å; F421-A435 HydrophobicContact CE1-CB 4.29Å
436	L	93.9	Very high	92.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.4	170.8	-58.3	-174.7	0	0	0	108.1	I120 G121 V122 I374 L388 F415 R420 H438 Y439	I120-L436 HydrophobicContact CD1-CD2 4.16Å; G121-L436 CarbonylContact O-C 3.42Å; G121-L436 WeakPolarHBondContact O-CA 3.2Å; V122-L436 HydrophobicContact CB-CD2 4.38Å; V122-L436 HydrophobicContact CG1-CD2 4.12Å; V122-L436 HydrophobicContact CG2-CD2 3.67Å; I374-L436 HydrophobicContact CD1-CD1 4.28Å; L388-L436 HydrophobicContact CD1-CD2 4.18Å; F415-L436 HydrophobicContact CE1-CD1 3.92Å; R420-L436 PolarHBondContact O-N 3.33Å; L436-H438 PolarHBondContact O-N 3.22Å; L436-Y439 HydrophobicContact CB-CD2 3.8Å; L436-Y439 HydrophobicContact CB-CE2 4.46Å; L436-Y439 HydrophobicContact CD1-CD2 3.87Å; L436-Y439 HydrophobicContact CD1-CE2 3.97Å; L436-Y439 PolarHBondContact O-N 3.04Å
437	S	89.9	Confident	92.3	Very high	86 Å²	86	42.8 Å²	42.8	60%	0.601	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.1	-173.8	63.3	0	0	0	0	113.7	G121 Y439	G121-S437 VanDerWaalsContact CA-OG 3.29Å; G121-S437 WeakPolarHBondContact CA-OG 3.46Å; G121-S437 PolarHBondContact O-N 3.11Å; G121-S437 PolarHBondContact O-OG 3.25Å; S437-Y439 VanDerWaalsContact C-N 3.32Å
438	H	86.9	Confident	92.1	Very high	59 Å²	59	42.7 Å²	42.7	27%	0.273	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.2	177.8	-172.9	-86.6	0	0	0	112	E112 L114 L436	E112-H438 PolarHBondContact O-CE1 3.19Å; E112-H438 PolarHBondContact O-NE2 3.21Å; L114-H438 HydrophobicContact CD2-CB 4.1Å; L114-H438 PolarHBondContact N-NE2 3.14Å; L436-H438 PolarHBondContact O-N 3.22Å
439	Y	89.7	Confident	91.8	Very high	21 Å²	21	41.2 Å²	41.2	8%	0.082	20%	0.203	C	C	.	.			trans	-102.9	123.9	179.6	-52.1	-71.6	0	0	0	110.9	H369 S371 E373 I374 R420 L436 S437	H369-Y439 AromaticContact CE1-CD1 3.58Å; H369-Y439 AromaticContact CE1-CD2 3.52Å; H369-Y439 AromaticContact CE1-CE1 3.4Å; H369-Y439 VanDerWaalsContact CE1-CE1 3.4Å; H369-Y439 WeakPolarHBondContact CE1-CE1 3.36Å; H369-Y439 AromaticContact CE1-CE2 3.35Å; H369-Y439 WeakPolarHBondContact CE1-CE2 3.5Å; H369-Y439 AromaticContact CE1-CG 3.64Å; H369-Y439 AromaticContact CE1-CZ 3.29Å; H369-Y439 AromaticContact ND1-CZ 3.73Å; H369-Y439 AromaticContact NE2-CD2 3.34Å; H369-Y439 VanDerWaalsContact NE2-CD2 3.34Å; H369-Y439 WeakPolarHBondContact NE2-CD2 3.44Å; H369-Y439 AromaticContact NE2-CE2 3.38Å; H369-Y439 WeakPolarHBondContact NE2-CE2 3.35Å; H369-Y439 AromaticContact NE2-CG 3.78Å; H369-Y439 AromaticContact NE2-CZ 3.84Å; S371-Y439 PolarHBondContact OG-OH 3.19Å; E373-Y439 VanDerWaalsContact OE2-CE1 3.26Å; E373-Y439 WeakPolarHBondContact OE2-CE1 3.41Å; E373-Y439 PolarHBondContact OE2-OH 3.37Å; I374-Y439 HydrophobicContact CD1-CE2 3.75Å; R420-Y439 WeakPolarHBondContact CB-O 3.47Å; R420-Y439 WeakPolarHBondContact CG-O 3.39Å; L436-Y439 HydrophobicContact CB-CD2 3.8Å; L436-Y439 HydrophobicContact CB-CE2 4.46Å; L436-Y439 HydrophobicContact CD1-CD2 3.87Å; L436-Y439 HydrophobicContact CD1-CE2 3.97Å; L436-Y439 PolarHBondContact O-N 3.04Å; S437-Y439 VanDerWaalsContact C-N 3.32Å
440	K	83.7	Confident	91.6	Very high	146 Å²	146	44.4 Å²	44.4	64%	0.635	22%	0.218	S	C	*	.			trans	-91.5	-24.8	-174.4	-65.6	-179.1	-178.4	174.6	0	113.2	R420	R420-K440 VanDerWaalsContact CD-O 3.26Å; R420-K440 WeakPolarHBondContact CD-O 3.49Å; R420-K440 PolarHBondContact NH1-O 2.91Å
441	D	84.8	Confident	91.1	Very high	117 Å²	117	39.3 Å²	39.3	63%	0.626	20%	0.203	S	C	*	.			trans	-94.8	146.1	-170	-64.6	-33.8	0	0	0	112.9	G418 R420	G418-D441 CarbonylContact C-O 3.58Å; R420-D441 WeakPolarHBondContact CB-O 3.44Å; R420-D441 PolarHBondContact N-O 2.8Å; R420-D441 VanDerWaalsContact N-O 3.11Å
442	Y	82.3	Confident	90.5	Very high	30 Å²	30	42.9 Å²	42.9	12%	0.118	22%	0.222	C	C	.	.			trans	-59.5	0	174.7	167.2	-96.4	0	0	0	109.7	F143 N144 H147 R148 M149 V164 S416 P417 G418 G419 F421	F143-Y442 AromaticContact CD1-CE2 3.73Å; F143-Y442 HydrophobicContact CD1-CE2 3.73Å; F143-Y442 HydrophobicContact CE1-CE2 4.34Å; N144-Y442 PolarHBondContact N-OH 3.36Å; N144-Y442 WeakPolarHBondContact O-CE1 3.3Å; N144-Y442 PolarHBondContact O-OH 3.37Å; H147-Y442 WeakPolarHBondContact O-CE1 3.44Å; H147-Y442 PolarHBondContact O-OH 3.38Å; R148-Y442 HydrophobicContact CB-CD2 4.28Å; R148-Y442 HydrophobicContact CB-CE2 4.24Å; R148-Y442 HydrophobicContact CG-CD1 4.14Å; R148-Y442 HydrophobicContact CG-CD2 3.89Å; R148-Y442 HydrophobicContact CG-CE1 4.5Å; R148-Y442 HydrophobicContact CG-CE2 4.29Å; R148-Y442 HydrophobicContact CG-CG 3.82Å; M149-Y442 PolarHBondContact N-OH 3.44Å; M149-Y442 PolarHBondContact O-OH 3.09Å; V164-Y442 HydrophobicContact CB-CE2 4.01Å; V164-Y442 HydrophobicContact CG1-CD2 4.44Å; V164-Y442 HydrophobicContact CG1-CE2 4.23Å; V164-Y442 HydrophobicContact CG2-CE2 4.29Å; S416-Y442 VanDerWaalsContact C-OXT 3.25Å; S416-Y442 WeakPolarHBondContact CB-OXT 3.24Å; S416-Y442 PolarHBondContact OG-OXT 2.85Å; P417-Y442 WeakPolarHBondContact CD-OXT 3.37Å; P417-Y442 HydrophobicContact CG-CD1 4.13Å; P417-Y442 HydrophobicContact CG-CE1 3.69Å; G418-Y442 VanDerWaalsContact CA-O 3.28Å; G418-Y442 WeakPolarHBondContact CA-O 3.28Å; G418-Y442 PolarHBondContact N-O 3.11Å; G418-Y442 PolarHBondContact N-OXT 3.16Å; G419-Y442 PolarHBondContact N-OXT 3.27Å; F421-Y442 HydrophobicContact CD2-CD2 4.04Å; F421-Y442 HydrophobicContact CE2-CD2 4.2Å

Retrieved 442 of 442 residues in 78.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).