A0A087Y534_POEFO Loading...

Plasminogen activator, tissue type

AlphaFold DB , UniProt , Accession A0A087Y534, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 608 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.5	Very low	27.1	Very low	232 Å²	232	157.2 Å²	157.2	100%	1.143	86%	0.859	S	S	*	*				0	87.4	0	-74.7	165.3	70.5	0	0	107.2
2	M	28.8	Very low	27.4	Very low	190 Å²	190	153.8 Å²	153.8	94%	0.936	86%	0.855	S	S	*	*				74.9	100.5	110.8	-78.1	178.2	85.7	0	0	113.6
3	S	24.3	Very low	27.6	Very low	107 Å²	107	148.7 Å²	148.7	75%	0.748	85%	0.845	S	S	*	*				-175	151	119.8	-159.7	0	0	0	0	112.1
4	L	27.1	Very low	27.5	Very low	160 Å²	160	150.1 Å²	150.1	84%	0.838	85%	0.848	S	S	*	*			trans	77.7	109.4	159.9	-70.8	133.9	0	0	0	119.6
5	C	23.7	Very low	27.4	Very low	131 Å²	131	148.4 Å²	148.4	89%	0.885	85%	0.847	S	S	*	*			trans	-125.5	108.1	161.6	-153.1	0	0	0	0	108.7
6	Q	28.9	Very low	27.6	Very low	194 Å²	194	146.8 Å²	146.8	91%	0.907	85%	0.846	S	S	*	*			trans	-144	127.7	158.7	-93.4	-173.4	-17.4	0	0	106.8
7	G	25.4	Very low	27.7	Very low	82 Å²	82	145.1 Å²	145.1	85%	0.845	84%	0.843	S	S	*	*			trans	-178.8	104.4	-179	0	0	0	0	0	112.8
8	I	26.2	Very low	27.9	Very low	148 Å²	148	146.6 Å²	146.6	76%	0.759	85%	0.846	S	S	*	*			trans	-82.5	155	-171.9	-79.4	167.1	0	0	0	114.2
9	F	27.2	Very low	28.2	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.803	85%	0.846	S	S	*	*			trans	62.3	124.5	157.3	-78.9	-59.1	0	0	0	122.5
10	L	26.8	Very low	28.5	Very low	154 Å²	154	144.8 Å²	144.8	81%	0.806	85%	0.845	S	S	*	*				165.9	159.7	94.7	-110.4	138.7	0	0	0	114.2
11	L	29.9	Very low	29.2	Very low	148 Å²	148	145.3 Å²	145.3	78%	0.775	85%	0.845	S	S	*	*			trans	-66.2	155.4	-173	-71.8	98.4	0	0	0	117
12	S	30.6	Very low	29.9	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	82%	0.82	S	S	*	*				164.8	136.7	106.9	51.9	0	0	0	0	115.8
13	A	29.9	Very low	30.5	Very low	87 Å²	87	135.8 Å²	135.8	72%	0.719	81%	0.812	S	S	*	*			trans	43.3	125.6	144.7	0	0	0	0	0	123.3
14	L	26.8	Very low	31.3	Very low	169 Å²	169	134.1 Å²	134.1	89%	0.885	79%	0.794	S	S	*	*				168.5	110.8	114.3	-97.4	145.7	0	0	0	112.4
15	C	26.6	Very low	32.4	Very low	124 Å²	124	133.6 Å²	133.6	84%	0.838	79%	0.792	S	S	*	*				169.7	112.2	120.4	-104.6	0	0	0	0	111.4
16	C	30.2	Very low	33.3	Very low	123 Å²	123	137.8 Å²	137.8	83%	0.831	79%	0.789	S	S	*	*			trans	-102.2	144.3	155.2	-87.8	0	0	0	0	107.9
17	C	29.6	Very low	33.9	Very low	118 Å²	118	132.8 Å²	132.8	80%	0.797	78%	0.775	S	S	*	*				171.6	138.9	119.7	-96.7	0	0	0	0	115.3
18	L	31.3	Very low	34.2	Very low	172 Å²	172	137.9 Å²	137.9	90%	0.901	77%	0.774	S	S	*	*			trans	87.9	104.7	151.2	-62.1	159.9	0	0	0	120.5
19	A	33.1	Very low	34.7	Very low	101 Å²	101	142.3 Å²	142.3	84%	0.835	78%	0.781	S	S	*	*				177.9	114.8	93.9	0	0	0	0	0	111.7
20	D	35.3	Very low	35.4	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	78%	0.784	S	S	*	*			trans	-95.3	156.5	171.7	-80.9	-51.9	0	0	0	111.6
21	N	43.3	Very low	35.9	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	77%	0.769	S	S	*	*			trans	113.9	88.7	157.1	-61.1	-41.3	0	0	0	118.5
22	V	43.9	Very low	36.3	Very low	105 Å²	105	134.9 Å²	134.9	64%	0.636	76%	0.762	S	S	*	*			trans	-135.3	126.3	146.3	-175.8	0	0	0	0	108.4	Y34	V22-Y34 HydrophobicContact CB-CD1 4.38Å; V22-Y34 HydrophobicContact CB-CE1 4.3Å; V22-Y34 HydrophobicContact CG1-CD1 3.66Å; V22-Y34 HydrophobicContact CG1-CE1 4.04Å
23	P	40.6	Very low	36.7	Very low	116 Å²	116	137 Å²	137	75%	0.753	76%	0.756	S	S	*	*			trans	-77.8	142	-171.2	29.9	-32.6	0	0	0	112.7
24	L	42.1	Very low	37.4	Very low	72 Å²	72	138.6 Å²	138.6	38%	0.377	75%	0.745	S	S	.	*			trans	-105.5	119	-168.5	-161	152.2	0	0	0	110	R32	L24-R32 HydrophobicContact CD1-CG 4.07Å
25	L	48.4	Very low	37.8	Very low	150 Å²	150	141.7 Å²	141.7	79%	0.785	75%	0.745	S	S	*	*			trans	-84.3	-31	-170.1	-83.6	153.1	0	0	0	114.8
26	R	43.7	Very low	38.4	Very low	219 Å²	219	139.1 Å²	139.1	83%	0.826	74%	0.74	S	S	*	*			trans	-169.2	158.1	170.1	-145.8	173.1	179.6	177.8	2.2	113.2
27	S	41.1	Very low	38.6	Very low	89 Å²	89	142.6 Å²	142.6	62%	0.622	74%	0.744	S	S	*	*			trans	-127	128.2	175	166.4	0	0	0	0	111.9
28	K	32.7	Very low	39.4	Very low	188 Å²	188	142.1 Å²	142.1	82%	0.817	74%	0.739	S	S	*	*	B	Isolated β-bridge	trans	-155.6	128.1	161.4	-137	179.6	-175.6	-178	0	110
29	R	35.3	Very low	39.6	Very low	242 Å²	242	141.5 Å²	141.5	91%	0.913	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.3	61.2	-177.9	-64.3	-174.6	-172.7	172.4	2.6	114.7	T31	R29-T31 VanDerWaalsContact C-N 3.28Å; R29-T31 PolarHBondContact O-N 2.7Å; R29-T31 PolarHBondContact O-OG1 3.44Å
30	G	42.8	Very low	39.5	Very low	84 Å²	84	148.8 Å²	148.8	87%	0.866	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.1	3.7	157.9	0	0	0	0	0	118
31	T	36.5	Very low	39.4	Very low	80 Å²	80	150.5 Å²	150.5	49%	0.491	75%	0.746	S	S	.	*	B	Isolated β-bridge	trans	-116.5	132.9	179.1	-42.7	0	0	0	0	110.7	R29 F33	R29-T31 VanDerWaalsContact C-N 3.28Å; R29-T31 PolarHBondContact O-N 2.7Å; R29-T31 PolarHBondContact O-OG1 3.44Å; T31-F33 HydrophobicContact CG2-CE2 4.22Å; T31-F33 HydrophobicContact CG2-CZ 4.13Å
32	R	39.1	Very low	39.4	Very low	165 Å²	165	148.8 Å²	148.8	62%	0.623	74%	0.743	S	S	*	*			trans	-109.5	135.2	176.4	-66.7	179.2	179.4	-158.5	0.5	109.6	L24 Y34	L24-R32 HydrophobicContact CD1-CG 4.07Å; R32-Y34 HydrophobicContact CB-CE2 3.78Å
33	F	39.3	Very low	38.8	Very low	160 Å²	160	148.4 Å²	148.4	70%	0.702	75%	0.751	S	S	*	*			trans	-111.8	132.1	178.6	-64.2	-89	0	0	0	110.3	T31	T31-F33 HydrophobicContact CG2-CE2 4.22Å; T31-F33 HydrophobicContact CG2-CZ 4.13Å
34	Y	44.1	Very low	38.5	Very low	121 Å²	121	154.3 Å²	154.3	48%	0.475	76%	0.758	S	S	.	*			trans	-124.9	147.4	177.2	-61.1	-84.6	0	0	0	109.7	V22 R32	V22-Y34 HydrophobicContact CB-CD1 4.38Å; V22-Y34 HydrophobicContact CB-CE1 4.3Å; V22-Y34 HydrophobicContact CG1-CD1 3.66Å; V22-Y34 HydrophobicContact CG1-CE1 4.04Å; R32-Y34 HydrophobicContact CB-CE2 3.78Å
35	R	35.6	Very low	38.4	Very low	234 Å²	234	163 Å²	163	88%	0.883	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.6	128.5	-177.8	-176.5	-175.4	-83.9	177.9	-5.7	110.1
36	G	37.8	Very low	37.6	Very low	71 Å²	71	161.4 Å²	161.4	73%	0.732	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-101.8	139	171.8	0	0	0	0	0	111.9
37	E	34.3	Very low	36.9	Very low	196 Å²	196	158.3 Å²	158.3	92%	0.916	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.9	147.4	168.3	-81	-166.3	166	0	0	112
38	P	48.3	Very low	36.2	Very low	107 Å²	107	160.7 Å²	160.7	70%	0.695	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-98.8	126.9	-176.9	35.7	-26.2	0	0	0	111.2
39	N	35.1	Very low	36.3	Very low	160 Å²	160	158.5 Å²	158.5	86%	0.856	78%	0.782	S	S	*	*			trans	162	106.4	139.8	-87.1	-30.7	0	0	0	112.2
40	R	30.3	Very low	36	Very low	254 Å²	254	151.7 Å²	151.7	96%	0.958	77%	0.767	S	S	*	*				-176.6	134.2	125.6	-102.4	173.1	-179.6	179.4	1	111.7
41	Q	33.4	Very low	35.4	Very low	191 Å²	191	156.1 Å²	156.1	89%	0.893	77%	0.765	S	S	*	*			trans	-74.9	170.6	-178	-96.2	-175.7	-7.2	0	0	113.9
42	P	42.9	Very low	35	Very low	121 Å²	121	159.6 Å²	159.6	79%	0.786	78%	0.78	S	S	*	*			trans	-101.4	145.5	-150.8	37.8	-31.6	0	0	0	113.8
43	A	32.2	Very low	34.8	Very low	96 Å²	96	161.3 Å²	161.3	79%	0.793	79%	0.792	S	S	*	*			trans	-150.3	128.1	161.2	0	0	0	0	0	113.3
44	R	34.3	Very low	34.2	Very low	240 Å²	240	162.1 Å²	162.1	91%	0.906	80%	0.795	S	S	*	*			trans	64.2	105.5	162.3	-70.1	-176.8	173.9	-177.4	-1.9	118.3	T46	R44-T46 PolarHBondContact O-N 2.82Å; R44-T46 VanDerWaalsContact O-N 3.12Å
45	R	38.7	Very low	33.6	Very low	255 Å²	255	162 Å²	162	96%	0.962	81%	0.81	S	S	*	*			trans	-61.4	102.1	162.1	-72.6	178.5	173.7	-178.7	-2.1	110
46	T	31.7	Very low	33.4	Very low	116 Å²	116	156.2 Å²	156.2	71%	0.712	81%	0.805	S	S	*	*			trans	-109.1	113.8	155.2	-53.1	0	0	0	0	106.6	R44 L48	R44-T46 PolarHBondContact O-N 2.82Å; R44-T46 VanDerWaalsContact O-N 3.12Å; T46-L48 VanDerWaalsContact C-N 3.31Å; T46-L48 PolarHBondContact O-N 3.36Å
47	L	30.5	Very low	33.4	Very low	155 Å²	155	156.9 Å²	156.9	81%	0.812	80%	0.796	S	S	*	*			trans	-79	82.8	-177	-136.6	142.6	0	0	0	108.6	I49	L47-I49 HydrophobicContact CD2-CD1 4.38Å; L47-I49 HydrophobicContact CD2-CG1 3.84Å; L47-I49 PolarHBondContact O-N 3.26Å
48	L	26.1	Very low	33.7	Very low	138 Å²	138	153.4 Å²	153.4	72%	0.723	79%	0.793	S	S	*	*			trans	-81.2	100.5	170.1	-124.5	138.1	0	0	0	107.3	T46 V50	T46-L48 VanDerWaalsContact C-N 3.31Å; T46-L48 PolarHBondContact O-N 3.36Å; L48-V50 HydrophobicContact CD2-CG2 3.54Å; L48-V50 PolarHBondContact O-N 3.07Å
49	I	33.2	Very low	33.3	Very low	143 Å²	143	155.7 Å²	155.7	73%	0.733	79%	0.793	S	S	*	*			trans	-73	82.3	170	-57.5	175.9	0	0	0	107	L47	L47-I49 HydrophobicContact CD2-CD1 4.38Å; L47-I49 HydrophobicContact CD2-CG1 3.84Å; L47-I49 PolarHBondContact O-N 3.26Å
50	V	29.2	Very low	33.5	Very low	99 Å²	99	157.1 Å²	157.1	60%	0.6	79%	0.794	S	S	*	*			trans	-82.8	112.9	162.2	-179.3	0	0	0	0	106.4	L48 L52	L48-V50 HydrophobicContact CD2-CG2 3.54Å; L48-V50 PolarHBondContact O-N 3.07Å; V50-L52 VanDerWaalsContact C-N 3.27Å; V50-L52 PolarHBondContact O-N 3.22Å
51	Q	31	Very low	34.4	Very low	177 Å²	177	149 Å²	149	83%	0.827	77%	0.773	S	S	*	*			trans	-57.6	91.2	166.4	-85.6	-114.2	-23.8	0	0	109.2	K53	Q51-K53 PolarHBondContact O-N 3.15Å
52	L	27.2	Very low	35.5	Very low	153 Å²	153	143.6 Å²	143.6	80%	0.801	76%	0.757	S	S	*	*			trans	-67.1	103.9	157.3	-76.4	166	0	0	0	106.2	V50 K54	V50-L52 VanDerWaalsContact C-N 3.27Å; V50-L52 PolarHBondContact O-N 3.22Å; L52-K54 PolarHBondContact O-N 3.04Å
53	K	35.1	Very low	36.8	Very low	201 Å²	201	141.9 Å²	141.9	87%	0.874	74%	0.737	S	S	*	*			trans	-52.2	96.4	165.7	-158.3	177.1	-172.3	179.9	0	106.2	Q51	Q51-K53 PolarHBondContact O-N 3.15Å
54	K	28.3	Very low	39	Very low	176 Å²	176	141.4 Å²	141.4	77%	0.765	72%	0.72	S	S	*	*			trans	-52.6	140.4	176.2	-86.9	-179.3	175.3	177.4	0	107.4	L52 S56	L52-K54 PolarHBondContact O-N 3.04Å; K54-S56 PolarHBondContact O-N 3.31Å
55	P	30.2	Very low	41.4	Very low	120 Å²	120	130 Å²	130	78%	0.779	68%	0.678	S	S	*	*			trans	-52.6	133.7	169	26.5	-32.7	0	0	0	106.4	P57	P55-P57 WeakPolarHBondContact O-CD 3.44Å
56	S	32.6	Very low	43.5	Very low	112 Å²	112	122 Å²	122	78%	0.783	66%	0.657	S	S	*	*			trans	-36.4	113	-178.1	-49	0	0	0	0	108.7	K54 S58	K54-S56 PolarHBondContact O-N 3.31Å; S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact O-N 3.15Å
57	P	36.8	Very low	45.7	Very low	85 Å²	85	116.5 Å²	116.5	55%	0.552	62%	0.623	S	S	*	*			trans	-58.9	113.8	159.7	17.6	-16.3	0	0	0	103.7	P55 F59	P55-P57 WeakPolarHBondContact O-CD 3.44Å; P57-F59 HydrophobicContact CB-CB 3.93Å; P57-F59 HydrophobicContact CB-CD2 3.22Å; P57-F59 HydrophobicContact CB-CE2 4.01Å; P57-F59 HydrophobicContact CB-CG 3.9Å; P57-F59 HydrophobicContact CG-CD2 4.43Å; P57-F59 PolarHBondContact O-N 3.22Å
58	S	40.4	Very low	48.1	Very low	122 Å²	122	112.8 Å²	112.8	85%	0.853	61%	0.61	S	S	*	*			trans	-62.6	59	144.8	58.3	0	0	0	0	107.4	S56	S56-S58 VanDerWaalsContact C-N 3.32Å; S56-S58 PolarHBondContact O-N 3.15Å
59	F	39.4	Very low	50.6	Low	155 Å²	155	111.4 Å²	111.4	68%	0.68	60%	0.6	S	S	*	*			trans	-87.9	98.6	154.9	-86.7	-115.4	0	0	0	101.7	P57 T61	P57-F59 HydrophobicContact CB-CB 3.93Å; P57-F59 HydrophobicContact CB-CD2 3.22Å; P57-F59 HydrophobicContact CB-CE2 4.01Å; P57-F59 HydrophobicContact CB-CG 3.9Å; P57-F59 HydrophobicContact CG-CD2 4.43Å; P57-F59 PolarHBondContact O-N 3.22Å; F59-T61 HydrophobicContact CB-CG2 4.35Å; F59-T61 PolarHBondContact O-N 3.05Å
60	E	41.1	Very low	52.4	Low	191 Å²	191	108.6 Å²	108.6	89%	0.893	59%	0.589	S	S	*	*			trans	-52.4	81.2	138.9	-73.5	179.2	157.5	0	0	106.1	S62	E60-S62 PolarHBondContact O-N 3.12Å
61	T	47.9	Very low	54.7	Low	83 Å²	83	108.1 Å²	108.1	51%	0.509	59%	0.591	S	S	.	*			trans	-65.6	93.4	155.7	27.3	0	0	0	0	102.3	F59 F63	F59-T61 HydrophobicContact CB-CG2 4.35Å; F59-T61 PolarHBondContact O-N 3.05Å; T61-F63 WeakPolarHBondContact O-CD2 3.48Å; T61-F63 PolarHBondContact O-N 2.92Å
62	S	56.6	Low	56.6	Low	78 Å²	78	100.7 Å²	100.7	55%	0.545	56%	0.559	S	S	.	*			trans	-57.3	99.4	170.4	57.1	0	0	0	0	105.2	E60 L64	E60-S62 PolarHBondContact O-N 3.12Å; S62-L64 PolarHBondContact O-N 3.5Å
63	F	69.8	Low	59.1	Low	84 Å²	84	97.3 Å²	97.3	37%	0.368	55%	0.545	S	S	.	.			trans	-66.3	109.5	173.6	-68	-70.7	0	0	0	105.6	T61 F76	T61-F63 WeakPolarHBondContact O-CD2 3.48Å; T61-F63 PolarHBondContact O-N 2.92Å; F63-F76 HydrophobicContact CB-CB 4.45Å; F63-F76 PolarHBondContact O-N 3.13Å
64	L	79.9	Confident	61.3	Low	86 Å²	86	91 Å²	91	45%	0.45	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.8	179.3	-62.3	172.3	0	0	0	108.4	S62 V73 R74	S62-L64 PolarHBondContact O-N 3.5Å; L64-V73 HydrophobicContact CB-CG1 3.9Å; L64-V73 HydrophobicContact CD1-CG1 3.88Å; L64-V73 HydrophobicContact CD2-CG1 3.97Å; L64-V73 HydrophobicContact CG-CG1 4.11Å; L64-R74 CarbonylContact C-O 3.49Å; L64-R74 WeakPolarHBondContact CA-O 3.41Å
65	C	84.3	Confident	63.8	Low	1 Å²	1	85.4 Å²	85.4	1%	0.007	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	144.9	166	-60.4	0	0	0	0	108.7	V73 R74 C93	C65-V73 CarbonylContact O-C 3.57Å; C65-V73 WeakPolarHBondContact O-CA 3.47Å; C65-R74 HydrophobicContact CB-CB 4.31Å; C65-R74 PolarHBondContact N-O 3.03Å; C65-R74 PolarHBondContact O-N 2.89Å; C65-C93 HydrophobicContact CB-CB 3.76Å; C65-C93 WeakPolarHBondContact CB-SG 3.29Å; C65-C93 PolarHBondContact N-SG 2.91Å; C65-C93 WeakPolarHBondContact SG-CA 3.37Å; C65-C93 WeakPolarHBondContact SG-CB 3.22Å; C65-C93 CovalentContact SG-SG 2.04Å; C65-C93 PolarHBondContact SG-SG 3.3Å
66	V	81.5	Confident	66.3	Low	86 Å²	86	85 Å²	85	52%	0.521	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119	169.7	-177.5	0	0	0	0	106.9	S68 A72	V66-S68 PolarHBondContact O-N 2.98Å; V66-A72 WeakPolarHBondContact CA-O 3.29Å
67	D	78.9	Confident	68.7	Low	1 Å²	1	82 Å²	82	1%	0.005	47%	0.471	C	S	.	.			trans	-62.5	120.9	176	-177.7	-10.5	0	0	0	109.5	E69 T70 S71 A72 W80 R82	D67-E69 PolarHBondContact O-N 3.21Å; D67-E69 PolarHBondContact OD1-N 3.29Å; D67-E69 VanDerWaalsContact OD1-N 3.09Å; D67-T70 WeakPolarHBondContact CB-OG1 3.17Å; D67-T70 PolarHBondContact OD2-OG1 2.86Å; D67-S71 WeakPolarHBondContact O-CA 3.45Å; D67-S71 PolarHBondContact O-N 3.3Å; D67-A72 HydrophobicContact CB-CB 4.24Å; D67-A72 PolarHBondContact N-O 3.48Å; D67-W80 HydrophobicContact CB-CZ2 4.2Å; D67-W80 PolarHBondContact OD2-NE1 3.12Å; D67-R82 WeakPolarHBondContact OD1-CD 3.25Å; D67-R82 IonicContact OD1-CZ 2.67Å; D67-R82 IonicContact OD1-NH1 3.71Å; D67-R82 PolarHBondContact OD1-NH1 3.23Å
68	S	79.7	Confident	70.8	Confident	77 Å²	77	80.8 Å²	80.8	54%	0.538	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.2	-175.9	49.4	0	0	0	0	114.6	V66 R82 E99	V66-S68 PolarHBondContact O-N 2.98Å; S68-R82 PolarHBondContact OG-NH1 2.64Å; S68-E99 PolarHBondContact N-OE2 2.82Å; S68-E99 PolarHBondContact OG-OE1 3.4Å
69	E	78.6	Confident	73.1	Confident	110 Å²	110	78.4 Å²	78.4	51%	0.514	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-40.8	179.9	-67.9	-66.4	161	0	0	112.4	D67	D67-E69 PolarHBondContact O-N 3.21Å; D67-E69 PolarHBondContact OD1-N 3.29Å; D67-E69 VanDerWaalsContact OD1-N 3.09Å
70	T	72.3	Confident	75.4	Confident	83 Å²	83	71.7 Å²	71.7	51%	0.509	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-7.9	-172.2	64.9	0	0	0	0	113.8	D67 A72	D67-T70 WeakPolarHBondContact CB-OG1 3.17Å; D67-T70 PolarHBondContact OD2-OG1 2.86Å; T70-A72 PolarHBondContact O-N 2.77Å; T70-A72 VanDerWaalsContact O-N 3.09Å; T70-A72 VanDerWaalsContact OG1-CB 3.24Å; T70-A72 WeakPolarHBondContact OG1-CB 3.46Å; T70-A72 PolarHBondContact OG1-N 3.08Å
71	S	76.9	Confident	77.6	Confident	90 Å²	90	63.5 Å²	63.5	63%	0.629	37%	0.373	S	S	*	.			trans	55.7	16.4	-168.5	-57.2	0	0	0	0	113.9	D67 V73	D67-S71 WeakPolarHBondContact O-CA 3.45Å; D67-S71 PolarHBondContact O-N 3.3Å; S71-V73 PolarHBondContact O-N 3.14Å
72	A	71.8	Confident	79.6	Confident	20 Å²	20	60 Å²	60	17%	0.165	35%	0.35	C	S	.	.			trans	-70.5	131.6	179.4	0	0	0	0	0	110.7	V66 D67 T70	V66-A72 WeakPolarHBondContact CA-O 3.29Å; D67-A72 HydrophobicContact CB-CB 4.24Å; D67-A72 PolarHBondContact N-O 3.48Å; T70-A72 PolarHBondContact O-N 2.77Å; T70-A72 VanDerWaalsContact O-N 3.09Å; T70-A72 VanDerWaalsContact OG1-CB 3.24Å; T70-A72 WeakPolarHBondContact OG1-CB 3.46Å; T70-A72 PolarHBondContact OG1-N 3.08Å
73	V	79	Confident	80.9	Confident	82 Å²	82	59.1 Å²	59.1	50%	0.497	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	127.2	176.2	-173.6	0	0	0	0	109.4	L64 C65 S71	L64-V73 HydrophobicContact CB-CG1 3.9Å; L64-V73 HydrophobicContact CD1-CG1 3.88Å; L64-V73 HydrophobicContact CD2-CG1 3.97Å; L64-V73 HydrophobicContact CG-CG1 4.11Å; C65-V73 CarbonylContact O-C 3.57Å; C65-V73 WeakPolarHBondContact O-CA 3.47Å; S71-V73 PolarHBondContact O-N 3.14Å
74	R	80.7	Confident	81.7	Confident	69 Å²	69	59.2 Å²	59.2	26%	0.26	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.9	-176	-58.1	-63.9	-174.3	-170.1	-0.7	110.3	L64 C65 D78 W80 C93	L64-R74 CarbonylContact C-O 3.49Å; L64-R74 WeakPolarHBondContact CA-O 3.41Å; C65-R74 HydrophobicContact CB-CB 4.31Å; C65-R74 PolarHBondContact N-O 3.03Å; C65-R74 PolarHBondContact O-N 2.89Å; R74-D78 WeakPolarHBondContact CA-OD2 3.41Å; R74-D78 HydrophobicContact CB-CB 4.07Å; R74-W80 HydrophobicContact CB-CH2 4.45Å; R74-W80 HydrophobicContact CB-CZ3 4.09Å; R74-W80 HydrophobicContact CG-CD2 4.28Å; R74-W80 HydrophobicContact CG-CE3 3.94Å; R74-W80 HydrophobicContact CG-CH2 4.07Å; R74-W80 HydrophobicContact CG-CZ2 4.37Å; R74-W80 HydrophobicContact CG-CZ3 3.84Å; R74-C93 HydrophobicContact CB-CB 4.47Å
75	S	81.2	Confident	81.9	Confident	59 Å²	59	58.8 Å²	58.8	41%	0.413	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	159.1	175.8	-60.3	0	0	0	0	111.4	G77 D78 C93	S75-G77 PolarHBondContact O-N 3.08Å; S75-D78 PolarHBondContact N-OD2 3.18Å; S75-D78 VanDerWaalsContact O-CB 3.23Å; S75-D78 WeakPolarHBondContact O-CB 3.31Å; S75-D78 VanDerWaalsContact O-CG 3.3Å; S75-D78 PolarHBondContact O-N 3.07Å; S75-C93 WeakPolarHBondContact O-CB 3.25Å
76	F	83.9	Confident	81.8	Confident	111 Å²	111	67.8 Å²	67.8	49%	0.487	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	129.2	172.3	173.4	-108	0	0	0	111.5	F63 D78 L95	F63-F76 HydrophobicContact CB-CB 4.45Å; F63-F76 PolarHBondContact O-N 3.13Å; F76-D78 VanDerWaalsContact C-N 3.32Å; F76-L95 HydrophobicContact CD2-CD2 4.19Å; F76-L95 HydrophobicContact CD2-CG 4.42Å; F76-L95 HydrophobicContact CE1-CD2 4.32Å; F76-L95 HydrophobicContact CE2-CB 4.21Å; F76-L95 HydrophobicContact CE2-CD2 3.52Å; F76-L95 HydrophobicContact CE2-CG 3.51Å; F76-L95 HydrophobicContact CZ-CD2 3.58Å; F76-L95 HydrophobicContact CZ-CG 3.81Å
77	G	81.7	Confident	82.2	Confident	48 Å²	48	71.2 Å²	71.2	50%	0.495	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	-10.8	-177.7	0	0	0	0	0	115.1	S75 C93	S75-G77 PolarHBondContact O-N 3.08Å; G77-C93 PolarHBondContact N-O 2.66Å
78	D	82.2	Confident	82.7	Confident	61 Å²	61	71.3 Å²	71.3	33%	0.326	40%	0.398	S	S	.	.			trans	-61.6	139.9	174.7	-74.5	-3.7	0	0	0	110.5	R74 S75 F76 H92 C93	R74-D78 WeakPolarHBondContact CA-OD2 3.41Å; R74-D78 HydrophobicContact CB-CB 4.07Å; S75-D78 PolarHBondContact N-OD2 3.18Å; S75-D78 VanDerWaalsContact O-CB 3.23Å; S75-D78 WeakPolarHBondContact O-CB 3.31Å; S75-D78 VanDerWaalsContact O-CG 3.3Å; S75-D78 PolarHBondContact O-N 3.07Å; F76-D78 VanDerWaalsContact C-N 3.32Å; D78-H92 CarbonylContact O-C 3.52Å; D78-H92 VanDerWaalsContact O-CA 3.22Å; D78-H92 WeakPolarHBondContact O-CA 3.48Å; D78-C93 PolarHBondContact O-N 3.08Å
79	T	87.4	Confident	83.3	Confident	72 Å²	72	68.4 Å²	68.4	44%	0.442	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	144.5	173.3	64.9	0	0	0	0	110.3	F90 C91 H92	T79-F90 HydrophobicContact CG2-CE1 4.22Å; T79-F90 HydrophobicContact CG2-CZ 3.94Å; T79-C91 CarbonylContact C-O 3.55Å; T79-C91 VanDerWaalsContact CA-O 3.26Å; T79-C91 WeakPolarHBondContact CA-O 3.49Å; T79-H92 HydrophobicContact CG2-CB 3.8Å
80	W	87.1	Confident	83.8	Confident	13 Å²	13	65.1 Å²	65.1	5%	0.049	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	158	177.9	69.1	104	0	0	0	111.8	D67 R74 C91 C93 E99	D67-W80 HydrophobicContact CB-CZ2 4.2Å; D67-W80 PolarHBondContact OD2-NE1 3.12Å; R74-W80 HydrophobicContact CB-CH2 4.45Å; R74-W80 HydrophobicContact CB-CZ3 4.09Å; R74-W80 HydrophobicContact CG-CD2 4.28Å; R74-W80 HydrophobicContact CG-CE3 3.94Å; R74-W80 HydrophobicContact CG-CH2 4.07Å; R74-W80 HydrophobicContact CG-CZ2 4.37Å; R74-W80 HydrophobicContact CG-CZ3 3.84Å; W80-C91 HydrophobicContact CD2-CB 3.68Å; W80-C91 HydrophobicContact CE3-CB 4.09Å; W80-C91 HydrophobicContact CG-CB 4.25Å; W80-C91 HydrophobicContact CH2-CB 3.92Å; W80-C91 HydrophobicContact CZ2-CB 3.51Å; W80-C91 HydrophobicContact CZ3-CB 4.19Å; W80-C91 PolarHBondContact N-O 3.2Å; W80-C91 PolarHBondContact O-N 2.93Å; W80-C93 HydrophobicContact CZ3-CB 4.16Å; W80-E99 HydrophobicContact CH2-CB 4.12Å; W80-E99 HydrophobicContact CZ2-CB 4.37Å
81	L	88.8	Confident	84.7	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.099	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	145.8	167.6	-68.5	171.4	0	0	0	108.9	V88 E89 F90 V104 A123 N128 I130	L81-V88 HydrophobicContact CB-CG1 4.19Å; L81-V88 HydrophobicContact CD2-CG1 3.87Å; L81-V88 HydrophobicContact CG-CG1 4.48Å; L81-E89 CarbonylContact C-O 3.58Å; L81-E89 WeakPolarHBondContact CA-O 3.47Å; L81-F90 HydrophobicContact CD2-CB 3.93Å; L81-F90 HydrophobicContact CD2-CD2 3.8Å; L81-F90 HydrophobicContact CD2-CG 4.34Å; L81-F90 HydrophobicContact CG-CD2 4.46Å; L81-V104 HydrophobicContact CD2-CG2 3.88Å; L81-A123 HydrophobicContact CD1-CB 4.31Å; L81-A123 HydrophobicContact CD2-CB 4.32Å; L81-N128 HydrophobicContact CD1-CB 3.74Å; L81-N128 WeakPolarHBondContact CD1-O 3.37Å; L81-N128 HydrophobicContact CG-CB 4.15Å; L81-I130 HydrophobicContact CB-CB 3.9Å; L81-I130 HydrophobicContact CB-CD1 4.11Å; L81-I130 HydrophobicContact CB-CG1 4.45Å; L81-I130 HydrophobicContact CB-CG2 4.41Å; L81-I130 HydrophobicContact CD1-CB 4.26Å; L81-I130 HydrophobicContact CD1-CG2 4.44Å; L81-I130 WeakPolarHBondContact O-CD1 3.38Å
82	R	88.4	Confident	85.3	Confident	9 Å²	9	59.8 Å²	59.8	3%	0.034	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155.5	169.5	70.6	175.5	-179.9	-157.6	-1.2	112.5	D67 S68 V88 E89 C91 E99 C101 I130	D67-R82 WeakPolarHBondContact OD1-CD 3.25Å; D67-R82 IonicContact OD1-CZ 2.67Å; D67-R82 IonicContact OD1-NH1 3.71Å; D67-R82 PolarHBondContact OD1-NH1 3.23Å; S68-R82 PolarHBondContact OG-NH1 2.64Å; R82-V88 WeakPolarHBondContact O-CA 3.31Å; R82-E89 HydrophobicContact CG-CB 4.13Å; R82-E89 IonicContact CZ-OE2 3.86Å; R82-E89 PolarHBondContact N-O 3.47Å; R82-E89 IonicContact NE-OE2 2.93Å; R82-E89 PolarHBondContact NE-OE2 2.99Å; R82-E89 IonicContact NH2-OE2 2.67Å; R82-E89 PolarHBondContact NH2-OE2 3.28Å; R82-E89 PolarHBondContact O-N 2.81Å; R82-C91 PolarHBondContact NE-SG 3.48Å; R82-E99 IonicContact CZ-OE1 3.35Å; R82-E99 IonicContact CZ-OE2 3.14Å; R82-E99 VanDerWaalsContact NH1-CD 3.28Å; R82-E99 IonicContact NH1-OE1 2.94Å; R82-E99 PolarHBondContact NH1-OE1 3.04Å; R82-E99 IonicContact NH1-OE2 2.76Å; R82-E99 PolarHBondContact NH1-OE2 2.63Å; R82-E99 IonicContact NH2-OE1 3.02Å; R82-E99 PolarHBondContact NH2-OE1 3.34Å; R82-C101 PolarHBondContact NH2-SG 3.24Å; R82-I130 VanDerWaalsContact CA-CD1 3.44Å
83	W	85.8	Confident	86.2	Confident	60 Å²	60	58.9 Å²	58.9	23%	0.227	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	136.7	169.9	-69.9	103.7	0	0	0	110.3	V88 K121 I130 Q132	W83-V88 HydrophobicContact CD2-CG2 4.07Å; W83-V88 HydrophobicContact CE3-CG2 3.65Å; W83-V88 HydrophobicContact CH2-CG2 3.84Å; W83-V88 HydrophobicContact CZ2-CG2 4.21Å; W83-V88 HydrophobicContact CZ3-CG2 3.53Å; W83-K121 HydrophobicContact CH2-CG 3.66Å; W83-K121 HydrophobicContact CZ2-CB 4.33Å; W83-K121 HydrophobicContact CZ2-CG 3.73Å; W83-I130 HydrophobicContact CG-CD1 4.03Å; W83-I130 HydrophobicContact CZ2-CG2 4.19Å; W83-Q132 HydrophobicContact CZ2-CB 3.98Å
84	K	86.3	Confident	86.5	Confident	87 Å²	87	55.6 Å²	55.6	38%	0.378	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	96.7	170.5	-169.8	176.6	-174.9	170	0	109.4	Q86 R87 E89	K84-Q86 PolarHBondContact O-N 2.63Å; K84-R87 PolarHBondContact N-O 2.88Å; K84-R87 PolarHBondContact O-N 3.43Å; K84-E89 HydrophobicContact CB-CG 4.42Å; K84-E89 VanDerWaalsContact CD-CD 3.4Å; K84-E89 HydrophobicContact CD-CG 4.37Å; K84-E89 WeakPolarHBondContact CD-OE1 3.16Å; K84-E89 IonicContact NZ-OE1 3.21Å; K84-E89 PolarHBondContact NZ-OE1 3.1Å; K84-E89 IonicContact NZ-OE2 3.37Å
85	G	83.6	Confident	86.5	Confident	76 Å²	76	57.9 Å²	57.9	78%	0.784	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	-120.5	-164.8	0	0	0	0	0	110.5
86	Q	82.3	Confident	86.3	Confident	191 Å²	191	64.6 Å²	64.6	89%	0.893	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	0.5	178.8	-65	-175.7	-6.1	0	0	114.4	K84	K84-Q86 PolarHBondContact O-N 2.63Å
87	R	89	Confident	85.9	Confident	157 Å²	157	60.5 Å²	60.5	59%	0.592	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	154.4	-177.7	-67.5	-178.7	-72.1	173.6	-3.7	110.8	K84 V103	K84-R87 PolarHBondContact N-O 2.88Å; K84-R87 PolarHBondContact O-N 3.43Å; R87-V103 HydrophobicContact CB-CG1 4.24Å; R87-V103 HydrophobicContact CG-CG1 4.5Å
88	V	90.3	Very high	85.9	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.3	172.6	-179.3	0	0	0	0	108.9	L81 R82 W83 V103 V104 V106 I130	L81-V88 HydrophobicContact CB-CG1 4.19Å; L81-V88 HydrophobicContact CD2-CG1 3.87Å; L81-V88 HydrophobicContact CG-CG1 4.48Å; R82-V88 WeakPolarHBondContact O-CA 3.31Å; W83-V88 HydrophobicContact CD2-CG2 4.07Å; W83-V88 HydrophobicContact CE3-CG2 3.65Å; W83-V88 HydrophobicContact CH2-CG2 3.84Å; W83-V88 HydrophobicContact CZ2-CG2 4.21Å; W83-V88 HydrophobicContact CZ3-CG2 3.53Å; V88-V103 WeakPolarHBondContact O-CA 3.48Å; V88-V104 HydrophobicContact CB-CG2 4.48Å; V88-V104 HydrophobicContact CG1-CG2 4.13Å; V88-V104 PolarHBondContact O-N 2.88Å; V88-V106 HydrophobicContact CB-CG1 3.72Å; V88-V106 HydrophobicContact CB-CG2 4.45Å; V88-V106 HydrophobicContact CG1-CG1 3.91Å; V88-V106 HydrophobicContact CG2-CG1 3.89Å; V88-V106 HydrophobicContact CG2-CG2 3.94Å; V88-I130 HydrophobicContact CG1-CG2 4.19Å; V88-I130 HydrophobicContact CG2-CG2 4.29Å
89	E	91.9	Very high	86.1	Confident	17 Å²	17	66.3 Å²	66.3	8%	0.079	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	137.7	172.1	-67.7	-177.4	160.4	0	0	109.9	L81 R82 K84 C101 H102 V103	L81-E89 CarbonylContact C-O 3.58Å; L81-E89 WeakPolarHBondContact CA-O 3.47Å; R82-E89 HydrophobicContact CG-CB 4.13Å; R82-E89 IonicContact CZ-OE2 3.86Å; R82-E89 PolarHBondContact N-O 3.47Å; R82-E89 IonicContact NE-OE2 2.93Å; R82-E89 PolarHBondContact NE-OE2 2.99Å; R82-E89 IonicContact NH2-OE2 2.67Å; R82-E89 PolarHBondContact NH2-OE2 3.28Å; R82-E89 PolarHBondContact O-N 2.81Å; K84-E89 HydrophobicContact CB-CG 4.42Å; K84-E89 VanDerWaalsContact CD-CD 3.4Å; K84-E89 HydrophobicContact CD-CG 4.37Å; K84-E89 WeakPolarHBondContact CD-OE1 3.16Å; K84-E89 IonicContact NZ-OE1 3.21Å; K84-E89 PolarHBondContact NZ-OE1 3.1Å; K84-E89 IonicContact NZ-OE2 3.37Å; E89-C101 HydrophobicContact CB-CB 4.26Å; E89-H102 CarbonylContact C-O 3.56Å; E89-H102 VanDerWaalsContact CA-O 3.23Å; E89-H102 WeakPolarHBondContact CA-O 3.24Å; E89-V103 HydrophobicContact CG-CG2 4.21Å
90	F	90.3	Very high	86.3	Confident	41 Å²	41	68 Å²	68	18%	0.18	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.8	162.9	-176.3	-83	0	0	0	108.6	T79 L81 C101 H102 V104	T79-F90 HydrophobicContact CG2-CE1 4.22Å; T79-F90 HydrophobicContact CG2-CZ 3.94Å; L81-F90 HydrophobicContact CD2-CB 3.93Å; L81-F90 HydrophobicContact CD2-CD2 3.8Å; L81-F90 HydrophobicContact CD2-CG 4.34Å; L81-F90 HydrophobicContact CG-CD2 4.46Å; F90-C101 VanDerWaalsContact O-CA 3.29Å; F90-C101 WeakPolarHBondContact O-CA 3.4Å; F90-H102 AromaticContact CD1-CE1 3.78Å; F90-H102 PolarHBondContact N-O 2.89Å; F90-H102 PolarHBondContact O-N 3.31Å; F90-H102 PolarHBondContact O-ND1 2.96Å; F90-V104 HydrophobicContact CB-CB 4.49Å; F90-V104 HydrophobicContact CB-CG1 3.55Å; F90-V104 HydrophobicContact CB-CG2 4.09Å
91	C	89.6	Confident	86.4	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.1	-175.8	-68.1	0	0	0	0	110.9	T79 W80 R82 Q100 C101	T79-C91 CarbonylContact C-O 3.55Å; T79-C91 VanDerWaalsContact CA-O 3.26Å; T79-C91 WeakPolarHBondContact CA-O 3.49Å; W80-C91 HydrophobicContact CD2-CB 3.68Å; W80-C91 HydrophobicContact CE3-CB 4.09Å; W80-C91 HydrophobicContact CG-CB 4.25Å; W80-C91 HydrophobicContact CH2-CB 3.92Å; W80-C91 HydrophobicContact CZ2-CB 3.51Å; W80-C91 HydrophobicContact CZ3-CB 4.19Å; W80-C91 PolarHBondContact N-O 3.2Å; W80-C91 PolarHBondContact O-N 2.93Å; R82-C91 PolarHBondContact NE-SG 3.48Å; C91-Q100 CarbonylContact C-O 3.54Å; C91-Q100 VanDerWaalsContact CA-O 3.29Å; C91-Q100 WeakPolarHBondContact CA-O 3.41Å; C91-C101 HydrophobicContact CB-CB 4.14Å; C91-C101 WeakPolarHBondContact CB-SG 3.25Å; C91-C101 WeakPolarHBondContact SG-CB 3.38Å; C91-C101 CovalentContact SG-SG 2.04Å; C91-C101 PolarHBondContact SG-SG 3.46Å
92	H	91	Very high	86.5	Confident	61 Å²	61	73.5 Å²	73.5	28%	0.282	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149	167.4	69.3	100.2	0	0	0	111.6	D78 T79 A94 Q100	D78-H92 CarbonylContact O-C 3.52Å; D78-H92 VanDerWaalsContact O-CA 3.22Å; D78-H92 WeakPolarHBondContact O-CA 3.48Å; T79-H92 HydrophobicContact CG2-CB 3.8Å; H92-A94 PolarHBondContact O-N 3.43Å; H92-Q100 PolarHBondContact CD2-O 3Å; H92-Q100 PolarHBondContact CE1-OE1 3.36Å; H92-Q100 PolarHBondContact N-O 3.05Å; H92-Q100 WeakPolarHBondContact NE2-CB 3.35Å; H92-Q100 PolarHBondContact NE2-OE1 2.82Å; H92-Q100 PolarHBondContact O-N 3.36Å
93	C	89.1	Confident	86.6	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.007	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	106.3	178.3	-174.6	0	0	0	0	110.1	C65 R74 S75 G77 D78 W80	C65-C93 HydrophobicContact CB-CB 3.76Å; C65-C93 WeakPolarHBondContact CB-SG 3.29Å; C65-C93 PolarHBondContact N-SG 2.91Å; C65-C93 WeakPolarHBondContact SG-CA 3.37Å; C65-C93 WeakPolarHBondContact SG-CB 3.22Å; C65-C93 CovalentContact SG-SG 2.04Å; C65-C93 PolarHBondContact SG-SG 3.3Å; R74-C93 HydrophobicContact CB-CB 4.47Å; S75-C93 WeakPolarHBondContact O-CB 3.25Å; G77-C93 PolarHBondContact N-O 2.66Å; D78-C93 PolarHBondContact O-N 3.08Å; W80-C93 HydrophobicContact CZ3-CB 4.16Å
94	A	86.5	Confident	86.8	Confident	13 Å²	13	74.3 Å²	74.3	11%	0.107	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	170.7	-177.5	0	0	0	0	0	112.5	H92 R96 G97 R98 Q100	H92-A94 PolarHBondContact O-N 3.43Å; A94-R96 PolarHBondContact O-N 3.15Å; A94-G97 PolarHBondContact O-N 2.93Å; A94-R98 WeakPolarHBondContact CB-O 3.2Å; A94-R98 PolarHBondContact N-O 3.2Å; A94-Q100 HydrophobicContact CB-CG 4.03Å
95	L	80.2	Confident	86.9	Confident	116 Å²	116	73.4 Å²	73.4	61%	0.607	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	140.9	175.8	-76	166	0	0	0	110.2	F76	F76-L95 HydrophobicContact CD2-CD2 4.19Å; F76-L95 HydrophobicContact CD2-CG 4.42Å; F76-L95 HydrophobicContact CE1-CD2 4.32Å; F76-L95 HydrophobicContact CE2-CB 4.21Å; F76-L95 HydrophobicContact CE2-CD2 3.52Å; F76-L95 HydrophobicContact CE2-CG 3.51Å; F76-L95 HydrophobicContact CZ-CD2 3.58Å; F76-L95 HydrophobicContact CZ-CG 3.81Å
96	R	77.6	Confident	87.1	Confident	200 Å²	200	71.8 Å²	71.8	76%	0.755	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	17.4	-176.2	-46.8	175.7	177.8	174.2	-0.9	115.8	A94 R98	A94-R96 PolarHBondContact O-N 3.15Å; R96-R98 PolarHBondContact O-N 3.47Å
97	G	74.9	Confident	87.3	Confident	25 Å²	25	67.2 Å²	67.2	26%	0.258	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	24.2	171.5	0	0	0	0	0	113.9	A94	A94-G97 PolarHBondContact O-N 2.93Å
98	R	81.6	Confident	87.1	Confident	174 Å²	174	65 Å²	65	66%	0.657	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.2	175.6	-68.4	-175.3	179.9	-176.5	-2	109.8	A94 R96	A94-R98 WeakPolarHBondContact CB-O 3.2Å; A94-R98 PolarHBondContact N-O 3.2Å; R96-R98 PolarHBondContact O-N 3.47Å
99	E	87.1	Confident	86.6	Confident	58 Å²	58	65.8 Å²	65.8	27%	0.271	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.6	167.3	65.3	173.2	-150.1	0	0	110.2	S68 W80 R82	S68-E99 PolarHBondContact N-OE2 2.82Å; S68-E99 PolarHBondContact OG-OE1 3.4Å; W80-E99 HydrophobicContact CH2-CB 4.12Å; W80-E99 HydrophobicContact CZ2-CB 4.37Å; R82-E99 IonicContact CZ-OE1 3.35Å; R82-E99 IonicContact CZ-OE2 3.14Å; R82-E99 VanDerWaalsContact NH1-CD 3.28Å; R82-E99 IonicContact NH1-OE1 2.94Å; R82-E99 PolarHBondContact NH1-OE1 3.04Å; R82-E99 IonicContact NH1-OE2 2.76Å; R82-E99 PolarHBondContact NH1-OE2 2.63Å; R82-E99 IonicContact NH2-OE1 3.02Å; R82-E99 PolarHBondContact NH2-OE1 3.34Å
100	Q	90.3	Very high	85.6	Confident	106 Å²	106	75.7 Å²	75.7	50%	0.495	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.9	170.9	-74.6	-175.2	-16.6	0	0	108.3	C91 H92 A94	C91-Q100 CarbonylContact C-O 3.54Å; C91-Q100 VanDerWaalsContact CA-O 3.29Å; C91-Q100 WeakPolarHBondContact CA-O 3.41Å; H92-Q100 PolarHBondContact CD2-O 3Å; H92-Q100 PolarHBondContact CE1-OE1 3.36Å; H92-Q100 PolarHBondContact N-O 3.05Å; H92-Q100 WeakPolarHBondContact NE2-CB 3.35Å; H92-Q100 PolarHBondContact NE2-OE1 2.82Å; H92-Q100 PolarHBondContact O-N 3.36Å; A94-Q100 HydrophobicContact CB-CG 4.03Å
101	C	90.7	Very high	84.7	Confident	43 Å²	43	76.6 Å²	76.6	29%	0.291	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	143.5	-173.2	-58.9	0	0	0	0	111.1	R82 E89 F90 C91	R82-C101 PolarHBondContact NH2-SG 3.24Å; E89-C101 HydrophobicContact CB-CB 4.26Å; F90-C101 VanDerWaalsContact O-CA 3.29Å; F90-C101 WeakPolarHBondContact O-CA 3.4Å; C91-C101 HydrophobicContact CB-CB 4.14Å; C91-C101 WeakPolarHBondContact CB-SG 3.25Å; C91-C101 WeakPolarHBondContact SG-CB 3.38Å; C91-C101 CovalentContact SG-SG 2.04Å; C91-C101 PolarHBondContact SG-SG 3.46Å
102	H	90	Very high	84.2	Confident	105 Å²	105	78.4 Å²	78.4	49%	0.486	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151.8	172.5	61.5	-81.6	0	0	0	110.3	E89 F90	E89-H102 CarbonylContact C-O 3.56Å; E89-H102 VanDerWaalsContact CA-O 3.23Å; E89-H102 WeakPolarHBondContact CA-O 3.24Å; F90-H102 AromaticContact CD1-CE1 3.78Å; F90-H102 PolarHBondContact N-O 2.89Å; F90-H102 PolarHBondContact O-N 3.31Å; F90-H102 PolarHBondContact O-ND1 2.96Å
103	V	90.9	Very high	83.7	Confident	69 Å²	69	78.7 Å²	78.7	42%	0.418	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.9	179.5	177.9	0	0	0	0	109.7	R87 V88 E89	R87-V103 HydrophobicContact CB-CG1 4.24Å; R87-V103 HydrophobicContact CG-CG1 4.5Å; V88-V103 WeakPolarHBondContact O-CA 3.48Å; E89-V103 HydrophobicContact CG-CG2 4.21Å
104	V	89.4	Confident	83.6	Confident	18 Å²	18	78.6 Å²	78.6	11%	0.109	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.5	177.3	-66.9	0	0	0	0	111	L81 V88 F90 V106 A123	L81-V104 HydrophobicContact CD2-CG2 3.88Å; V88-V104 HydrophobicContact CB-CG2 4.48Å; V88-V104 HydrophobicContact CG1-CG2 4.13Å; V88-V104 PolarHBondContact O-N 2.88Å; F90-V104 HydrophobicContact CB-CB 4.49Å; F90-V104 HydrophobicContact CB-CG1 3.55Å; F90-V104 HydrophobicContact CB-CG2 4.09Å; V104-V106 HydrophobicContact CG2-CG1 4.37Å; V104-A123 HydrophobicContact CG2-CB 4.28Å
105	P	88.7	Confident	83.5	Confident	67 Å²	67	78.8 Å²	78.8	44%	0.435	39%	0.388	S	S	.	.			trans	-68.8	139.8	171	29.2	-32.7	0	0	0	109.8	V124 Y125	P105-V124 HydrophobicContact CB-CG2 4.13Å; P105-V124 HydrophobicContact CG-CB 4.25Å; P105-V124 HydrophobicContact CG-CG2 4.2Å; P105-V124 WeakPolarHBondContact O-CG2 3.49Å; P105-V124 PolarHBondContact O-N 2.81Å; P105-V124 VanDerWaalsContact O-N 3.1Å; P105-Y125 HydrophobicContact CG-CD2 4.36Å; P105-Y125 HydrophobicContact CG-CE2 3.65Å
106	V	87.4	Confident	83.6	Confident	43 Å²	43	74.1 Å²	74.1	26%	0.261	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.4	-179.6	-63.8	0	0	0	0	111.4	V88 V104 K121 E122 A123	V88-V106 HydrophobicContact CB-CG1 3.72Å; V88-V106 HydrophobicContact CB-CG2 4.45Å; V88-V106 HydrophobicContact CG1-CG1 3.91Å; V88-V106 HydrophobicContact CG2-CG1 3.89Å; V88-V106 HydrophobicContact CG2-CG2 3.94Å; V104-V106 HydrophobicContact CG2-CG1 4.37Å; V106-K121 HydrophobicContact CB-CB 4.07Å; V106-K121 HydrophobicContact CG2-CB 4.13Å; V106-K121 HydrophobicContact CG2-CD 4.21Å; V106-K121 HydrophobicContact CG2-CG 4.23Å; V106-E122 CarbonylContact C-O 3.6Å; V106-E122 VanDerWaalsContact CA-O 3.24Å; V106-E122 WeakPolarHBondContact CA-O 3.28Å; V106-E122 WeakPolarHBondContact CB-O 3.39Å; V106-A123 HydrophobicContact CG1-CB 4.5Å
107	I	86.4	Confident	83.6	Confident	94 Å²	94	66 Å²	66	48%	0.482	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	169.2	173	55.2	170.6	0	0	0	109.8	K121 E122 V124	I107-K121 CarbonylContact O-C 3.41Å; I107-K121 VanDerWaalsContact O-CA 3.32Å; I107-K121 WeakPolarHBondContact O-CA 3.07Å; I107-E122 PolarHBondContact N-O 2.96Å; I107-E122 PolarHBondContact O-N 3.16Å; I107-V124 HydrophobicContact CG2-CG2 3.91Å
108	N	85.3	Confident	84	Confident	111 Å²	111	65.1 Å²	65.1	59%	0.594	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	135.2	170.5	-66.8	-29.3	0	0	0	109.2	Y110 K121	N108-Y110 PolarHBondContact O-N 3.21Å; N108-K121 PolarHBondContact OD1-NZ 2.93Å
109	C	79.6	Confident	84.3	Confident	19 Å²	19	60 Å²	60	13%	0.128	32%	0.321	C	S	.	.			trans	-58.1	137.3	174.9	-55.8	0	0	0	0	110.4	V111 C120 K121	C109-V111 VanDerWaalsContact C-N 3.31Å; C109-V111 PolarHBondContact O-N 2.78Å; C109-C120 HydrophobicContact CB-CB 3.63Å; C109-C120 WeakPolarHBondContact CB-SG 3.05Å; C109-C120 PolarHBondContact N-O 3.21Å; C109-C120 WeakPolarHBondContact SG-CB 3.26Å; C109-C120 CovalentContact SG-SG 2.03Å; C109-C120 PolarHBondContact SG-SG 3.16Å; C109-K121 VanDerWaalsContact SG-C 3.51Å; C109-K121 PolarHBondContact SG-N 3.28Å; C109-K121 VanDerWaalsContact SG-N 3.43Å
110	Y	71	Confident	84.4	Confident	226 Å²	226	57.8 Å²	57.8	89%	0.886	31%	0.311	S	S	*	.	S	Bend	trans	-63.5	-37.7	175.1	179	-106.8	0	0	0	112.1	N108	N108-Y110 PolarHBondContact O-N 3.21Å
111	V	71.4	Confident	84.4	Confident	59 Å²	59	55 Å²	55	36%	0.358	30%	0.298	S	S	.	.	S	Bend	trans	-127	121.3	170.1	178.6	0	0	0	0	107.9	C109 Q113 R269	C109-V111 VanDerWaalsContact C-N 3.31Å; C109-V111 PolarHBondContact O-N 2.78Å; V111-Q113 PolarHBondContact O-N 3.07Å; V111-R269 HydrophobicContact CG1-CG 4.04Å
112	S	78.9	Confident	84.3	Confident	39 Å²	39	55.6 Å²	55.6	27%	0.273	30%	0.296	S	S	.	.			trans	-64.4	129.9	178.2	-173.2	0	0	0	0	110.6	C114	S112-C114 PolarHBondContact OG-N 2.98Å
113	Q	80.9	Confident	84.1	Confident	66 Å²	66	50.9 Å²	50.9	31%	0.308	28%	0.275	S	S	.	.			trans	-103.1	6.5	170.7	-61	-172.8	53.7	0	0	111.7	V111 Y129 Q141	V111-Q113 PolarHBondContact O-N 3.07Å; Q113-Y129 HydrophobicContact CB-CD2 4.12Å; Q113-Y129 HydrophobicContact CB-CE1 4.18Å; Q113-Y129 HydrophobicContact CB-CE2 3.54Å; Q113-Y129 HydrophobicContact CG-CE1 4.29Å; Q113-Y129 HydrophobicContact CG-CE2 4.44Å; Q113-Y129 PolarHBondContact OE1-OH 3.49Å; Q113-Y129 VanDerWaalsContact OE1-OH 3.14Å; Q113-Q141 PolarHBondContact O-NE2 2.75Å
114	C	87.6	Confident	83.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.			trans	-97	125.6	-178.7	-48.7	0	0	0	0	110	S112 G118 C120 C131 Q141	S112-C114 PolarHBondContact OG-N 2.98Å; C114-G118 WeakPolarHBondContact CB-O 3.28Å; C114-C120 VanDerWaalsContact SG-CA 3.54Å; C114-C120 WeakPolarHBondContact SG-CB 2.97Å; C114-C131 WeakPolarHBondContact CA-SG 3.41Å; C114-C131 HydrophobicContact CB-CB 3.74Å; C114-C131 WeakPolarHBondContact CB-SG 3.41Å; C114-C131 WeakPolarHBondContact SG-CA 2.97Å; C114-C131 WeakPolarHBondContact SG-CB 3.33Å; C114-C131 CovalentContact SG-SG 2.02Å; C114-C131 PolarHBondContact SG-SG 3.32Å; C114-Q141 CarbonylContact C-O 3.6Å; C114-Q141 WeakPolarHBondContact CA-O 3.22Å
115	Y	84.6	Confident	83	Confident	17 Å²	17	59.4 Å²	59.4	7%	0.067	31%	0.307	C	S	.	.	S	Bend	trans	-71.7	165.2	174.1	-65.5	-76.9	0	0	0	111.6	G117 G118 Q141 C142 E143 D264 A275 W276	Y115-G117 PolarHBondContact O-N 2.9Å; Y115-G117 VanDerWaalsContact O-N 3.07Å; Y115-G118 PolarHBondContact O-N 3.46Å; Y115-Q141 WeakPolarHBondContact CB-O 3.17Å; Y115-Q141 HydrophobicContact CD2-CB 3.66Å; Y115-Q141 WeakPolarHBondContact CD2-O 3.46Å; Y115-Q141 HydrophobicContact CE2-CB 3.9Å; Y115-Q141 PolarHBondContact N-O 3.39Å; Y115-C142 WeakPolarHBondContact O-CB 3.23Å; Y115-E143 HydrophobicContact CD2-CB 3.75Å; Y115-E143 HydrophobicContact CE2-CB 4.13Å; Y115-D264 HydrophobicContact CE1-CB 3.61Å; Y115-A275 HydrophobicContact CD1-CB 4.03Å; Y115-A275 HydrophobicContact CE1-CB 4.08Å; Y115-W276 AromaticContact CD1-CD1 3.83Å; Y115-W276 HydrophobicContact CD1-CG 4.47Å; Y115-W276 AromaticContact CD1-NE1 3.68Å; Y115-W276 AromaticContact CE1-CD1 3.85Å; Y115-W276 HydrophobicContact CE1-CD2 4.26Å; Y115-W276 AromaticContact CE1-CE2 3.54Å; Y115-W276 HydrophobicContact CE1-CG 4.44Å; Y115-W276 AromaticContact CE1-CZ2 3.95Å; Y115-W276 HydrophobicContact CE1-CZ2 3.95Å; Y115-W276 AromaticContact CE1-NE1 3.22Å; Y115-W276 AromaticContact CE2-NE1 3.84Å; Y115-W276 AromaticContact CZ-CE2 3.78Å; Y115-W276 AromaticContact CZ-CZ2 3.94Å; Y115-W276 AromaticContact CZ-NE1 3.33Å; Y115-W276 VanDerWaalsContact CZ-NE1 3.33Å; Y115-W276 WeakPolarHBondContact OH-CZ2 3.27Å
116	N	81.1	Confident	82.5	Confident	18 Å²	18	57.9 Å²	57.9	10%	0.096	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	33.9	165.7	-57.2	-54.3	0	0	0	114.3	G118 P134 F137 C142	N116-G118 VanDerWaalsContact C-N 3.33Å; N116-G118 PolarHBondContact O-N 2.01Å; N116-P134 WeakPolarHBondContact O-CG 3.34Å; N116-F137 HydrophobicContact CB-CD1 3.66Å; N116-F137 HydrophobicContact CB-CD2 4.15Å; N116-F137 HydrophobicContact CB-CE1 3.58Å; N116-F137 HydrophobicContact CB-CE2 4.06Å; N116-F137 HydrophobicContact CB-CG 3.95Å; N116-F137 HydrophobicContact CB-CZ 3.79Å; N116-F137 VanDerWaalsContact ND2-CD1 3.33Å; N116-F137 WeakPolarHBondContact ND2-CD1 3.13Å; N116-F137 VanDerWaalsContact ND2-CE1 3.29Å; N116-F137 WeakPolarHBondContact ND2-CE1 3.08Å; N116-C142 PolarHBondContact ND2-O 2.6Å
117	G	76.9	Confident	81.8	Confident	29 Å²	29	60.5 Å²	60.5	30%	0.299	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	19	-179.3	0	0	0	0	0	115.5	Y115	Y115-G117 PolarHBondContact O-N 2.9Å; Y115-G117 VanDerWaalsContact O-N 3.07Å
118	G	84.8	Confident	81.6	Confident	7 Å²	7	58.6 Å²	58.6	7%	0.072	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-57.8	139.3	170.5	0	0	0	0	0	112.5	C114 Y115 N116 C120 Q132	C114-G118 WeakPolarHBondContact CB-O 3.28Å; Y115-G118 PolarHBondContact O-N 3.46Å; N116-G118 VanDerWaalsContact C-N 3.33Å; N116-G118 PolarHBondContact O-N 2.01Å; G118-C120 PolarHBondContact O-N 3.02Å; G118-Q132 CarbonylContact C-O 3.46Å; G118-Q132 VanDerWaalsContact CA-O 3.27Å; G118-Q132 WeakPolarHBondContact CA-O 3.36Å
119	T	87.4	Confident	81.8	Confident	66 Å²	66	56.3 Å²	56.3	41%	0.405	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.3	176.3	-61.6	0	0	0	0	109.5	C131 Q132	T119-C131 WeakPolarHBondContact O-CA 3.22Å; T119-Q132 PolarHBondContact N-O 2.83Å; T119-Q132 PolarHBondContact O-N 2.89Å
120	C	89.2	Confident	82.3	Confident	11 Å²	11	56.3 Å²	56.3	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.3	-179.5	-166.9	0	0	0	0	111.4	C109 C114 G118	C109-C120 HydrophobicContact CB-CB 3.63Å; C109-C120 WeakPolarHBondContact CB-SG 3.05Å; C109-C120 PolarHBondContact N-O 3.21Å; C109-C120 WeakPolarHBondContact SG-CB 3.26Å; C109-C120 CovalentContact SG-SG 2.03Å; C109-C120 PolarHBondContact SG-SG 3.16Å; C114-C120 VanDerWaalsContact SG-CA 3.54Å; C114-C120 WeakPolarHBondContact SG-CB 2.97Å; G118-C120 PolarHBondContact O-N 3.02Å
121	K	89.6	Confident	83.2	Confident	48 Å²	48	46.1 Å²	46.1	21%	0.209	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.3	171.3	-65.4	-60.9	-174	174.8	0	110.5	W83 V106 I107 N108 C109 Y129 I130	W83-K121 HydrophobicContact CH2-CG 3.66Å; W83-K121 HydrophobicContact CZ2-CB 4.33Å; W83-K121 HydrophobicContact CZ2-CG 3.73Å; V106-K121 HydrophobicContact CB-CB 4.07Å; V106-K121 HydrophobicContact CG2-CB 4.13Å; V106-K121 HydrophobicContact CG2-CD 4.21Å; V106-K121 HydrophobicContact CG2-CG 4.23Å; I107-K121 CarbonylContact O-C 3.41Å; I107-K121 VanDerWaalsContact O-CA 3.32Å; I107-K121 WeakPolarHBondContact O-CA 3.07Å; N108-K121 PolarHBondContact OD1-NZ 2.93Å; C109-K121 VanDerWaalsContact SG-C 3.51Å; C109-K121 PolarHBondContact SG-N 3.28Å; C109-K121 VanDerWaalsContact SG-N 3.43Å; K121-Y129 CarbonylContact O-C 3.59Å; K121-Y129 WeakPolarHBondContact O-CA 3.1Å; K121-Y129 WeakPolarHBondContact O-CB 3.26Å; K121-I130 HydrophobicContact CB-CG2 3.94Å; K121-I130 PolarHBondContact N-O 3.32Å; K121-I130 PolarHBondContact O-N 2.97Å
122	E	89.1	Confident	84.1	Confident	56 Å²	56	48 Å²	48	26%	0.262	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.2	177.2	-173.4	172	-163.9	0	0	109.5	V106 I107	V106-E122 CarbonylContact C-O 3.6Å; V106-E122 VanDerWaalsContact CA-O 3.24Å; V106-E122 WeakPolarHBondContact CA-O 3.28Å; V106-E122 WeakPolarHBondContact CB-O 3.39Å; I107-E122 PolarHBondContact N-O 2.96Å; I107-E122 PolarHBondContact O-N 3.16Å
123	A	85.5	Confident	84.5	Confident	6 Å²	6	48.1 Å²	48.1	5%	0.05	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.2	179.1	0	0	0	0	0	110.8	L81 V104 V106 Y125 S126 N128	L81-A123 HydrophobicContact CD1-CB 4.31Å; L81-A123 HydrophobicContact CD2-CB 4.32Å; V104-A123 HydrophobicContact CG2-CB 4.28Å; V106-A123 HydrophobicContact CG1-CB 4.5Å; A123-Y125 PolarHBondContact O-N 3.44Å; A123-Y125 VanDerWaalsContact O-N 3.1Å; A123-S126 WeakPolarHBondContact CB-OG 3.29Å; A123-S126 PolarHBondContact O-N 2.67Å; A123-N128 PolarHBondContact N-O 3.14Å
124	V	81.9	Confident	84.9	Confident	68 Å²	68	46.9 Å²	46.9	41%	0.412	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.7	-170.2	174.4	0	0	0	0	113.6	P105 I107	P105-V124 HydrophobicContact CB-CG2 4.13Å; P105-V124 HydrophobicContact CG-CB 4.25Å; P105-V124 HydrophobicContact CG-CG2 4.2Å; P105-V124 WeakPolarHBondContact O-CG2 3.49Å; P105-V124 PolarHBondContact O-N 2.81Å; P105-V124 VanDerWaalsContact O-N 3.1Å; I107-V124 HydrophobicContact CG2-CG2 3.91Å
125	Y	76.3	Confident	84.9	Confident	197 Å²	197	53.1 Å²	53.1	77%	0.773	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	10.3	-174.3	-48.3	-67.9	0	0	0	113.8	P105 A123	P105-Y125 HydrophobicContact CG-CD2 4.36Å; P105-Y125 HydrophobicContact CG-CE2 3.65Å; A123-Y125 PolarHBondContact O-N 3.44Å; A123-Y125 VanDerWaalsContact O-N 3.1Å
126	S	76.7	Confident	85	Confident	36 Å²	36	53 Å²	53	25%	0.252	30%	0.3	S	S	.	.	S	Bend	trans	-151.7	153.9	179.7	68.2	0	0	0	0	111	A123 N128	A123-S126 WeakPolarHBondContact CB-OG 3.29Å; A123-S126 PolarHBondContact O-N 2.67Å; S126-N128 PolarHBondContact O-N 2.88Å; S126-N128 VanDerWaalsContact O-N 3.13Å; S126-N128 PolarHBondContact OG-N 2.88Å
127	S	73.3	Confident	85.4	Confident	98 Å²	98	53.5 Å²	53.5	69%	0.685	30%	0.301	S	S	*	.	S	Bend	trans	-76.1	8.5	171.9	52.3	0	0	0	0	114.1
128	N	82.6	Confident	86	Confident	53 Å²	53	54.2 Å²	54.2	28%	0.283	30%	0.302	S	S	.	.			trans	-72.9	134	175.7	-65.2	64.3	0	0	0	110	L81 A123 S126	L81-N128 HydrophobicContact CD1-CB 3.74Å; L81-N128 WeakPolarHBondContact CD1-O 3.37Å; L81-N128 HydrophobicContact CG-CB 4.15Å; A123-N128 PolarHBondContact N-O 3.14Å; S126-N128 PolarHBondContact O-N 2.88Å; S126-N128 VanDerWaalsContact O-N 3.13Å; S126-N128 PolarHBondContact OG-N 2.88Å
129	Y	88.4	Confident	86	Confident	63 Å²	63	55.7 Å²	55.7	25%	0.247	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	161.8	174.9	71.8	-84.6	0	0	0	111.3	Q113 K121 Q141	Q113-Y129 HydrophobicContact CB-CD2 4.12Å; Q113-Y129 HydrophobicContact CB-CE1 4.18Å; Q113-Y129 HydrophobicContact CB-CE2 3.54Å; Q113-Y129 HydrophobicContact CG-CE1 4.29Å; Q113-Y129 HydrophobicContact CG-CE2 4.44Å; Q113-Y129 PolarHBondContact OE1-OH 3.49Å; Q113-Y129 VanDerWaalsContact OE1-OH 3.14Å; K121-Y129 CarbonylContact O-C 3.59Å; K121-Y129 WeakPolarHBondContact O-CA 3.1Å; K121-Y129 WeakPolarHBondContact O-CB 3.26Å; Y129-Q141 HydrophobicContact CE2-CG 4.43Å; Y129-Q141 PolarHBondContact OH-NE2 3.37Å
130	I	90.3	Very high	85.8	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.097	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.9	174.9	-170.3	171.6	0	0	0	110.1	L81 R82 W83 V88 K121	L81-I130 HydrophobicContact CB-CB 3.9Å; L81-I130 HydrophobicContact CB-CD1 4.11Å; L81-I130 HydrophobicContact CB-CG1 4.45Å; L81-I130 HydrophobicContact CB-CG2 4.41Å; L81-I130 HydrophobicContact CD1-CB 4.26Å; L81-I130 HydrophobicContact CD1-CG2 4.44Å; L81-I130 WeakPolarHBondContact O-CD1 3.38Å; R82-I130 VanDerWaalsContact CA-CD1 3.44Å; W83-I130 HydrophobicContact CG-CD1 4.03Å; W83-I130 HydrophobicContact CZ2-CG2 4.19Å; V88-I130 HydrophobicContact CG1-CG2 4.19Å; V88-I130 HydrophobicContact CG2-CG2 4.29Å; K121-I130 HydrophobicContact CB-CG2 3.94Å; K121-I130 PolarHBondContact N-O 3.32Å; K121-I130 PolarHBondContact O-N 2.97Å
131	C	90.3	Very high	85.7	Confident	12 Å²	12	56.5 Å²	56.5	8%	0.081	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.6	174.3	-64.6	0	0	0	0	110.6	C114 T119 A140	C114-C131 WeakPolarHBondContact CA-SG 3.41Å; C114-C131 HydrophobicContact CB-CB 3.74Å; C114-C131 WeakPolarHBondContact CB-SG 3.41Å; C114-C131 WeakPolarHBondContact SG-CA 2.97Å; C114-C131 WeakPolarHBondContact SG-CB 3.33Å; C114-C131 CovalentContact SG-SG 2.02Å; C114-C131 PolarHBondContact SG-SG 3.32Å; T119-C131 WeakPolarHBondContact O-CA 3.22Å; C131-A140 WeakPolarHBondContact CB-O 3.37Å
132	Q	89.8	Confident	85.7	Confident	100 Å²	100	54.2 Å²	54.2	47%	0.467	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	114.1	163.9	-173.3	178.8	2.6	0	0	108.4	W83 G118 T119	W83-Q132 HydrophobicContact CZ2-CB 3.98Å; G118-Q132 CarbonylContact C-O 3.46Å; G118-Q132 VanDerWaalsContact CA-O 3.27Å; G118-Q132 WeakPolarHBondContact CA-O 3.36Å; T119-Q132 PolarHBondContact N-O 2.83Å; T119-Q132 PolarHBondContact O-N 2.89Å
133	C	88.8	Confident	85.5	Confident	41 Å²	41	52.9 Å²	52.9	28%	0.277	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-84.9	140.4	-174.1	-56.1	0	0	0	0	112.6	F137 C142	C133-F137 HydrophobicContact CB-CB 4.22Å; C133-C142 WeakPolarHBondContact CA-SG 3.45Å; C133-C142 HydrophobicContact CB-CB 3.75Å; C133-C142 WeakPolarHBondContact CB-SG 3.33Å; C133-C142 WeakPolarHBondContact SG-CA 3.25Å; C133-C142 WeakPolarHBondContact SG-CB 3.17Å; C133-C142 CovalentContact SG-SG 2.04Å; C133-C142 PolarHBondContact SG-SG 3.1Å
134	P	88	Confident	85.7	Confident	40 Å²	40	52.7 Å²	52.7	26%	0.26	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69.3	161.6	171.9	25	-26.4	0	0	0	111.1	N116 G136 F137	N116-P134 WeakPolarHBondContact O-CG 3.34Å; P134-G136 PolarHBondContact O-N 3.19Å; P134-F137 HydrophobicContact CG-CD2 3.86Å; P134-F137 HydrophobicContact CG-CG 4.49Å; P134-F137 PolarHBondContact O-N 3.17Å; P134-F137 VanDerWaalsContact O-N 3.11Å
135	P	89.1	Confident	86	Confident	130 Å²	130	50.7 Å²	50.7	84%	0.844	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	136.8	175.9	-25.6	34.6	0	0	0	112.1	F137	P135-F137 VanDerWaalsContact C-N 3.35Å
136	G	86.5	Confident	86.6	Confident	15 Å²	15	43.5 Å²	43.5	16%	0.155	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	-3.2	-176.1	0	0	0	0	0	115.1	P134 T146 N147	P134-G136 PolarHBondContact O-N 3.19Å; G136-T146 VanDerWaalsContact C-OG1 3.25Å; G136-T146 WeakPolarHBondContact CA-OG1 3.46Å; G136-T146 PolarHBondContact O-N 2.96Å; G136-T146 PolarHBondContact O-OG1 2.86Å; G136-N147 WeakPolarHBondContact CA-ND2 3.31Å
137	F	89.1	Confident	87.1	Confident	28 Å²	28	47.1 Å²	47.1	12%	0.123	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.1	176.6	-65.7	-84.1	0	0	0	112.6	N116 C133 P134 P135 C142 I144 N145 L281	N116-F137 HydrophobicContact CB-CD1 3.66Å; N116-F137 HydrophobicContact CB-CD2 4.15Å; N116-F137 HydrophobicContact CB-CE1 3.58Å; N116-F137 HydrophobicContact CB-CE2 4.06Å; N116-F137 HydrophobicContact CB-CG 3.95Å; N116-F137 HydrophobicContact CB-CZ 3.79Å; N116-F137 VanDerWaalsContact ND2-CD1 3.33Å; N116-F137 WeakPolarHBondContact ND2-CD1 3.13Å; N116-F137 VanDerWaalsContact ND2-CE1 3.29Å; N116-F137 WeakPolarHBondContact ND2-CE1 3.08Å; C133-F137 HydrophobicContact CB-CB 4.22Å; P134-F137 HydrophobicContact CG-CD2 3.86Å; P134-F137 HydrophobicContact CG-CG 4.49Å; P134-F137 PolarHBondContact O-N 3.17Å; P134-F137 VanDerWaalsContact O-N 3.11Å; P135-F137 VanDerWaalsContact C-N 3.35Å; F137-C142 HydrophobicContact CB-CB 4.3Å; F137-I144 CarbonylContact C-O 3.55Å; F137-I144 VanDerWaalsContact CA-O 3.24Å; F137-I144 WeakPolarHBondContact CA-O 3.19Å; F137-I144 WeakPolarHBondContact CD1-O 3.47Å; F137-N145 HydrophobicContact CD1-CB 4.29Å; F137-N145 HydrophobicContact CE1-CB 3.91Å; F137-L281 HydrophobicContact CE1-CD1 4.42Å; F137-L281 HydrophobicContact CE2-CD2 3.85Å; F137-L281 HydrophobicContact CZ-CB 4.48Å; F137-L281 HydrophobicContact CZ-CD1 3.82Å; F137-L281 HydrophobicContact CZ-CD2 3.53Å; F137-L281 HydrophobicContact CZ-CG 4.12Å
138	S	88.6	Confident	87.8	Confident	45 Å²	45	44.4 Å²	44.4	32%	0.315	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	-177.3	175.6	69.9	0	0	0	0	111.3	C142 E143 I144	S138-C142 CarbonylContact O-C 3.49Å; S138-C142 VanDerWaalsContact O-CA 3.28Å; S138-C142 WeakPolarHBondContact O-CA 3.44Å; S138-E143 PolarHBondContact O-N 3.41Å; S138-I144 PolarHBondContact N-O 2.96Å; S138-I144 VanDerWaalsContact O-CB 3.32Å; S138-I144 WeakPolarHBondContact O-CB 3.49Å; S138-I144 PolarHBondContact O-N 3.06Å; S138-I144 WeakPolarHBondContact OG-CB 3.48Å
139	G	85.8	Confident	88	Confident	37 Å²	37	47.8 Å²	47.8	38%	0.381	28%	0.28	S	S	.	.	S	Bend	trans	98.2	171.6	-173.6	0	0	0	0	0	112.7	Q141 C142 E143	G139-Q141 VanDerWaalsContact C-N 3.26Å; G139-Q141 PolarHBondContact O-N 2.05Å; G139-C142 PolarHBondContact O-N 3.33Å; G139-E143 WeakPolarHBondContact CA-OE1 3.36Å
140	A	83.8	Confident	88	Confident	81 Å²	81	46.3 Å²	46.3	67%	0.669	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-25.8	-173.9	0	0	0	0	0	112.6	C131 E143	C131-A140 WeakPolarHBondContact CB-O 3.37Å; A140-E143 PolarHBondContact N-OE1 2.88Å; A140-E143 PolarHBondContact N-OE2 3.24Å
141	Q	87.2	Confident	87.9	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.065	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	13	178.7	-60.7	-174.5	-82.5	0	0	112.1	Q113 C114 Y115 Y129 G139 E143 N192	Q113-Q141 PolarHBondContact O-NE2 2.75Å; C114-Q141 CarbonylContact C-O 3.6Å; C114-Q141 WeakPolarHBondContact CA-O 3.22Å; Y115-Q141 WeakPolarHBondContact CB-O 3.17Å; Y115-Q141 HydrophobicContact CD2-CB 3.66Å; Y115-Q141 WeakPolarHBondContact CD2-O 3.46Å; Y115-Q141 HydrophobicContact CE2-CB 3.9Å; Y115-Q141 PolarHBondContact N-O 3.39Å; Y129-Q141 HydrophobicContact CE2-CG 4.43Å; Y129-Q141 PolarHBondContact OH-NE2 3.37Å; G139-Q141 VanDerWaalsContact C-N 3.26Å; G139-Q141 PolarHBondContact O-N 2.05Å; Q141-E143 VanDerWaalsContact C-N 3.25Å; Q141-E143 VanDerWaalsContact C-OE2 3.28Å; Q141-E143 VanDerWaalsContact CA-OE2 3.27Å; Q141-E143 WeakPolarHBondContact CA-OE2 3.27Å; Q141-E143 WeakPolarHBondContact CB-OE2 3.35Å; Q141-E143 PolarHBondContact N-OE2 3.1Å; Q141-E143 PolarHBondContact O-N 2.89Å; Q141-N192 PolarHBondContact OE1-ND2 2.85Å
142	C	87.9	Confident	87.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	63.9	29.8	-173.3	-43.8	0	0	0	0	113.8	Y115 N116 C133 F137 S138 G139	Y115-C142 WeakPolarHBondContact O-CB 3.23Å; N116-C142 PolarHBondContact ND2-O 2.6Å; C133-C142 WeakPolarHBondContact CA-SG 3.45Å; C133-C142 HydrophobicContact CB-CB 3.75Å; C133-C142 WeakPolarHBondContact CB-SG 3.33Å; C133-C142 WeakPolarHBondContact SG-CA 3.25Å; C133-C142 WeakPolarHBondContact SG-CB 3.17Å; C133-C142 CovalentContact SG-SG 2.04Å; C133-C142 PolarHBondContact SG-SG 3.1Å; F137-C142 HydrophobicContact CB-CB 4.3Å; S138-C142 CarbonylContact O-C 3.49Å; S138-C142 VanDerWaalsContact O-CA 3.28Å; S138-C142 WeakPolarHBondContact O-CA 3.44Å; G139-C142 PolarHBondContact O-N 3.33Å
143	E	86.8	Confident	87.2	Confident	27 Å²	27	43.4 Å²	43.4	13%	0.126	28%	0.276	C	S	.	.			trans	-80.8	-14.2	-176.8	72.5	-76.3	-179	0	0	114.3	Y115 S138 G139 A140 Q141 R159	Y115-E143 HydrophobicContact CD2-CB 3.75Å; Y115-E143 HydrophobicContact CE2-CB 4.13Å; S138-E143 PolarHBondContact O-N 3.41Å; G139-E143 WeakPolarHBondContact CA-OE1 3.36Å; A140-E143 PolarHBondContact N-OE1 2.88Å; A140-E143 PolarHBondContact N-OE2 3.24Å; Q141-E143 VanDerWaalsContact C-N 3.25Å; Q141-E143 VanDerWaalsContact C-OE2 3.28Å; Q141-E143 VanDerWaalsContact CA-OE2 3.27Å; Q141-E143 WeakPolarHBondContact CA-OE2 3.27Å; Q141-E143 WeakPolarHBondContact CB-OE2 3.35Å; Q141-E143 PolarHBondContact N-OE2 3.1Å; Q141-E143 PolarHBondContact O-N 2.89Å; E143-R159 WeakPolarHBondContact O-CB 3.47Å; E143-R159 VanDerWaalsContact O-CD 3.31Å; E143-R159 WeakPolarHBondContact O-CD 3.48Å; E143-R159 WeakPolarHBondContact O-CG 3.49Å
144	I	88.7	Confident	87.2	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.5	-178.7	-50.9	-60.1	0	0	0	109.1	F137 S138 T161 F201	F137-I144 CarbonylContact C-O 3.55Å; F137-I144 VanDerWaalsContact CA-O 3.24Å; F137-I144 WeakPolarHBondContact CA-O 3.19Å; F137-I144 WeakPolarHBondContact CD1-O 3.47Å; S138-I144 PolarHBondContact N-O 2.96Å; S138-I144 VanDerWaalsContact O-CB 3.32Å; S138-I144 WeakPolarHBondContact O-CB 3.49Å; S138-I144 PolarHBondContact O-N 3.06Å; S138-I144 WeakPolarHBondContact OG-CB 3.48Å; I144-T161 HydrophobicContact CG2-CG2 3.84Å; I144-F201 HydrophobicContact CD1-CD2 4.05Å; I144-F201 HydrophobicContact CD1-CE2 4.28Å; I144-F201 HydrophobicContact CG1-CE2 4.37Å; I144-F201 HydrophobicContact CG2-CD2 4.24Å; I144-F201 HydrophobicContact CG2-CE2 3.9Å
145	N	89.1	Confident	87.2	Confident	26 Å²	26	43.9 Å²	43.9	14%	0.139	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	104.3	175	-174.3	-18.7	0	0	0	109.2	F137 N147 E148 R159 G160	F137-N145 HydrophobicContact CD1-CB 4.29Å; F137-N145 HydrophobicContact CE1-CB 3.91Å; N145-N147 PolarHBondContact O-N 3.08Å; N145-N147 WeakPolarHBondContact OD1-CB 3.32Å; N145-N147 PolarHBondContact OD1-N 2.86Å; N145-E148 HydrophobicContact CB-CB 3.89Å; N145-E148 PolarHBondContact O-N 3.23Å; N145-E148 PolarHBondContact OD1-N 3.39Å; N145-R159 HydrophobicContact CB-CB 4.29Å; N145-R159 PolarHBondContact N-O 3.05Å; N145-G160 WeakPolarHBondContact O-CA 3.43Å
146	T	88.8	Confident	87.1	Confident	46 Å²	46	39.2 Å²	39.2	28%	0.282	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18	-176.6	61.7	0	0	0	0	112.8	G136 K149 T161	G136-T146 VanDerWaalsContact C-OG1 3.25Å; G136-T146 WeakPolarHBondContact CA-OG1 3.46Å; G136-T146 PolarHBondContact O-N 2.96Å; G136-T146 PolarHBondContact O-OG1 2.86Å; T146-K149 PolarHBondContact O-NZ 2.84Å; T146-T161 HydrophobicContact CG2-CG2 4.29Å
147	N	87.4	Confident	87	Confident	112 Å²	112	39 Å²	39	60%	0.599	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-13.6	177.4	-64.8	-29.2	0	0	0	113	G136 N145 K149	G136-N147 WeakPolarHBondContact CA-ND2 3.31Å; N145-N147 PolarHBondContact O-N 3.08Å; N145-N147 WeakPolarHBondContact OD1-CB 3.32Å; N145-N147 PolarHBondContact OD1-N 2.86Å; N147-K149 PolarHBondContact O-N 3.31Å
148	E	87.3	Confident	87.1	Confident	41 Å²	41	37.9 Å²	37.9	19%	0.192	23%	0.23	C	C	.	.			trans	-75.8	111.6	179.5	-168.6	176.1	-170.5	0	0	110.8	N145 Y158 R159 G160	N145-E148 HydrophobicContact CB-CB 3.89Å; N145-E148 PolarHBondContact O-N 3.23Å; N145-E148 PolarHBondContact OD1-N 3.39Å; E148-Y158 HydrophobicContact CG-CD2 4.04Å; E148-Y158 HydrophobicContact CG-CE2 3.97Å; E148-R159 WeakPolarHBondContact OE2-CA 3.5Å; E148-R159 PolarHBondContact OE2-N 2.8Å; E148-G160 WeakPolarHBondContact O-CA 2.96Å; E148-G160 PolarHBondContact OE2-N 3.34Å
149	K	86.5	Confident	87.2	Confident	124 Å²	124	36.1 Å²	36.1	54%	0.539	22%	0.217	S	C	.	.			trans	-106.6	-7	-176.4	-57.5	-50.2	-175.1	-162.8	0	114.4	T146 N147	T146-K149 PolarHBondContact O-NZ 2.84Å; N147-K149 PolarHBondContact O-N 3.31Å
150	C	88.6	Confident	87.5	Confident	32 Å²	32	34.4 Å²	34.4	22%	0.216	20%	0.199	C	C	.	.	S	Bend	trans	-143.7	154.6	-174.3	62.5	0	0	0	0	111.5	P229 C231	C150-P229 CarbonylContact C-O 3.33Å; C150-P229 WeakPolarHBondContact CA-O 3.06Å; C150-P229 HydrophobicContact CB-CB 4.43Å; C150-P229 WeakPolarHBondContact CB-O 3.25Å; C150-C231 HydrophobicContact CB-CB 3.91Å; C150-C231 WeakPolarHBondContact CB-SG 3.37Å; C150-C231 PolarHBondContact O-SG 3.26Å; C150-C231 WeakPolarHBondContact SG-CA 3.41Å; C150-C231 WeakPolarHBondContact SG-CB 3.48Å; C150-C231 CovalentContact SG-SG 2.04Å; C150-C231 PolarHBondContact SG-SG 3.31Å
151	A	88.3	Confident	87.9	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.033	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-96.6	141.9	176	0	0	0	0	0	111.2	Y158 P211 V228 P229 K230 C231	A151-Y158 HydrophobicContact CB-CD2 4.2Å; A151-Y158 HydrophobicContact CB-CG 4.41Å; A151-P211 HydrophobicContact CB-CG 4.34Å; A151-V228 HydrophobicContact CB-CB 4.37Å; A151-V228 HydrophobicContact CB-CG1 3.7Å; A151-P229 PolarHBondContact N-O 2.95Å; A151-K230 WeakPolarHBondContact O-CA 3.47Å; A151-C231 PolarHBondContact O-N 2.78Å
152	V	83.8	Confident	88.2	Confident	30 Å²	30	36.2 Å²	36.2	18%	0.182	19%	0.193	C	C	.	.			trans	-98.9	134.4	173.3	-169.9	0	0	0	0	109.2	Q154 G155 C231 T250	V152-Q154 PolarHBondContact O-N 3.01Å; V152-G155 PolarHBondContact O-N 2Å; V152-C231 HydrophobicContact CG2-CB 4.5Å; V152-T250 HydrophobicContact CG1-CG2 3.63Å
153	G	82.5	Confident	88.5	Confident	37 Å²	37	38 Å²	38	38%	0.381	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-124	-176	0	0	0	0	0	112.1	G155	G153-G155 VanDerWaalsContact C-N 3.35Å
154	Q	87.3	Confident	88.7	Confident	90 Å²	90	40.6 Å²	40.6	42%	0.421	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-2.7	174.9	-71.5	176.6	-20.3	0	0	113.4	V152 N204 D208 P211	V152-Q154 PolarHBondContact O-N 3.01Å; Q154-N204 PolarHBondContact O-ND2 2.81Å; Q154-D208 WeakPolarHBondContact CB-O 3.25Å; Q154-P211 WeakPolarHBondContact O-CD 3.42Å
155	G	88	Confident	89	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	80.6	22.8	177	0	0	0	0	0	115.7	V152 G153 G157 Y158	V152-G155 PolarHBondContact O-N 2Å; G153-G155 VanDerWaalsContact C-N 3.35Å; G155-G157 VanDerWaalsContact C-N 3.27Å; G155-G157 PolarHBondContact O-N 3.08Å; G155-Y158 VanDerWaalsContact O-CB 3.24Å; G155-Y158 WeakPolarHBondContact O-CB 3.03Å; G155-Y158 PolarHBondContact O-N 3.01Å; G155-Y158 VanDerWaalsContact O-N 3.14Å
156	E	86.5	Confident	89.1	Confident	33 Å²	33	44.9 Å²	44.9	15%	0.154	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-38.8	174.6	-57.3	-174.6	-170.1	0	0	112.9	Y158 H207 N287 F290	E156-Y158 VanDerWaalsContact C-N 3.33Å; E156-H207 IonicContact OE1-CE1 3.86Å; E156-H207 IonicContact OE1-CG 3.93Å; E156-H207 IonicContact OE1-ND1 3.42Å; E156-H207 PolarHBondContact OE1-ND1 3.06Å; E156-H207 IonicContact OE2-CE1 2.99Å; E156-H207 PolarHBondContact OE2-CE1 2.83Å; E156-H207 VanDerWaalsContact OE2-CE1 3.28Å; E156-H207 IonicContact OE2-ND1 2.98Å; E156-H207 PolarHBondContact OE2-ND1 3.28Å; E156-N287 PolarHBondContact O-ND2 2.87Å; E156-F290 HydrophobicContact CB-CZ 4.33Å
157	G	85.8	Confident	89.2	Confident	11 Å²	11	47.4 Å²	47.4	11%	0.113	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	1.5	177.8	0	0	0	0	0	114.6	G155 R159 N287	G155-G157 VanDerWaalsContact C-N 3.27Å; G155-G157 PolarHBondContact O-N 3.08Å; G157-R159 PolarHBondContact O-N 3.09Å; G157-N287 PolarHBondContact O-OD1 3.28Å
158	Y	90.3	Very high	89.4	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.012	25%	0.253	C	S	.	.			trans	-67	125	-172.7	-178.8	-111.3	0	0	0	111.1	E148 A151 G155 E156 G160 W162 C202 P211 V228	E148-Y158 HydrophobicContact CG-CD2 4.04Å; E148-Y158 HydrophobicContact CG-CE2 3.97Å; A151-Y158 HydrophobicContact CB-CD2 4.2Å; A151-Y158 HydrophobicContact CB-CG 4.41Å; G155-Y158 VanDerWaalsContact O-CB 3.24Å; G155-Y158 WeakPolarHBondContact O-CB 3.03Å; G155-Y158 PolarHBondContact O-N 3.01Å; G155-Y158 VanDerWaalsContact O-N 3.14Å; E156-Y158 VanDerWaalsContact C-N 3.33Å; Y158-G160 VanDerWaalsContact CZ-CA 3.48Å; Y158-W162 HydrophobicContact CE1-CB 4.18Å; Y158-W162 VanDerWaalsContact OH-CB 3.3Å; Y158-W162 WeakPolarHBondContact OH-CB 3.48Å; Y158-C202 WeakPolarHBondContact CD1-O 3.42Å; Y158-P211 HydrophobicContact CD1-CG 4.35Å; Y158-V228 HydrophobicContact CD1-CG1 4.4Å; Y158-V228 HydrophobicContact CD1-CG2 4.42Å; Y158-V228 HydrophobicContact CD2-CG1 4.09Å; Y158-V228 HydrophobicContact CE1-CG1 3.97Å; Y158-V228 HydrophobicContact CE1-CG2 3.91Å; Y158-V228 HydrophobicContact CE2-CG1 3.64Å; Y158-V228 HydrophobicContact CG-CG1 4.45Å
159	R	91	Very high	89.7	Confident	9 Å²	9	44 Å²	44	3%	0.034	25%	0.254	C	S	.	.			trans	-126.1	12.1	179.2	-70.4	-61.3	-174.9	-87.5	5.4	113.7	E143 N145 E148 G157 S193 L194 N287	E143-R159 WeakPolarHBondContact O-CB 3.47Å; E143-R159 VanDerWaalsContact O-CD 3.31Å; E143-R159 WeakPolarHBondContact O-CD 3.48Å; E143-R159 WeakPolarHBondContact O-CG 3.49Å; N145-R159 HydrophobicContact CB-CB 4.29Å; N145-R159 PolarHBondContact N-O 3.05Å; E148-R159 WeakPolarHBondContact OE2-CA 3.5Å; E148-R159 PolarHBondContact OE2-N 2.8Å; G157-R159 PolarHBondContact O-N 3.09Å; R159-S193 PolarHBondContact NH2-O 2.99Å; R159-L194 VanDerWaalsContact NH2-C 3.31Å; R159-N287 VanDerWaalsContact NH1-CG 3.32Å; R159-N287 PolarHBondContact NH1-ND2 3.48Å; R159-N287 PolarHBondContact NH1-OD1 2.77Å; R159-N287 PolarHBondContact NH2-ND2 3.21Å; R159-N287 PolarHBondContact NH2-OD1 2.8Å
160	G	91.1	Very high	90	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-64.1	174.6	171.7	0	0	0	0	0	113.8	N145 E148 Y158 R203	N145-G160 WeakPolarHBondContact O-CA 3.43Å; E148-G160 WeakPolarHBondContact O-CA 2.96Å; E148-G160 PolarHBondContact OE2-N 3.34Å; Y158-G160 VanDerWaalsContact CZ-CA 3.48Å; G160-R203 PolarHBondContact O-NH1 3.37Å
161	T	93.3	Very high	90.3	Very high	48 Å²	48	40.4 Å²	40.4	29%	0.294	25%	0.249	S	C	.	.			trans	-100.6	16.9	-170.4	60.3	0	0	0	0	113.7	I144 T146 S163 F201	I144-T161 HydrophobicContact CG2-CG2 3.84Å; T146-T161 HydrophobicContact CG2-CG2 4.29Å; T161-S163 PolarHBondContact O-N 3.02Å; T161-F201 VanDerWaalsContact C-CD1 3.43Å; T161-F201 VanDerWaalsContact CA-CD1 3.49Å; T161-F201 HydrophobicContact CG2-CE1 4.23Å; T161-F201 HydrophobicContact CG2-CE2 4.22Å; T161-F201 HydrophobicContact CG2-CZ 3.98Å; T161-F201 WeakPolarHBondContact O-CD1 3.09Å
162	W	93.6	Very high	90.6	Very high	86 Å²	86	40.7 Å²	40.7	33%	0.326	25%	0.25	S	S	.	.			trans	-66.2	130	179.2	-150.5	-86.5	0	0	0	110.4	Y158 F201 C202 Y227 V228 P229	Y158-W162 HydrophobicContact CE1-CB 4.18Å; Y158-W162 VanDerWaalsContact OH-CB 3.3Å; Y158-W162 WeakPolarHBondContact OH-CB 3.48Å; W162-F201 CarbonylContact O-C 3.43Å; W162-F201 WeakPolarHBondContact O-CA 3.46Å; W162-C202 PolarHBondContact O-N 3.37Å; W162-C202 PolarHBondContact O-SG 2.79Å; W162-Y227 VanDerWaalsContact CZ2-O 3.26Å; W162-Y227 WeakPolarHBondContact CZ2-O 3.22Å; W162-Y227 PolarHBondContact NE1-O 2.81Å; W162-V228 HydrophobicContact CB-CG2 4.03Å; W162-V228 HydrophobicContact CG-CG2 4.07Å; W162-P229 HydrophobicContact CH2-CG 4.19Å; W162-P229 HydrophobicContact CZ3-CG 4.22Å
163	S	94.3	Very high	91	Very high	36 Å²	36	41.6 Å²	41.6	25%	0.252	25%	0.254	S	S	.	.			trans	-137	24.7	-172	65.7	0	0	0	0	113.7	T161 C171	T161-S163 PolarHBondContact O-N 3.02Å; S163-C171 WeakPolarHBondContact O-CB 3.33Å; S163-C171 PolarHBondContact O-N 3.07Å; S163-C171 PolarHBondContact O-SG 3.44Å
164	I	90.9	Very high	91.5	Very high	83 Å²	83	39.8 Å²	39.8	43%	0.426	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-128.4	132.7	-177	-54	178	0	0	0	108.9
165	S	93.8	Very high	91.6	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.028	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-73.2	169.5	176.1	81	0	0	0	0	112.2	T167 G168 A169 E224 F225	S165-T167 PolarHBondContact O-N 2.91Å; S165-T167 PolarHBondContact OG-N 2.9Å; S165-T167 PolarHBondContact OG-OG1 2.03Å; S165-G168 PolarHBondContact O-N 3.02Å; S165-A169 PolarHBondContact N-O 2.88Å; S165-A169 WeakPolarHBondContact OG-CB 3.17Å; S165-A169 PolarHBondContact OG-N 2.84Å; S165-A169 VanDerWaalsContact OG-N 3.16Å; S165-E224 VanDerWaalsContact CB-OE2 3.27Å; S165-E224 WeakPolarHBondContact CB-OE2 3.38Å; S165-E224 PolarHBondContact OG-OE2 2.92Å; S165-F225 CarbonylContact C-O 3.59Å; S165-F225 WeakPolarHBondContact CA-O 3.46Å
166	Q	92.6	Very high	91.6	Very high	113 Å²	113	40 Å²	40	53%	0.528	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.8	176.1	-73.9	176.4	-0.9	0	0	113.3	G168 F225	Q166-G168 VanDerWaalsContact C-N 3.3Å; Q166-F225 VanDerWaalsContact CD-CB 3.49Å; Q166-F225 HydrophobicContact CG-CB 4.16Å; Q166-F225 WeakPolarHBondContact CG-O 3.16Å; Q166-F225 PolarHBondContact N-O 2.79Å; Q166-F225 VanDerWaalsContact NE2-CB 3.33Å
167	T	90.9	Very high	91.6	Very high	100 Å²	100	43.5 Å²	43.5	61%	0.613	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-1.4	176.6	69	0	0	0	0	112.8	S165 E224	S165-T167 PolarHBondContact O-N 2.91Å; S165-T167 PolarHBondContact OG-N 2.9Å; S165-T167 PolarHBondContact OG-OG1 2.03Å; T167-E224 WeakPolarHBondContact CG2-OE2 3.29Å; T167-E224 PolarHBondContact OG1-OE2 3.02Å
168	G	91	Very high	91.7	Very high	55 Å²	55	45.8 Å²	45.8	57%	0.567	28%	0.279	S	S	*	.	S	Bend	trans	86.8	2.6	-175.2	0	0	0	0	0	114.2	S165 Q166	S165-G168 PolarHBondContact O-N 3.02Å; Q166-G168 VanDerWaalsContact C-N 3.3Å
169	A	92.9	Very high	91.7	Very high	27 Å²	27	45.6 Å²	45.6	22%	0.223	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-72	137.7	178.6	0	0	0	0	0	111.4	S165 C171 V215	S165-A169 PolarHBondContact N-O 2.88Å; S165-A169 WeakPolarHBondContact OG-CB 3.17Å; S165-A169 PolarHBondContact OG-N 2.84Å; S165-A169 VanDerWaalsContact OG-N 3.16Å; A169-C171 PolarHBondContact O-N 2.82Å; A169-V215 HydrophobicContact CB-CB 3.94Å; A169-V215 HydrophobicContact CB-CG1 3.84Å; A169-V215 HydrophobicContact CB-CG2 4.49Å
170	A	92.8	Very high	91.4	Very high	72 Å²	72	55 Å²	55	60%	0.595	31%	0.314	S	S	*	.	B	Isolated β-bridge	trans	-69.2	131.5	175.4	0	0	0	0	0	110.5
171	C	95.7	Very high	91	Very high	8 Å²	8	58.9 Å²	58.9	5%	0.054	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-66.7	141.8	177.1	-66	0	0	0	0	111.6	S163 A169 N200 C213 Y214	S163-C171 WeakPolarHBondContact O-CB 3.33Å; S163-C171 PolarHBondContact O-N 3.07Å; S163-C171 PolarHBondContact O-SG 3.44Å; A169-C171 PolarHBondContact O-N 2.82Å; C171-N200 HydrophobicContact CB-CB 4.05Å; C171-N200 WeakPolarHBondContact CB-O 3.21Å; C171-N200 VanDerWaalsContact O-CB 3.24Å; C171-N200 WeakPolarHBondContact O-CB 3.48Å; C171-N200 PolarHBondContact O-ND2 3.21Å; C171-C213 VanDerWaalsContact CA-SG 3.52Å; C171-C213 HydrophobicContact CB-CB 3.52Å; C171-C213 WeakPolarHBondContact CB-SG 3.43Å; C171-C213 WeakPolarHBondContact SG-CB 3.08Å; C171-C213 CovalentContact SG-SG 2.02Å; C171-C213 PolarHBondContact SG-SG 3.2Å; C171-Y214 CarbonylContact C-O 3.5Å; C171-Y214 WeakPolarHBondContact CA-O 3.35Å
172	I	93.7	Very high	90.9	Very high	10 Å²	10	62.4 Å²	62.4	5%	0.051	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-77.9	138.7	172.2	-57.9	173.8	0	0	0	108.8	W174 L179 Y214 Y216 I221	I172-W174 PolarHBondContact O-N 3.26Å; I172-L179 HydrophobicContact CD1-CD2 4.4Å; I172-L179 HydrophobicContact CG2-CD1 4.01Å; I172-L179 HydrophobicContact CG2-CD2 4.09Å; I172-L179 HydrophobicContact CG2-CG 3.98Å; I172-Y214 WeakPolarHBondContact CG1-O 3.12Å; I172-Y214 PolarHBondContact N-O 2.86Å; I172-Y216 HydrophobicContact CD1-CD1 4.08Å; I172-Y216 HydrophobicContact CD1-CD2 3.67Å; I172-Y216 HydrophobicContact CD1-CE1 3.95Å; I172-Y216 HydrophobicContact CD1-CE2 3.53Å; I172-Y216 HydrophobicContact CD1-CG 3.95Å; I172-Y216 HydrophobicContact CG1-CD2 3.77Å; I172-Y216 HydrophobicContact CG1-CE2 3.58Å; I172-I221 HydrophobicContact CD1-CD1 4.47Å; I172-I221 HydrophobicContact CD1-CG1 4.17Å; I172-I221 HydrophobicContact CD1-CG2 4.12Å
173	N	92.7	Very high	90.7	Very high	48 Å²	48	67.9 Å²	67.9	26%	0.257	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-60.1	130.6	175	-176.2	-36.9	0	0	0	110.7	N175 S176 L179 G197 N198 H199 N200	N173-N175 PolarHBondContact O-N 3.1Å; N173-N175 VanDerWaalsContact O-N 3.13Å; N173-N175 WeakPolarHBondContact OD1-CB 3.47Å; N173-N175 PolarHBondContact OD1-N 2.79Å; N173-S176 WeakPolarHBondContact O-CB 3.31Å; N173-S176 PolarHBondContact O-N 3.22Å; N173-L179 VanDerWaalsContact O-CD1 3.27Å; N173-L179 WeakPolarHBondContact O-CD1 3.36Å; N173-G197 PolarHBondContact OD1-O 3.22Å; N173-N198 PolarHBondContact ND2-OD1 2.73Å; N173-H199 WeakPolarHBondContact CA-O 3.32Å; N173-H199 PolarHBondContact OD1-N 3.03Å; N173-H199 PolarHBondContact OD1-O 3.11Å; N173-N200 HydrophobicContact CB-CB 4.36Å
174	W	93.2	Very high	90.6	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.8	-178.2	-59.5	103.8	0	0	0	113.4	I172 F184 A186 L196 G197 H199 F201 R203 W212 C213 Y214	I172-W174 PolarHBondContact O-N 3.26Å; W174-F184 HydrophobicContact CZ3-CB 4.41Å; W174-A186 HydrophobicContact CB-CB 4.25Å; W174-A186 PolarHBondContact O-N 3.13Å; W174-L196 HydrophobicContact CB-CB 4.27Å; W174-L196 HydrophobicContact CD2-CD2 3.62Å; W174-L196 HydrophobicContact CE3-CD2 3.74Å; W174-L196 HydrophobicContact CG-CB 4.32Å; W174-L196 HydrophobicContact CG-CD2 4.12Å; W174-L196 HydrophobicContact CH2-CD2 4.1Å; W174-L196 HydrophobicContact CZ2-CD2 4.01Å; W174-L196 HydrophobicContact CZ3-CD2 3.95Å; W174-G197 WeakPolarHBondContact CB-O 3.46Å; W174-H199 AromaticContact CD1-CE1 3.75Å; W174-H199 AromaticContact CD1-ND1 3.69Å; W174-H199 PolarHBondContact N-O 3.04Å; W174-F201 PolarHBondContact NE1-O 3.32Å; W174-R203 HydrophobicContact CZ2-CB 4Å; W174-R203 HydrophobicContact CZ2-CG 4.3Å; W174-W212 HydrophobicContact CH2-CE3 4.02Å; W174-W212 HydrophobicContact CH2-CH2 4.17Å; W174-W212 AromaticContact CH2-CZ3 3.81Å; W174-W212 HydrophobicContact CH2-CZ3 3.81Å; W174-W212 HydrophobicContact CZ3-CH2 4.1Å; W174-W212 AromaticContact CZ3-CZ3 3.95Å; W174-W212 HydrophobicContact CZ3-CZ3 3.95Å; W174-C213 HydrophobicContact CZ2-CB 4.21Å; W174-Y214 AromaticContact CE3-CD2 3.98Å; W174-Y214 HydrophobicContact CE3-CD2 3.98Å; W174-Y214 AromaticContact CE3-CE2 3.95Å; W174-Y214 HydrophobicContact CE3-CE2 3.95Å; W174-Y214 HydrophobicContact CH2-CD2 4.44Å; W174-Y214 HydrophobicContact CH2-CE2 4.49Å; W174-Y214 AromaticContact CZ3-CD2 3.65Å; W174-Y214 HydrophobicContact CZ3-CD2 3.65Å; W174-Y214 AromaticContact CZ3-CE2 3.49Å; W174-Y214 HydrophobicContact CZ3-CE2 3.49Å; W174-Y214 VanDerWaalsContact CZ3-CE2 3.49Å
175	N	88.8	Confident	90.7	Very high	68 Å²	68	63.6 Å²	63.6	36%	0.364	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.8	174.7	-163.2	32.4	0	0	0	113.7	N173 T177 A186 Q187 N198	N173-N175 PolarHBondContact O-N 3.1Å; N173-N175 VanDerWaalsContact O-N 3.13Å; N173-N175 WeakPolarHBondContact OD1-CB 3.47Å; N173-N175 PolarHBondContact OD1-N 2.79Å; N175-T177 PolarHBondContact O-N 2.73Å; N175-A186 HydrophobicContact CB-CB 3.68Å; N175-Q187 PolarHBondContact O-NE2 2.92Å; N175-Q187 PolarHBondContact OD1-NE2 2.88Å; N175-N198 HydrophobicContact CB-CB 4.26Å
176	S	88.4	Confident	90.5	Very high	27 Å²	27	64.3 Å²	64.3	19%	0.189	36%	0.364	C	S	.	.			trans	-64.3	134.7	178.9	178.6	0	0	0	0	111.8	N173 S178 L179	N173-S176 WeakPolarHBondContact O-CB 3.31Å; N173-S176 PolarHBondContact O-N 3.22Å; S176-S178 PolarHBondContact O-N 2.87Å; S176-S178 PolarHBondContact OG-N 3.18Å; S176-S178 PolarHBondContact OG-OG 3.47Å; S176-L179 PolarHBondContact O-N 2.54Å
177	T	86.8	Confident	90.1	Very high	106 Å²	106	64 Å²	64	65%	0.65	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-61.8	-23.1	174.6	53.9	0	0	0	0	112.6	N175 L179 R180	N175-T177 PolarHBondContact O-N 2.73Å; T177-L179 PolarHBondContact O-N 3.29Å; T177-R180 VanDerWaalsContact O-CB 3.24Å; T177-R180 WeakPolarHBondContact O-CB 3.26Å; T177-R180 PolarHBondContact O-N 3.26Å; T177-R180 VanDerWaalsContact O-N 3.16Å
178	S	87.8	Confident	89.9	Confident	58 Å²	58	62.7 Å²	62.7	41%	0.406	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-65.9	-20.1	174.4	-50.7	0	0	0	0	113.3	S176 R180 Y216 I221	S176-S178 PolarHBondContact O-N 2.87Å; S176-S178 PolarHBondContact OG-N 3.18Å; S176-S178 PolarHBondContact OG-OG 3.47Å; S178-R180 VanDerWaalsContact C-N 3.32Å; S178-Y216 PolarHBondContact OG-OH 2.66Å; S178-I221 WeakPolarHBondContact O-CD1 3.22Å
179	L	89.4	Confident	89.5	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-88.8	4	176.9	-58.6	-179.3	0	0	0	113	I172 N173 S176 T177 G181 R182 T185 Y214 I221	I172-L179 HydrophobicContact CD1-CD2 4.4Å; I172-L179 HydrophobicContact CG2-CD1 4.01Å; I172-L179 HydrophobicContact CG2-CD2 4.09Å; I172-L179 HydrophobicContact CG2-CG 3.98Å; N173-L179 VanDerWaalsContact O-CD1 3.27Å; N173-L179 WeakPolarHBondContact O-CD1 3.36Å; S176-L179 PolarHBondContact O-N 2.54Å; T177-L179 PolarHBondContact O-N 3.29Å; L179-G181 PolarHBondContact O-N 2.99Å; L179-R182 HydrophobicContact CB-CG 4.41Å; L179-R182 HydrophobicContact CD2-CG 4.47Å; L179-R182 VanDerWaalsContact O-CB 3.24Å; L179-R182 WeakPolarHBondContact O-CB 3.38Å; L179-R182 WeakPolarHBondContact O-CG 3.36Å; L179-R182 PolarHBondContact O-N 2.84Å; L179-T185 HydrophobicContact CB-CG2 3.87Å; L179-T185 WeakPolarHBondContact O-CG2 3.45Å; L179-Y214 HydrophobicContact CD1-CD2 3.7Å; L179-Y214 HydrophobicContact CD1-CE2 4.27Å; L179-Y214 HydrophobicContact CD1-CG 4.43Å; L179-Y214 HydrophobicContact CD2-CD1 4.35Å; L179-Y214 HydrophobicContact CD2-CD2 3.73Å; L179-Y214 HydrophobicContact CD2-CE2 4.38Å; L179-Y214 HydrophobicContact CD2-CG 3.7Å; L179-Y214 HydrophobicContact CG-CD2 4.35Å; L179-I221 HydrophobicContact CD2-CD1 4.21Å; L179-I221 HydrophobicContact CD2-CG2 3.85Å
180	R	86.1	Confident	88.9	Confident	206 Å²	206	70.6 Å²	70.6	78%	0.777	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	127.3	179	-173.8	-178.2	-73.7	167.7	-4	110.5	T177 S178	T177-R180 VanDerWaalsContact O-CB 3.24Å; T177-R180 WeakPolarHBondContact O-CB 3.26Å; T177-R180 PolarHBondContact O-N 3.26Å; T177-R180 VanDerWaalsContact O-N 3.16Å; S178-R180 VanDerWaalsContact C-N 3.32Å
181	G	82.8	Confident	88.6	Confident	82 Å²	82	67.3 Å²	67.3	85%	0.845	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-2.4	-177.7	0	0	0	0	0	115.1	L179	L179-G181 PolarHBondContact O-N 2.99Å
182	R	90.9	Very high	88	Confident	121 Å²	121	70.6 Å²	70.6	46%	0.457	36%	0.363	S	S	.	.			trans	-76.8	155.4	168.2	-61.4	-60.4	-172.8	-179.8	4.8	110.9	L179 T185 Y214 I221	L179-R182 HydrophobicContact CB-CG 4.41Å; L179-R182 HydrophobicContact CD2-CG 4.47Å; L179-R182 VanDerWaalsContact O-CB 3.24Å; L179-R182 WeakPolarHBondContact O-CB 3.38Å; L179-R182 WeakPolarHBondContact O-CG 3.36Å; L179-R182 PolarHBondContact O-N 2.84Å; R182-T185 HydrophobicContact CB-CG2 4.06Å; R182-Y214 HydrophobicContact CB-CE1 4.46Å; R182-Y214 HydrophobicContact CG-CE1 4.36Å; R182-I221 PolarHBondContact NH2-O 3.41Å
183	R	89.6	Confident	87.4	Confident	202 Å²	202	71.6 Å²	71.6	76%	0.762	37%	0.371	S	S	*	.	S	Bend	trans	-68.2	-38.6	-172.8	-174.3	177.5	179.9	-179.9	0.1	113.5
184	F	92.8	Very high	87.2	Confident	16 Å²	16	71 Å²	71	7%	0.07	37%	0.367	C	S	.	.	S	Bend	trans	-117.4	109.7	-177.5	-63	-72.6	0	0	0	109.6	W174 K188 L194 L196 P205 D206 W212 Y214	W174-F184 HydrophobicContact CZ3-CB 4.41Å; F184-K188 HydrophobicContact CD1-CD 4.45Å; F184-L194 HydrophobicContact CD1-CD1 4.33Å; F184-L196 HydrophobicContact CB-CD1 3.98Å; F184-L196 HydrophobicContact CD1-CD1 4.48Å; F184-P205 HydrophobicContact CB-CG 3.98Å; F184-P205 HydrophobicContact CD1-CB 3.57Å; F184-P205 HydrophobicContact CD1-CG 3.69Å; F184-P205 HydrophobicContact CD2-CG 4.12Å; F184-P205 HydrophobicContact CE1-CB 3.86Å; F184-P205 HydrophobicContact CE1-CG 4.17Å; F184-P205 WeakPolarHBondContact CE1-O 3.21Å; F184-P205 HydrophobicContact CG-CB 4.09Å; F184-P205 HydrophobicContact CG-CG 3.66Å; F184-D206 HydrophobicContact CE2-CB 3.67Å; F184-D206 HydrophobicContact CZ-CB 3.58Å; F184-W212 HydrophobicContact CB-CH2 4.21Å; F184-W212 AromaticContact CD2-CH2 3.94Å; F184-W212 HydrophobicContact CD2-CH2 3.94Å; F184-W212 AromaticContact CD2-CZ2 3.74Å; F184-W212 HydrophobicContact CD2-CZ2 3.74Å; F184-W212 HydrophobicContact CE2-CZ2 4.35Å; F184-W212 HydrophobicContact CG-CH2 4.45Å; F184-W212 HydrophobicContact CG-CZ2 4.36Å; F184-Y214 WeakPolarHBondContact O-CE2 3.46Å; F184-Y214 PolarHBondContact O-OH 3.03Å
185	T	92.4	Very high	87	Confident	12 Å²	12	71.1 Å²	71.1	7%	0.074	37%	0.368	C	S	.	.	S	Bend	trans	-147.1	170.1	177.9	72.4	0	0	0	0	109.7	L179 R182 Q187 K188	L179-T185 HydrophobicContact CB-CG2 3.87Å; L179-T185 WeakPolarHBondContact O-CG2 3.45Å; R182-T185 HydrophobicContact CB-CG2 4.06Å; T185-Q187 PolarHBondContact O-N 2.83Å; T185-Q187 PolarHBondContact OG1-N 3.35Å; T185-Q187 PolarHBondContact OG1-OE1 2.77Å; T185-K188 WeakPolarHBondContact O-CB 3.45Å; T185-K188 PolarHBondContact O-N 2.81Å
186	A	88.3	Confident	87.1	Confident	20 Å²	20	68 Å²	68	17%	0.165	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.9	175.3	0	0	0	0	0	113.6	W174 N175 K188	W174-A186 HydrophobicContact CB-CB 4.25Å; W174-A186 PolarHBondContact O-N 3.13Å; N175-A186 HydrophobicContact CB-CB 3.68Å; A186-K188 VanDerWaalsContact C-N 3.33Å
187	Q	85.7	Confident	87.1	Confident	105 Å²	105	67.1 Å²	67.1	49%	0.491	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.8	176.6	-57.4	84	23.5	0	0	113.2	N175 T185	N175-Q187 PolarHBondContact O-NE2 2.92Å; N175-Q187 PolarHBondContact OD1-NE2 2.88Å; T185-Q187 PolarHBondContact O-N 2.83Å; T185-Q187 PolarHBondContact OG1-N 3.35Å; T185-Q187 PolarHBondContact OG1-OE1 2.77Å
188	K	87.1	Confident	87.1	Confident	74 Å²	74	66.1 Å²	66.1	32%	0.322	34%	0.338	S	S	.	.	S	Bend	trans	-69	143.5	175.3	-157.5	-168.7	175.9	-24.3	0	109.8	F184 T185 A186 D190 A191 L194	F184-K188 HydrophobicContact CD1-CD 4.45Å; T185-K188 WeakPolarHBondContact O-CB 3.45Å; T185-K188 PolarHBondContact O-N 2.81Å; A186-K188 VanDerWaalsContact C-N 3.33Å; K188-D190 WeakPolarHBondContact CD-OD1 3.13Å; K188-D190 WeakPolarHBondContact CE-OD1 3.16Å; K188-D190 WeakPolarHBondContact CG-OD1 3.38Å; K188-D190 VanDerWaalsContact NZ-CG 3.34Å; K188-D190 IonicContact NZ-OD1 3.18Å; K188-D190 PolarHBondContact NZ-OD1 3.03Å; K188-D190 IonicContact NZ-OD2 3.93Å; K188-D190 PolarHBondContact NZ-OD2 2.83Å; K188-D190 PolarHBondContact O-N 2.76Å; K188-A191 HydrophobicContact CB-CB 4.19Å; K188-A191 WeakPolarHBondContact O-CB 3.3Å; K188-A191 PolarHBondContact O-N 3.42Å; K188-L194 HydrophobicContact CD-CD1 3.79Å
189	L	81.7	Confident	87.2	Confident	185 Å²	185	64.3 Å²	64.3	97%	0.969	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-34.9	-175.6	-171.7	69.4	0	0	0	113.5
190	D	80.9	Confident	87.4	Confident	63 Å²	63	66.6 Å²	66.6	34%	0.337	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	19.1	179.5	57.7	-22.5	0	0	0	112.2	K188 N192 S193 L194	K188-D190 WeakPolarHBondContact CD-OD1 3.13Å; K188-D190 WeakPolarHBondContact CE-OD1 3.16Å; K188-D190 WeakPolarHBondContact CG-OD1 3.38Å; K188-D190 VanDerWaalsContact NZ-CG 3.34Å; K188-D190 IonicContact NZ-OD1 3.18Å; K188-D190 PolarHBondContact NZ-OD1 3.03Å; K188-D190 IonicContact NZ-OD2 3.93Å; K188-D190 PolarHBondContact NZ-OD2 2.83Å; K188-D190 PolarHBondContact O-N 2.76Å; D190-N192 VanDerWaalsContact C-N 3.29Å; D190-N192 PolarHBondContact O-N 2.84Å; D190-S193 PolarHBondContact O-N 3.02Å; D190-S193 PolarHBondContact O-OG 3.23Å; D190-L194 WeakPolarHBondContact O-CG 3.19Å; D190-L194 PolarHBondContact O-N 3.49Å; D190-L194 VanDerWaalsContact O-N 3.17Å
191	A	86.9	Confident	87.8	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-45.4	-178.8	0	0	0	0	0	112.4	K188 S193 L194 G195 L196	K188-A191 HydrophobicContact CB-CB 4.19Å; K188-A191 WeakPolarHBondContact O-CB 3.3Å; K188-A191 PolarHBondContact O-N 3.42Å; A191-S193 PolarHBondContact O-N 2.95Å; A191-L194 CarbonylContact O-C 3.55Å; A191-L194 WeakPolarHBondContact O-CA 3.26Å; A191-L194 WeakPolarHBondContact O-CB 3.43Å; A191-L194 PolarHBondContact O-N 3.02Å; A191-L194 VanDerWaalsContact O-N 3.09Å; A191-G195 PolarHBondContact O-N 2.91Å; A191-L196 CarbonylContact C-O 3.54Å; A191-L196 HydrophobicContact CB-CB 4.07Å; A191-L196 PolarHBondContact O-N 2.76Å
192	N	82.9	Confident	88.4	Confident	78 Å²	78	54.8 Å²	54.8	42%	0.417	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-40.6	-177.1	-64.8	5.3	0	0	0	112.3	Q141 D190 L194 G195	Q141-N192 PolarHBondContact OE1-ND2 2.85Å; D190-N192 VanDerWaalsContact C-N 3.29Å; D190-N192 PolarHBondContact O-N 2.84Å; N192-L194 VanDerWaalsContact C-N 3.26Å; N192-L194 PolarHBondContact O-N 3.07Å; N192-G195 WeakPolarHBondContact O-CA 3.49Å; N192-G195 PolarHBondContact O-N 2.93Å
193	S	80.8	Confident	88.6	Confident	31 Å²	31	49 Å²	49	22%	0.217	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.5	176.2	47.4	0	0	0	0	113	R159 D190 A191 G195 D264 N287	R159-S193 PolarHBondContact NH2-O 2.99Å; D190-S193 PolarHBondContact O-N 3.02Å; D190-S193 PolarHBondContact O-OG 3.23Å; A191-S193 PolarHBondContact O-N 2.95Å; S193-G195 VanDerWaalsContact C-N 3.26Å; S193-D264 WeakPolarHBondContact CA-OD2 3.36Å; S193-D264 VanDerWaalsContact CB-OD2 3.28Å; S193-D264 WeakPolarHBondContact CB-OD2 3.44Å; S193-N287 WeakPolarHBondContact O-CB 3.37Å; S193-N287 PolarHBondContact O-ND2 2.89Å
194	L	88.3	Confident	88.8	Confident	35 Å²	35	39.8 Å²	39.8	18%	0.183	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-6.2	171.3	-61.6	173.8	0	0	0	112.8	R159 F184 K188 D190 A191 N192 L196 P205	R159-L194 VanDerWaalsContact NH2-C 3.31Å; F184-L194 HydrophobicContact CD1-CD1 4.33Å; K188-L194 HydrophobicContact CD-CD1 3.79Å; D190-L194 WeakPolarHBondContact O-CG 3.19Å; D190-L194 PolarHBondContact O-N 3.49Å; D190-L194 VanDerWaalsContact O-N 3.17Å; A191-L194 CarbonylContact O-C 3.55Å; A191-L194 WeakPolarHBondContact O-CA 3.26Å; A191-L194 WeakPolarHBondContact O-CB 3.43Å; A191-L194 PolarHBondContact O-N 3.02Å; A191-L194 VanDerWaalsContact O-N 3.09Å; N192-L194 VanDerWaalsContact C-N 3.26Å; N192-L194 PolarHBondContact O-N 3.07Å; L194-L196 VanDerWaalsContact C-N 3.27Å; L194-L196 HydrophobicContact CB-CD1 4.04Å; L194-L196 HydrophobicContact CB-CG 3.84Å; L194-L196 HydrophobicContact CD1-CD1 4.24Å; L194-P205 HydrophobicContact CB-CB 4.04Å; L194-P205 HydrophobicContact CD1-CB 4.15Å; L194-P205 HydrophobicContact CD2-CB 4.17Å; L194-P205 HydrophobicContact CG-CB 4.35Å
195	G	88.3	Confident	88.8	Confident	2 Å²	2	39.4 Å²	39.4	2%	0.021	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	20.5	179.9	0	0	0	0	0	112.8	A191 N192 S193 H199 R203	A191-G195 PolarHBondContact O-N 2.91Å; N192-G195 WeakPolarHBondContact O-CA 3.49Å; N192-G195 PolarHBondContact O-N 2.93Å; S193-G195 VanDerWaalsContact C-N 3.26Å; G195-H199 PolarHBondContact O-CE1 3.08Å; G195-H199 PolarHBondContact O-NE2 3.37Å; G195-H199 VanDerWaalsContact O-NE2 3.17Å; G195-R203 WeakPolarHBondContact O-CD 3.21Å; G195-R203 WeakPolarHBondContact O-CG 3.36Å; G195-R203 PolarHBondContact O-NE 3.05Å
196	L	91.8	Very high	88.6	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.22	C	C	.	.			trans	-91	126.6	175.9	-47.1	177.8	0	0	0	107.7	W174 F184 A191 L194 R203 P205	W174-L196 HydrophobicContact CB-CB 4.27Å; W174-L196 HydrophobicContact CD2-CD2 3.62Å; W174-L196 HydrophobicContact CE3-CD2 3.74Å; W174-L196 HydrophobicContact CG-CB 4.32Å; W174-L196 HydrophobicContact CG-CD2 4.12Å; W174-L196 HydrophobicContact CH2-CD2 4.1Å; W174-L196 HydrophobicContact CZ2-CD2 4.01Å; W174-L196 HydrophobicContact CZ3-CD2 3.95Å; F184-L196 HydrophobicContact CB-CD1 3.98Å; F184-L196 HydrophobicContact CD1-CD1 4.48Å; A191-L196 CarbonylContact C-O 3.54Å; A191-L196 HydrophobicContact CB-CB 4.07Å; A191-L196 PolarHBondContact O-N 2.76Å; L194-L196 VanDerWaalsContact C-N 3.27Å; L194-L196 HydrophobicContact CB-CD1 4.04Å; L194-L196 HydrophobicContact CB-CG 3.84Å; L194-L196 HydrophobicContact CD1-CD1 4.24Å; L196-R203 HydrophobicContact CD2-CB 3.93Å; L196-R203 HydrophobicContact CD2-CG 4.05Å; L196-P205 HydrophobicContact CD1-CB 4.3Å; L196-P205 HydrophobicContact CD2-CB 4.38Å; L196-P205 HydrophobicContact CD2-CG 4.34Å
197	G	88.8	Confident	88.6	Confident	9 Å²	9	44.9 Å²	44.9	9%	0.093	23%	0.232	C	C	.	.	S	Bend	trans	-158.5	-163.4	-175.8	0	0	0	0	0	112.2	N173 W174 H199	N173-G197 PolarHBondContact OD1-O 3.22Å; W174-G197 WeakPolarHBondContact CB-O 3.46Å; G197-H199 PolarHBondContact O-N 2.96Å
198	N	86.6	Confident	88.9	Confident	86 Å²	86	42.3 Å²	42.3	46%	0.46	22%	0.222	S	C	.	.	S	Bend	trans	-78.8	61.8	175.9	-169.2	25.1	0	0	0	111.9	N173 N175	N173-N198 PolarHBondContact ND2-OD1 2.73Å; N175-N198 HydrophobicContact CB-CB 4.26Å
199	H	88.9	Confident	89	Confident	19 Å²	19	41.9 Å²	41.9	9%	0.088	23%	0.228	C	C	.	.	S	Bend	trans	-156.1	172	176.6	60.7	68.5	0	0	0	109	N173 W174 G195 G197 F201	N173-H199 WeakPolarHBondContact CA-O 3.32Å; N173-H199 PolarHBondContact OD1-N 3.03Å; N173-H199 PolarHBondContact OD1-O 3.11Å; W174-H199 AromaticContact CD1-CE1 3.75Å; W174-H199 AromaticContact CD1-ND1 3.69Å; W174-H199 PolarHBondContact N-O 3.04Å; G195-H199 PolarHBondContact O-CE1 3.08Å; G195-H199 PolarHBondContact O-NE2 3.37Å; G195-H199 VanDerWaalsContact O-NE2 3.17Å; G197-H199 PolarHBondContact O-N 2.96Å; H199-F201 HydrophobicContact CB-CD2 3.68Å; H199-F201 HydrophobicContact CB-CE2 3.65Å; H199-F201 HydrophobicContact CB-CG 4.28Å; H199-F201 HydrophobicContact CB-CZ 4.22Å; H199-F201 AromaticContact CD2-CD2 3.95Å; H199-F201 AromaticContact CE1-CD2 3.95Å; H199-F201 AromaticContact CG-CD2 3.4Å; H199-F201 VanDerWaalsContact CG-CD2 3.4Å; H199-F201 AromaticContact CG-CE2 3.82Å; H199-F201 AromaticContact ND1-CD2 3.41Å; H199-F201 WeakPolarHBondContact ND1-CD2 3.26Å; H199-F201 AromaticContact ND1-CG 3.74Å; H199-F201 PolarHBondContact ND1-N 3.28Å
200	N	93.3	Very high	89.5	Confident	48 Å²	48	34.2 Å²	34.2	26%	0.257	19%	0.19	S	C	.	.			trans	-114.2	17.1	178.7	67.7	-24.3	0	0	0	113.8	C171 N173	C171-N200 HydrophobicContact CB-CB 4.05Å; C171-N200 WeakPolarHBondContact CB-O 3.21Å; C171-N200 VanDerWaalsContact O-CB 3.24Å; C171-N200 WeakPolarHBondContact O-CB 3.48Å; C171-N200 PolarHBondContact O-ND2 3.21Å; N173-N200 HydrophobicContact CB-CB 4.36Å
201	F	95.3	Very high	90.2	Very high	40 Å²	40	31.3 Å²	31.3	18%	0.175	18%	0.175	C	C	.	.			trans	-65.4	144.3	179	-48.2	-44.2	0	0	0	113.1	I144 T161 W162 W174 H199	I144-F201 HydrophobicContact CD1-CD2 4.05Å; I144-F201 HydrophobicContact CD1-CE2 4.28Å; I144-F201 HydrophobicContact CG1-CE2 4.37Å; I144-F201 HydrophobicContact CG2-CD2 4.24Å; I144-F201 HydrophobicContact CG2-CE2 3.9Å; T161-F201 VanDerWaalsContact C-CD1 3.43Å; T161-F201 VanDerWaalsContact CA-CD1 3.49Å; T161-F201 HydrophobicContact CG2-CE1 4.23Å; T161-F201 HydrophobicContact CG2-CE2 4.22Å; T161-F201 HydrophobicContact CG2-CZ 3.98Å; T161-F201 WeakPolarHBondContact O-CD1 3.09Å; W162-F201 CarbonylContact O-C 3.43Å; W162-F201 WeakPolarHBondContact O-CA 3.46Å; W174-F201 PolarHBondContact NE1-O 3.32Å; H199-F201 HydrophobicContact CB-CD2 3.68Å; H199-F201 HydrophobicContact CB-CE2 3.65Å; H199-F201 HydrophobicContact CB-CG 4.28Å; H199-F201 HydrophobicContact CB-CZ 4.22Å; H199-F201 AromaticContact CD2-CD2 3.95Å; H199-F201 AromaticContact CE1-CD2 3.95Å; H199-F201 AromaticContact CG-CD2 3.4Å; H199-F201 VanDerWaalsContact CG-CD2 3.4Å; H199-F201 AromaticContact CG-CE2 3.82Å; H199-F201 AromaticContact ND1-CD2 3.41Å; H199-F201 WeakPolarHBondContact ND1-CD2 3.26Å; H199-F201 AromaticContact ND1-CG 3.74Å; H199-F201 PolarHBondContact ND1-N 3.28Å
202	C	95.6	Very high	90.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.			trans	-62.4	137	178.8	-58.3	0	0	0	0	112	Y158 W162 P211 C226 V228	Y158-C202 WeakPolarHBondContact CD1-O 3.42Å; W162-C202 PolarHBondContact O-N 3.37Å; W162-C202 PolarHBondContact O-SG 2.79Å; C202-P211 HydrophobicContact CB-CB 4.05Å; C202-C226 HydrophobicContact CB-CB 3.58Å; C202-C226 WeakPolarHBondContact CB-SG 3.31Å; C202-C226 WeakPolarHBondContact SG-CB 3.41Å; C202-C226 CovalentContact SG-SG 2.02Å; C202-C226 PolarHBondContact SG-SG 2.85Å; C202-V228 HydrophobicContact CB-CG2 4.22Å
203	R	95.4	Very high	91.4	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-141.4	163.3	-178.8	-63.3	-64.4	177.4	-107	7.4	110.2	G160 W174 G195 L196 P205 P211 W212	G160-R203 PolarHBondContact O-NH1 3.37Å; W174-R203 HydrophobicContact CZ2-CB 4Å; W174-R203 HydrophobicContact CZ2-CG 4.3Å; G195-R203 WeakPolarHBondContact O-CD 3.21Å; G195-R203 WeakPolarHBondContact O-CG 3.36Å; G195-R203 PolarHBondContact O-NE 3.05Å; L196-R203 HydrophobicContact CD2-CB 3.93Å; L196-R203 HydrophobicContact CD2-CG 4.05Å; R203-P205 VanDerWaalsContact C-CD 3.44Å; R203-P205 WeakPolarHBondContact O-CD 3.24Å; R203-P211 WeakPolarHBondContact O-CA 3.33Å; R203-W212 PolarHBondContact N-O 3.03Å; R203-W212 PolarHBondContact O-N 2.86Å
204	N	94.2	Very high	92.2	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.043	15%	0.147	C	C	.	.			trans	-124.6	70.9	176.1	-168.8	1.1	0	0	0	110.9	Q154 D206 H207 D208 P211	Q154-N204 PolarHBondContact O-ND2 2.81Å; N204-D206 VanDerWaalsContact C-N 3.28Å; N204-D206 PolarHBondContact O-N 3.23Å; N204-D206 PolarHBondContact OD1-OD1 2.93Å; N204-D206 VanDerWaalsContact OD1-OD1 3.12Å; N204-H207 PolarHBondContact OD1-N 3.35Å; N204-D208 PolarHBondContact ND2-O 3.14Å; N204-D208 PolarHBondContact OD1-N 3.48Å; N204-P211 HydrophobicContact CB-CG 4.47Å
205	P	92.1	Very high	92.5	Very high	8 Å²	8	25.3 Å²	25.3	5%	0.052	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.8	-172.5	34.3	-38.9	0	0	0	114.5	F184 L194 L196 R203 W212	F184-P205 HydrophobicContact CB-CG 3.98Å; F184-P205 HydrophobicContact CD1-CB 3.57Å; F184-P205 HydrophobicContact CD1-CG 3.69Å; F184-P205 HydrophobicContact CD2-CG 4.12Å; F184-P205 HydrophobicContact CE1-CB 3.86Å; F184-P205 HydrophobicContact CE1-CG 4.17Å; F184-P205 WeakPolarHBondContact CE1-O 3.21Å; F184-P205 HydrophobicContact CG-CB 4.09Å; F184-P205 HydrophobicContact CG-CG 3.66Å; L194-P205 HydrophobicContact CB-CB 4.04Å; L194-P205 HydrophobicContact CD1-CB 4.15Å; L194-P205 HydrophobicContact CD2-CB 4.17Å; L194-P205 HydrophobicContact CG-CB 4.35Å; L196-P205 HydrophobicContact CD1-CB 4.3Å; L196-P205 HydrophobicContact CD2-CB 4.38Å; L196-P205 HydrophobicContact CD2-CG 4.34Å; R203-P205 VanDerWaalsContact C-CD 3.44Å; R203-P205 WeakPolarHBondContact O-CD 3.24Å; P205-W212 HydrophobicContact CG-CZ2 3.78Å
206	D	88.8	Confident	92.8	Very high	58 Å²	58	30.9 Å²	30.9	31%	0.31	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117	7.1	-175.7	54.2	-7.9	0	0	0	114.4	F184 N204 D208 W212	F184-D206 HydrophobicContact CE2-CB 3.67Å; F184-D206 HydrophobicContact CZ-CB 3.58Å; N204-D206 VanDerWaalsContact C-N 3.28Å; N204-D206 PolarHBondContact O-N 3.23Å; N204-D206 PolarHBondContact OD1-OD1 2.93Å; N204-D206 VanDerWaalsContact OD1-OD1 3.12Å; D206-D208 VanDerWaalsContact C-N 3.32Å; D206-W212 PolarHBondContact OD1-NE1 2.86Å; D206-W212 PolarHBondContact OD2-NE1 2.98Å
207	H	87.8	Confident	92.7	Very high	89 Å²	89	36.1 Å²	36.1	41%	0.412	18%	0.183	S	C	.	.			trans	62.6	35.8	-178.6	-49.8	-88.8	0	0	0	113.2	E156 N204	E156-H207 IonicContact OE1-CE1 3.86Å; E156-H207 IonicContact OE1-CG 3.93Å; E156-H207 IonicContact OE1-ND1 3.42Å; E156-H207 PolarHBondContact OE1-ND1 3.06Å; E156-H207 IonicContact OE2-CE1 2.99Å; E156-H207 PolarHBondContact OE2-CE1 2.83Å; E156-H207 VanDerWaalsContact OE2-CE1 3.28Å; E156-H207 IonicContact OE2-ND1 2.98Å; E156-H207 PolarHBondContact OE2-ND1 3.28Å; N204-H207 PolarHBondContact OD1-N 3.35Å
208	D	91.8	Very high	92.6	Very high	50 Å²	50	39.2 Å²	39.2	27%	0.267	22%	0.215	S	C	.	.			trans	-71.9	176.1	172.4	-150.7	-52.5	0	0	0	110.6	Q154 N204 D206 S210 F225	Q154-D208 WeakPolarHBondContact CB-O 3.25Å; N204-D208 PolarHBondContact ND2-O 3.14Å; N204-D208 PolarHBondContact OD1-N 3.48Å; D206-D208 VanDerWaalsContact C-N 3.32Å; D208-S210 VanDerWaalsContact C-N 3.25Å; D208-S210 PolarHBondContact O-N 2.67Å; D208-F225 HydrophobicContact CB-CE1 4.15Å; D208-F225 WeakPolarHBondContact OD1-CE1 3.39Å; D208-F225 WeakPolarHBondContact OD1-CZ 3.17Å
209	S	89.4	Confident	92.6	Very high	66 Å²	66	42 Å²	42	46%	0.462	24%	0.235	S	C	.	.	S	Bend	trans	-60.9	-23.5	180	57.5	0	0	0	0	115.5	F225	S209-F225 WeakPolarHBondContact OG-CZ 3.35Å
210	S	91.3	Very high	92.7	Very high	24 Å²	24	48 Å²	48	17%	0.168	26%	0.263	C	S	.	.	S	Bend	trans	-158.6	155.2	-176.5	-178.1	0	0	0	0	111.3	D208 W212 F225	D208-S210 VanDerWaalsContact C-N 3.25Å; D208-S210 PolarHBondContact O-N 2.67Å; S210-W212 PolarHBondContact O-N 2.76Å; S210-F225 WeakPolarHBondContact O-CD1 2.95Å
211	P	96.1	Very high	92.6	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.013	26%	0.258	C	S	.	.			trans	-55.5	141.4	169.9	-24.7	35.9	0	0	0	112.1	A151 Q154 Y158 C202 R203 N204 C226 V228	A151-P211 HydrophobicContact CB-CG 4.34Å; Q154-P211 WeakPolarHBondContact O-CD 3.42Å; Y158-P211 HydrophobicContact CD1-CG 4.35Å; C202-P211 HydrophobicContact CB-CB 4.05Å; R203-P211 WeakPolarHBondContact O-CA 3.33Å; N204-P211 HydrophobicContact CB-CG 4.47Å; P211-C226 WeakPolarHBondContact O-CB 3.46Å; P211-C226 PolarHBondContact O-N 3.38Å; P211-V228 HydrophobicContact CB-CG2 4.14Å; P211-V228 HydrophobicContact CG-CG2 4.28Å
212	W	97.1	Very high	92.5	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	172.2	-178.9	63	-95.3	0	0	0	110.9	W174 F184 R203 P205 D206 S210 Y214 W223 E224 F225	W174-W212 HydrophobicContact CH2-CE3 4.02Å; W174-W212 HydrophobicContact CH2-CH2 4.17Å; W174-W212 AromaticContact CH2-CZ3 3.81Å; W174-W212 HydrophobicContact CH2-CZ3 3.81Å; W174-W212 HydrophobicContact CZ3-CH2 4.1Å; W174-W212 AromaticContact CZ3-CZ3 3.95Å; W174-W212 HydrophobicContact CZ3-CZ3 3.95Å; F184-W212 HydrophobicContact CB-CH2 4.21Å; F184-W212 AromaticContact CD2-CH2 3.94Å; F184-W212 HydrophobicContact CD2-CH2 3.94Å; F184-W212 AromaticContact CD2-CZ2 3.74Å; F184-W212 HydrophobicContact CD2-CZ2 3.74Å; F184-W212 HydrophobicContact CE2-CZ2 4.35Å; F184-W212 HydrophobicContact CG-CH2 4.45Å; F184-W212 HydrophobicContact CG-CZ2 4.36Å; R203-W212 PolarHBondContact N-O 3.03Å; R203-W212 PolarHBondContact O-N 2.86Å; P205-W212 HydrophobicContact CG-CZ2 3.78Å; D206-W212 PolarHBondContact OD1-NE1 2.86Å; D206-W212 PolarHBondContact OD2-NE1 2.98Å; S210-W212 PolarHBondContact O-N 2.76Å; W212-Y214 HydrophobicContact CH2-CE1 4.22Å; W212-Y214 AromaticContact CH2-CE2 3.99Å; W212-Y214 HydrophobicContact CH2-CE2 3.99Å; W212-Y214 AromaticContact CH2-CZ 3.71Å; W212-Y214 HydrophobicContact CZ3-CD1 4.14Å; W212-Y214 HydrophobicContact CZ3-CD2 4.06Å; W212-Y214 AromaticContact CZ3-CE1 3.85Å; W212-Y214 HydrophobicContact CZ3-CE1 3.85Å; W212-Y214 AromaticContact CZ3-CE2 3.75Å; W212-Y214 HydrophobicContact CZ3-CE2 3.75Å; W212-Y214 HydrophobicContact CZ3-CG 4.25Å; W212-Y214 AromaticContact CZ3-CZ 3.64Å; W212-W223 HydrophobicContact CB-CE3 4.41Å; W212-W223 HydrophobicContact CD2-CB 4.47Å; W212-W223 HydrophobicContact CE3-CB 3.6Å; W212-W223 HydrophobicContact CE3-CG 4.43Å; W212-W223 HydrophobicContact CG-CE3 4.46Å; W212-W223 HydrophobicContact CZ3-CB 3.68Å; W212-E224 VanDerWaalsContact CA-O 3.27Å; W212-E224 WeakPolarHBondContact CA-O 3.1Å; W212-E224 WeakPolarHBondContact CB-O 3.5Å; W212-F225 HydrophobicContact CB-CD1 4.06Å
213	C	97.4	Very high	92.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	166	171.8	69.3	0	0	0	0	111	C171 W174 W223 E224	C171-C213 VanDerWaalsContact CA-SG 3.52Å; C171-C213 HydrophobicContact CB-CB 3.52Å; C171-C213 WeakPolarHBondContact CB-SG 3.43Å; C171-C213 WeakPolarHBondContact SG-CB 3.08Å; C171-C213 CovalentContact SG-SG 2.02Å; C171-C213 PolarHBondContact SG-SG 3.2Å; W174-C213 HydrophobicContact CZ2-CB 4.21Å; C213-W223 WeakPolarHBondContact O-CA 3.02Å; C213-E224 PolarHBondContact N-O 2.53Å; C213-E224 PolarHBondContact O-N 3.1Å
214	Y	97	Very high	92.4	Very high	14 Å²	14	53.5 Å²	53.5	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	144.3	168.6	-63.9	-75.3	0	0	0	110.9	C171 I172 W174 L179 R182 F184 W212 I221 A222 W223	C171-Y214 CarbonylContact C-O 3.5Å; C171-Y214 WeakPolarHBondContact CA-O 3.35Å; I172-Y214 WeakPolarHBondContact CG1-O 3.12Å; I172-Y214 PolarHBondContact N-O 2.86Å; W174-Y214 AromaticContact CE3-CD2 3.98Å; W174-Y214 HydrophobicContact CE3-CD2 3.98Å; W174-Y214 AromaticContact CE3-CE2 3.95Å; W174-Y214 HydrophobicContact CE3-CE2 3.95Å; W174-Y214 HydrophobicContact CH2-CD2 4.44Å; W174-Y214 HydrophobicContact CH2-CE2 4.49Å; W174-Y214 AromaticContact CZ3-CD2 3.65Å; W174-Y214 HydrophobicContact CZ3-CD2 3.65Å; W174-Y214 AromaticContact CZ3-CE2 3.49Å; W174-Y214 HydrophobicContact CZ3-CE2 3.49Å; W174-Y214 VanDerWaalsContact CZ3-CE2 3.49Å; L179-Y214 HydrophobicContact CD1-CD2 3.7Å; L179-Y214 HydrophobicContact CD1-CE2 4.27Å; L179-Y214 HydrophobicContact CD1-CG 4.43Å; L179-Y214 HydrophobicContact CD2-CD1 4.35Å; L179-Y214 HydrophobicContact CD2-CD2 3.73Å; L179-Y214 HydrophobicContact CD2-CE2 4.38Å; L179-Y214 HydrophobicContact CD2-CG 3.7Å; L179-Y214 HydrophobicContact CG-CD2 4.35Å; R182-Y214 HydrophobicContact CB-CE1 4.46Å; R182-Y214 HydrophobicContact CG-CE1 4.36Å; F184-Y214 WeakPolarHBondContact O-CE2 3.46Å; F184-Y214 PolarHBondContact O-OH 3.03Å; W212-Y214 HydrophobicContact CH2-CE1 4.22Å; W212-Y214 AromaticContact CH2-CE2 3.99Å; W212-Y214 HydrophobicContact CH2-CE2 3.99Å; W212-Y214 AromaticContact CH2-CZ 3.71Å; W212-Y214 HydrophobicContact CZ3-CD1 4.14Å; W212-Y214 HydrophobicContact CZ3-CD2 4.06Å; W212-Y214 AromaticContact CZ3-CE1 3.85Å; W212-Y214 HydrophobicContact CZ3-CE1 3.85Å; W212-Y214 AromaticContact CZ3-CE2 3.75Å; W212-Y214 HydrophobicContact CZ3-CE2 3.75Å; W212-Y214 HydrophobicContact CZ3-CG 4.25Å; W212-Y214 AromaticContact CZ3-CZ 3.64Å; Y214-I221 HydrophobicContact CD1-CG2 3.94Å; Y214-I221 HydrophobicContact CG-CG2 4.26Å; Y214-A222 CarbonylContact C-O 3.54Å; Y214-A222 VanDerWaalsContact CA-O 3.29Å; Y214-A222 WeakPolarHBondContact CA-O 3.08Å; Y214-W223 HydrophobicContact CD1-CB 4.08Å; Y214-W223 HydrophobicContact CE1-CB 4.26Å
215	V	96.3	Very high	92.5	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157	177.8	-60.4	0	0	0	0	110.1	A169 K217 A222 E224	A169-V215 HydrophobicContact CB-CB 3.94Å; A169-V215 HydrophobicContact CB-CG1 3.84Å; A169-V215 HydrophobicContact CB-CG2 4.49Å; V215-K217 HydrophobicContact CG2-CG 4.41Å; V215-A222 PolarHBondContact N-O 2.88Å; V215-A222 PolarHBondContact O-N 3.35Å; V215-E224 HydrophobicContact CG1-CB 4.5Å; V215-E224 HydrophobicContact CG2-CB 4.15Å; V215-E224 HydrophobicContact CG2-CG 3.62Å
216	Y	93.4	Very high	92.7	Very high	120 Å²	120	55 Å²	55	47%	0.471	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.4	170.3	-69.3	-73.9	0	0	0	110	I172 S178 I221	I172-Y216 HydrophobicContact CD1-CD1 4.08Å; I172-Y216 HydrophobicContact CD1-CD2 3.67Å; I172-Y216 HydrophobicContact CD1-CE1 3.95Å; I172-Y216 HydrophobicContact CD1-CE2 3.53Å; I172-Y216 HydrophobicContact CD1-CG 3.95Å; I172-Y216 HydrophobicContact CG1-CD2 3.77Å; I172-Y216 HydrophobicContact CG1-CE2 3.58Å; S178-Y216 PolarHBondContact OG-OH 2.66Å; Y216-I221 HydrophobicContact CD1-CG1 3.97Å; Y216-I221 HydrophobicContact CE1-CD1 4.11Å; Y216-I221 HydrophobicContact CE1-CG1 3.81Å
217	K	89.9	Confident	92.7	Very high	112 Å²	112	60.1 Å²	60.1	49%	0.487	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	89.4	166.8	-70.7	-165.2	178.7	-167.2	0	108.7	V215 T219 Q220 A222 E224	V215-K217 HydrophobicContact CG2-CG 4.41Å; K217-T219 PolarHBondContact O-N 3.08Å; K217-Q220 PolarHBondContact N-O 3.16Å; K217-Q220 PolarHBondContact O-N 2.94Å; K217-Q220 VanDerWaalsContact O-N 3.11Å; K217-A222 HydrophobicContact CD-CB 3.81Å; K217-A222 HydrophobicContact CG-CB 4.04Å; K217-E224 WeakPolarHBondContact CE-OE1 3.45Å; K217-E224 IonicContact NZ-OE1 2.85Å; K217-E224 PolarHBondContact NZ-OE1 2.85Å
218	G	86.9	Confident	92.8	Very high	74 Å²	74	56.4 Å²	56.4	76%	0.763	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	-117.2	-169.5	0	0	0	0	0	110.6
219	T	86.2	Confident	92.6	Very high	145 Å²	145	56.3 Å²	56.3	89%	0.89	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-3.9	177.4	56.3	0	0	0	0	113.8	K217	K217-T219 PolarHBondContact O-N 3.08Å
220	Q	90.3	Very high	92.5	Very high	143 Å²	143	60.2 Å²	60.2	67%	0.668	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	150.7	-177.5	-62.4	-173.7	5.9	0	0	111.5	K217	K217-Q220 PolarHBondContact N-O 3.16Å; K217-Q220 PolarHBondContact O-N 2.94Å; K217-Q220 VanDerWaalsContact O-N 3.11Å
221	I	92.3	Very high	92.1	Very high	30 Å²	30	59.9 Å²	59.9	15%	0.154	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.4	172.3	-63.3	172.7	0	0	0	107.9	I172 S178 L179 R182 Y214 Y216	I172-I221 HydrophobicContact CD1-CD1 4.47Å; I172-I221 HydrophobicContact CD1-CG1 4.17Å; I172-I221 HydrophobicContact CD1-CG2 4.12Å; S178-I221 WeakPolarHBondContact O-CD1 3.22Å; L179-I221 HydrophobicContact CD2-CD1 4.21Å; L179-I221 HydrophobicContact CD2-CG2 3.85Å; R182-I221 PolarHBondContact NH2-O 3.41Å; Y214-I221 HydrophobicContact CD1-CG2 3.94Å; Y214-I221 HydrophobicContact CG-CG2 4.26Å; Y216-I221 HydrophobicContact CD1-CG1 3.97Å; Y216-I221 HydrophobicContact CE1-CD1 4.11Å; Y216-I221 HydrophobicContact CE1-CG1 3.81Å
222	A	92.4	Very high	91.3	Very high	30 Å²	30	65 Å²	65	25%	0.248	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	171.1	171.7	0	0	0	0	0	109.5	Y214 V215 K217	Y214-A222 CarbonylContact C-O 3.54Å; Y214-A222 VanDerWaalsContact CA-O 3.29Å; Y214-A222 WeakPolarHBondContact CA-O 3.08Å; V215-A222 PolarHBondContact N-O 2.88Å; V215-A222 PolarHBondContact O-N 3.35Å; K217-A222 HydrophobicContact CD-CB 3.81Å; K217-A222 HydrophobicContact CG-CB 4.04Å
223	W	94.3	Very high	89.7	Confident	125 Å²	125	73.5 Å²	73.5	47%	0.473	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	148.5	168	64.2	-93.1	0	0	0	109.5	W212 C213 Y214 F225	W212-W223 HydrophobicContact CB-CE3 4.41Å; W212-W223 HydrophobicContact CD2-CB 4.47Å; W212-W223 HydrophobicContact CE3-CB 3.6Å; W212-W223 HydrophobicContact CE3-CG 4.43Å; W212-W223 HydrophobicContact CG-CE3 4.46Å; W212-W223 HydrophobicContact CZ3-CB 3.68Å; C213-W223 WeakPolarHBondContact O-CA 3.02Å; Y214-W223 HydrophobicContact CD1-CB 4.08Å; Y214-W223 HydrophobicContact CE1-CB 4.26Å; W223-F225 HydrophobicContact CH2-CE2 4.29Å; W223-F225 HydrophobicContact CH2-CZ 4.06Å; W223-F225 HydrophobicContact CZ3-CD1 4.41Å; W223-F225 HydrophobicContact CZ3-CD2 4.34Å; W223-F225 AromaticContact CZ3-CE1 3.98Å; W223-F225 HydrophobicContact CZ3-CE1 3.98Å; W223-F225 AromaticContact CZ3-CE2 3.91Å; W223-F225 HydrophobicContact CZ3-CE2 3.91Å; W223-F225 AromaticContact CZ3-CZ 3.71Å; W223-F225 HydrophobicContact CZ3-CZ 3.71Å
224	E	95.7	Very high	88.1	Confident	21 Å²	21	78.3 Å²	78.3	10%	0.098	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.3	175.8	-71.9	-169.7	163.1	0	0	110.5	S165 T167 W212 C213 V215 K217	S165-E224 VanDerWaalsContact CB-OE2 3.27Å; S165-E224 WeakPolarHBondContact CB-OE2 3.38Å; S165-E224 PolarHBondContact OG-OE2 2.92Å; T167-E224 WeakPolarHBondContact CG2-OE2 3.29Å; T167-E224 PolarHBondContact OG1-OE2 3.02Å; W212-E224 VanDerWaalsContact CA-O 3.27Å; W212-E224 WeakPolarHBondContact CA-O 3.1Å; W212-E224 WeakPolarHBondContact CB-O 3.5Å; C213-E224 PolarHBondContact N-O 2.53Å; C213-E224 PolarHBondContact O-N 3.1Å; V215-E224 HydrophobicContact CG1-CB 4.5Å; V215-E224 HydrophobicContact CG2-CB 4.15Å; V215-E224 HydrophobicContact CG2-CG 3.62Å; K217-E224 WeakPolarHBondContact CE-OE1 3.45Å; K217-E224 IonicContact NZ-OE1 2.85Å; K217-E224 PolarHBondContact NZ-OE1 2.85Å
225	F	96.4	Very high	86.3	Confident	47 Å²	47	87.3 Å²	87.3	21%	0.206	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	151.4	170	-66.5	-61.1	0	0	0	111.5	S165 Q166 D208 S209 S210 W212 W223	S165-F225 CarbonylContact C-O 3.59Å; S165-F225 WeakPolarHBondContact CA-O 3.46Å; Q166-F225 VanDerWaalsContact CD-CB 3.49Å; Q166-F225 HydrophobicContact CG-CB 4.16Å; Q166-F225 WeakPolarHBondContact CG-O 3.16Å; Q166-F225 PolarHBondContact N-O 2.79Å; Q166-F225 VanDerWaalsContact NE2-CB 3.33Å; D208-F225 HydrophobicContact CB-CE1 4.15Å; D208-F225 WeakPolarHBondContact OD1-CE1 3.39Å; D208-F225 WeakPolarHBondContact OD1-CZ 3.17Å; S209-F225 WeakPolarHBondContact OG-CZ 3.35Å; S210-F225 WeakPolarHBondContact O-CD1 2.95Å; W212-F225 HydrophobicContact CB-CD1 4.06Å; W223-F225 HydrophobicContact CH2-CE2 4.29Å; W223-F225 HydrophobicContact CH2-CZ 4.06Å; W223-F225 HydrophobicContact CZ3-CD1 4.41Å; W223-F225 HydrophobicContact CZ3-CD2 4.34Å; W223-F225 AromaticContact CZ3-CE1 3.98Å; W223-F225 HydrophobicContact CZ3-CE1 3.98Å; W223-F225 AromaticContact CZ3-CE2 3.91Å; W223-F225 HydrophobicContact CZ3-CE2 3.91Å; W223-F225 AromaticContact CZ3-CZ 3.71Å; W223-F225 HydrophobicContact CZ3-CZ 3.71Å
226	C	95.6	Very high	84.7	Confident	1 Å²	1	91.1 Å²	91.1	1%	0.007	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-98.7	150.9	172.4	-64.8	0	0	0	0	111.5	C202 P211 V228	C202-C226 HydrophobicContact CB-CB 3.58Å; C202-C226 WeakPolarHBondContact CB-SG 3.31Å; C202-C226 WeakPolarHBondContact SG-CB 3.41Å; C202-C226 CovalentContact SG-SG 2.02Å; C202-C226 PolarHBondContact SG-SG 2.85Å; P211-C226 WeakPolarHBondContact O-CB 3.46Å; P211-C226 PolarHBondContact O-N 3.38Å; C226-V228 HydrophobicContact CB-CG2 3.88Å; C226-V228 PolarHBondContact O-N 3.09Å; C226-V228 VanDerWaalsContact O-N 3.09Å
227	Y	88.4	Confident	83.7	Confident	164 Å²	164	88.5 Å²	88.5	64%	0.643	45%	0.45	S	S	*	.			trans	-85	61.9	171.5	-168	-100.9	0	0	0	110.3	W162 P229	W162-Y227 VanDerWaalsContact CZ2-O 3.26Å; W162-Y227 WeakPolarHBondContact CZ2-O 3.22Å; W162-Y227 PolarHBondContact NE1-O 2.81Å; Y227-P229 WeakPolarHBondContact O-CD 3.41Å
228	V	89.6	Confident	83.5	Confident	12 Å²	12	87.1 Å²	87.1	7%	0.073	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-80.2	119.9	173.7	-175.7	0	0	0	0	107.8	A151 Y158 W162 C202 P211 C226 K230	A151-V228 HydrophobicContact CB-CB 4.37Å; A151-V228 HydrophobicContact CB-CG1 3.7Å; Y158-V228 HydrophobicContact CD1-CG1 4.4Å; Y158-V228 HydrophobicContact CD1-CG2 4.42Å; Y158-V228 HydrophobicContact CD2-CG1 4.09Å; Y158-V228 HydrophobicContact CE1-CG1 3.97Å; Y158-V228 HydrophobicContact CE1-CG2 3.91Å; Y158-V228 HydrophobicContact CE2-CG1 3.64Å; Y158-V228 HydrophobicContact CG-CG1 4.45Å; W162-V228 HydrophobicContact CB-CG2 4.03Å; W162-V228 HydrophobicContact CG-CG2 4.07Å; C202-V228 HydrophobicContact CB-CG2 4.22Å; P211-V228 HydrophobicContact CB-CG2 4.14Å; P211-V228 HydrophobicContact CG-CG2 4.28Å; C226-V228 HydrophobicContact CB-CG2 3.88Å; C226-V228 PolarHBondContact O-N 3.09Å; C226-V228 VanDerWaalsContact O-N 3.09Å; V228-K230 PolarHBondContact O-N 2.71Å
229	P	88.7	Confident	83.4	Confident	48 Å²	48	84.3 Å²	84.3	31%	0.312	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-55.8	138.1	177.9	-24.8	34.3	0	0	0	110.7	C150 A151 W162 Y227	C150-P229 CarbonylContact C-O 3.33Å; C150-P229 WeakPolarHBondContact CA-O 3.06Å; C150-P229 HydrophobicContact CB-CB 4.43Å; C150-P229 WeakPolarHBondContact CB-O 3.25Å; A151-P229 PolarHBondContact N-O 2.95Å; W162-P229 HydrophobicContact CH2-CG 4.19Å; W162-P229 HydrophobicContact CZ3-CG 4.22Å; Y227-P229 WeakPolarHBondContact O-CD 3.41Å
230	K	86.3	Confident	83.4	Confident	147 Å²	147	77.9 Å²	77.9	64%	0.639	37%	0.374	S	S	*	.	B	Isolated β-bridge	trans	-73.5	139.5	168.5	-69.9	-170.9	177.2	-175.9	0	108.9	A151 V228	A151-K230 WeakPolarHBondContact O-CA 3.47Å; V228-K230 PolarHBondContact O-N 2.71Å
231	C	83.3	Confident	82.9	Confident	17 Å²	17	75.4 Å²	75.4	12%	0.115	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-62.4	149.7	174.8	-61.2	0	0	0	0	109.7	C150 A151 V152 E233	C150-C231 HydrophobicContact CB-CB 3.91Å; C150-C231 WeakPolarHBondContact CB-SG 3.37Å; C150-C231 PolarHBondContact O-SG 3.26Å; C150-C231 WeakPolarHBondContact SG-CA 3.41Å; C150-C231 WeakPolarHBondContact SG-CB 3.48Å; C150-C231 CovalentContact SG-SG 2.04Å; C150-C231 PolarHBondContact SG-SG 3.31Å; A151-C231 PolarHBondContact O-N 2.78Å; V152-C231 HydrophobicContact CG2-CB 4.5Å; C231-E233 PolarHBondContact O-N 3.31Å
232	P	78.9	Confident	82.4	Confident	110 Å²	110	77 Å²	77	71%	0.714	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-47.8	130.3	-179.4	-27.8	34	0	0	0	111.7	D234	P232-D234 PolarHBondContact O-N 2.97Å
233	E	64.8	Low	81.6	Confident	183 Å²	183	77 Å²	77	86%	0.855	39%	0.39	S	S	*	.			trans	-70.7	97.5	176.2	-70.5	-167.7	175.3	0	0	108.8	C231	C231-E233 PolarHBondContact O-N 3.31Å
234	D	63.5	Low	81	Confident	100 Å²	100	71.1 Å²	71.1	54%	0.535	37%	0.368	S	S	.	.			trans	-83.4	118.6	163.8	-179.4	-5.9	0	0	0	107.5	P232 N236 R237	P232-D234 PolarHBondContact O-N 2.97Å; D234-N236 PolarHBondContact O-N 3.32Å; D234-N236 PolarHBondContact OD1-N 2.93Å; D234-R237 HydrophobicContact CB-CB 4.15Å; D234-R237 WeakPolarHBondContact O-CB 3.22Å; D234-R237 PolarHBondContact O-N 2.82Å
235	K	58.9	Low	80.4	Confident	204 Å²	204	74.6 Å²	74.6	89%	0.887	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-21.5	178.5	-74.3	-175.9	177.4	-179.2	0	112.3
236	N	62.6	Low	79.8	Confident	80 Å²	80	77.6 Å²	77.6	43%	0.428	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	2.9	178.3	-66.8	-26.6	0	0	0	114.3	D234 C239 C320	D234-N236 PolarHBondContact O-N 3.32Å; D234-N236 PolarHBondContact OD1-N 2.93Å; N236-C239 WeakPolarHBondContact CA-SG 3.21Å; N236-C239 VanDerWaalsContact O-O 3.04Å; N236-C239 PolarHBondContact O-SG 3.43Å; N236-C320 PolarHBondContact O-SG 3.01Å
237	R	73.2	Confident	79.3	Confident	66 Å²	66	77.9 Å²	77.9	25%	0.249	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-31.3	-172.6	-162.8	174.5	-175.4	155.3	6.4	114.2	D234 Y247 G249	D234-R237 HydrophobicContact CB-CB 4.15Å; D234-R237 WeakPolarHBondContact O-CB 3.22Å; D234-R237 PolarHBondContact O-N 2.82Å; R237-Y247 WeakPolarHBondContact O-CE2 3.49Å; R237-G249 WeakPolarHBondContact O-CA 3.38Å; R237-G249 PolarHBondContact O-N 2.65Å
238	E	85.1	Confident	79.3	Confident	83 Å²	83	73.5 Å²	73.5	39%	0.388	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	11.7	179.9	-66.8	-59.1	161.1	0	0	113.4	Y247 T250	E238-Y247 PolarHBondContact OE2-OH 3.01Å; E238-T250 VanDerWaalsContact CD-OG1 3.28Å; E238-T250 WeakPolarHBondContact OE1-CB 3.36Å; E238-T250 WeakPolarHBondContact OE1-CG2 3.41Å; E238-T250 PolarHBondContact OE1-N 2.03Å; E238-T250 VanDerWaalsContact OE1-N 3.09Å; E238-T250 PolarHBondContact OE1-OG1 3.32Å; E238-T250 PolarHBondContact OE2-N 2.75Å; E238-T250 PolarHBondContact OE2-OG1 2.04Å
239	C	85.9	Confident	79.1	Confident	15 Å²	15	72.9 Å²	72.9	10%	0.101	39%	0.387	C	S	.	.	S	Bend	trans	-131.1	159.7	174.5	56.4	0	0	0	0	110.8	N236 Y247 P318 C320	N236-C239 WeakPolarHBondContact CA-SG 3.21Å; N236-C239 VanDerWaalsContact O-O 3.04Å; N236-C239 PolarHBondContact O-SG 3.43Å; C239-Y247 WeakPolarHBondContact O-CD2 3.3Å; C239-P318 CarbonylContact C-O 3.51Å; C239-P318 WeakPolarHBondContact CA-O 3.43Å; C239-P318 HydrophobicContact CB-CG 4.34Å; C239-P318 WeakPolarHBondContact CB-O 3.47Å; C239-C320 HydrophobicContact CB-CB 3.98Å; C239-C320 WeakPolarHBondContact CB-SG 3.37Å; C239-C320 PolarHBondContact O-SG 2.93Å; C239-C320 WeakPolarHBondContact SG-CA 3.49Å; C239-C320 WeakPolarHBondContact SG-CB 3.31Å; C239-C320 CovalentContact SG-SG 2.04Å; C239-C320 PolarHBondContact SG-SG 2.66Å
240	V	85.1	Confident	79.1	Confident	10 Å²	10	72.3 Å²	72.3	6%	0.061	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-94.1	128.7	-177.7	171	0	0	0	0	110.2	G242 Y247 P300 I317 P318 K319 C320	V240-G242 WeakPolarHBondContact CG1-O 3.39Å; V240-Y247 HydrophobicContact CG2-CD2 3.99Å; V240-Y247 HydrophobicContact CG2-CG 4.22Å; V240-P300 HydrophobicContact CG2-CG 3.7Å; V240-I317 HydrophobicContact CG2-CB 3.81Å; V240-I317 HydrophobicContact CG2-CD1 4.22Å; V240-I317 HydrophobicContact CG2-CG2 3.64Å; V240-P318 PolarHBondContact N-O 3.49Å; V240-K319 WeakPolarHBondContact O-CA 3.27Å; V240-C320 PolarHBondContact O-N 3.44Å; V240-C320 VanDerWaalsContact O-N 3.14Å
241	V	80.8	Confident	79.3	Confident	91 Å²	91	66.5 Å²	66.5	55%	0.552	36%	0.362	S	S	*	.	S	Bend	trans	-100.2	131.6	162.6	-176.9	0	0	0	0	108.2	S243 G244 C320	V241-S243 PolarHBondContact O-N 3.11Å; V241-G244 PolarHBondContact O-N 3.41Å; V241-G244 VanDerWaalsContact O-N 3.11Å; V241-C320 HydrophobicContact CG2-CB 4.08Å
242	G	80.6	Confident	79.7	Confident	63 Å²	63	67 Å²	67	65%	0.649	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-129.3	-176.7	0	0	0	0	0	112.3	V240	V240-G242 WeakPolarHBondContact CG1-O 3.39Å
243	S	75.6	Confident	80.3	Confident	30 Å²	30	65 Å²	65	21%	0.21	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.4	174.8	60.6	0	0	0	0	113.8	V241 N293 N296 D297 A299 P300	V241-S243 PolarHBondContact O-N 3.11Å; S243-N293 PolarHBondContact O-ND2 3.14Å; S243-N296 PolarHBondContact OG-OD1 2.92Å; S243-D297 WeakPolarHBondContact CB-O 3.46Å; S243-A299 WeakPolarHBondContact O-CA 3.47Å; S243-P300 WeakPolarHBondContact O-CD 3.48Å
244	G	82.8	Confident	81.6	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.01	31%	0.311	C	S	.	.	S	Bend	trans	79.9	21.8	177.8	0	0	0	0	0	115.5	V241 T246 Y247	V241-G244 PolarHBondContact O-N 3.41Å; V241-G244 VanDerWaalsContact O-N 3.11Å; G244-T246 PolarHBondContact O-N 2.85Å; G244-Y247 WeakPolarHBondContact O-CB 3.48Å; G244-Y247 PolarHBondContact O-N 3.5Å
245	Q	81.9	Confident	82.9	Confident	94 Å²	94	57.5 Å²	57.5	44%	0.439	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-39.1	170.7	-71.1	-179.2	67.8	0	0	112.9	Y247 R248 N296	Q245-Y247 VanDerWaalsContact C-N 3.32Å; Q245-R248 PolarHBondContact O-NH1 2.77Å; Q245-R248 PolarHBondContact O-NH2 2.94Å; Q245-N296 HydrophobicContact CG-CB 3.99Å; Q245-N296 WeakPolarHBondContact CG-OD1 3.09Å; Q245-N296 PolarHBondContact NE2-OD1 3.26Å
246	T	83.9	Confident	84.3	Confident	110 Å²	110	51 Å²	51	68%	0.675	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	2.2	176.8	57	0	0	0	0	112.8	G244 R248	G244-T246 PolarHBondContact O-N 2.85Å; T246-R248 WeakPolarHBondContact O-CG 3Å; T246-R248 PolarHBondContact O-N 2.83Å
247	Y	86.1	Confident	85.6	Confident	8 Å²	8	49.7 Å²	49.7	3%	0.031	30%	0.296	C	S	.	.			trans	-62.6	120.9	178.9	177.9	-103	0	0	0	110	R237 E238 C239 V240 G244 Q245 G249 T250 A251 C291 P300 I317	R237-Y247 WeakPolarHBondContact O-CE2 3.49Å; E238-Y247 PolarHBondContact OE2-OH 3.01Å; C239-Y247 WeakPolarHBondContact O-CD2 3.3Å; V240-Y247 HydrophobicContact CG2-CD2 3.99Å; V240-Y247 HydrophobicContact CG2-CG 4.22Å; G244-Y247 WeakPolarHBondContact O-CB 3.48Å; G244-Y247 PolarHBondContact O-N 3.5Å; Q245-Y247 VanDerWaalsContact C-N 3.32Å; Y247-G249 WeakPolarHBondContact OH-CA 3.07Å; Y247-T250 PolarHBondContact OH-N 3.38Å; Y247-A251 HydrophobicContact CE1-CB 4.44Å; Y247-A251 VanDerWaalsContact OH-CB 3.26Å; Y247-A251 WeakPolarHBondContact OH-CB 2.97Å; Y247-A251 PolarHBondContact OH-N 3.22Å; Y247-C291 WeakPolarHBondContact CD1-O 3.45Å; Y247-P300 HydrophobicContact CD1-CB 4.14Å; Y247-P300 HydrophobicContact CD1-CG 3.96Å; Y247-P300 HydrophobicContact CG-CG 4.06Å; Y247-I317 HydrophobicContact CD1-CD1 3.98Å; Y247-I317 HydrophobicContact CD2-CG2 4.41Å; Y247-I317 HydrophobicContact CE1-CD1 3.56Å; Y247-I317 HydrophobicContact CE2-CD1 4.44Å; Y247-I317 HydrophobicContact CE2-CG2 3.72Å
248	R	86.9	Confident	86.5	Confident	71 Å²	71	48 Å²	48	27%	0.268	30%	0.295	S	S	.	.			trans	-127	27	178.3	-62.4	-65.7	175.3	-79	-6	111.4	Q245 T246 D282	Q245-R248 PolarHBondContact O-NH1 2.77Å; Q245-R248 PolarHBondContact O-NH2 2.94Å; T246-R248 WeakPolarHBondContact O-CG 3Å; T246-R248 PolarHBondContact O-N 2.83Å; R248-D282 PolarHBondContact NH2-O 3.4Å
249	G	86.1	Confident	86.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-77.7	-171.1	173	0	0	0	0	0	112.7	R237 Y247 R292	R237-G249 WeakPolarHBondContact O-CA 3.38Å; R237-G249 PolarHBondContact O-N 2.65Å; Y247-G249 WeakPolarHBondContact OH-CA 3.07Å; G249-R292 PolarHBondContact O-NH1 2.88Å; G249-R292 PolarHBondContact O-NH2 2.82Å
250	T	89.1	Confident	87.1	Confident	36 Å²	36	49.6 Å²	49.6	22%	0.221	30%	0.3	C	S	.	.			trans	-114.3	4.9	-165.9	57.7	0	0	0	0	114.3	V152 E238 Y247 S252 F290	V152-T250 HydrophobicContact CG1-CG2 3.63Å; E238-T250 VanDerWaalsContact CD-OG1 3.28Å; E238-T250 WeakPolarHBondContact OE1-CB 3.36Å; E238-T250 WeakPolarHBondContact OE1-CG2 3.41Å; E238-T250 PolarHBondContact OE1-N 2.03Å; E238-T250 VanDerWaalsContact OE1-N 3.09Å; E238-T250 PolarHBondContact OE1-OG1 3.32Å; E238-T250 PolarHBondContact OE2-N 2.75Å; E238-T250 PolarHBondContact OE2-OG1 2.04Å; Y247-T250 PolarHBondContact OH-N 3.38Å; T250-S252 PolarHBondContact O-N 3.15Å; T250-F290 HydrophobicContact CG2-CE1 4.32Å; T250-F290 HydrophobicContact CG2-CE2 4.26Å; T250-F290 HydrophobicContact CG2-CZ 4.11Å; T250-F290 WeakPolarHBondContact O-CD1 3.45Å
251	A	90.3	Very high	87.4	Confident	25 Å²	25	50.5 Å²	50.5	21%	0.207	30%	0.304	C	S	.	.			trans	-53.6	132.1	172.4	0	0	0	0	0	110.6	Y247 F290 C291 I317	Y247-A251 HydrophobicContact CE1-CB 4.44Å; Y247-A251 VanDerWaalsContact OH-CB 3.26Å; Y247-A251 WeakPolarHBondContact OH-CB 2.97Å; Y247-A251 PolarHBondContact OH-N 3.22Å; A251-F290 CarbonylContact O-C 3.45Å; A251-F290 VanDerWaalsContact O-CA 3.24Å; A251-F290 WeakPolarHBondContact O-CA 3.3Å; A251-C291 WeakPolarHBondContact O-CB 3.34Å; A251-C291 PolarHBondContact O-N 2.83Å; A251-C291 PolarHBondContact O-SG 3.26Å; A251-I317 HydrophobicContact CB-CD1 3.95Å; A251-I317 HydrophobicContact CB-CG1 3.66Å
252	S	91.9	Very high	87.8	Confident	26 Å²	26	48.2 Å²	48.2	18%	0.182	29%	0.291	C	S	.	.			trans	-142.5	23.6	-174.6	58.1	0	0	0	0	113	T250 C260 N289	T250-S252 PolarHBondContact O-N 3.15Å; S252-C260 VanDerWaalsContact O-CB 3.27Å; S252-C260 WeakPolarHBondContact O-CB 3.33Å; S252-C260 PolarHBondContact O-N 2.94Å; S252-C260 PolarHBondContact O-SG 3.08Å; S252-N289 WeakPolarHBondContact CB-OD1 3.24Å
253	V	91.3	Very high	88.2	Confident	69 Å²	69	45.2 Å²	45.2	42%	0.418	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-129.1	136.2	-180	-177.1	0	0	0	0	109	S258	V253-S258 WeakPolarHBondContact CA-O 3.01Å
254	T	92.2	Very high	88.7	Confident	3 Å²	3	44 Å²	44	2%	0.018	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-78.1	168.1	179.9	71.5	0	0	0	0	111.7	S256 G257 S258 C302 T304 E313 L314	T254-S256 PolarHBondContact O-N 3.03Å; T254-S256 PolarHBondContact OG1-OG 3.29Å; T254-G257 WeakPolarHBondContact O-CA 3.27Å; T254-G257 PolarHBondContact O-N 3.21Å; T254-S258 PolarHBondContact N-O 2.8Å; T254-S258 VanDerWaalsContact OG1-CB 3.31Å; T254-S258 WeakPolarHBondContact OG1-CB 3.47Å; T254-S258 PolarHBondContact OG1-N 2.61Å; T254-S258 PolarHBondContact OG1-O 3.04Å; T254-C302 WeakPolarHBondContact CG2-SG 3.46Å; T254-T304 HydrophobicContact CG2-CG2 4.27Å; T254-E313 VanDerWaalsContact CB-CD 3.46Å; T254-E313 VanDerWaalsContact CB-OE2 3.24Å; T254-E313 WeakPolarHBondContact CB-OE2 3.5Å; T254-E313 HydrophobicContact CG2-CB 3.78Å; T254-E313 HydrophobicContact CG2-CG 4.36Å; T254-E313 VanDerWaalsContact OG1-CD 3.26Å; T254-E313 PolarHBondContact OG1-OE2 3.4Å; T254-L314 CarbonylContact C-O 3.45Å; T254-L314 WeakPolarHBondContact CA-O 3.35Å
255	K	89.9	Confident	88.8	Confident	122 Å²	122	44.8 Å²	44.8	53%	0.53	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.3	176	-73.2	-178.2	178.3	179.5	0	113.7	G257 L314 D316	K255-G257 PolarHBondContact O-N 3.49Å; K255-L314 HydrophobicContact CD-CB 4.16Å; K255-L314 PolarHBondContact N-O 3.18Å; K255-D316 HydrophobicContact CG-CB 4.02Å
256	S	88.8	Confident	88.7	Confident	67 Å²	67	44.4 Å²	44.4	47%	0.469	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.2	173.5	70.9	0	0	0	0	114.5	T254 S258 E313	T254-S256 PolarHBondContact O-N 3.03Å; T254-S256 PolarHBondContact OG1-OG 3.29Å; S256-S258 PolarHBondContact OG-OG 2.75Å; S256-S258 VanDerWaalsContact OG-OG 3.07Å; S256-E313 WeakPolarHBondContact CA-OE1 3.22Å; S256-E313 WeakPolarHBondContact CB-OE1 3.48Å; S256-E313 PolarHBondContact N-OE1 3.41Å; S256-E313 PolarHBondContact OG-OE1 2.64Å; S256-E313 PolarHBondContact OG-OE2 3.29Å
257	G	90.9	Very high	88.5	Confident	53 Å²	53	41 Å²	41	55%	0.546	25%	0.245	S	C	.	.	S	Bend	trans	86.2	8.6	-176.2	0	0	0	0	0	114.5	T254 K255	T254-G257 WeakPolarHBondContact O-CA 3.27Å; T254-G257 PolarHBondContact O-N 3.21Å; K255-G257 PolarHBondContact O-N 3.49Å
258	S	91.4	Very high	88.2	Confident	32 Å²	32	40.6 Å²	40.6	22%	0.224	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-77.6	138.6	179.9	-56.4	0	0	0	0	111.3	V253 T254 S256 T304	V253-S258 WeakPolarHBondContact CA-O 3.01Å; T254-S258 PolarHBondContact N-O 2.8Å; T254-S258 VanDerWaalsContact OG1-CB 3.31Å; T254-S258 WeakPolarHBondContact OG1-CB 3.47Å; T254-S258 PolarHBondContact OG1-N 2.61Å; T254-S258 PolarHBondContact OG1-O 3.04Å; S256-S258 PolarHBondContact OG-OG 2.75Å; S256-S258 VanDerWaalsContact OG-OG 3.07Å; S258-T304 VanDerWaalsContact CB-OG1 3.3Å; S258-T304 WeakPolarHBondContact CB-OG1 3.35Å
259	K	91.2	Very high	87.6	Confident	126 Å²	126	42 Å²	42	55%	0.548	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-73.5	131	177	-169.3	171.8	-176.9	177.3	0	110.5	T304	K259-T304 PolarHBondContact O-OG1 3.14Å
260	C	93.2	Very high	86.9	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.034	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.9	146.9	177.3	-67.1	0	0	0	0	112.5	S252 N289 C291 C302	S252-C260 VanDerWaalsContact O-CB 3.27Å; S252-C260 WeakPolarHBondContact O-CB 3.33Å; S252-C260 PolarHBondContact O-N 2.94Å; S252-C260 PolarHBondContact O-SG 3.08Å; C260-N289 HydrophobicContact CB-CB 3.85Å; C260-N289 WeakPolarHBondContact CB-O 3.23Å; C260-N289 VanDerWaalsContact O-CB 3.23Å; C260-N289 WeakPolarHBondContact O-CB 3.48Å; C260-N289 PolarHBondContact O-ND2 2.87Å; C260-C291 VanDerWaalsContact SG-SG 3.67Å; C260-C302 WeakPolarHBondContact CA-SG 3.24Å; C260-C302 HydrophobicContact CB-CB 3.47Å; C260-C302 VanDerWaalsContact CB-CB 3.47Å; C260-C302 WeakPolarHBondContact CB-SG 3.45Å; C260-C302 WeakPolarHBondContact SG-CB 3.31Å; C260-C302 CovalentContact SG-SG 2Å; C260-C302 PolarHBondContact SG-SG 2.86Å
261	L	90.4	Very high	86.2	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.147	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-82.2	145.2	167.7	-64.9	174.6	0	0	0	110.7	N289 H303 Y305 L310	L261-N289 VanDerWaalsContact C-CB 3.5Å; L261-H303 HydrophobicContact CB-CB 4.27Å; L261-H303 WeakPolarHBondContact CB-O 3.38Å; L261-H303 HydrophobicContact CD1-CB 4.19Å; L261-H303 PolarHBondContact N-O 2.96Å; L261-Y305 HydrophobicContact CD1-CD2 3.99Å; L261-Y305 HydrophobicContact CD1-CE2 3.76Å; L261-Y305 HydrophobicContact CD2-CD2 4.02Å; L261-Y305 HydrophobicContact CD2-CE2 3.89Å; L261-Y305 HydrophobicContact CG-CD2 4.45Å; L261-Y305 HydrophobicContact CG-CE2 4.43Å; L261-L310 HydrophobicContact CD1-CD1 3.47Å; L261-L310 VanDerWaalsContact CD1-CD1 3.47Å
262	P	89.4	Confident	85.5	Confident	44 Å²	44	61 Å²	61	29%	0.286	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-56.3	144.6	170.1	-26.9	36.1	0	0	0	112.7	D264 S265 I268 H288 N289	P262-D264 WeakPolarHBondContact CB-OD1 3.46Å; P262-D264 PolarHBondContact O-N 2.99Å; P262-S265 WeakPolarHBondContact O-CB 3.44Å; P262-S265 PolarHBondContact O-N 2.76Å; P262-I268 WeakPolarHBondContact O-CD1 3.36Å; P262-H288 WeakPolarHBondContact CA-O 3.49Å; P262-N289 HydrophobicContact CG-CB 4.35Å
263	W	89.2	Confident	85	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.4	179.1	-58.7	94.6	0	0	0	113.4	I268 N273 N274 A275 L285 S286 H288 F290 R292 P294 W301 C302 H303	W263-I268 HydrophobicContact CE3-CD1 4.49Å; W263-I268 WeakPolarHBondContact O-CD1 3.37Å; W263-N273 HydrophobicContact CZ3-CB 4.04Å; W263-N274 CarbonylContact O-C 3.59Å; W263-N274 WeakPolarHBondContact O-CA 2.98Å; W263-N274 WeakPolarHBondContact O-CB 3.41Å; W263-A275 HydrophobicContact CB-CB 4.24Å; W263-A275 PolarHBondContact O-N 2.89Å; W263-L285 HydrophobicContact CB-CB 4Å; W263-L285 HydrophobicContact CD2-CB 4.33Å; W263-L285 HydrophobicContact CD2-CD2 3.47Å; W263-L285 VanDerWaalsContact CD2-CD2 3.47Å; W263-L285 HydrophobicContact CD2-CG 4.36Å; W263-L285 HydrophobicContact CE3-CD1 4.37Å; W263-L285 HydrophobicContact CE3-CD2 3.69Å; W263-L285 HydrophobicContact CE3-CG 4.46Å; W263-L285 HydrophobicContact CG-CB 4.02Å; W263-L285 HydrophobicContact CG-CD2 3.96Å; W263-L285 HydrophobicContact CH2-CD2 4.01Å; W263-L285 HydrophobicContact CZ2-CD2 3.83Å; W263-L285 HydrophobicContact CZ3-CD2 3.94Å; W263-S286 WeakPolarHBondContact CB-O 3.45Å; W263-S286 PolarHBondContact N-O 2.52Å; W263-H288 AromaticContact CD1-CE1 3.95Å; W263-H288 AromaticContact CD1-ND1 3.85Å; W263-H288 PolarHBondContact N-O 3.22Å; W263-H288 VanDerWaalsContact N-O 3.1Å; W263-F290 PolarHBondContact NE1-O 3.39Å; W263-R292 HydrophobicContact CZ2-CB 3.76Å; W263-R292 HydrophobicContact CZ2-CG 4.18Å; W263-P294 HydrophobicContact CH2-CG 4.26Å; W263-P294 HydrophobicContact CZ3-CG 4.41Å; W263-W301 HydrophobicContact CH2-CD2 4.3Å; W263-W301 AromaticContact CH2-CE3 3.99Å; W263-W301 HydrophobicContact CH2-CE3 3.99Å; W263-W301 AromaticContact CH2-CH2 3.97Å; W263-W301 HydrophobicContact CH2-CH2 3.97Å; W263-W301 HydrophobicContact CH2-CZ2 4.26Å; W263-W301 AromaticContact CH2-CZ3 3.83Å; W263-W301 HydrophobicContact CH2-CZ3 3.83Å; W263-W301 WeakPolarHBondContact CZ2-O 3.5Å; W263-W301 AromaticContact CZ3-CH2 3.85Å; W263-W301 HydrophobicContact CZ3-CH2 3.85Å; W263-W301 HydrophobicContact CZ3-CZ2 4.42Å; W263-W301 AromaticContact CZ3-CZ3 3.92Å; W263-W301 HydrophobicContact CZ3-CZ3 3.92Å; W263-C302 HydrophobicContact CZ2-CB 4.36Å; W263-H303 AromaticContact CE3-CD2 3.9Å; W263-H303 AromaticContact CZ3-CD2 3.63Å; W263-H303 AromaticContact CZ3-NE2 3.77Å
264	D	85.8	Confident	84.6	Confident	3 Å²	3	58 Å²	58	2%	0.016	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	17.6	169.6	72.5	-17.9	0	0	0	113.3	Y115 S193 P262 A275 W276 N287	Y115-D264 HydrophobicContact CE1-CB 3.61Å; S193-D264 WeakPolarHBondContact CA-OD2 3.36Å; S193-D264 VanDerWaalsContact CB-OD2 3.28Å; S193-D264 WeakPolarHBondContact CB-OD2 3.44Å; P262-D264 WeakPolarHBondContact CB-OD1 3.46Å; P262-D264 PolarHBondContact O-N 2.99Å; D264-A275 HydrophobicContact CB-CB 3.77Å; D264-W276 VanDerWaalsContact C-CH2 3.4Å; D264-W276 HydrophobicContact CB-CH2 4.04Å; D264-W276 HydrophobicContact CB-CZ2 4.08Å; D264-W276 HydrophobicContact CB-CZ3 4.47Å; D264-W276 WeakPolarHBondContact O-CH2 3.41Å; D264-N287 WeakPolarHBondContact OD1-CA 3.35Å; D264-N287 WeakPolarHBondContact OD2-CA 3.31Å; D264-N287 WeakPolarHBondContact OD2-CB 3.2Å
265	S	85.5	Confident	84.2	Confident	19 Å²	19	57.8 Å²	57.8	13%	0.133	31%	0.305	C	S	.	.			trans	-63	131.6	175.6	173	0	0	0	0	109.9	P262 A267 I268 R269	P262-S265 WeakPolarHBondContact O-CB 3.44Å; P262-S265 PolarHBondContact O-N 2.76Å; S265-A267 PolarHBondContact O-N 2.9Å; S265-A267 PolarHBondContact OG-N 2.74Å; S265-I268 WeakPolarHBondContact O-CG1 3.35Å; S265-I268 PolarHBondContact O-N 2.92Å; S265-R269 PolarHBondContact O-N 3.09Å
266	P	79.2	Confident	83.8	Confident	85 Å²	85	53 Å²	53	55%	0.552	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-54.6	-28.6	175.7	-26.9	34.6	0	0	0	113.3	I268 R269	P266-I268 PolarHBondContact O-N 3.18Å; P266-R269 WeakPolarHBondContact O-CB 3.22Å; P266-R269 PolarHBondContact O-N 3.16Å
267	A	79.6	Confident	83.3	Confident	38 Å²	38	52.5 Å²	52.5	31%	0.314	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61	-31.1	178.3	0	0	0	0	0	113.1	S265 Y305 L310	S265-A267 PolarHBondContact O-N 2.9Å; S265-A267 PolarHBondContact OG-N 2.74Å; A267-Y305 VanDerWaalsContact CB-OH 3.26Å; A267-Y305 WeakPolarHBondContact CB-OH 3.4Å; A267-L310 HydrophobicContact CB-CD1 4.43Å; A267-L310 HydrophobicContact CB-CD2 4.32Å; A267-L310 WeakPolarHBondContact O-CD2 3.5Å
268	I	81	Confident	82.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-106.6	8	-177	64.2	167.4	0	0	0	112.8	P262 W263 S265 P266 R270 K271 N274 H303 L310	P262-I268 WeakPolarHBondContact O-CD1 3.36Å; W263-I268 HydrophobicContact CE3-CD1 4.49Å; W263-I268 WeakPolarHBondContact O-CD1 3.37Å; S265-I268 WeakPolarHBondContact O-CG1 3.35Å; S265-I268 PolarHBondContact O-N 2.92Å; P266-I268 PolarHBondContact O-N 3.18Å; I268-R270 PolarHBondContact O-N 2.93Å; I268-K271 HydrophobicContact CB-CB 4.23Å; I268-K271 HydrophobicContact CB-CG 3.97Å; I268-K271 HydrophobicContact CG2-CG 4.31Å; I268-K271 VanDerWaalsContact O-CB 3.28Å; I268-K271 WeakPolarHBondContact O-CB 3.29Å; I268-K271 PolarHBondContact O-N 3.42Å; I268-N274 HydrophobicContact CD1-CB 4.32Å; I268-N274 HydrophobicContact CG1-CB 4.45Å; I268-H303 HydrophobicContact CG2-CB 3.72Å; I268-L310 HydrophobicContact CG2-CD1 3.84Å; I268-L310 HydrophobicContact CG2-CD2 3.96Å; I268-L310 HydrophobicContact CG2-CG 4.38Å
269	R	73.2	Confident	81.5	Confident	100 Å²	100	55.7 Å²	55.7	38%	0.377	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.6	-179.5	-173.4	178.9	-68.4	152.1	-1.7	113.6	V111 S265 P266 N274 W276	V111-R269 HydrophobicContact CG1-CG 4.04Å; S265-R269 PolarHBondContact O-N 3.09Å; P266-R269 WeakPolarHBondContact O-CB 3.22Å; P266-R269 PolarHBondContact O-N 3.16Å; R269-N274 PolarHBondContact O-ND2 2.04Å; R269-W276 HydrophobicContact CB-CE3 4.46Å; R269-W276 HydrophobicContact CB-CH2 4.42Å; R269-W276 HydrophobicContact CB-CZ3 3.91Å; R269-W276 HydrophobicContact CG-CE3 4.2Å; R269-W276 HydrophobicContact CG-CH2 4.44Å; R269-W276 HydrophobicContact CG-CZ3 4.02Å
270	R	70.7	Confident	80.8	Confident	244 Å²	244	49.7 Å²	49.7	92%	0.921	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-1.5	177.2	-62.5	-175.8	-179.3	178.7	0.2	113.9	I268	I268-R270 PolarHBondContact O-N 2.93Å
271	K	74.5	Confident	79.9	Confident	99 Å²	99	53.3 Å²	53.3	43%	0.43	27%	0.274	S	S	.	.	S	Bend	trans	-86.8	153	176.2	-58.5	-65.3	-172.9	172.9	0	109.7	I268 N274	I268-K271 HydrophobicContact CB-CB 4.23Å; I268-K271 HydrophobicContact CB-CG 3.97Å; I268-K271 HydrophobicContact CG2-CG 4.31Å; I268-K271 VanDerWaalsContact O-CB 3.28Å; I268-K271 WeakPolarHBondContact O-CB 3.29Å; I268-K271 PolarHBondContact O-N 3.42Å; K271-N274 PolarHBondContact O-ND2 3.11Å
272	V	76.6	Confident	79.3	Confident	119 Å²	119	57.3 Å²	57.3	72%	0.721	30%	0.296	S	S	*	.	S	Bend	trans	-67	-44.4	-176.4	178.6	0	0	0	0	112.1	N274	V272-N274 PolarHBondContact O-N 3.28Å
273	N	80.6	Confident	79.1	Confident	18 Å²	18	56.8 Å²	56.8	10%	0.096	29%	0.29	C	S	.	.	S	Bend	trans	-90	94.7	179.1	-66.5	-46.4	0	0	0	110.1	W263 R277 L285 P294 D295 W301 H303	W263-N273 HydrophobicContact CZ3-CB 4.04Å; N273-R277 PolarHBondContact OD1-NH1 2.71Å; N273-L285 HydrophobicContact CB-CD1 4.36Å; N273-P294 HydrophobicContact CB-CG 3.83Å; N273-D295 PolarHBondContact ND2-OD2 2.9Å; N273-W301 HydrophobicContact CB-CH2 3.81Å; N273-W301 HydrophobicContact CB-CZ2 4Å; N273-W301 WeakPolarHBondContact ND2-CZ2 3.37Å; N273-H303 PolarHBondContact O-NE2 3.27Å
274	N	84	Confident	78.8	Confident	12 Å²	12	57.3 Å²	57.3	6%	0.064	30%	0.295	C	S	.	.	S	Bend	trans	-148.5	176.5	177.5	71.8	47.5	0	0	0	110.9	W263 I268 R269 K271 V272 W276 R277 L285	W263-N274 CarbonylContact O-C 3.59Å; W263-N274 WeakPolarHBondContact O-CA 2.98Å; W263-N274 WeakPolarHBondContact O-CB 3.41Å; I268-N274 HydrophobicContact CD1-CB 4.32Å; I268-N274 HydrophobicContact CG1-CB 4.45Å; R269-N274 PolarHBondContact O-ND2 2.04Å; K271-N274 PolarHBondContact O-ND2 3.11Å; V272-N274 PolarHBondContact O-N 3.28Å; N274-W276 VanDerWaalsContact C-N 3.35Å; N274-W276 HydrophobicContact CB-CE3 4.2Å; N274-W276 PolarHBondContact O-N 3.02Å; N274-W276 WeakPolarHBondContact OD1-CA 2.99Å; N274-W276 WeakPolarHBondContact OD1-CB 3.47Å; N274-W276 PolarHBondContact OD1-N 2.97Å; N274-R277 WeakPolarHBondContact O-CG 3.38Å; N274-R277 PolarHBondContact OD1-N 3.19Å; N274-L285 WeakPolarHBondContact O-CD1 3.12Å
275	A	84.3	Confident	78.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.8	-176.2	0	0	0	0	0	115.6	Y115 W263 D264 A280	Y115-A275 HydrophobicContact CD1-CB 4.03Å; Y115-A275 HydrophobicContact CE1-CB 4.08Å; W263-A275 HydrophobicContact CB-CB 4.24Å; W263-A275 PolarHBondContact O-N 2.89Å; D264-A275 HydrophobicContact CB-CB 3.77Å; A275-A280 WeakPolarHBondContact O-CB 3Å
276	W	79.8	Confident	78.8	Confident	20 Å²	20	57.5 Å²	57.5	8%	0.076	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	0.1	-179.5	-61.5	-78.8	0	0	0	113.8	Y115 D264 R269 N274	Y115-W276 AromaticContact CD1-CD1 3.83Å; Y115-W276 HydrophobicContact CD1-CG 4.47Å; Y115-W276 AromaticContact CD1-NE1 3.68Å; Y115-W276 AromaticContact CE1-CD1 3.85Å; Y115-W276 HydrophobicContact CE1-CD2 4.26Å; Y115-W276 AromaticContact CE1-CE2 3.54Å; Y115-W276 HydrophobicContact CE1-CG 4.44Å; Y115-W276 AromaticContact CE1-CZ2 3.95Å; Y115-W276 HydrophobicContact CE1-CZ2 3.95Å; Y115-W276 AromaticContact CE1-NE1 3.22Å; Y115-W276 AromaticContact CE2-NE1 3.84Å; Y115-W276 AromaticContact CZ-CE2 3.78Å; Y115-W276 AromaticContact CZ-CZ2 3.94Å; Y115-W276 AromaticContact CZ-NE1 3.33Å; Y115-W276 VanDerWaalsContact CZ-NE1 3.33Å; Y115-W276 WeakPolarHBondContact OH-CZ2 3.27Å; D264-W276 VanDerWaalsContact C-CH2 3.4Å; D264-W276 HydrophobicContact CB-CH2 4.04Å; D264-W276 HydrophobicContact CB-CZ2 4.08Å; D264-W276 HydrophobicContact CB-CZ3 4.47Å; D264-W276 WeakPolarHBondContact O-CH2 3.41Å; R269-W276 HydrophobicContact CB-CE3 4.46Å; R269-W276 HydrophobicContact CB-CH2 4.42Å; R269-W276 HydrophobicContact CB-CZ3 3.91Å; R269-W276 HydrophobicContact CG-CE3 4.2Å; R269-W276 HydrophobicContact CG-CH2 4.44Å; R269-W276 HydrophobicContact CG-CZ3 4.02Å; N274-W276 VanDerWaalsContact C-N 3.35Å; N274-W276 HydrophobicContact CB-CE3 4.2Å; N274-W276 PolarHBondContact O-N 3.02Å; N274-W276 WeakPolarHBondContact OD1-CA 2.99Å; N274-W276 WeakPolarHBondContact OD1-CB 3.47Å; N274-W276 PolarHBondContact OD1-N 2.97Å
277	R	79.6	Confident	78.8	Confident	58 Å²	58	54.1 Å²	54.1	22%	0.219	27%	0.274	C	S	.	.	S	Bend	trans	-69.7	155.3	173	72.1	-176.8	-71	-173.1	-7.6	111.1	N273 N274 N279 A280	N273-R277 PolarHBondContact OD1-NH1 2.71Å; N274-R277 WeakPolarHBondContact O-CG 3.38Å; N274-R277 PolarHBondContact OD1-N 3.19Å; R277-N279 VanDerWaalsContact C-N 3.32Å; R277-N279 PolarHBondContact NE-OD1 2.9Å; R277-N279 PolarHBondContact NH2-ND2 3.01Å; R277-N279 PolarHBondContact NH2-OD1 2.98Å; R277-N279 PolarHBondContact O-N 2.6Å; R277-A280 HydrophobicContact CG-CB 3.73Å; R277-A280 VanDerWaalsContact O-CB 3.31Å; R277-A280 WeakPolarHBondContact O-CB 3.33Å; R277-A280 PolarHBondContact O-N 3.18Å
278	S	70.1	Confident	78.9	Confident	100 Å²	100	53.1 Å²	53.1	70%	0.699	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-37.1	-174.5	50.1	0	0	0	0	114.4
279	N	73.5	Confident	79.3	Confident	52 Å²	52	53.4 Å²	53.4	28%	0.278	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	28.8	179	64.7	-26.1	0	0	0	112.9	R277 L281 D282 L283	R277-N279 VanDerWaalsContact C-N 3.32Å; R277-N279 PolarHBondContact NE-OD1 2.9Å; R277-N279 PolarHBondContact NH2-ND2 3.01Å; R277-N279 PolarHBondContact NH2-OD1 2.98Å; R277-N279 PolarHBondContact O-N 2.6Å; N279-L281 PolarHBondContact O-N 3.32Å; N279-D282 HydrophobicContact CB-CB 4.5Å; N279-D282 PolarHBondContact O-N 2.97Å; N279-L283 WeakPolarHBondContact O-CG 3.22Å; N279-L283 PolarHBondContact O-N 2.81Å
280	A	76.3	Confident	80.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-41.9	-179	0	0	0	0	0	111.8	A275 R277 L283 G284 L285	A275-A280 WeakPolarHBondContact O-CB 3Å; R277-A280 HydrophobicContact CG-CB 3.73Å; R277-A280 VanDerWaalsContact O-CB 3.31Å; R277-A280 WeakPolarHBondContact O-CB 3.33Å; R277-A280 PolarHBondContact O-N 3.18Å; A280-L283 CarbonylContact O-C 3.55Å; A280-L283 PolarHBondContact O-N 2.99Å; A280-G284 PolarHBondContact O-N 2.9Å; A280-L285 HydrophobicContact CB-CB 4.33Å; A280-L285 WeakPolarHBondContact CB-O 3.23Å; A280-L285 PolarHBondContact O-N 3.12Å
281	L	74.5	Confident	81.3	Confident	80 Å²	80	37.5 Å²	37.5	42%	0.419	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-51.9	177.5	-178.2	70.5	0	0	0	112.4	F137 N279 L283 G284	F137-L281 HydrophobicContact CE1-CD1 4.42Å; F137-L281 HydrophobicContact CE2-CD2 3.85Å; F137-L281 HydrophobicContact CZ-CB 4.48Å; F137-L281 HydrophobicContact CZ-CD1 3.82Å; F137-L281 HydrophobicContact CZ-CD2 3.53Å; F137-L281 HydrophobicContact CZ-CG 4.12Å; N279-L281 PolarHBondContact O-N 3.32Å; L281-L283 PolarHBondContact O-N 3.46Å; L281-G284 PolarHBondContact O-N 2.83Å
282	D	78.8	Confident	82.2	Confident	113 Å²	113	33.2 Å²	33.2	60%	0.604	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.3	-177	-62.2	-31.1	0	0	0	111.4	R248 N279	R248-D282 PolarHBondContact NH2-O 3.4Å; N279-D282 HydrophobicContact CB-CB 4.5Å; N279-D282 PolarHBondContact O-N 2.97Å
283	L	84.1	Confident	82.7	Confident	33 Å²	33	27.7 Å²	27.7	17%	0.173	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-2.3	178.8	-59.4	174.9	0	0	0	113.2	N279 A280 L281 L285 P294	N279-L283 WeakPolarHBondContact O-CG 3.22Å; N279-L283 PolarHBondContact O-N 2.81Å; A280-L283 CarbonylContact O-C 3.55Å; A280-L283 PolarHBondContact O-N 2.99Å; L281-L283 PolarHBondContact O-N 3.46Å; L283-L285 VanDerWaalsContact C-N 3.26Å; L283-L285 HydrophobicContact CB-CD1 4.39Å; L283-L285 HydrophobicContact CB-CG 3.97Å; L283-L285 PolarHBondContact O-N 3.1Å; L283-P294 HydrophobicContact CB-CB 4.06Å; L283-P294 HydrophobicContact CD1-CB 3.89Å; L283-P294 HydrophobicContact CG-CB 4.41Å
284	G	83.6	Confident	82.8	Confident	10 Å²	10	27.4 Å²	27.4	10%	0.103	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	25.8	-177.3	0	0	0	0	0	113.7	A280 L281 H288 R292	A280-G284 PolarHBondContact O-N 2.9Å; L281-G284 PolarHBondContact O-N 2.83Å; G284-H288 PolarHBondContact O-CE1 3Å; G284-H288 PolarHBondContact O-NE2 2.9Å; G284-R292 WeakPolarHBondContact O-CD 3.47Å; G284-R292 WeakPolarHBondContact O-CG 3.41Å; G284-R292 PolarHBondContact O-NE 2.9Å
285	L	88.6	Confident	82.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.			trans	-88.4	112.8	174	-49.1	-177.9	0	0	0	108.7	W263 N273 N274 A280 L283 R292 P294	W263-L285 HydrophobicContact CB-CB 4Å; W263-L285 HydrophobicContact CD2-CB 4.33Å; W263-L285 HydrophobicContact CD2-CD2 3.47Å; W263-L285 VanDerWaalsContact CD2-CD2 3.47Å; W263-L285 HydrophobicContact CD2-CG 4.36Å; W263-L285 HydrophobicContact CE3-CD1 4.37Å; W263-L285 HydrophobicContact CE3-CD2 3.69Å; W263-L285 HydrophobicContact CE3-CG 4.46Å; W263-L285 HydrophobicContact CG-CB 4.02Å; W263-L285 HydrophobicContact CG-CD2 3.96Å; W263-L285 HydrophobicContact CH2-CD2 4.01Å; W263-L285 HydrophobicContact CZ2-CD2 3.83Å; W263-L285 HydrophobicContact CZ3-CD2 3.94Å; N273-L285 HydrophobicContact CB-CD1 4.36Å; N274-L285 WeakPolarHBondContact O-CD1 3.12Å; A280-L285 HydrophobicContact CB-CB 4.33Å; A280-L285 WeakPolarHBondContact CB-O 3.23Å; A280-L285 PolarHBondContact O-N 3.12Å; L283-L285 VanDerWaalsContact C-N 3.26Å; L283-L285 HydrophobicContact CB-CD1 4.39Å; L283-L285 HydrophobicContact CB-CG 3.97Å; L283-L285 PolarHBondContact O-N 3.1Å; L285-R292 HydrophobicContact CD2-CB 3.61Å; L285-R292 HydrophobicContact CD2-CG 3.83Å; L285-P294 HydrophobicContact CD1-CB 3.76Å; L285-P294 HydrophobicContact CD1-CG 4.15Å; L285-P294 HydrophobicContact CD2-CB 3.87Å; L285-P294 HydrophobicContact CD2-CG 3.86Å; L285-P294 HydrophobicContact CG-CB 4.12Å
286	S	82.8	Confident	82	Confident	27 Å²	27	33.2 Å²	33.2	19%	0.189	18%	0.183	C	C	.	.	S	Bend	trans	-144.4	-165.2	-177.7	-168.1	0	0	0	0	110.2	W263 H288	W263-S286 WeakPolarHBondContact CB-O 3.45Å; W263-S286 PolarHBondContact N-O 2.52Å; S286-H288 PolarHBondContact O-N 2.75Å
287	N	77.9	Confident	82	Confident	14 Å²	14	34.6 Å²	34.6	8%	0.075	19%	0.191	C	C	.	.	S	Bend	trans	-66.8	-1.3	-179.5	78.4	-80.8	0	0	0	115.8	E156 G157 R159 S193 D264	E156-N287 PolarHBondContact O-ND2 2.87Å; G157-N287 PolarHBondContact O-OD1 3.28Å; R159-N287 VanDerWaalsContact NH1-CG 3.32Å; R159-N287 PolarHBondContact NH1-ND2 3.48Å; R159-N287 PolarHBondContact NH1-OD1 2.77Å; R159-N287 PolarHBondContact NH2-ND2 3.21Å; R159-N287 PolarHBondContact NH2-OD1 2.8Å; S193-N287 WeakPolarHBondContact O-CB 3.37Å; S193-N287 PolarHBondContact O-ND2 2.89Å; D264-N287 WeakPolarHBondContact OD1-CA 3.35Å; D264-N287 WeakPolarHBondContact OD2-CA 3.31Å; D264-N287 WeakPolarHBondContact OD2-CB 3.2Å
288	H	83	Confident	82	Confident	16 Å²	16	35.5 Å²	35.5	7%	0.074	21%	0.212	C	C	.	.	S	Bend	trans	-92.1	165.8	177.7	63.1	56.1	0	0	0	109.9	P262 W263 G284 S286 F290 R292	P262-H288 WeakPolarHBondContact CA-O 3.49Å; W263-H288 AromaticContact CD1-CE1 3.95Å; W263-H288 AromaticContact CD1-ND1 3.85Å; W263-H288 PolarHBondContact N-O 3.22Å; W263-H288 VanDerWaalsContact N-O 3.1Å; G284-H288 PolarHBondContact O-CE1 3Å; G284-H288 PolarHBondContact O-NE2 2.9Å; S286-H288 PolarHBondContact O-N 2.75Å; H288-F290 HydrophobicContact CB-CD2 3.71Å; H288-F290 HydrophobicContact CB-CE2 3.74Å; H288-F290 HydrophobicContact CB-CG 4.18Å; H288-F290 HydrophobicContact CB-CZ 4.23Å; H288-F290 AromaticContact CD2-CD2 3.47Å; H288-F290 VanDerWaalsContact CD2-CD2 3.47Å; H288-F290 WeakPolarHBondContact CD2-CD2 3.37Å; H288-F290 AromaticContact CD2-CE2 3.86Å; H288-F290 AromaticContact CE1-CD2 3.75Å; H288-F290 AromaticContact CG-CD2 3.27Å; H288-F290 AromaticContact CG-CE2 3.74Å; H288-F290 AromaticContact CG-CG 3.86Å; H288-F290 AromaticContact ND1-CD2 3.46Å; H288-F290 WeakPolarHBondContact ND1-CD2 3.17Å; H288-F290 AromaticContact ND1-CG 3.67Å; H288-F290 PolarHBondContact ND1-N 2.75Å; H288-F290 AromaticContact NE2-CD2 3.74Å; H288-R292 PolarHBondContact CE1-NH2 2.81Å; H288-R292 PolarHBondContact NE2-NH2 3.46Å; H288-R292 VanDerWaalsContact NE2-NH2 3.17Å
289	N	89.6	Confident	82.7	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.037	19%	0.186	C	C	.	.			trans	-102.8	14.5	176.8	70.1	-20.2	0	0	0	113.6	S252 C260 L261 P262	S252-N289 WeakPolarHBondContact CB-OD1 3.24Å; C260-N289 HydrophobicContact CB-CB 3.85Å; C260-N289 WeakPolarHBondContact CB-O 3.23Å; C260-N289 VanDerWaalsContact O-CB 3.23Å; C260-N289 WeakPolarHBondContact O-CB 3.48Å; C260-N289 PolarHBondContact O-ND2 2.87Å; L261-N289 VanDerWaalsContact C-CB 3.5Å; P262-N289 HydrophobicContact CG-CB 4.35Å
290	F	92	Very high	83.7	Confident	10 Å²	10	29.3 Å²	29.3	4%	0.044	17%	0.173	C	C	.	.			trans	-61.7	140.5	178.3	-50.1	-40.3	0	0	0	112	E156 T250 A251 W263 H288 R292	E156-F290 HydrophobicContact CB-CZ 4.33Å; T250-F290 HydrophobicContact CG2-CE1 4.32Å; T250-F290 HydrophobicContact CG2-CE2 4.26Å; T250-F290 HydrophobicContact CG2-CZ 4.11Å; T250-F290 WeakPolarHBondContact O-CD1 3.45Å; A251-F290 CarbonylContact O-C 3.45Å; A251-F290 VanDerWaalsContact O-CA 3.24Å; A251-F290 WeakPolarHBondContact O-CA 3.3Å; W263-F290 PolarHBondContact NE1-O 3.39Å; H288-F290 HydrophobicContact CB-CD2 3.71Å; H288-F290 HydrophobicContact CB-CE2 3.74Å; H288-F290 HydrophobicContact CB-CG 4.18Å; H288-F290 HydrophobicContact CB-CZ 4.23Å; H288-F290 AromaticContact CD2-CD2 3.47Å; H288-F290 VanDerWaalsContact CD2-CD2 3.47Å; H288-F290 WeakPolarHBondContact CD2-CD2 3.37Å; H288-F290 AromaticContact CD2-CE2 3.86Å; H288-F290 AromaticContact CE1-CD2 3.75Å; H288-F290 AromaticContact CG-CD2 3.27Å; H288-F290 AromaticContact CG-CE2 3.74Å; H288-F290 AromaticContact CG-CG 3.86Å; H288-F290 AromaticContact ND1-CD2 3.46Å; H288-F290 WeakPolarHBondContact ND1-CD2 3.17Å; H288-F290 AromaticContact ND1-CG 3.67Å; H288-F290 PolarHBondContact ND1-N 2.75Å; H288-F290 AromaticContact NE2-CD2 3.74Å; F290-R292 VanDerWaalsContact CB-NH1 3.33Å
291	C	93.6	Very high	84.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.174	C	C	.	.			trans	-61.5	135.2	178.4	-57.7	0	0	0	0	110.9	Y247 A251 C260 P300 W301 C315 I317	Y247-C291 WeakPolarHBondContact CD1-O 3.45Å; A251-C291 WeakPolarHBondContact O-CB 3.34Å; A251-C291 PolarHBondContact O-N 2.83Å; A251-C291 PolarHBondContact O-SG 3.26Å; C260-C291 VanDerWaalsContact SG-SG 3.67Å; C291-P300 HydrophobicContact CB-CB 3.99Å; C291-W301 WeakPolarHBondContact CA-O 3.09Å; C291-C315 HydrophobicContact CB-CB 3.57Å; C291-C315 WeakPolarHBondContact CB-SG 3.18Å; C291-C315 WeakPolarHBondContact SG-CB 3.07Å; C291-C315 CovalentContact SG-SG 2Å; C291-C315 PolarHBondContact SG-SG 3.46Å; C291-I317 HydrophobicContact CB-CD1 3.89Å
292	R	94	Very high	85.5	Confident	8 Å²	8	25.8 Å²	25.8	3%	0.03	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-138.4	160.7	179.7	-62.9	-66	177.4	-107.1	5.2	108.8	G249 W263 G284 L285 H288 F290 P294 P300 W301	G249-R292 PolarHBondContact O-NH1 2.88Å; G249-R292 PolarHBondContact O-NH2 2.82Å; W263-R292 HydrophobicContact CZ2-CB 3.76Å; W263-R292 HydrophobicContact CZ2-CG 4.18Å; G284-R292 WeakPolarHBondContact O-CD 3.47Å; G284-R292 WeakPolarHBondContact O-CG 3.41Å; G284-R292 PolarHBondContact O-NE 2.9Å; L285-R292 HydrophobicContact CD2-CB 3.61Å; L285-R292 HydrophobicContact CD2-CG 3.83Å; H288-R292 PolarHBondContact CE1-NH2 2.81Å; H288-R292 PolarHBondContact NE2-NH2 3.46Å; H288-R292 VanDerWaalsContact NE2-NH2 3.17Å; F290-R292 VanDerWaalsContact CB-NH1 3.33Å; R292-P294 VanDerWaalsContact O-CD 3.29Å; R292-P294 WeakPolarHBondContact O-CD 3.44Å; R292-P300 WeakPolarHBondContact O-CA 3.4Å; R292-W301 PolarHBondContact N-O 3.29Å; R292-W301 PolarHBondContact O-N 2.86Å; R292-W301 VanDerWaalsContact O-O 3.05Å
293	N	87.3	Confident	86.1	Confident	3 Å²	3	20.9 Å²	20.9	2%	0.016	13%	0.128	C	C	.	.			trans	-119.2	69.9	172.6	-168.5	-1.4	0	0	0	110.4	S243 D295 N296 D297 P300	S243-N293 PolarHBondContact O-ND2 3.14Å; N293-D295 VanDerWaalsContact C-N 3.27Å; N293-D295 PolarHBondContact O-N 2.86Å; N293-D295 PolarHBondContact OD1-OD1 2.81Å; N293-N296 WeakPolarHBondContact OD1-CA 3.1Å; N293-N296 PolarHBondContact OD1-N 3.16Å; N293-D297 PolarHBondContact ND2-O 3.28Å; N293-D297 PolarHBondContact OD1-N 3.28Å; N293-P300 HydrophobicContact CB-CB 4.41Å; N293-P300 HydrophobicContact CB-CG 4.4Å
294	P	82.4	Confident	86.5	Confident	12 Å²	12	19.6 Å²	19.6	8%	0.078	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.8	-173.3	31	-36.4	0	0	0	115.1	W263 N273 L283 L285 R292 W301	W263-P294 HydrophobicContact CH2-CG 4.26Å; W263-P294 HydrophobicContact CZ3-CG 4.41Å; N273-P294 HydrophobicContact CB-CG 3.83Å; L283-P294 HydrophobicContact CB-CB 4.06Å; L283-P294 HydrophobicContact CD1-CB 3.89Å; L283-P294 HydrophobicContact CG-CB 4.41Å; L285-P294 HydrophobicContact CD1-CB 3.76Å; L285-P294 HydrophobicContact CD1-CG 4.15Å; L285-P294 HydrophobicContact CD2-CB 3.87Å; L285-P294 HydrophobicContact CD2-CG 3.86Å; L285-P294 HydrophobicContact CG-CB 4.12Å; R292-P294 VanDerWaalsContact O-CD 3.29Å; R292-P294 WeakPolarHBondContact O-CD 3.44Å; P294-W301 HydrophobicContact CG-CZ2 3.93Å
295	D	73.4	Confident	86.6	Confident	67 Å²	67	24.8 Å²	24.8	36%	0.358	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	8.3	-175.5	54.1	-2.1	0	0	0	112.9	N273 N293 D297 W301	N273-D295 PolarHBondContact ND2-OD2 2.9Å; N293-D295 VanDerWaalsContact C-N 3.27Å; N293-D295 PolarHBondContact O-N 2.86Å; N293-D295 PolarHBondContact OD1-OD1 2.81Å; D295-D297 VanDerWaalsContact C-N 3.34Å; D295-D297 PolarHBondContact O-N 3.44Å; D295-W301 PolarHBondContact OD1-NE1 2.86Å; D295-W301 WeakPolarHBondContact OD2-CZ2 3.17Å; D295-W301 PolarHBondContact OD2-NE1 3.29Å
296	N	77.8	Confident	86.2	Confident	68 Å²	68	30.5 Å²	30.5	36%	0.364	16%	0.163	S	C	.	.			trans	57.9	41.3	179.2	-171.5	36	0	0	0	114	S243 Q245 N293	S243-N296 PolarHBondContact OG-OD1 2.92Å; Q245-N296 HydrophobicContact CG-CB 3.99Å; Q245-N296 WeakPolarHBondContact CG-OD1 3.09Å; Q245-N296 PolarHBondContact NE2-OD1 3.26Å; N293-N296 WeakPolarHBondContact OD1-CA 3.1Å; N293-N296 PolarHBondContact OD1-N 3.16Å
297	D	79.3	Confident	86	Confident	48 Å²	48	36.3 Å²	36.3	26%	0.257	19%	0.192	S	C	.	.			trans	-61.3	175.9	165.3	-152.4	-48.2	0	0	0	111.4	S243 N293 D295 A299 W312	S243-D297 WeakPolarHBondContact CB-O 3.46Å; N293-D297 PolarHBondContact ND2-O 3.28Å; N293-D297 PolarHBondContact OD1-N 3.28Å; D295-D297 VanDerWaalsContact C-N 3.34Å; D295-D297 PolarHBondContact O-N 3.44Å; D297-A299 PolarHBondContact O-N 3.32Å; D297-W312 WeakPolarHBondContact OD2-CH2 3.21Å; D297-W312 WeakPolarHBondContact OD2-CZ3 3.47Å
298	A	79.9	Confident	86	Confident	78 Å²	78	44.3 Å²	44.3	65%	0.645	23%	0.232	S	C	*	.	S	Bend	trans	-61.8	-25.8	-178.9	0	0	0	0	0	114.1
299	A	84.6	Confident	85.6	Confident	20 Å²	20	50.6 Å²	50.6	17%	0.165	26%	0.261	C	S	.	.	S	Bend	trans	-157.6	165.7	177.4	0	0	0	0	0	110.5	S243 D297 L314	S243-A299 WeakPolarHBondContact O-CA 3.47Å; D297-A299 PolarHBondContact O-N 3.32Å; A299-L314 HydrophobicContact CB-CD2 4.31Å
300	P	93.9	Very high	85.1	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	27%	0.272	C	S	.	.			trans	-59.5	142.9	171.6	-20	32.6	0	0	0	111.8	V240 S243 Y247 C291 R292 N293 C315 I317	V240-P300 HydrophobicContact CG2-CG 3.7Å; S243-P300 WeakPolarHBondContact O-CD 3.48Å; Y247-P300 HydrophobicContact CD1-CB 4.14Å; Y247-P300 HydrophobicContact CD1-CG 3.96Å; Y247-P300 HydrophobicContact CG-CG 4.06Å; C291-P300 HydrophobicContact CB-CB 3.99Å; R292-P300 WeakPolarHBondContact O-CA 3.4Å; N293-P300 HydrophobicContact CB-CB 4.41Å; N293-P300 HydrophobicContact CB-CG 4.4Å; P300-C315 WeakPolarHBondContact O-CB 3.05Å; P300-C315 PolarHBondContact O-N 2.66Å; P300-I317 HydrophobicContact CB-CD1 3.61Å; P300-I317 HydrophobicContact CG-CD1 3.74Å
301	W	95.1	Very high	84.9	Confident	6 Å²	6	54.9 Å²	54.9	2%	0.023	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	175.5	-174.6	63.9	-95.3	0	0	0	110.5	W263 N273 C291 R292 P294 D295 H303 W312 E313 L314	W263-W301 HydrophobicContact CH2-CD2 4.3Å; W263-W301 AromaticContact CH2-CE3 3.99Å; W263-W301 HydrophobicContact CH2-CE3 3.99Å; W263-W301 AromaticContact CH2-CH2 3.97Å; W263-W301 HydrophobicContact CH2-CH2 3.97Å; W263-W301 HydrophobicContact CH2-CZ2 4.26Å; W263-W301 AromaticContact CH2-CZ3 3.83Å; W263-W301 HydrophobicContact CH2-CZ3 3.83Å; W263-W301 WeakPolarHBondContact CZ2-O 3.5Å; W263-W301 AromaticContact CZ3-CH2 3.85Å; W263-W301 HydrophobicContact CZ3-CH2 3.85Å; W263-W301 HydrophobicContact CZ3-CZ2 4.42Å; W263-W301 AromaticContact CZ3-CZ3 3.92Å; W263-W301 HydrophobicContact CZ3-CZ3 3.92Å; N273-W301 HydrophobicContact CB-CH2 3.81Å; N273-W301 HydrophobicContact CB-CZ2 4Å; N273-W301 WeakPolarHBondContact ND2-CZ2 3.37Å; C291-W301 WeakPolarHBondContact CA-O 3.09Å; R292-W301 PolarHBondContact N-O 3.29Å; R292-W301 PolarHBondContact O-N 2.86Å; R292-W301 VanDerWaalsContact O-O 3.05Å; P294-W301 HydrophobicContact CG-CZ2 3.93Å; D295-W301 PolarHBondContact OD1-NE1 2.86Å; D295-W301 WeakPolarHBondContact OD2-CZ2 3.17Å; D295-W301 PolarHBondContact OD2-NE1 3.29Å; W301-H303 AromaticContact CH2-CE1 3.95Å; W301-H303 AromaticContact CH2-NE2 3.73Å; W301-H303 AromaticContact CZ3-CD2 3.85Å; W301-H303 AromaticContact CZ3-CE1 3.77Å; W301-H303 AromaticContact CZ3-NE2 3.63Å; W301-W312 HydrophobicContact CB-CE3 4.21Å; W301-W312 HydrophobicContact CB-CZ3 4.49Å; W301-W312 HydrophobicContact CD2-CE3 4.14Å; W301-W312 HydrophobicContact CE3-CB 3.61Å; W301-W312 HydrophobicContact CE3-CD2 4.37Å; W301-W312 HydrophobicContact CE3-CE3 4.14Å; W301-W312 HydrophobicContact CE3-CG 4.2Å; W301-W312 HydrophobicContact CG-CE3 4.18Å; W301-W312 HydrophobicContact CG-CZ3 4.5Å; W301-W312 HydrophobicContact CZ3-CB 3.59Å; W301-W312 HydrophobicContact CZ3-CG 4.19Å; W301-E313 WeakPolarHBondContact CA-O 3.24Å; W301-E313 VanDerWaalsContact CB-O 3.25Å; W301-E313 WeakPolarHBondContact CB-O 3.5Å; W301-L314 HydrophobicContact CB-CD2 4.01Å
302	C	94.4	Very high	84.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	165.2	173.3	67.7	0	0	0	0	111.8	T254 C260 W263 W312 E313	T254-C302 WeakPolarHBondContact CG2-SG 3.46Å; C260-C302 WeakPolarHBondContact CA-SG 3.24Å; C260-C302 HydrophobicContact CB-CB 3.47Å; C260-C302 VanDerWaalsContact CB-CB 3.47Å; C260-C302 WeakPolarHBondContact CB-SG 3.45Å; C260-C302 WeakPolarHBondContact SG-CB 3.31Å; C260-C302 CovalentContact SG-SG 2Å; C260-C302 PolarHBondContact SG-SG 2.86Å; W263-C302 HydrophobicContact CZ2-CB 4.36Å; C302-W312 VanDerWaalsContact O-CA 3.29Å; C302-W312 WeakPolarHBondContact O-CA 3.45Å; C302-E313 PolarHBondContact N-O 3.39Å; C302-E313 VanDerWaalsContact N-O 3.11Å; C302-E313 PolarHBondContact O-N 3.46Å
303	H	91.3	Very high	84.6	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.046	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	144.3	170.5	-62.8	-86.5	0	0	0	110.4	L261 W263 I268 N273 W301 L310 T311	L261-H303 HydrophobicContact CB-CB 4.27Å; L261-H303 WeakPolarHBondContact CB-O 3.38Å; L261-H303 HydrophobicContact CD1-CB 4.19Å; L261-H303 PolarHBondContact N-O 2.96Å; W263-H303 AromaticContact CE3-CD2 3.9Å; W263-H303 AromaticContact CZ3-CD2 3.63Å; W263-H303 AromaticContact CZ3-NE2 3.77Å; I268-H303 HydrophobicContact CG2-CB 3.72Å; N273-H303 PolarHBondContact O-NE2 3.27Å; W301-H303 AromaticContact CH2-CE1 3.95Å; W301-H303 AromaticContact CH2-NE2 3.73Å; W301-H303 AromaticContact CZ3-CD2 3.85Å; W301-H303 AromaticContact CZ3-CE1 3.77Å; W301-H303 AromaticContact CZ3-NE2 3.63Å; H303-L310 HydrophobicContact CB-CD1 4.49Å; H303-T311 CarbonylContact C-O 3.39Å; H303-T311 WeakPolarHBondContact CA-O 3.44Å
304	T	92.4	Very high	84.8	Confident	6 Å²	6	64 Å²	64	4%	0.037	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	167.4	178.9	-173.5	0	0	0	0	110.8	T254 S258 K259 T311 E313	T254-T304 HydrophobicContact CG2-CG2 4.27Å; S258-T304 VanDerWaalsContact CB-OG1 3.3Å; S258-T304 WeakPolarHBondContact CB-OG1 3.35Å; K259-T304 PolarHBondContact O-OG1 3.14Å; T304-T311 HydrophobicContact CG2-CG2 3.96Å; T304-T311 PolarHBondContact N-O 2.04Å; T304-T311 CarbonylContact O-C 3.42Å; T304-T311 PolarHBondContact O-N 3.26Å; T304-E313 HydrophobicContact CG2-CB 4.19Å
305	Y	85.2	Confident	85.3	Confident	120 Å²	120	63.5 Å²	63.5	47%	0.471	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.8	169.5	-75.3	-74.1	0	0	0	110.2	L261 A267 Q309 L310	L261-Y305 HydrophobicContact CD1-CD2 3.99Å; L261-Y305 HydrophobicContact CD1-CE2 3.76Å; L261-Y305 HydrophobicContact CD2-CD2 4.02Å; L261-Y305 HydrophobicContact CD2-CE2 3.89Å; L261-Y305 HydrophobicContact CG-CD2 4.45Å; L261-Y305 HydrophobicContact CG-CE2 4.43Å; A267-Y305 VanDerWaalsContact CB-OH 3.26Å; A267-Y305 WeakPolarHBondContact CB-OH 3.4Å; Y305-Q309 WeakPolarHBondContact CA-O 3.37Å; Y305-L310 HydrophobicContact CD1-CB 4.31Å; Y305-L310 HydrophobicContact CE1-CB 3.93Å; Y305-L310 HydrophobicContact CE1-CD1 4.23Å
306	K	80.2	Confident	86	Confident	119 Å²	119	66 Å²	66	52%	0.517	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.8	170.4	-167.8	173.8	-175.9	173.9	0	108.5	M308 Q309 T311	K306-M308 VanDerWaalsContact C-N 3.25Å; K306-M308 PolarHBondContact O-N 3.36Å; K306-Q309 PolarHBondContact N-O 3.08Å; K306-Q309 PolarHBondContact O-N 2.66Å; K306-T311 HydrophobicContact CB-CG2 3.7Å
307	N	79.8	Confident	86.5	Confident	149 Å²	149	63.8 Å²	63.8	80%	0.797	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	44.4	-176.3	-58	-21.6	0	0	0	113	Q309	N307-Q309 PolarHBondContact O-N 3.06Å; N307-Q309 VanDerWaalsContact O-N 3.09Å
308	M	76.7	Confident	87	Confident	182 Å²	182	65.5 Å²	65.5	90%	0.897	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	8.7	-175.8	-56.7	179.8	61.8	0	0	115.8	K306	K306-M308 VanDerWaalsContact C-N 3.25Å; K306-M308 PolarHBondContact O-N 3.36Å
309	Q	75.1	Confident	87.2	Confident	148 Å²	148	69.8 Å²	69.8	69%	0.692	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.7	173.1	-66.4	-176.2	-8.1	0	0	110.4	Y305 K306 N307 T311	Y305-Q309 WeakPolarHBondContact CA-O 3.37Å; K306-Q309 PolarHBondContact N-O 3.08Å; K306-Q309 PolarHBondContact O-N 2.66Å; N307-Q309 PolarHBondContact O-N 3.06Å; N307-Q309 VanDerWaalsContact O-N 3.09Å; Q309-T311 PolarHBondContact O-N 3.01Å
310	L	79.9	Confident	87.2	Confident	51 Å²	51	69.9 Å²	69.9	27%	0.267	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	116.9	175.5	178.8	68.6	0	0	0	109.5	L261 A267 I268 H303 Y305	L261-L310 HydrophobicContact CD1-CD1 3.47Å; L261-L310 VanDerWaalsContact CD1-CD1 3.47Å; A267-L310 HydrophobicContact CB-CD1 4.43Å; A267-L310 HydrophobicContact CB-CD2 4.32Å; A267-L310 WeakPolarHBondContact O-CD2 3.5Å; I268-L310 HydrophobicContact CG2-CD1 3.84Å; I268-L310 HydrophobicContact CG2-CD2 3.96Å; I268-L310 HydrophobicContact CG2-CG 4.38Å; H303-L310 HydrophobicContact CB-CD1 4.49Å; Y305-L310 HydrophobicContact CD1-CB 4.31Å; Y305-L310 HydrophobicContact CE1-CB 3.93Å; Y305-L310 HydrophobicContact CE1-CD1 4.23Å
311	T	87.6	Confident	86.3	Confident	57 Å²	57	77 Å²	77	35%	0.35	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	-175.3	178.6	-168.8	0	0	0	0	109.8	H303 T304 K306 Q309	H303-T311 CarbonylContact C-O 3.39Å; H303-T311 WeakPolarHBondContact CA-O 3.44Å; T304-T311 HydrophobicContact CG2-CG2 3.96Å; T304-T311 PolarHBondContact N-O 2.04Å; T304-T311 CarbonylContact O-C 3.42Å; T304-T311 PolarHBondContact O-N 3.26Å; K306-T311 HydrophobicContact CB-CG2 3.7Å; Q309-T311 PolarHBondContact O-N 3.01Å
312	W	90.4	Very high	84.7	Confident	123 Å²	123	83.1 Å²	83.1	47%	0.466	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	160.2	168	66.2	-90.6	0	0	0	110.3	D297 W301 C302 L314	D297-W312 WeakPolarHBondContact OD2-CH2 3.21Å; D297-W312 WeakPolarHBondContact OD2-CZ3 3.47Å; W301-W312 HydrophobicContact CB-CE3 4.21Å; W301-W312 HydrophobicContact CB-CZ3 4.49Å; W301-W312 HydrophobicContact CD2-CE3 4.14Å; W301-W312 HydrophobicContact CE3-CB 3.61Å; W301-W312 HydrophobicContact CE3-CD2 4.37Å; W301-W312 HydrophobicContact CE3-CE3 4.14Å; W301-W312 HydrophobicContact CE3-CG 4.2Å; W301-W312 HydrophobicContact CG-CE3 4.18Å; W301-W312 HydrophobicContact CG-CZ3 4.5Å; W301-W312 HydrophobicContact CZ3-CB 3.59Å; W301-W312 HydrophobicContact CZ3-CG 4.19Å; C302-W312 VanDerWaalsContact O-CA 3.29Å; C302-W312 WeakPolarHBondContact O-CA 3.45Å; W312-L314 HydrophobicContact CZ3-CD2 4.1Å; W312-L314 HydrophobicContact CZ3-CG 4.39Å
313	E	90.5	Very high	82.4	Confident	40 Å²	40	90.8 Å²	90.8	19%	0.187	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	147	177.5	-168.2	-174.5	171.8	0	0	111.3	T254 S256 W301 C302 T304	T254-E313 VanDerWaalsContact CB-CD 3.46Å; T254-E313 VanDerWaalsContact CB-OE2 3.24Å; T254-E313 WeakPolarHBondContact CB-OE2 3.5Å; T254-E313 HydrophobicContact CG2-CB 3.78Å; T254-E313 HydrophobicContact CG2-CG 4.36Å; T254-E313 VanDerWaalsContact OG1-CD 3.26Å; T254-E313 PolarHBondContact OG1-OE2 3.4Å; S256-E313 WeakPolarHBondContact CA-OE1 3.22Å; S256-E313 WeakPolarHBondContact CB-OE1 3.48Å; S256-E313 PolarHBondContact N-OE1 3.41Å; S256-E313 PolarHBondContact OG-OE1 2.64Å; S256-E313 PolarHBondContact OG-OE2 3.29Å; W301-E313 WeakPolarHBondContact CA-O 3.24Å; W301-E313 VanDerWaalsContact CB-O 3.25Å; W301-E313 WeakPolarHBondContact CB-O 3.5Å; C302-E313 PolarHBondContact N-O 3.39Å; C302-E313 VanDerWaalsContact N-O 3.11Å; C302-E313 PolarHBondContact O-N 3.46Å; T304-E313 HydrophobicContact CG2-CB 4.19Å
314	L	91.6	Very high	80	Confident	38 Å²	38	95.9 Å²	95.9	20%	0.199	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	144.9	172.9	-61.7	179.1	0	0	0	111.6	T254 K255 A299 W301 W312	T254-L314 CarbonylContact C-O 3.45Å; T254-L314 WeakPolarHBondContact CA-O 3.35Å; K255-L314 HydrophobicContact CD-CB 4.16Å; K255-L314 PolarHBondContact N-O 3.18Å; A299-L314 HydrophobicContact CB-CD2 4.31Å; W301-L314 HydrophobicContact CB-CD2 4.01Å; W312-L314 HydrophobicContact CZ3-CD2 4.1Å; W312-L314 HydrophobicContact CZ3-CG 4.39Å
315	C	92.7	Very high	77.3	Confident	3 Å²	3	101.2 Å²	101.2	2%	0.02	52%	0.522	C	S	.	.	B	Isolated β-bridge	trans	-89.6	152.9	174.1	-61.5	0	0	0	0	112.5	C291 P300 I317	C291-C315 HydrophobicContact CB-CB 3.57Å; C291-C315 WeakPolarHBondContact CB-SG 3.18Å; C291-C315 WeakPolarHBondContact SG-CB 3.07Å; C291-C315 CovalentContact SG-SG 2Å; C291-C315 PolarHBondContact SG-SG 3.46Å; P300-C315 WeakPolarHBondContact O-CB 3.05Å; P300-C315 PolarHBondContact O-N 2.66Å; C315-I317 HydrophobicContact CB-CD1 3.9Å; C315-I317 HydrophobicContact CB-CG1 3.92Å; C315-I317 PolarHBondContact O-N 3.06Å
316	D	87.5	Confident	75	Confident	120 Å²	120	101.5 Å²	101.5	64%	0.642	54%	0.537	S	S	*	.			trans	-91.3	97.3	173.7	-167.6	21.6	0	0	0	109.4	K255	K255-D316 HydrophobicContact CG-CB 4.02Å
317	I	89.6	Confident	72.9	Confident	20 Å²	20	103.7 Å²	103.7	10%	0.103	55%	0.552	C	S	.	*			trans	-129.5	126.8	-177.2	-48.9	168.3	0	0	0	108.3	V240 Y247 A251 C291 P300 C315	V240-I317 HydrophobicContact CG2-CB 3.81Å; V240-I317 HydrophobicContact CG2-CD1 4.22Å; V240-I317 HydrophobicContact CG2-CG2 3.64Å; Y247-I317 HydrophobicContact CD1-CD1 3.98Å; Y247-I317 HydrophobicContact CD2-CG2 4.41Å; Y247-I317 HydrophobicContact CE1-CD1 3.56Å; Y247-I317 HydrophobicContact CE2-CD1 4.44Å; Y247-I317 HydrophobicContact CE2-CG2 3.72Å; A251-I317 HydrophobicContact CB-CD1 3.95Å; A251-I317 HydrophobicContact CB-CG1 3.66Å; C291-I317 HydrophobicContact CB-CD1 3.89Å; P300-I317 HydrophobicContact CB-CD1 3.61Å; P300-I317 HydrophobicContact CG-CD1 3.74Å; C315-I317 HydrophobicContact CB-CD1 3.9Å; C315-I317 HydrophobicContact CB-CG1 3.92Å; C315-I317 PolarHBondContact O-N 3.06Å
318	P	88.9	Confident	70.4	Confident	85 Å²	85	101.9 Å²	101.9	55%	0.552	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-65.5	151.1	-178.1	27.2	-34.8	0	0	0	111.3	C239 V240	C239-P318 CarbonylContact C-O 3.51Å; C239-P318 WeakPolarHBondContact CA-O 3.43Å; C239-P318 HydrophobicContact CB-CG 4.34Å; C239-P318 WeakPolarHBondContact CB-O 3.47Å; V240-P318 PolarHBondContact N-O 3.49Å
319	K	85	Confident	68.3	Low	168 Å²	168	99 Å²	99	73%	0.73	54%	0.539	S	S	*	.	B	Isolated β-bridge	trans	-78.6	146.2	169.6	-67.8	-173.1	179	-177.8	0	110.4	V240 L321	V240-K319 WeakPolarHBondContact O-CA 3.27Å; K319-L321 PolarHBondContact O-N 3.49Å
320	C	83.9	Confident	66.3	Low	21 Å²	21	97.7 Å²	97.7	14%	0.142	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-66.1	135.6	-179.5	-60.2	0	0	0	0	112	N236 C239 V240 V241 T322	N236-C320 PolarHBondContact O-SG 3.01Å; C239-C320 HydrophobicContact CB-CB 3.98Å; C239-C320 WeakPolarHBondContact CB-SG 3.37Å; C239-C320 PolarHBondContact O-SG 2.93Å; C239-C320 WeakPolarHBondContact SG-CA 3.49Å; C239-C320 WeakPolarHBondContact SG-CB 3.31Å; C239-C320 CovalentContact SG-SG 2.04Å; C239-C320 PolarHBondContact SG-SG 2.66Å; V240-C320 PolarHBondContact O-N 3.44Å; V240-C320 VanDerWaalsContact O-N 3.14Å; V241-C320 HydrophobicContact CG2-CB 4.08Å; C320-T322 PolarHBondContact O-N 3.49Å
321	L	75.1	Confident	63.9	Low	152 Å²	152	98.8 Å²	98.8	80%	0.796	57%	0.567	S	S	*	*			trans	-70.7	111.5	175.3	-68.1	171.1	0	0	0	109	K319 H323	K319-L321 PolarHBondContact O-N 3.49Å; L321-H323 PolarHBondContact O-N 3Å
322	T	60.8	Low	61.1	Low	133 Å²	133	104.3 Å²	104.3	82%	0.816	59%	0.593	S	S	*	*			trans	-79.7	106.1	170.5	45.4	0	0	0	0	108.2	C320 P324	C320-T322 PolarHBondContact O-N 3.49Å; T322-P324 WeakPolarHBondContact O-CD 3.29Å
323	H	46.2	Very low	58.2	Low	162 Å²	162	109.5 Å²	109.5	75%	0.75	61%	0.612	S	S	*	*			trans	-71.4	123.8	168.6	-91.1	-70.7	0	0	0	109.2	L321 S325	L321-H323 PolarHBondContact O-N 3Å; H323-S325 PolarHBondContact O-N 3.13Å
324	P	40.6	Very low	55.1	Low	116 Å²	116	112.3 Å²	112.3	75%	0.753	64%	0.636	S	S	*	*			trans	-70.9	104.5	172.8	28	-30.1	0	0	0	108.3	T322 V326	T322-P324 WeakPolarHBondContact O-CD 3.29Å; P324-V326 PolarHBondContact O-N 2.76Å
325	S	36.4	Very low	52.3	Low	118 Å²	118	116.9 Å²	116.9	83%	0.825	67%	0.669	S	S	*	*			trans	-84.1	105.7	176.3	-57.8	0	0	0	0	109.1	H323	H323-S325 PolarHBondContact O-N 3.13Å
326	V	36.7	Very low	49.1	Very low	127 Å²	127	121.9 Å²	121.9	77%	0.77	70%	0.699	S	S	*	*			trans	-75.7	114.1	170.8	174.3	0	0	0	0	108.8	P324	P324-V326 PolarHBondContact O-N 2.76Å
327	I	35.8	Very low	46.5	Very low	164 Å²	164	122.3 Å²	122.3	84%	0.841	71%	0.706	S	S	*	*			trans	-137.3	115.1	151.4	-59	-176.8	0	0	0	109.1
328	T	27.4	Very low	43.4	Very low	112 Å²	112	128.1 Å²	128.1	69%	0.687	74%	0.737	S	S	*	*			trans	-36.5	138.1	167.2	-22.2	0	0	0	0	112.7
329	T	31.8	Very low	40.9	Very low	121 Å²	121	131 Å²	131	74%	0.742	75%	0.748	S	S	*	*				-179.1	178.8	67.6	-30.2	0	0	0	0	109
330	P	34.7	Very low	38.4	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	75%	0.753	S	S	*	*				-115.1	146.5	-98.9	36.4	-18.6	0	0	0	114.8
331	G	28.5	Very low	36.2	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	79%	0.789	S	S	*	*			trans	103	77.1	142.3	0	0	0	0	0	117.6
332	I	28.9	Very low	34.3	Very low	173 Å²	173	133.3 Å²	133.3	89%	0.887	78%	0.784	S	S	*	*			trans	-132.6	133.9	133.6	-61.6	-174.6	0	0	0	108
333	R	29.7	Very low	33.8	Very low	232 Å²	232	130.2 Å²	130.2	88%	0.875	77%	0.771	S	S	*	*			trans	-43.1	155.8	178.6	-78.5	168.3	165.9	169.5	-5.5	113.5
334	S	26.2	Very low	35.2	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	75%	0.753	S	S	*	*	S	Bend	trans	-15.5	142.6	164.7	-54.2	0	0	0	0	115.5	T336	S334-T336 VanDerWaalsContact C-N 3.29Å; S334-T336 PolarHBondContact O-N 3.24Å
335	P	31.6	Very low	37.6	Very low	135 Å²	135	121 Å²	121	88%	0.877	73%	0.726	S	S	*	*			trans	-61.9	92.8	179.3	27.1	-32.8	0	0	0	109.7	T337	P335-T337 PolarHBondContact O-N 2.82Å
336	T	25.7	Very low	40	Very low	107 Å²	107	115.5 Å²	115.5	66%	0.656	69%	0.687	S	S	*	*			trans	-60.5	118.6	152.7	45	0	0	0	0	105.6	S334 N338	S334-T336 VanDerWaalsContact C-N 3.29Å; S334-T336 PolarHBondContact O-N 3.24Å; T336-N338 PolarHBondContact O-N 3.41Å
337	T	32.8	Very low	42.4	Very low	130 Å²	130	113.7 Å²	113.7	80%	0.798	67%	0.67	S	S	*	*			trans	-23.8	91.7	158.9	49.5	0	0	0	0	112.5	P335	P335-T337 PolarHBondContact O-N 2.82Å
338	N	25.2	Very low	44.6	Very low	141 Å²	141	108 Å²	108	75%	0.754	64%	0.638	S	S	*	*			trans	-102.1	89.4	162.6	-85.1	-19.8	0	0	0	106.9	T336 N340	T336-N338 PolarHBondContact O-N 3.41Å; N338-N340 PolarHBondContact O-N 2.99Å
339	N	36.4	Very low	46.4	Very low	146 Å²	146	107.7 Å²	107.7	78%	0.781	63%	0.632	S	S	*	*			trans	-42.3	108	152.2	-81.9	-32.3	0	0	0	109.2
340	N	31	Very low	47.2	Very low	155 Å²	155	105.1 Å²	105.1	83%	0.829	61%	0.614	S	S	*	*			trans	-151.2	68.3	151.9	-90.3	-26.5	0	0	0	107.9	N338 G342	N338-N340 PolarHBondContact O-N 2.99Å; N340-G342 PolarHBondContact O-N 2.7Å
341	N	37.8	Very low	47.9	Very low	169 Å²	169	103.6 Å²	103.6	90%	0.904	60%	0.599	S	S	*	*			trans	-63.1	85	152	-81.6	-11.8	0	0	0	107.6	A343	N341-A343 PolarHBondContact O-N 3.37Å
342	G	36	Very low	48.6	Very low	66 Å²	66	104.1 Å²	104.1	68%	0.68	59%	0.587	S	S	*	*			trans	-82.4	84.8	170.4	0	0	0	0	0	109.5	N340 T344	N340-G342 PolarHBondContact O-N 2.7Å; G342-T344 PolarHBondContact O-N 3.09Å
343	A	49.4	Very low	49	Very low	67 Å²	67	103.4 Å²	103.4	55%	0.554	59%	0.585	S	S	*	*			trans	-54.3	123.1	170.7	0	0	0	0	0	109.7	N341 C345	N341-A343 PolarHBondContact O-N 3.37Å; A343-C345 PolarHBondContact O-N 3.18Å
344	T	77	Confident	49	Very low	61 Å²	61	99.8 Å²	99.8	37%	0.374	58%	0.583	S	S	.	*			trans	-72.6	118.2	171.2	51.1	0	0	0	0	108	G342 H476	G342-T344 PolarHBondContact O-N 3.09Å; T344-H476 PolarHBondContact O-NE2 3.27Å; T344-H476 VanDerWaalsContact O-NE2 3.13Å
345	C	89.9	Confident	49.5	Very low	25 Å²	25	102.2 Å²	102.2	17%	0.169	58%	0.577	C	S	.	*			trans	-130	162	-179.8	62.7	0	0	0	0	110.1	A343 Q347 P477 C479	A343-C345 PolarHBondContact O-N 3.18Å; C345-Q347 PolarHBondContact O-N 3.17Å; C345-Q347 VanDerWaalsContact O-N 3.1Å; C345-P477 CarbonylContact C-O 3.48Å; C345-P477 WeakPolarHBondContact CA-O 3.47Å; C345-C479 HydrophobicContact CB-CB 4.01Å; C345-C479 WeakPolarHBondContact CB-SG 3.46Å; C345-C479 PolarHBondContact O-SG 3.45Å; C345-C479 WeakPolarHBondContact SG-CA 3.18Å; C345-C479 WeakPolarHBondContact SG-CB 3.19Å; C345-C479 CovalentContact SG-SG 2.05Å; C345-C479 PolarHBondContact SG-SG 2.73Å
346	G	88.3	Confident	49.5	Very low	2 Å²	2	100.5 Å²	100.5	2%	0.021	57%	0.565	C	S	.	*	S	Bend	trans	66.3	13.3	170.8	0	0	0	0	0	114.4	P477 M568	G346-P477 PolarHBondContact N-O 3.29Å; G346-M568 WeakPolarHBondContact CA-O 3.43Å; G346-M568 PolarHBondContact O-N 2.92Å
347	Q	86.5	Confident	49.9	Very low	89 Å²	89	100 Å²	100	42%	0.416	57%	0.572	S	S	.	*			trans	-95.1	140.7	176.3	-67.5	-179.6	-23.2	0	0	109.6	C345	C345-Q347 PolarHBondContact O-N 3.17Å; C345-Q347 VanDerWaalsContact O-N 3.1Å
348	R	82.2	Confident	49.8	Very low	45 Å²	45	102.2 Å²	102.2	17%	0.17	57%	0.571	C	S	.	*			trans	-147.6	162.7	174.2	60.7	169.6	177.1	-159.4	4.1	109.4	D350 E370 P372 W373 E494	R348-D350 PolarHBondContact O-N 3.34Å; R348-E370 WeakPolarHBondContact CD-O 3.29Å; R348-E370 PolarHBondContact NH1-O 2.86Å; R348-P372 HydrophobicContact CB-CG 4.08Å; R348-W373 HydrophobicContact CB-CH2 4.36Å; R348-W373 HydrophobicContact CB-CZ3 4.31Å; R348-W373 HydrophobicContact CG-CH2 4.28Å; R348-E494 IonicContact CZ-OE1 3.91Å; R348-E494 IonicContact CZ-OE2 2.75Å; R348-E494 IonicContact NH1-OE1 3.14Å; R348-E494 IonicContact NH1-OE2 3.83Å; R348-E494 PolarHBondContact NH1-OE2 3.41Å; R348-E494 VanDerWaalsContact NH2-CD 3.28Å; R348-E494 IonicContact NH2-OE1 3.85Å; R348-E494 PolarHBondContact NH2-OE1 2.83Å; R348-E494 IonicContact NH2-OE2 3.51Å; R348-E494 PolarHBondContact NH2-OE2 3.29Å; R348-E494 VanDerWaalsContact NH2-OE2 3.14Å
349	L	64.3	Low	50.2	Low	105 Å²	105	100.2 Å²	100.2	55%	0.55	55%	0.553	S	S	.	*			trans	-72.6	97	175	-162.3	76.9	0	0	0	109.2	N351	L349-N351 PolarHBondContact O-N 3.38Å
350	D	50.1	Low	49.9	Very low	67 Å²	67	98.6 Å²	98.6	36%	0.358	54%	0.542	S	S	.	.			trans	-76.2	89.5	-176.6	-156.8	-13.9	0	0	0	111.1	R348 T352 R563	R348-D350 PolarHBondContact O-N 3.34Å; D350-T352 PolarHBondContact O-N 3.04Å; D350-T352 WeakPolarHBondContact OD1-CB 3.46Å; D350-T352 WeakPolarHBondContact OD1-CG2 3.11Å; D350-T352 PolarHBondContact OD1-N 2.71Å; D350-T352 PolarHBondContact OD1-OG1 3.26Å; D350-R563 IonicContact OD2-CZ 3.76Å; D350-R563 IonicContact OD2-NH1 2.77Å; D350-R563 PolarHBondContact OD2-NH1 3.25Å
351	N	48.3	Very low	50.1	Low	88 Å²	88	96.9 Å²	96.9	47%	0.471	54%	0.537	S	S	.	.			trans	-84.8	17.6	178.1	-91.7	-27.9	0	0	0	113.7	L349 L353	L349-N351 PolarHBondContact O-N 3.38Å; N351-L353 PolarHBondContact O-N 3.34Å
352	T	42.7	Very low	50.7	Low	84 Å²	84	90.1 Å²	90.1	52%	0.515	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10.4	-171.4	49.9	0	0	0	0	115.2	D350	D350-T352 PolarHBondContact O-N 3.04Å; D350-T352 WeakPolarHBondContact OD1-CB 3.46Å; D350-T352 WeakPolarHBondContact OD1-CG2 3.11Å; D350-T352 PolarHBondContact OD1-N 2.71Å; D350-T352 PolarHBondContact OD1-OG1 3.26Å
353	L	37.3	Very low	51.7	Low	159 Å²	159	87.4 Å²	87.4	83%	0.832	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-6.2	-175.2	-71.3	168.2	0	0	0	115.8	N351	N351-L353 PolarHBondContact O-N 3.34Å
354	N	31.1	Very low	52.6	Low	156 Å²	156	88.1 Å²	88.1	83%	0.834	47%	0.467	S	S	*	.	S	Bend	trans	-139	26.1	-171	-87.3	-25.7	0	0	0	116.8
355	R	36.3	Very low	52.3	Low	150 Å²	150	90.4 Å²	90.4	57%	0.566	47%	0.47	S	S	*	.			trans	-128.9	129.1	173.5	-75.8	-176.3	173.5	176.9	-1.4	112.4	A357	R355-A357 PolarHBondContact O-N 3.47Å
356	P	30.9	Very low	51.4	Low	99 Å²	99	89.2 Å²	89.2	64%	0.643	46%	0.462	S	S	*	.			trans	-57.3	135	167.9	-19.2	29.7	0	0	0	110.9	F358	P356-F358 HydrophobicContact CB-CD2 4.29Å; P356-F358 HydrophobicContact CB-CE2 4.13Å; P356-F358 PolarHBondContact O-N 2.78Å; P356-F358 VanDerWaalsContact O-N 3.09Å
357	A	34.1	Very low	51	Low	96 Å²	96	91.6 Å²	91.6	79%	0.793	47%	0.474	S	S	*	.			trans	-78.5	85.8	179	0	0	0	0	0	111	R355	R355-A357 PolarHBondContact O-N 3.47Å
358	F	30	Very low	51.1	Low	176 Å²	176	87.4 Å²	87.4	77%	0.772	46%	0.455	S	S	*	.			trans	-92.6	106.3	159.4	-70.7	-75.9	0	0	0	108.4	P356	P356-F358 HydrophobicContact CB-CD2 4.29Å; P356-F358 HydrophobicContact CB-CE2 4.13Å; P356-F358 PolarHBondContact O-N 2.78Å; P356-F358 VanDerWaalsContact O-N 3.09Å
359	R	34.4	Very low	51.2	Low	100 Å²	100	86.3 Å²	86.3	38%	0.377	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-97.3	117.1	-177.2	-168.9	177.1	-165.5	153.8	3.9	108.8	D549	R359-D549 IonicContact CZ-OD2 2.73Å; R359-D549 IonicContact NE-OD2 3.74Å; R359-D549 IonicContact NH2-OD2 2.85Å; R359-D549 PolarHBondContact NH2-OD2 2.94Å
360	M	30.1	Very low	52.3	Low	111 Å²	111	82.2 Å²	82.2	55%	0.547	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-95.7	152.6	174	-64.3	-167.6	-69.1	0	0	109.7	Y365	M360-Y365 HydrophobicContact CE-CD2 4.02Å; M360-Y365 HydrophobicContact CE-CE2 4.14Å
361	V	36	Very low	54.3	Low	120 Å²	120	79 Å²	79	73%	0.727	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	132.3	177.9	-178.6	0	0	0	0	109.8	L548	V361-L548 HydrophobicContact CG2-CD2 4.21Å
362	G	50	Low	56.5	Low	27 Å²	27	74.9 Å²	74.9	28%	0.278	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	31	179.8	0	0	0	0	0	115.1	K513 L548	G362-K513 PolarHBondContact O-NZ 2.71Å; G362-L548 PolarHBondContact N-O 3.5Å
363	G	55.9	Low	59	Low	9 Å²	9	70.9 Å²	70.9	9%	0.093	37%	0.367	C	S	.	.			trans	84.3	159.7	-176.7	0	0	0	0	0	114.3	R514 D549	G363-R514 WeakPolarHBondContact CA-O 3.19Å; G363-D549 WeakPolarHBondContact CA-OD1 2.98Å; G363-D549 PolarHBondContact N-OD1 2.91Å
364	R	68.8	Low	61.9	Low	82 Å²	82	63.3 Å²	63.3	31%	0.309	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	140	174.4	-172.1	-172.8	173.4	172.7	5.7	109.7	S366 K513 R514	R364-S366 PolarHBondContact O-N 2.86Å; R364-S366 VanDerWaalsContact O-N 3.16Å; R364-K513 WeakPolarHBondContact O-CA 3.47Å; R364-R514 PolarHBondContact N-O 3.43Å; R364-R514 PolarHBondContact O-N 2.84Å
365	Y	71.8	Confident	65	Low	108 Å²	108	55.9 Å²	55.9	42%	0.424	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	121.5	164.2	-70	-56.1	0	0	0	110.2	M360 R511 K513	M360-Y365 HydrophobicContact CE-CD2 4.02Å; M360-Y365 HydrophobicContact CE-CE2 4.14Å; Y365-R511 HydrophobicContact CD1-CB 3.88Å; Y365-R511 HydrophobicContact CD1-CG 4.07Å; Y365-R511 HydrophobicContact CE1-CB 4.22Å; Y365-K513 HydrophobicContact CD1-CG 4.26Å
366	S	70.9	Confident	67.8	Low	1 Å²	1	48.9 Å²	48.9	1%	0.007	26%	0.262	C	S	.	.			trans	-104.9	163.6	-178.8	-169.8	0	0	0	0	109.8	R364 E370 R511 V512	R364-S366 PolarHBondContact O-N 2.86Å; R364-S366 VanDerWaalsContact O-N 3.16Å; S366-E370 PolarHBondContact OG-OE2 3.19Å; S366-R511 PolarHBondContact O-NE 3.24Å; S366-R511 PolarHBondContact O-NH2 2.98Å; S366-V512 PolarHBondContact N-O 2.75Å; S366-V512 WeakPolarHBondContact O-CG1 3.38Å
367	D	80.4	Confident	70.9	Confident	51 Å²	51	44.1 Å²	44.1	27%	0.273	23%	0.231	S	C	.	.			trans	-97.1	152.2	159.3	-169.7	-95.9	0	0	0	108.9	T369 E370 T424	D367-T369 PolarHBondContact O-N 3.48Å; D367-T369 WeakPolarHBondContact OD1-CB 3.42Å; D367-T369 VanDerWaalsContact OD1-CG2 3.31Å; D367-T369 WeakPolarHBondContact OD1-CG2 3.49Å; D367-T369 PolarHBondContact OD1-N 2.82Å; D367-T369 PolarHBondContact OD1-OG1 3.06Å; D367-E370 PolarHBondContact O-N 3.42Å; D367-E370 VanDerWaalsContact O-N 3.09Å; D367-T424 PolarHBondContact OD2-OG1 3.03Å
368	I	87.6	Confident	73.8	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.7	-27	179.2	-165.3	63.8	0	0	0	112.1	E370 Q371 P372 Q374 T424 E474	I368-E370 PolarHBondContact O-N 2.86Å; I368-E370 VanDerWaalsContact O-N 3.16Å; I368-Q371 CarbonylContact O-C 3.56Å; I368-Q371 WeakPolarHBondContact O-CA 2.98Å; I368-Q371 PolarHBondContact O-N 3.29Å; I368-P372 WeakPolarHBondContact O-CA 3.42Å; I368-P372 VanDerWaalsContact O-N 3.08Å; I368-Q374 HydrophobicContact CD1-CB 3.87Å; I368-Q374 HydrophobicContact CD1-CG 4.41Å; I368-T424 WeakPolarHBondContact CB-OG1 3.26Å; I368-T424 VanDerWaalsContact CG2-OG1 3.31Å; I368-T424 WeakPolarHBondContact CG2-OG1 3.29Å; I368-T424 PolarHBondContact N-OG1 2.82Å; I368-E474 HydrophobicContact CG2-CB 3.7Å; I368-E474 HydrophobicContact CG2-CG 3.67Å
369	T	84.2	Confident	76.8	Confident	22 Å²	22	32.3 Å²	32.3	14%	0.135	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-62.9	-19.8	174.7	56.1	0	0	0	0	114.2	D367 P473 E474	D367-T369 PolarHBondContact O-N 3.48Å; D367-T369 WeakPolarHBondContact OD1-CB 3.42Å; D367-T369 VanDerWaalsContact OD1-CG2 3.31Å; D367-T369 WeakPolarHBondContact OD1-CG2 3.49Å; D367-T369 PolarHBondContact OD1-N 2.82Å; D367-T369 PolarHBondContact OD1-OG1 3.06Å; T369-P473 WeakPolarHBondContact CA-O 3.38Å; T369-P473 HydrophobicContact CG2-CB 4.11Å; T369-E474 HydrophobicContact CG2-CG 3.79Å
370	E	86.6	Confident	79.6	Confident	18 Å²	18	31.8 Å²	31.8	8%	0.084	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-86.1	-15.9	173.8	-59	-174.8	-173.9	0	0	112.4	R348 S366 D367 I368 R514	R348-E370 WeakPolarHBondContact CD-O 3.29Å; R348-E370 PolarHBondContact NH1-O 2.86Å; S366-E370 PolarHBondContact OG-OE2 3.19Å; D367-E370 PolarHBondContact O-N 3.42Å; D367-E370 VanDerWaalsContact O-N 3.09Å; I368-E370 PolarHBondContact O-N 2.86Å; I368-E370 VanDerWaalsContact O-N 3.16Å; E370-R514 IonicContact OE2-CZ 3.88Å; E370-R514 IonicContact OE2-NH1 3.26Å; E370-R514 PolarHBondContact OE2-NH1 2.03Å
371	Q	92.6	Very high	82.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-138.3	57.4	-179.9	-59.5	-64	-36.1	0	0	110.9	I368 W373 Q374 E494 S496	I368-Q371 CarbonylContact O-C 3.56Å; I368-Q371 WeakPolarHBondContact O-CA 2.98Å; I368-Q371 PolarHBondContact O-N 3.29Å; Q371-W373 PolarHBondContact O-N 3.08Å; Q371-W373 VanDerWaalsContact O-N 3.08Å; Q371-W373 VanDerWaalsContact OE1-CZ2 3.27Å; Q371-W373 VanDerWaalsContact OE1-NE1 3.16Å; Q371-Q374 HydrophobicContact CB-CB 4.24Å; Q371-Q374 WeakPolarHBondContact O-CB 3.37Å; Q371-Q374 PolarHBondContact O-N 3.38Å; Q371-E494 PolarHBondContact NE2-OE2 3.26Å; Q371-S496 PolarHBondContact OE1-OG 3.21Å
372	P	94.1	Very high	84.9	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.5	-166.6	31	-39	0	0	0	114.3	R348 I368 P473 E474 V475 H476	R348-P372 HydrophobicContact CB-CG 4.08Å; I368-P372 WeakPolarHBondContact O-CA 3.42Å; I368-P372 VanDerWaalsContact O-N 3.08Å; P372-P473 WeakPolarHBondContact CB-O 3.2Å; P372-E474 WeakPolarHBondContact CA-O 3.43Å; P372-V475 WeakPolarHBondContact O-CA 3.3Å; P372-H476 CarbonylContact C-O 3.6Å; P372-H476 HydrophobicContact CB-CB 3.79Å; P372-H476 HydrophobicContact CG-CB 3.82Å; P372-H476 PolarHBondContact O-N 2.89Å
373	W	97	Very high	86.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.3	172.1	45.8	76.3	0	0	0	113.1	R348 Q371 A375 I394 L395 H476 V478 V561 M568	R348-W373 HydrophobicContact CB-CH2 4.36Å; R348-W373 HydrophobicContact CB-CZ3 4.31Å; R348-W373 HydrophobicContact CG-CH2 4.28Å; Q371-W373 PolarHBondContact O-N 3.08Å; Q371-W373 VanDerWaalsContact O-N 3.08Å; Q371-W373 VanDerWaalsContact OE1-CZ2 3.27Å; Q371-W373 VanDerWaalsContact OE1-NE1 3.16Å; W373-A375 PolarHBondContact O-N 2.99Å; W373-I394 HydrophobicContact CB-CG2 4.43Å; W373-I394 CarbonylContact O-C 3.56Å; W373-I394 WeakPolarHBondContact O-CA 3.39Å; W373-L395 HydrophobicContact CB-CB 4.48Å; W373-L395 PolarHBondContact O-N 2.77Å; W373-H476 WeakPolarHBondContact CA-O 3.18Å; W373-H476 WeakPolarHBondContact CB-O 3.27Å; W373-H476 PolarHBondContact N-O 2.75Å; W373-H476 VanDerWaalsContact N-O 3.16Å; W373-V478 HydrophobicContact CB-CB 3.82Å; W373-V478 HydrophobicContact CB-CG1 4.34Å; W373-V478 HydrophobicContact CD2-CB 3.87Å; W373-V478 HydrophobicContact CD2-CG2 4.16Å; W373-V478 HydrophobicContact CE3-CB 4.08Å; W373-V478 HydrophobicContact CE3-CG2 4.36Å; W373-V478 HydrophobicContact CG-CB 3.75Å; W373-V478 HydrophobicContact CG-CG2 4.39Å; W373-V561 HydrophobicContact CZ2-CG1 4.35Å; W373-V561 HydrophobicContact CZ2-CG2 3.92Å; W373-M568 HydrophobicContact CH2-CB 3.51Å; W373-M568 HydrophobicContact CH2-CG 3.55Å; W373-M568 HydrophobicContact CZ2-CB 4.08Å; W373-M568 HydrophobicContact CZ2-CG 4.28Å; W373-M568 HydrophobicContact CZ3-CB 3.91Å; W373-M568 HydrophobicContact CZ3-CG 4.23Å
374	Q	96.6	Very high	88.2	Confident	1 Å²	1	42 Å²	42	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.7	-178.8	-178.3	69.1	51.3	0	0	110.4	I368 Q371 S496 Y498 V512	I368-Q374 HydrophobicContact CD1-CB 3.87Å; I368-Q374 HydrophobicContact CD1-CG 4.41Å; Q371-Q374 HydrophobicContact CB-CB 4.24Å; Q371-Q374 WeakPolarHBondContact O-CB 3.37Å; Q371-Q374 PolarHBondContact O-N 3.38Å; Q374-S496 PolarHBondContact OE1-O 2.95Å; Q374-S496 PolarHBondContact OE1-OG 3.45Å; Q374-Y498 HydrophobicContact CG-CE2 3.74Å; Q374-V512 HydrophobicContact CG-CG2 4.3Å
375	A	96.8	Very high	89.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152.8	173.4	0	0	0	0	0	111.5	W373 G392 G393 V401 V419 I420 L421	W373-A375 PolarHBondContact O-N 2.99Å; A375-G392 WeakPolarHBondContact O-CA 3.41Å; A375-G393 PolarHBondContact N-O 3.19Å; A375-G393 PolarHBondContact O-N 2.84Å; A375-V401 HydrophobicContact CB-CG1 4.2Å; A375-V419 HydrophobicContact CB-CG1 4.13Å; A375-I420 WeakPolarHBondContact CA-O 3.16Å; A375-L421 HydrophobicContact CB-CD2 3.53Å
376	I	95.6	Very high	89.9	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.5	165.3	-68.2	164.1	0	0	0	107.7	N378 Y389 V419 I420 R423 R426 Y498	I376-N378 WeakPolarHBondContact CG2-OD1 3.26Å; I376-Y389 HydrophobicContact CB-CE2 4.46Å; I376-Y389 HydrophobicContact CG1-CE2 4.34Å; I376-Y389 HydrophobicContact CG2-CD2 3.68Å; I376-Y389 HydrophobicContact CG2-CE2 3.89Å; I376-V419 CarbonylContact O-C 3.59Å; I376-V419 WeakPolarHBondContact O-CA 3.24Å; I376-I420 HydrophobicContact CB-CB 4.21Å; I376-I420 PolarHBondContact N-O 3.41Å; I376-I420 PolarHBondContact O-N 2.9Å; I376-R423 HydrophobicContact CD1-CB 4.18Å; I376-R423 HydrophobicContact CD1-CG 4.36Å; I376-R426 HydrophobicContact CD1-CG 4.23Å; I376-Y498 HydrophobicContact CD1-CD2 4.31Å; I376-Y498 HydrophobicContact CD1-CE1 4.19Å; I376-Y498 HydrophobicContact CD1-CE2 3.84Å; I376-Y498 HydrophobicContact CG1-CD2 3.77Å; I376-Y498 HydrophobicContact CG1-CE2 3.4Å; I376-Y498 VanDerWaalsContact CG1-CE2 3.4Å
377	I	96.1	Very high	90.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.5	172.9	-53.9	-176.4	0	0	0	108.6	R390 C391 G392 F408 V419 L459	I377-R390 WeakPolarHBondContact O-CB 3.36Å; I377-R390 PolarHBondContact O-N 3.48Å; I377-C391 PolarHBondContact N-O 2.81Å; I377-C391 PolarHBondContact O-N 3.42Å; I377-G392 WeakPolarHBondContact CD1-O 3.39Å; I377-F408 HydrophobicContact CD1-CZ 3.87Å; I377-F408 HydrophobicContact CG2-CE1 4.21Å; I377-F408 HydrophobicContact CG2-CZ 4.38Å; I377-V419 HydrophobicContact CG1-CG2 4.47Å; I377-L459 HydrophobicContact CD1-CD1 4.31Å; I377-L459 HydrophobicContact CD1-CD2 4.18Å
378	N	94.4	Very high	91.2	Very high	16 Å²	16	53.8 Å²	53.8	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	152.1	177.2	-75.3	-22.6	0	0	0	111.1	I376 H387 F388 Y389 L417 E418 I420	I376-N378 WeakPolarHBondContact CG2-OD1 3.26Å; N378-H387 HydrophobicContact CB-CB 4.04Å; N378-F388 CarbonylContact C-O 3.58Å; N378-F388 VanDerWaalsContact CA-O 3.24Å; N378-F388 WeakPolarHBondContact CA-O 3.47Å; N378-Y389 VanDerWaalsContact OD1-CA 3.31Å; N378-Y389 WeakPolarHBondContact OD1-CA 3.34Å; N378-Y389 PolarHBondContact OD1-N 2.9Å; N378-L417 WeakPolarHBondContact O-CA 3.14Å; N378-E418 HydrophobicContact CB-CB 4.17Å; N378-E418 PolarHBondContact N-O 3.26Å; N378-E418 PolarHBondContact ND2-OE1 3.09Å; N378-E418 PolarHBondContact O-N 2.9Å; N378-I420 WeakPolarHBondContact ND2-CD1 2.96Å
379	V	94.2	Very high	91.3	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.1	168.8	62.2	0	0	0	0	111.8	H387 F388 R390 E412 K416 L417	V379-H387 CarbonylContact O-C 3.56Å; V379-H387 WeakPolarHBondContact O-CA 3.46Å; V379-F388 PolarHBondContact N-O 3.33Å; V379-F388 PolarHBondContact O-N 3.26Å; V379-R390 HydrophobicContact CG1-CB 4.34Å; V379-R390 VanDerWaalsContact CG2-NH2 3.3Å; V379-E412 WeakPolarHBondContact CG2-OE1 3.12Å; V379-K416 CarbonylContact C-O 3.5Å; V379-K416 WeakPolarHBondContact CA-O 3.02Å; V379-K416 HydrophobicContact CG2-CB 4.26Å; V379-L417 HydrophobicContact CB-CD2 4.41Å; V379-L417 HydrophobicContact CG2-CD2 4.47Å
380	Y	92.9	Very high	91.6	Very high	90 Å²	90	56.4 Å²	56.4	35%	0.353	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	120	171.1	-171.6	-105.2	0	0	0	111.9	A382 H387 K416	Y380-A382 HydrophobicContact CE1-CB 4.39Å; Y380-H387 AromaticContact CD2-CE1 3.92Å; Y380-H387 AromaticContact CD2-NE2 3.86Å; Y380-H387 PolarHBondContact N-CD2 3.29Å; Y380-K416 PolarHBondContact N-O 2Å
381	Q	89.1	Confident	91.9	Very high	79 Å²	79	55.9 Å²	55.9	37%	0.369	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.2	173	-65.5	-173.4	3.1	0	0	110.9	R383 H384 R385 R386 F388	Q381-R383 PolarHBondContact O-N 3.06Å; Q381-H384 PolarHBondContact O-N 3.2Å; Q381-H384 VanDerWaalsContact O-N 3.08Å; Q381-H384 PolarHBondContact OE1-CD2 3.19Å; Q381-R385 PolarHBondContact O-N 3.32Å; Q381-R386 PolarHBondContact N-O 2.75Å; Q381-F388 HydrophobicContact CB-CD2 3.95Å; Q381-F388 HydrophobicContact CB-CE2 3.88Å; Q381-F388 HydrophobicContact CG-CD2 3.76Å; Q381-F388 HydrophobicContact CG-CE2 4.1Å
382	A	87.5	Confident	92	Very high	77 Å²	77	55.9 Å²	55.9	64%	0.636	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-56.5	-36.1	-177.4	0	0	0	0	0	113.5	Y380 H384 R385	Y380-A382 HydrophobicContact CE1-CB 4.39Å; A382-H384 VanDerWaalsContact C-N 3.26Å; A382-H384 PolarHBondContact O-N 3.29Å; A382-R385 PolarHBondContact O-N 3.31Å
383	R	88.9	Confident	92.1	Very high	228 Å²	228	55.8 Å²	55.8	86%	0.86	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-59.2	-35.1	178.7	-174.5	177.4	-179.8	168.1	-0.2	113.1	Q381	Q381-R383 PolarHBondContact O-N 3.06Å
384	H	86.6	Confident	92.2	Very high	97 Å²	97	55.8 Å²	55.8	45%	0.449	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-109.3	-1	-176.1	-63.6	-67.2	0	0	0	113.2	Q381 A382 R386 F388	Q381-H384 PolarHBondContact O-N 3.2Å; Q381-H384 VanDerWaalsContact O-N 3.08Å; Q381-H384 PolarHBondContact OE1-CD2 3.19Å; A382-H384 VanDerWaalsContact C-N 3.26Å; A382-H384 PolarHBondContact O-N 3.29Å; H384-R386 HydrophobicContact CB-CG 4.13Å; H384-R386 PolarHBondContact O-N 2.91Å; H384-F388 HydrophobicContact CB-CE2 3.72Å; H384-F388 HydrophobicContact CB-CZ 3.86Å; H384-F388 AromaticContact CD2-CE2 4Å; H384-F388 AromaticContact CD2-CZ 3.84Å; H384-F388 AromaticContact CG-CZ 3.9Å
385	R	86.9	Confident	92.3	Very high	214 Å²	214	55.8 Å²	55.8	81%	0.808	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	38.8	-179.3	-59.2	-175.7	176.4	179.6	-1.4	113.8	Q381 A382	Q381-R385 PolarHBondContact O-N 3.32Å; A382-R385 PolarHBondContact O-N 3.31Å
386	R	89.6	Confident	92.3	Very high	146 Å²	146	56.4 Å²	56.4	55%	0.551	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	160	179.5	70.5	-177.6	-177.2	-178	-4.3	112.5	Q381 H384 F388	Q381-R386 PolarHBondContact N-O 2.75Å; H384-R386 HydrophobicContact CB-CG 4.13Å; H384-R386 PolarHBondContact O-N 2.91Å; R386-F388 HydrophobicContact CG-CD2 4.01Å; R386-F388 HydrophobicContact CG-CE2 3.45Å; R386-F388 VanDerWaalsContact CG-CE2 3.45Å; R386-F388 HydrophobicContact CG-CZ 3.87Å
387	H	88.3	Confident	92.1	Very high	78 Å²	78	59.4 Å²	59.4	36%	0.361	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	137.5	171.1	-71.1	105.2	0	0	0	111.1	N378 V379 Y380 E418	N378-H387 HydrophobicContact CB-CB 4.04Å; V379-H387 CarbonylContact O-C 3.56Å; V379-H387 WeakPolarHBondContact O-CA 3.46Å; Y380-H387 AromaticContact CD2-CE1 3.92Å; Y380-H387 AromaticContact CD2-NE2 3.86Å; Y380-H387 PolarHBondContact N-CD2 3.29Å; H387-E418 IonicContact CE1-OE2 2.86Å; H387-E418 IonicContact CG-OE1 3.28Å; H387-E418 IonicContact ND1-OE2 3.87Å
388	F	89.3	Confident	91.9	Very high	52 Å²	52	61.4 Å²	61.4	23%	0.228	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	141.5	173.6	-70.9	-98.8	0	0	0	110.2	N378 V379 Q381 H384 R386 R390	N378-F388 CarbonylContact C-O 3.58Å; N378-F388 VanDerWaalsContact CA-O 3.24Å; N378-F388 WeakPolarHBondContact CA-O 3.47Å; V379-F388 PolarHBondContact N-O 3.33Å; V379-F388 PolarHBondContact O-N 3.26Å; Q381-F388 HydrophobicContact CB-CD2 3.95Å; Q381-F388 HydrophobicContact CB-CE2 3.88Å; Q381-F388 HydrophobicContact CG-CD2 3.76Å; Q381-F388 HydrophobicContact CG-CE2 4.1Å; H384-F388 HydrophobicContact CB-CE2 3.72Å; H384-F388 HydrophobicContact CB-CZ 3.86Å; H384-F388 AromaticContact CD2-CE2 4Å; H384-F388 AromaticContact CD2-CZ 3.84Å; H384-F388 AromaticContact CG-CZ 3.9Å; R386-F388 HydrophobicContact CG-CD2 4.01Å; R386-F388 HydrophobicContact CG-CE2 3.45Å; R386-F388 VanDerWaalsContact CG-CE2 3.45Å; R386-F388 HydrophobicContact CG-CZ 3.87Å; F388-R390 PolarHBondContact O-N 3.47Å
389	Y	90	Very high	91.9	Very high	21 Å²	21	60.8 Å²	60.8	8%	0.082	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	125	171.4	-177.9	-101.4	0	0	0	110	I376 N378 C391 G392 R426 Y498 Y508 G554	I376-Y389 HydrophobicContact CB-CE2 4.46Å; I376-Y389 HydrophobicContact CG1-CE2 4.34Å; I376-Y389 HydrophobicContact CG2-CD2 3.68Å; I376-Y389 HydrophobicContact CG2-CE2 3.89Å; N378-Y389 VanDerWaalsContact OD1-CA 3.31Å; N378-Y389 WeakPolarHBondContact OD1-CA 3.34Å; N378-Y389 PolarHBondContact OD1-N 2.9Å; Y389-C391 WeakPolarHBondContact CE2-O 2.92Å; Y389-G392 PolarHBondContact OH-N 2.92Å; Y389-R426 HydrophobicContact CD2-CG 4.3Å; Y389-Y498 HydrophobicContact CE2-CD2 4.5Å; Y389-Y508 HydrophobicContact CD1-CD1 4.05Å; Y389-Y508 HydrophobicContact CD1-CD2 4.42Å; Y389-Y508 HydrophobicContact CD1-CE1 4.08Å; Y389-Y508 HydrophobicContact CD1-CE2 4.42Å; Y389-Y508 HydrophobicContact CD1-CG 4.23Å; Y389-Y508 HydrophobicContact CE1-CD1 4.08Å; Y389-Y508 HydrophobicContact CE1-CE1 4.16Å; Y389-G554 VanDerWaalsContact CE1-O 3.3Å; Y389-G554 WeakPolarHBondContact CE1-O 3.48Å; Y389-G554 PolarHBondContact OH-O 3.41Å
390	R	90.4	Very high	92	Very high	57 Å²	57	60.7 Å²	60.7	22%	0.215	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-60.5	176.9	-175.8	173.5	-73	164.9	-23.6	111.3	I377 V379 F388 C407 E412	I377-R390 WeakPolarHBondContact O-CB 3.36Å; I377-R390 PolarHBondContact O-N 3.48Å; V379-R390 HydrophobicContact CG1-CB 4.34Å; V379-R390 VanDerWaalsContact CG2-NH2 3.3Å; F388-R390 PolarHBondContact O-N 3.47Å; R390-C407 WeakPolarHBondContact CD-O 3.18Å; R390-E412 IonicContact CZ-OE1 2.81Å; R390-E412 IonicContact CZ-OE2 3.57Å; R390-E412 IonicContact NH1-OE1 2.69Å; R390-E412 PolarHBondContact NH1-OE1 2.85Å; R390-E412 IonicContact NH1-OE2 3.91Å; R390-E412 PolarHBondContact NH1-OE2 2.74Å; R390-E412 IonicContact NH2-OE1 2.84Å; R390-E412 PolarHBondContact NH2-OE1 3.32Å; R390-E412 IonicContact NH2-OE2 2.71Å; R390-E412 PolarHBondContact NH2-OE2 3.18Å
391	C	92.9	Very high	92.2	Very high	7 Å²	7	56.4 Å²	56.4	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	169.7	-173.5	-79.4	0	0	0	0	111.7	I377 Y389 C407 S556	I377-C391 PolarHBondContact N-O 2.81Å; I377-C391 PolarHBondContact O-N 3.42Å; Y389-C391 WeakPolarHBondContact CE2-O 2.92Å; C391-C407 HydrophobicContact CB-CB 3.7Å; C391-C407 WeakPolarHBondContact CB-SG 3.25Å; C391-C407 WeakPolarHBondContact SG-CB 3.25Å; C391-C407 CovalentContact SG-SG 2.03Å; C391-C407 PolarHBondContact SG-SG 3.07Å; C391-S556 VanDerWaalsContact CB-O 3.3Å; C391-S556 WeakPolarHBondContact CB-O 3.38Å
392	G	94.4	Very high	92.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	165.1	162.6	0	0	0	0	0	111.7	A375 I377 Y389 S403 S556 G557	A375-G392 WeakPolarHBondContact O-CA 3.41Å; I377-G392 WeakPolarHBondContact CD1-O 3.39Å; Y389-G392 PolarHBondContact OH-N 2.92Å; G392-S403 PolarHBondContact O-OG 2.85Å; G392-S556 PolarHBondContact N-O 2.86Å; G392-G557 CarbonylContact C-O 3.27Å; G392-G557 CarbonylContact O-C 3.32Å
393	G	97	Very high	93.2	Very high	0 Å²	0	49 Å²	49	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	176.8	168	0	0	0	0	0	111	A375 L402 G557	A375-G393 PolarHBondContact N-O 3.19Å; A375-G393 PolarHBondContact O-N 2.84Å; G393-L402 CarbonylContact C-O 3.5Å; G393-L402 WeakPolarHBondContact CA-O 3.08Å; G393-G557 WeakPolarHBondContact CA-O 3.5Å
394	I	98.5	Very high	93.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	114.5	-170.5	-47.2	163.9	0	0	0	109.2	W373 I396 V401 L402 V478 G557 P559 L570 V573	W373-I394 HydrophobicContact CB-CG2 4.43Å; W373-I394 CarbonylContact O-C 3.56Å; W373-I394 WeakPolarHBondContact O-CA 3.39Å; I394-I396 HydrophobicContact CG2-CG2 4.31Å; I394-I396 PolarHBondContact O-N 3.45Å; I394-V401 CarbonylContact O-C 3.5Å; I394-V401 VanDerWaalsContact O-CA 3.24Å; I394-V401 WeakPolarHBondContact O-CA 3.46Å; I394-L402 HydrophobicContact CB-CB 4.35Å; I394-L402 HydrophobicContact CD1-CB 4.5Å; I394-L402 PolarHBondContact N-O 3.47Å; I394-L402 PolarHBondContact O-N 3.04Å; I394-V478 HydrophobicContact CG2-CG1 3.54Å; I394-G557 WeakPolarHBondContact CG1-O 3.39Å; I394-P559 HydrophobicContact CD1-CB 3.87Å; I394-P559 HydrophobicContact CG1-CB 3.82Å; I394-P559 HydrophobicContact CG1-CG 4.4Å; I394-P559 HydrophobicContact CG2-CB 4.14Å; I394-L570 HydrophobicContact CD1-CD1 3.86Å; I394-L570 HydrophobicContact CD1-CD2 4.1Å; I394-L570 HydrophobicContact CG2-CD1 4.22Å; I394-L570 HydrophobicContact CG2-CD2 4.1Å; I394-V573 HydrophobicContact CD1-CB 4.48Å; I394-V573 HydrophobicContact CD1-CG1 4.29Å; I394-V573 HydrophobicContact CD1-CG2 3.92Å
395	L	98.1	Very high	94.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	116.5	173	-170	70	0	0	0	109.7	W373 D397 V401 L421 A469 V475 P477 V478	W373-L395 HydrophobicContact CB-CB 4.48Å; W373-L395 PolarHBondContact O-N 2.77Å; L395-D397 WeakPolarHBondContact CD1-O 3.4Å; L395-V401 HydrophobicContact CD1-CG2 3.95Å; L395-L421 HydrophobicContact CB-CD2 4.08Å; L395-L421 HydrophobicContact CD1-CD1 3.82Å; L395-L421 HydrophobicContact CD1-CD2 4.37Å; L395-L421 HydrophobicContact CD2-CD1 4.11Å; L395-L421 HydrophobicContact CG-CD1 4.48Å; L395-A469 HydrophobicContact CD1-CB 4.08Å; L395-A469 HydrophobicContact CD2-CB 4.17Å; L395-V475 HydrophobicContact CD2-CG1 3.77Å; L395-P477 HydrophobicContact CD2-CB 4.42Å; L395-P477 HydrophobicContact CG-CB 4.23Å; L395-P477 CarbonylContact O-C 3.57Å; L395-P477 VanDerWaalsContact O-CA 3.26Å; L395-P477 WeakPolarHBondContact O-CA 3.46Å; L395-V478 PolarHBondContact O-N 2.91Å
396	I	96.8	Very high	94.5	Very high	14 Å²	14	26.1 Å²	26.1	7%	0.072	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-21.4	179.4	56.1	157.6	0	0	0	112.9	I394 W400 L402 I458 V478 L480 L570 I599	I394-I396 HydrophobicContact CG2-CG2 4.31Å; I394-I396 PolarHBondContact O-N 3.45Å; I396-W400 HydrophobicContact CD1-CB 4.12Å; I396-W400 HydrophobicContact CG1-CB 3.85Å; I396-W400 VanDerWaalsContact CG1-O 3.25Å; I396-W400 WeakPolarHBondContact CG1-O 3.45Å; I396-W400 PolarHBondContact N-O 2.75Å; I396-L402 HydrophobicContact CD1-CD1 4.1Å; I396-L402 HydrophobicContact CD1-CD2 4.02Å; I396-L402 HydrophobicContact CD1-CG 3.72Å; I396-L402 HydrophobicContact CG1-CG 4.13Å; I396-L402 HydrophobicContact CG2-CB 4.4Å; I396-L402 HydrophobicContact CG2-CD1 3.65Å; I396-L402 HydrophobicContact CG2-CG 3.8Å; I396-I458 HydrophobicContact CD1-CD1 4.17Å; I396-V478 HydrophobicContact CG2-CG1 4.06Å; I396-L480 HydrophobicContact CB-CD2 4.27Å; I396-L480 HydrophobicContact CB-CG 4.42Å; I396-L480 HydrophobicContact CD1-CD1 4.37Å; I396-L480 HydrophobicContact CG2-CD2 3.94Å; I396-L570 HydrophobicContact CG2-CD2 4.16Å; I396-I599 HydrophobicContact CD1-CG2 3.66Å
397	D	93.2	Very high	94.7	Very high	65 Å²	65	19.6 Å²	19.6	35%	0.348	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	168.3	172.6	-156.9	-20.1	0	0	0	107.8	L395 C399 W400	L395-D397 WeakPolarHBondContact CD1-O 3.4Å; D397-C399 PolarHBondContact O-N 3.31Å; D397-W400 HydrophobicContact CB-CB 4.07Å; D397-W400 HydrophobicContact CB-CG 4.45Å; D397-W400 PolarHBondContact N-O 3.26Å; D397-W400 PolarHBondContact O-N 3.47Å
398	S	91	Very high	95	Very high	41 Å²	41	16.5 Å²	16.5	29%	0.287	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.7	-172.9	60.9	0	0	0	0	113.5	C468 A469	S398-C468 VanDerWaalsContact C-CB 3.48Å; S398-C468 WeakPolarHBondContact O-CB 3.5Å; S398-A469 WeakPolarHBondContact CB-O 3.23Å; S398-A469 WeakPolarHBondContact O-CA 3.18Å; S398-A469 WeakPolarHBondContact O-CB 3.04Å; S398-A469 PolarHBondContact O-N 2.93Å
399	C	93.3	Very high	94.9	Very high	4 Å²	4	20.2 Å²	20.2	3%	0.027	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	5.2	-176.8	-47.5	0	0	0	0	113.8	D397 K460 L461 C468 V608	D397-C399 PolarHBondContact O-N 3.31Å; C399-K460 WeakPolarHBondContact O-CA 3.49Å; C399-L461 PolarHBondContact O-N 2.73Å; C399-C468 HydrophobicContact CB-CB 3.77Å; C399-C468 WeakPolarHBondContact CB-SG 3.47Å; C399-C468 WeakPolarHBondContact SG-CB 3.37Å; C399-C468 CovalentContact SG-SG 2Å; C399-C468 PolarHBondContact SG-SG 3.17Å; C399-V608 HydrophobicContact CB-CG2 3.81Å; C399-V608 VanDerWaalsContact SG-CG1 3.56Å; C399-V608 WeakPolarHBondContact SG-CG2 3.34Å
400	W	96.6	Very high	94.4	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.015	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.5	-165.2	-65.9	103	0	0	0	111.8	I396 D397 W442 I458 L459 K460 V603 N606	I396-W400 HydrophobicContact CD1-CB 4.12Å; I396-W400 HydrophobicContact CG1-CB 3.85Å; I396-W400 VanDerWaalsContact CG1-O 3.25Å; I396-W400 WeakPolarHBondContact CG1-O 3.45Å; I396-W400 PolarHBondContact N-O 2.75Å; D397-W400 HydrophobicContact CB-CB 4.07Å; D397-W400 HydrophobicContact CB-CG 4.45Å; D397-W400 PolarHBondContact N-O 3.26Å; D397-W400 PolarHBondContact O-N 3.47Å; W400-W442 HydrophobicContact CH2-CH2 4.08Å; W400-W442 AromaticContact CH2-CZ3 3.88Å; W400-W442 HydrophobicContact CH2-CZ3 3.88Å; W400-W442 HydrophobicContact CZ3-CE3 4.24Å; W400-W442 HydrophobicContact CZ3-CH2 4.24Å; W400-W442 AromaticContact CZ3-CZ3 3.56Å; W400-W442 HydrophobicContact CZ3-CZ3 3.56Å; W400-I458 HydrophobicContact CD2-CD1 4.3Å; W400-I458 HydrophobicContact CE3-CD1 3.54Å; W400-I458 HydrophobicContact CE3-CG1 3.65Å; W400-I458 HydrophobicContact CZ3-CD1 3.94Å; W400-I458 HydrophobicContact CZ3-CG1 4.06Å; W400-L459 WeakPolarHBondContact CA-O 3.32Å; W400-K460 HydrophobicContact CE3-CB 4.1Å; W400-K460 HydrophobicContact CH2-CB 3.91Å; W400-K460 HydrophobicContact CH2-CD 4.07Å; W400-K460 HydrophobicContact CH2-CG 4.09Å; W400-K460 HydrophobicContact CZ2-CB 4.46Å; W400-K460 HydrophobicContact CZ2-CD 4.14Å; W400-K460 HydrophobicContact CZ2-CG 4.18Å; W400-K460 HydrophobicContact CZ3-CB 3.71Å; W400-K460 HydrophobicContact CZ3-CG 4.31Å; W400-V603 HydrophobicContact CD2-CG2 3.8Å; W400-V603 HydrophobicContact CE3-CG2 4.27Å; W400-V603 HydrophobicContact CG-CG2 3.97Å; W400-V603 HydrophobicContact CZ2-CB 4.33Å; W400-V603 HydrophobicContact CZ2-CG1 4.5Å; W400-V603 HydrophobicContact CZ2-CG2 4.31Å; W400-N606 HydrophobicContact CH2-CB 4.06Å; W400-N606 HydrophobicContact CZ2-CB 4.4Å; W400-N606 VanDerWaalsContact CZ2-O 3.28Å; W400-N606 WeakPolarHBondContact CZ2-O 3.24Å
401	V	98.4	Very high	93.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131	179.7	175.1	0	0	0	0	109.7	A375 I394 L395 V419 I458 L459 L461	A375-V401 HydrophobicContact CB-CG1 4.2Å; I394-V401 CarbonylContact O-C 3.5Å; I394-V401 VanDerWaalsContact O-CA 3.24Å; I394-V401 WeakPolarHBondContact O-CA 3.46Å; L395-V401 HydrophobicContact CD1-CG2 3.95Å; V401-V419 HydrophobicContact CG2-CG1 4.17Å; V401-I458 CarbonylContact O-C 3.57Å; V401-I458 WeakPolarHBondContact O-CA 3.32Å; V401-L459 HydrophobicContact CB-CB 4.41Å; V401-L459 PolarHBondContact N-O 3.25Å; V401-L459 WeakPolarHBondContact O-CD1 3.28Å; V401-L459 PolarHBondContact O-N 2.85Å; V401-L461 HydrophobicContact CG2-CD1 4.24Å; V401-L461 HydrophobicContact CG2-CD2 4.04Å; V401-L461 HydrophobicContact CG2-CG 4.33Å
402	L	98.4	Very high	93.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	152.1	169.1	-66.4	179.8	0	0	0	111.2	G393 I394 I396 I456 A457 I458 L480 L570 I599	G393-L402 CarbonylContact C-O 3.5Å; G393-L402 WeakPolarHBondContact CA-O 3.08Å; I394-L402 HydrophobicContact CB-CB 4.35Å; I394-L402 HydrophobicContact CD1-CB 4.5Å; I394-L402 PolarHBondContact N-O 3.47Å; I394-L402 PolarHBondContact O-N 3.04Å; I396-L402 HydrophobicContact CD1-CD1 4.1Å; I396-L402 HydrophobicContact CD1-CD2 4.02Å; I396-L402 HydrophobicContact CD1-CG 3.72Å; I396-L402 HydrophobicContact CG1-CG 4.13Å; I396-L402 HydrophobicContact CG2-CB 4.4Å; I396-L402 HydrophobicContact CG2-CD1 3.65Å; I396-L402 HydrophobicContact CG2-CG 3.8Å; L402-I456 HydrophobicContact CD1-CD1 4.5Å; L402-I456 HydrophobicContact CD2-CD1 4.38Å; L402-A457 WeakPolarHBondContact CA-O 3.43Å; L402-I458 HydrophobicContact CD2-CB 3.76Å; L402-I458 HydrophobicContact CD2-CD1 4.13Å; L402-I458 HydrophobicContact CD2-CG1 3.82Å; L402-L480 HydrophobicContact CD1-CD2 4.28Å; L402-L570 HydrophobicContact CD1-CD2 3.83Å; L402-I599 HydrophobicContact CD1-CD1 3.75Å; L402-I599 HydrophobicContact CD1-CG1 4.44Å; L402-I599 HydrophobicContact CD2-CD1 4.29Å; L402-I599 HydrophobicContact CD2-CG1 4.08Å
403	S	98.1	Very high	93.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-176.7	170.5	-172.4	0	0	0	0	109.3	G392 A457 G557	G392-S403 PolarHBondContact O-OG 2.85Å; S403-A457 PolarHBondContact N-O 2.94Å; S403-A457 PolarHBondContact O-N 2.95Å; S403-G557 WeakPolarHBondContact OG-CA 3.48Å
404	A	97.5	Very high	93.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.			trans	-82	146	176.4	0	0	0	0	0	110.3	C407 F408 V573	A404-C407 WeakPolarHBondContact O-CB 3.46Å; A404-C407 PolarHBondContact O-N 3.2Å; A404-F408 VanDerWaalsContact O-CD2 3.25Å; A404-F408 WeakPolarHBondContact O-CD2 3.47Å; A404-F408 WeakPolarHBondContact O-CE2 3.41Å; A404-V573 HydrophobicContact CB-CG1 4.39Å
405	A	97.4	Very high	92.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-65.9	-37.8	179.5	0	0	0	0	0	112.6	C407 F408 I443 F447 D455	A405-C407 PolarHBondContact O-N 3.21Å; A405-F408 PolarHBondContact O-N 3.05Å; A405-I443 HydrophobicContact CB-CG2 3.74Å; A405-F447 HydrophobicContact CB-CB 4.17Å; A405-F447 HydrophobicContact CB-CD1 3.67Å; A405-F447 HydrophobicContact CB-CD2 3.66Å; A405-F447 HydrophobicContact CB-CE1 3.91Å; A405-F447 HydrophobicContact CB-CE2 3.91Å; A405-F447 HydrophobicContact CB-CG 3.53Å; A405-F447 HydrophobicContact CB-CZ 4.04Å; A405-D455 WeakPolarHBondContact CA-OD1 3.37Å; A405-D455 WeakPolarHBondContact CB-OD1 3.44Å; A405-D455 PolarHBondContact N-OD1 3.06Å
406	H	94.6	Very high	92.6	Very high	60 Å²	60	48.6 Å²	48.6	28%	0.278	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63.2	-12.7	-180	75.4	-100.5	0	0	0	113.6	F408 F447 F452 D455 S556 S575	H406-F408 PolarHBondContact O-N 3.21Å; H406-F447 HydrophobicContact CB-CZ 3.89Å; H406-F452 HydrophobicContact CB-CD1 4.26Å; H406-F452 HydrophobicContact CB-CE1 3.85Å; H406-F452 AromaticContact CG-CE1 3.94Å; H406-D455 IonicContact CE1-OD2 2.75Å; H406-D455 PolarHBondContact CE1-OD2 2.86Å; H406-D455 IonicContact CG-OD1 2.8Å; H406-D455 IonicContact CG-OD2 3.42Å; H406-D455 PolarHBondContact N-OD1 3.24Å; H406-D455 IonicContact ND1-OD1 3.08Å; H406-D455 PolarHBondContact ND1-OD1 2.79Å; H406-D455 IonicContact ND1-OD2 3.38Å; H406-D455 PolarHBondContact ND1-OD2 2.73Å; H406-S556 WeakPolarHBondContact NE2-CB 2.71Å; H406-S556 PolarHBondContact NE2-OG 2.83Å; H406-S556 VanDerWaalsContact NE2-OG 3.09Å; H406-S575 PolarHBondContact CE1-O 3.13Å
407	C	94.4	Very high	92.5	Very high	8 Å²	8	48 Å²	48	5%	0.054	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-75.5	-3.9	171.9	-65.2	0	0	0	0	113.3	R390 C391 A404 A405	R390-C407 WeakPolarHBondContact CD-O 3.18Å; C391-C407 HydrophobicContact CB-CB 3.7Å; C391-C407 WeakPolarHBondContact CB-SG 3.25Å; C391-C407 WeakPolarHBondContact SG-CB 3.25Å; C391-C407 CovalentContact SG-SG 2.03Å; C391-C407 PolarHBondContact SG-SG 3.07Å; A404-C407 WeakPolarHBondContact O-CB 3.46Å; A404-C407 PolarHBondContact O-N 3.2Å; A405-C407 PolarHBondContact O-N 3.21Å
408	F	94.6	Very high	92.7	Very high	13 Å²	13	46.7 Å²	46.7	6%	0.057	23%	0.234	C	C	.	.	S	Bend	trans	-134.4	150.7	-174	-53.4	-81.7	0	0	0	111.8	I377 A404 A405 H406 L417 Y441 I443 A457 L459	I377-F408 HydrophobicContact CD1-CZ 3.87Å; I377-F408 HydrophobicContact CG2-CE1 4.21Å; I377-F408 HydrophobicContact CG2-CZ 4.38Å; A404-F408 VanDerWaalsContact O-CD2 3.25Å; A404-F408 WeakPolarHBondContact O-CD2 3.47Å; A404-F408 WeakPolarHBondContact O-CE2 3.41Å; A405-F408 PolarHBondContact O-N 3.05Å; H406-F408 PolarHBondContact O-N 3.21Å; F408-L417 HydrophobicContact CD1-CD1 4.01Å; F408-L417 HydrophobicContact CE1-CD1 3.93Å; F408-Y441 HydrophobicContact CB-CD2 4.13Å; F408-Y441 HydrophobicContact CB-CE2 3.69Å; F408-Y441 HydrophobicContact CD1-CD2 4.22Å; F408-Y441 HydrophobicContact CD1-CE2 4.29Å; F408-Y441 HydrophobicContact CG-CD2 4.13Å; F408-Y441 HydrophobicContact CG-CE2 4.14Å; F408-I443 HydrophobicContact CB-CD1 3.89Å; F408-I443 HydrophobicContact CB-CG1 4.14Å; F408-A457 HydrophobicContact CD2-CB 3.69Å; F408-A457 HydrophobicContact CE2-CB 3.79Å; F408-L459 HydrophobicContact CE1-CD1 4.48Å; F408-L459 HydrophobicContact CE1-CD2 3.91Å; F408-L459 HydrophobicContact CE2-CD1 4.19Å; F408-L459 HydrophobicContact CZ-CD1 3.76Å; F408-L459 HydrophobicContact CZ-CD2 3.9Å; F408-L459 HydrophobicContact CZ-CG 4.25Å
409	E	87.5	Confident	92.9	Very high	131 Å²	131	44.7 Å²	44.7	61%	0.612	22%	0.221	S	C	*	.			trans	-106.9	136.2	175.4	-63.3	176.4	-170.7	0	0	109.5	N411 E412 Y441	E409-N411 PolarHBondContact O-N 3.18Å; E409-E412 HydrophobicContact CB-CB 4.15Å; E409-E412 PolarHBondContact O-N 2.69Å; E409-Y441 PolarHBondContact O-OH 2.81Å
410	I	78.8	Confident	93	Very high	146 Å²	146	44.6 Å²	44.6	75%	0.749	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-32.2	-173.4	-65.3	170.3	0	0	0	113.8	I443	I410-I443 HydrophobicContact CG1-CD1 4.22Å
411	N	80.8	Confident	93	Very high	153 Å²	153	44.4 Å²	44.4	82%	0.818	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	10.4	-174.9	-64.9	-34.9	0	0	0	113.8	E409	E409-N411 PolarHBondContact O-N 3.18Å
412	E	88.8	Confident	92.6	Very high	21 Å²	21	44.4 Å²	44.4	10%	0.098	22%	0.219	C	C	.	.			trans	-77.3	131.8	177.2	-173	178.1	-128	0	0	110.9	V379 R390 E409 K416 Y441	V379-E412 WeakPolarHBondContact CG2-OE1 3.12Å; R390-E412 IonicContact CZ-OE1 2.81Å; R390-E412 IonicContact CZ-OE2 3.57Å; R390-E412 IonicContact NH1-OE1 2.69Å; R390-E412 PolarHBondContact NH1-OE1 2.85Å; R390-E412 IonicContact NH1-OE2 3.91Å; R390-E412 PolarHBondContact NH1-OE2 2.74Å; R390-E412 IonicContact NH2-OE1 2.84Å; R390-E412 PolarHBondContact NH2-OE1 3.32Å; R390-E412 IonicContact NH2-OE2 2.71Å; R390-E412 PolarHBondContact NH2-OE2 3.18Å; E409-E412 HydrophobicContact CB-CB 4.15Å; E409-E412 PolarHBondContact O-N 2.69Å; E412-K416 HydrophobicContact CG-CD 4.14Å; E412-Y441 WeakPolarHBondContact O-CE1 3.26Å; E412-Y441 PolarHBondContact O-OH 2.81Å
413	K	89.9	Confident	92.1	Very high	144 Å²	144	45.2 Å²	45.2	63%	0.626	22%	0.222	S	C	*	.			trans	-69.3	133.4	176.7	-60.7	-174.2	175.9	-173.1	0	110.9	D415 K416	K413-D415 WeakPolarHBondContact CB-OD1 3.23Å; K413-D415 PolarHBondContact O-N 3.11Å; K413-K416 WeakPolarHBondContact O-CB 3.22Å; K413-K416 PolarHBondContact O-N 2Å
414	A	91.9	Very high	91.3	Very high	17 Å²	17	45.9 Å²	45.9	14%	0.14	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-62.7	-26.6	-179.3	0	0	0	0	0	113.5	K416 L417 V438 Y441	A414-K416 PolarHBondContact O-N 3.18Å; A414-K416 VanDerWaalsContact O-N 3.15Å; A414-L417 WeakPolarHBondContact O-CB 3.44Å; A414-L417 PolarHBondContact O-N 3.01Å; A414-V438 HydrophobicContact CB-CB 4.37Å; A414-V438 HydrophobicContact CB-CG1 4.14Å; A414-V438 WeakPolarHBondContact CB-O 3.33Å; A414-Y441 HydrophobicContact CB-CD1 4.1Å; A414-Y441 HydrophobicContact CB-CE1 4.28Å
415	D	89.4	Confident	90.5	Very high	111 Å²	111	49.7 Å²	49.7	59%	0.594	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-64	-16.5	177.7	68	-19.1	0	0	0	114.2	K413 L417	K413-D415 WeakPolarHBondContact CB-OD1 3.23Å; K413-D415 PolarHBondContact O-N 3.11Å; D415-L417 VanDerWaalsContact C-N 3.3Å
416	K	93.3	Very high	89.9	Confident	88 Å²	88	51.2 Å²	51.2	38%	0.383	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-79.4	-13.5	172.1	-63.9	-175.2	-178.9	176.5	0	113.2	V379 Y380 E412 K413 A414	V379-K416 CarbonylContact C-O 3.5Å; V379-K416 WeakPolarHBondContact CA-O 3.02Å; V379-K416 HydrophobicContact CG2-CB 4.26Å; Y380-K416 PolarHBondContact N-O 2Å; E412-K416 HydrophobicContact CG-CD 4.14Å; K413-K416 WeakPolarHBondContact O-CB 3.22Å; K413-K416 PolarHBondContact O-N 2Å; A414-K416 PolarHBondContact O-N 3.18Å; A414-K416 VanDerWaalsContact O-N 3.15Å
417	L	95.6	Very high	89.1	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	138.6	-174.1	-56.3	177.1	0	0	0	110.6	N378 V379 F408 A414 D415 V438 Y441 L459	N378-L417 WeakPolarHBondContact O-CA 3.14Å; V379-L417 HydrophobicContact CB-CD2 4.41Å; V379-L417 HydrophobicContact CG2-CD2 4.47Å; F408-L417 HydrophobicContact CD1-CD1 4.01Å; F408-L417 HydrophobicContact CE1-CD1 3.93Å; A414-L417 WeakPolarHBondContact O-CB 3.44Å; A414-L417 PolarHBondContact O-N 3.01Å; D415-L417 VanDerWaalsContact C-N 3.3Å; L417-V438 HydrophobicContact CB-CB 3.94Å; L417-V438 HydrophobicContact CB-CG2 3.54Å; L417-V438 HydrophobicContact CD1-CB 4.46Å; L417-V438 HydrophobicContact CD1-CG1 4.43Å; L417-V438 HydrophobicContact CD1-CG2 4.4Å; L417-V438 PolarHBondContact O-N 3.03Å; L417-Y441 HydrophobicContact CD1-CD1 3.67Å; L417-Y441 HydrophobicContact CD1-CE1 3.86Å; L417-Y441 HydrophobicContact CD1-CG 4.42Å; L417-L459 HydrophobicContact CD1-CD2 4.46Å
418	E	95.6	Very high	88	Confident	37 Å²	37	59.7 Å²	59.7	17%	0.173	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.2	175	176.2	-171.1	73.6	0	0	108.2	N378 H387 I420 I435 F436	N378-E418 HydrophobicContact CB-CB 4.17Å; N378-E418 PolarHBondContact N-O 3.26Å; N378-E418 PolarHBondContact ND2-OE1 3.09Å; N378-E418 PolarHBondContact O-N 2.9Å; H387-E418 IonicContact CE1-OE2 2.86Å; H387-E418 IonicContact CG-OE1 3.28Å; H387-E418 IonicContact ND1-OE2 3.87Å; E418-I420 HydrophobicContact CG-CG1 4.13Å; E418-I435 HydrophobicContact CG-CG2 3.57Å; E418-F436 WeakPolarHBondContact CA-O 3.46Å
419	V	96.8	Very high	86.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	175.3	176.1	0	0	0	0	108.5	A375 I376 I377 V401 L421 I435 F436 V438 L459 L461	A375-V419 HydrophobicContact CB-CG1 4.13Å; I376-V419 CarbonylContact O-C 3.59Å; I376-V419 WeakPolarHBondContact O-CA 3.24Å; I377-V419 HydrophobicContact CG1-CG2 4.47Å; V401-V419 HydrophobicContact CG2-CG1 4.17Å; V419-L421 HydrophobicContact CG1-CG 4.45Å; V419-I435 WeakPolarHBondContact O-CA 3.45Å; V419-F436 PolarHBondContact N-O 3.29Å; V419-F436 PolarHBondContact O-N 2.95Å; V419-V438 HydrophobicContact CG2-CG2 3.76Å; V419-L459 HydrophobicContact CG2-CD2 4.23Å; V419-L461 HydrophobicContact CB-CD2 3.87Å; V419-L461 HydrophobicContact CG1-CD2 4.05Å; V419-L461 HydrophobicContact CG2-CD2 3.9Å
420	I	95.5	Very high	85.9	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126	177.6	-47.9	-179	0	0	0	109.2	A375 I376 N378 E418 R423 E433 Q434 I435	A375-I420 WeakPolarHBondContact CA-O 3.16Å; I376-I420 HydrophobicContact CB-CB 4.21Å; I376-I420 PolarHBondContact N-O 3.41Å; I376-I420 PolarHBondContact O-N 2.9Å; N378-I420 WeakPolarHBondContact ND2-CD1 2.96Å; E418-I420 HydrophobicContact CG-CG1 4.13Å; I420-R423 VanDerWaalsContact CD1-NH1 3.27Å; I420-R423 HydrophobicContact CG2-CB 4.25Å; I420-E433 HydrophobicContact CG2-CB 4.28Å; I420-Q434 WeakPolarHBondContact CA-O 3.31Å; I420-I435 HydrophobicContact CG1-CG1 4.19Å; I420-I435 HydrophobicContact CG1-CG2 4.33Å; I420-I435 HydrophobicContact CG2-CG1 4.1Å
421	L	95.3	Very high	84.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	154.2	175	-59	167.7	0	0	0	109.6	A375 L395 V419 E433 Q434 F436 A469 V475	A375-L421 HydrophobicContact CB-CD2 3.53Å; L395-L421 HydrophobicContact CB-CD2 4.08Å; L395-L421 HydrophobicContact CD1-CD1 3.82Å; L395-L421 HydrophobicContact CD1-CD2 4.37Å; L395-L421 HydrophobicContact CD2-CD1 4.11Å; L395-L421 HydrophobicContact CG-CD1 4.48Å; V419-L421 HydrophobicContact CG1-CG 4.45Å; L421-E433 VanDerWaalsContact O-CA 3.24Å; L421-E433 WeakPolarHBondContact O-CA 3.32Å; L421-E433 WeakPolarHBondContact O-CB 3.46Å; L421-Q434 HydrophobicContact CB-CB 4.49Å; L421-Q434 PolarHBondContact N-O 3.48Å; L421-Q434 PolarHBondContact O-N 2.93Å; L421-F436 HydrophobicContact CD1-CD2 4.21Å; L421-F436 HydrophobicContact CD1-CE2 3.93Å; L421-A469 HydrophobicContact CD1-CB 3.6Å; L421-V475 HydrophobicContact CB-CB 4.47Å; L421-V475 HydrophobicContact CB-CG1 3.87Å; L421-V475 HydrophobicContact CB-CG2 3.77Å; L421-V475 HydrophobicContact CD1-CG1 3.84Å; L421-V475 HydrophobicContact CG-CG1 4.4Å
422	G	89.7	Confident	84.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	79	22	169.1	0	0	0	0	0	116	E474	G422-E474 WeakPolarHBondContact CA-O 3.27Å
423	R	87.8	Confident	83.9	Confident	17 Å²	17	55.2 Å²	55.2	6%	0.064	28%	0.284	C	S	.	.			trans	-108.8	109.8	-175.2	-171.4	176.5	-78.7	-178.2	-1.6	113.2	I376 I420 F425 R426 E433 Y498	I376-R423 HydrophobicContact CD1-CB 4.18Å; I376-R423 HydrophobicContact CD1-CG 4.36Å; I420-R423 VanDerWaalsContact CD1-NH1 3.27Å; I420-R423 HydrophobicContact CG2-CB 4.25Å; R423-F425 WeakPolarHBondContact CD-O 3.5Å; R423-F425 WeakPolarHBondContact CG-O 3.5Å; R423-R426 WeakPolarHBondContact CD-O 3.43Å; R423-R426 PolarHBondContact NH1-O 2.6Å; R423-E433 IonicContact CZ-OE1 3.08Å; R423-E433 IonicContact CZ-OE2 3.01Å; R423-E433 IonicContact NE-OE2 3.75Å; R423-E433 PolarHBondContact NE-OE2 2.98Å; R423-E433 IonicContact NH2-OE1 3.68Å; R423-E433 PolarHBondContact NH2-OE1 2.69Å; R423-E433 IonicContact NH2-OE2 2.74Å; R423-E433 PolarHBondContact NH2-OE2 2.89Å; R423-Y498 PolarHBondContact O-OH 2.84Å
424	T	81.7	Confident	83.9	Confident	13 Å²	13	50 Å²	50	8%	0.08	26%	0.262	C	S	.	.	S	Bend	trans	-68	-36.6	174	-66	0	0	0	0	112.8	D367 I368 R511 V512	D367-T424 PolarHBondContact OD2-OG1 3.03Å; I368-T424 WeakPolarHBondContact CB-OG1 3.26Å; I368-T424 VanDerWaalsContact CG2-OG1 3.31Å; I368-T424 WeakPolarHBondContact CG2-OG1 3.29Å; I368-T424 PolarHBondContact N-OG1 2.82Å; T424-R511 HydrophobicContact CG2-CG 3.99Å; T424-R511 WeakPolarHBondContact O-CA 2.95Å; T424-V512 HydrophobicContact CG2-CG1 4.38Å; T424-V512 PolarHBondContact O-N 3.4Å
425	F	81.7	Confident	83.9	Confident	80 Å²	80	53 Å²	53	35%	0.351	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-115.4	115.5	-176.7	-67.3	-81.9	0	0	0	112.1	R423 K427 Q428 E510 R511	R423-F425 WeakPolarHBondContact CD-O 3.5Å; R423-F425 WeakPolarHBondContact CG-O 3.5Å; F425-K427 PolarHBondContact O-N 3.15Å; F425-Q428 HydrophobicContact CB-CB 3.84Å; F425-Q428 HydrophobicContact CB-CG 4.15Å; F425-Q428 PolarHBondContact O-N 3.07Å; F425-E510 CarbonylContact C-O 3.03Å; F425-E510 VanDerWaalsContact C-O 3.27Å; F425-E510 WeakPolarHBondContact CA-O 3.45Å; F425-R511 HydrophobicContact CD1-CB 3.92Å; F425-R511 HydrophobicContact CD1-CG 4.25Å; F425-R511 HydrophobicContact CE1-CB 3.95Å; F425-R511 HydrophobicContact CE1-CG 4.04Å
426	R	83.8	Confident	84.1	Confident	32 Å²	32	49 Å²	49	12%	0.121	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-44.5	-170.1	-170.5	179.3	59	85.2	2.7	114.4	I376 Y389 R423 Y498 S509 E510	I376-R426 HydrophobicContact CD1-CG 4.23Å; Y389-R426 HydrophobicContact CD2-CG 4.3Å; R423-R426 WeakPolarHBondContact CD-O 3.43Å; R423-R426 PolarHBondContact NH1-O 2.6Å; R426-Y498 HydrophobicContact CB-CD1 3.81Å; R426-Y498 HydrophobicContact CB-CE1 4.34Å; R426-Y498 HydrophobicContact CB-CG 4.36Å; R426-Y498 HydrophobicContact CG-CD1 4.4Å; R426-Y498 HydrophobicContact CG-CG 4.49Å; R426-S509 PolarHBondContact NE-O 3.09Å; R426-E510 IonicContact CZ-OE1 3.83Å; R426-E510 PolarHBondContact N-O 2.85Å; R426-E510 IonicContact NH2-OE1 3.43Å; R426-E510 PolarHBondContact NH2-OE1 3.09Å
427	K	77.3	Confident	84.2	Confident	127 Å²	127	51.2 Å²	51.2	55%	0.552	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-9.2	-179.7	-68.7	-178.4	-177.9	140.9	0	114.8	F425 E510	F425-K427 PolarHBondContact O-N 3.15Å; K427-E510 VanDerWaalsContact CB-OE2 3.23Å; K427-E510 WeakPolarHBondContact CB-OE2 3.45Å; K427-E510 WeakPolarHBondContact CD-OE1 3.24Å; K427-E510 VanDerWaalsContact CD-OE2 3.25Å; K427-E510 WeakPolarHBondContact CD-OE2 3.38Å; K427-E510 WeakPolarHBondContact CE-OE1 3.48Å; K427-E510 WeakPolarHBondContact CG-OE2 2.93Å; K427-E510 IonicContact NZ-OE1 2.93Å; K427-E510 PolarHBondContact NZ-OE1 2.91Å
428	Q	72.9	Confident	84.2	Confident	119 Å²	119	51.2 Å²	51.2	56%	0.556	26%	0.262	S	S	*	.	S	Bend	trans	-108.2	130.8	-177.4	-55.6	178.7	16.4	0	0	109.8	F425	F425-Q428 HydrophobicContact CB-CB 3.84Å; F425-Q428 HydrophobicContact CB-CG 4.15Å; F425-Q428 PolarHBondContact O-N 3.07Å
429	N	70.9	Confident	84.1	Confident	129 Å²	129	53.9 Å²	53.9	69%	0.69	27%	0.274	S	S	*	.			trans	-66.8	138.6	177.7	-61	1.6	0	0	0	109.9	E433	N429-E433 WeakPolarHBondContact CA-OE2 3.49Å
430	S	65.8	Low	84	Confident	37 Å²	37	59 Å²	59	26%	0.259	30%	0.296	S	S	.	.			trans	-98.7	148.5	168.8	-175.2	0	0	0	0	109.9	S432 E433	S430-S432 PolarHBondContact O-N 3.4Å; S430-S432 PolarHBondContact OG-N 3.07Å; S430-S432 PolarHBondContact OG-OG 3.42Å; S430-E433 PolarHBondContact N-OE2 3.3Å; S430-E433 VanDerWaalsContact O-CG 3.26Å; S430-E433 WeakPolarHBondContact O-CG 3.02Å; S430-E433 PolarHBondContact O-N 3.11Å
431	S	55.9	Low	84	Confident	136 Å²	136	60.2 Å²	60.2	95%	0.951	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.5	172.5	53.8	0	0	0	0	113.5
432	S	68.6	Low	84.1	Confident	34 Å²	34	61.8 Å²	61.8	24%	0.238	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	6.9	-179.8	53.4	0	0	0	0	113.6	S430	S430-S432 PolarHBondContact O-N 3.4Å; S430-S432 PolarHBondContact OG-N 3.07Å; S430-S432 PolarHBondContact OG-OG 3.42Å
433	E	81.7	Confident	84.5	Confident	34 Å²	34	63.2 Å²	63.2	16%	0.159	31%	0.314	C	S	.	.			trans	-71.9	147.7	178.6	72.8	-164.8	-163.5	0	0	111.9	I420 L421 R423 N429 S430 I435	I420-E433 HydrophobicContact CG2-CB 4.28Å; L421-E433 VanDerWaalsContact O-CA 3.24Å; L421-E433 WeakPolarHBondContact O-CA 3.32Å; L421-E433 WeakPolarHBondContact O-CB 3.46Å; R423-E433 IonicContact CZ-OE1 3.08Å; R423-E433 IonicContact CZ-OE2 3.01Å; R423-E433 IonicContact NE-OE2 3.75Å; R423-E433 PolarHBondContact NE-OE2 2.98Å; R423-E433 IonicContact NH2-OE1 3.68Å; R423-E433 PolarHBondContact NH2-OE1 2.69Å; R423-E433 IonicContact NH2-OE2 2.74Å; R423-E433 PolarHBondContact NH2-OE2 2.89Å; N429-E433 WeakPolarHBondContact CA-OE2 3.49Å; S430-E433 PolarHBondContact N-OE2 3.3Å; S430-E433 VanDerWaalsContact O-CG 3.26Å; S430-E433 WeakPolarHBondContact O-CG 3.02Å; S430-E433 PolarHBondContact O-N 3.11Å; E433-I435 HydrophobicContact CG-CD1 4.38Å; E433-I435 HydrophobicContact CG-CG1 4.25Å
434	Q	90.3	Very high	85	Confident	35 Å²	35	63.5 Å²	63.5	16%	0.164	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.6	174.6	-58.6	177.3	44.6	0	0	108.1	I420 L421 F436 V470 V475	I420-Q434 WeakPolarHBondContact CA-O 3.31Å; L421-Q434 HydrophobicContact CB-CB 4.49Å; L421-Q434 PolarHBondContact N-O 3.48Å; L421-Q434 PolarHBondContact O-N 2.93Å; Q434-F436 HydrophobicContact CB-CD2 4.36Å; Q434-F436 HydrophobicContact CB-CE2 3.45Å; Q434-F436 VanDerWaalsContact CB-CE2 3.45Å; Q434-F436 HydrophobicContact CB-CZ 3.97Å; Q434-V470 PolarHBondContact NE2-O 2.94Å; Q434-V475 HydrophobicContact CG-CG2 4.38Å
435	I	91.8	Very high	85.6	Confident	81 Å²	81	68.8 Å²	68.8	42%	0.415	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.3	-175.2	-56.7	175.1	0	0	0	108.3	E418 V419 I420 E433	E418-I435 HydrophobicContact CG-CG2 3.57Å; V419-I435 WeakPolarHBondContact O-CA 3.45Å; I420-I435 HydrophobicContact CG1-CG1 4.19Å; I420-I435 HydrophobicContact CG1-CG2 4.33Å; I420-I435 HydrophobicContact CG2-CG1 4.1Å; E433-I435 HydrophobicContact CG-CD1 4.38Å; E433-I435 HydrophobicContact CG-CG1 4.25Å
436	F	94.4	Very high	86.4	Confident	26 Å²	26	72.6 Å²	72.6	11%	0.114	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.3	-177.9	-64.1	-83.8	0	0	0	110.7	E418 V419 L421 Q434 L461 A469	E418-F436 WeakPolarHBondContact CA-O 3.46Å; V419-F436 PolarHBondContact N-O 3.29Å; V419-F436 PolarHBondContact O-N 2.95Å; L421-F436 HydrophobicContact CD1-CD2 4.21Å; L421-F436 HydrophobicContact CD1-CE2 3.93Å; Q434-F436 HydrophobicContact CB-CD2 4.36Å; Q434-F436 HydrophobicContact CB-CE2 3.45Å; Q434-F436 VanDerWaalsContact CB-CE2 3.45Å; Q434-F436 HydrophobicContact CB-CZ 3.97Å; F436-L461 HydrophobicContact CB-CB 4.19Å; F436-L461 HydrophobicContact CB-CD1 4.27Å; F436-L461 HydrophobicContact CB-CD2 3.95Å; F436-L461 HydrophobicContact CB-CG 4.36Å; F436-L461 HydrophobicContact CD1-CB 4.32Å; F436-L461 HydrophobicContact CD1-CD1 4.34Å; F436-L461 HydrophobicContact CD2-CD1 3.9Å; F436-L461 HydrophobicContact CE2-CD1 4.34Å; F436-L461 HydrophobicContact CG-CB 4.3Å; F436-L461 HydrophobicContact CG-CD1 3.9Å; F436-L461 HydrophobicContact CG-CD2 4.48Å; F436-L461 HydrophobicContact CG-CG 4.45Å; F436-A469 HydrophobicContact CE2-CB 4.09Å; F436-A469 HydrophobicContact CZ-CB 4.15Å
437	K	94.4	Very high	87	Confident	134 Å²	134	73.5 Å²	73.5	58%	0.583	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	159.9	159.2	-68.9	-178.7	-178.7	176.1	0	109.4	Q462	K437-Q462 HydrophobicContact CB-CB 4.05Å; K437-Q462 VanDerWaalsContact CB-OE1 3.27Å; K437-Q462 WeakPolarHBondContact O-CB 3.24Å; K437-Q462 PolarHBondContact O-N 3.21Å
438	V	95.5	Very high	87.9	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.8	176.1	-177.3	0	0	0	0	109.3	A414 L417 V419 K440 L459	A414-V438 HydrophobicContact CB-CB 4.37Å; A414-V438 HydrophobicContact CB-CG1 4.14Å; A414-V438 WeakPolarHBondContact CB-O 3.33Å; L417-V438 HydrophobicContact CB-CB 3.94Å; L417-V438 HydrophobicContact CB-CG2 3.54Å; L417-V438 HydrophobicContact CD1-CB 4.46Å; L417-V438 HydrophobicContact CD1-CG1 4.43Å; L417-V438 HydrophobicContact CD1-CG2 4.4Å; L417-V438 PolarHBondContact O-N 3.03Å; V419-V438 HydrophobicContact CG2-CG2 3.76Å; V438-K440 WeakPolarHBondContact CG1-O 3.21Å; V438-L459 HydrophobicContact CG1-CB 4.25Å; V438-L459 HydrophobicContact CG1-CD2 4.23Å; V438-L459 HydrophobicContact CG2-CD2 3.99Å
439	E	94	Very high	88.8	Confident	93 Å²	93	70.3 Å²	70.3	44%	0.435	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-49.5	174.1	-179.4	-172.4	143.3	0	0	109.8	K460 Q462	E439-K460 PolarHBondContact N-O 3.32Å; E439-K460 IonicContact OE1-NZ 2.64Å; E439-K460 PolarHBondContact OE1-NZ 2.92Å; E439-K460 WeakPolarHBondContact OE2-CD 3.4Å; E439-K460 WeakPolarHBondContact OE2-CE 3.35Å; E439-K460 IonicContact OE2-NZ 3.44Å; E439-K460 PolarHBondContact OE2-NZ 2.88Å; E439-K460 VanDerWaalsContact OE2-NZ 3.08Å; E439-Q462 HydrophobicContact CB-CB 4.3Å
440	K	95	Very high	89.7	Confident	106 Å²	106	71.5 Å²	71.5	46%	0.461	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	154.9	-179.1	-169	163.3	178.8	177	0	110.6	V438 W442 K460	V438-K440 WeakPolarHBondContact CG1-O 3.21Å; K440-W442 HydrophobicContact CB-CH2 3.92Å; K440-W442 HydrophobicContact CB-CZ2 4.28Å; K440-W442 HydrophobicContact CB-CZ3 4.22Å; K440-W442 HydrophobicContact CD-CH2 4.08Å; K440-W442 HydrophobicContact CD-CZ2 3.58Å; K440-W442 HydrophobicContact CG-CD2 4.49Å; K440-W442 HydrophobicContact CG-CH2 3.99Å; K440-W442 HydrophobicContact CG-CZ2 3.86Å; K440-W442 HydrophobicContact CG-CZ3 4.33Å; K440-K460 PolarHBondContact O-N 2.9Å
441	Y	96.4	Very high	91	Very high	28 Å²	28	72.1 Å²	72.1	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	157.3	168.8	66.6	-84.1	0	0	0	110.6	F408 E409 E412 A414 L417 I443 I458	F408-Y441 HydrophobicContact CB-CD2 4.13Å; F408-Y441 HydrophobicContact CB-CE2 3.69Å; F408-Y441 HydrophobicContact CD1-CD2 4.22Å; F408-Y441 HydrophobicContact CD1-CE2 4.29Å; F408-Y441 HydrophobicContact CG-CD2 4.13Å; F408-Y441 HydrophobicContact CG-CE2 4.14Å; E409-Y441 PolarHBondContact O-OH 2.81Å; E412-Y441 WeakPolarHBondContact O-CE1 3.26Å; E412-Y441 PolarHBondContact O-OH 2.81Å; A414-Y441 HydrophobicContact CB-CD1 4.1Å; A414-Y441 HydrophobicContact CB-CE1 4.28Å; L417-Y441 HydrophobicContact CD1-CD1 3.67Å; L417-Y441 HydrophobicContact CD1-CE1 3.86Å; L417-Y441 HydrophobicContact CD1-CG 4.42Å; Y441-I443 HydrophobicContact CD2-CG1 4.34Å; Y441-I443 HydrophobicContact CE2-CD1 4.21Å; Y441-I443 HydrophobicContact CE2-CG1 4.21Å; Y441-I458 CarbonylContact C-O 3.57Å; Y441-I458 WeakPolarHBondContact CA-O 3.4Å; Y441-I458 WeakPolarHBondContact CB-O 3.36Å
442	W	97.1	Very high	92.8	Very high	34 Å²	34	67.6 Å²	67.6	13%	0.129	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120	177.1	-61.6	-97	0	0	0	109.1	W400 K440 A457 I458 K460 W598 K602 N606	W400-W442 HydrophobicContact CH2-CH2 4.08Å; W400-W442 AromaticContact CH2-CZ3 3.88Å; W400-W442 HydrophobicContact CH2-CZ3 3.88Å; W400-W442 HydrophobicContact CZ3-CE3 4.24Å; W400-W442 HydrophobicContact CZ3-CH2 4.24Å; W400-W442 AromaticContact CZ3-CZ3 3.56Å; W400-W442 HydrophobicContact CZ3-CZ3 3.56Å; K440-W442 HydrophobicContact CB-CH2 3.92Å; K440-W442 HydrophobicContact CB-CZ2 4.28Å; K440-W442 HydrophobicContact CB-CZ3 4.22Å; K440-W442 HydrophobicContact CD-CH2 4.08Å; K440-W442 HydrophobicContact CD-CZ2 3.58Å; K440-W442 HydrophobicContact CG-CD2 4.49Å; K440-W442 HydrophobicContact CG-CH2 3.99Å; K440-W442 HydrophobicContact CG-CZ2 3.86Å; K440-W442 HydrophobicContact CG-CZ3 4.33Å; W442-A457 VanDerWaalsContact O-CA 3.23Å; W442-A457 WeakPolarHBondContact O-CA 3.2Å; W442-I458 HydrophobicContact CB-CG2 4.06Å; W442-I458 HydrophobicContact CE3-CG2 4.01Å; W442-I458 PolarHBondContact N-O 3.45Å; W442-I458 PolarHBondContact O-N 2.79Å; W442-K460 HydrophobicContact CH2-CB 4.18Å; W442-K460 HydrophobicContact CZ3-CB 3.86Å; W442-W598 HydrophobicContact CB-CZ2 4.48Å; W442-K602 HydrophobicContact CB-CD 4.42Å; W442-K602 HydrophobicContact CG-CD 4.15Å; W442-N606 HydrophobicContact CH2-CB 4.07Å; W442-N606 HydrophobicContact CZ2-CB 4.25Å; W442-N606 VanDerWaalsContact CZ2-CG 3.48Å; W442-N606 WeakPolarHBondContact CZ2-OD1 3.41Å
443	I	97.4	Very high	94.1	Very high	30 Å²	30	67.4 Å²	67.4	15%	0.154	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	139.7	164.3	-64.4	168	0	0	0	107.5	A405 F408 I410 Y441 E445 F447 A457	A405-I443 HydrophobicContact CB-CG2 3.74Å; F408-I443 HydrophobicContact CB-CD1 3.89Å; F408-I443 HydrophobicContact CB-CG1 4.14Å; I410-I443 HydrophobicContact CG1-CD1 4.22Å; Y441-I443 HydrophobicContact CD2-CG1 4.34Å; Y441-I443 HydrophobicContact CE2-CD1 4.21Å; Y441-I443 HydrophobicContact CE2-CG1 4.21Å; I443-E445 PolarHBondContact O-N 3.09Å; I443-F447 HydrophobicContact CG2-CB 3.79Å; I443-F447 HydrophobicContact CG2-CD1 3.93Å; I443-F447 HydrophobicContact CG2-CG 4.15Å; I443-A457 HydrophobicContact CG1-CB 4.47Å
444	H	97.6	Very high	94.9	Very high	23 Å²	23	66.5 Å²	66.5	11%	0.106	31%	0.314	C	S	.	.			trans	-55.9	133	175.5	-169.1	-82.7	0	0	0	111.1	K446 F447 N454 I456 Y595 W598	H444-K446 PolarHBondContact ND1-N 3.31Å; H444-K446 PolarHBondContact O-N 3.28Å; H444-F447 VanDerWaalsContact O-CB 3.27Å; H444-F447 WeakPolarHBondContact O-CB 3.33Å; H444-F447 PolarHBondContact O-N 3.14Å; H444-N454 HydrophobicContact CB-CB 4.21Å; H444-N454 WeakPolarHBondContact ND1-CB 3.49Å; H444-I456 HydrophobicContact CB-CG2 3.83Å; H444-I456 WeakPolarHBondContact CB-O 3.3Å; H444-I456 PolarHBondContact N-O 3.01Å; H444-I456 VanDerWaalsContact N-O 3.08Å; H444-Y595 AromaticContact CD2-CD1 3.67Å; H444-Y595 AromaticContact CD2-CE1 3.6Å; H444-Y595 AromaticContact NE2-CD1 3.79Å; H444-Y595 AromaticContact NE2-CE1 3.54Å; H444-W598 HydrophobicContact CB-CH2 4.38Å; H444-W598 HydrophobicContact CB-CZ2 3.97Å; H444-W598 AromaticContact CD2-CD1 3.6Å; H444-W598 AromaticContact CD2-CD2 3.6Å; H444-W598 AromaticContact CD2-CE2 3.52Å; H444-W598 AromaticContact CD2-CG 3.69Å; H444-W598 AromaticContact CD2-NE1 3.47Å; H444-W598 PolarHBondContact CD2-NE1 3.07Å; H444-W598 AromaticContact NE2-CD1 3.8Å
445	E	96.1	Very high	95.2	Very high	124 Å²	124	64.9 Å²	64.9	58%	0.579	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.5	-169.8	-65.5	83.7	170.9	0	0	113.5	I443 W598 K602	I443-E445 PolarHBondContact O-N 3.09Å; E445-W598 PolarHBondContact OE2-NE1 3.41Å; E445-K602 WeakPolarHBondContact OE1-CE 3.47Å; E445-K602 IonicContact OE1-NZ 3.45Å; E445-K602 PolarHBondContact OE1-NZ 3.47Å
446	K	96.9	Very high	95.5	Very high	160 Å²	160	61 Å²	61	70%	0.696	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	15.8	177.9	-56.7	-177.5	179.6	179	0	113.4	H444 N448 N454	H444-K446 PolarHBondContact ND1-N 3.31Å; H444-K446 PolarHBondContact O-N 3.28Å; K446-N448 PolarHBondContact O-N 2.8Å; K446-N454 PolarHBondContact O-ND2 3Å
447	F	96.9	Very high	95.7	Very high	50 Å²	50	59.8 Å²	59.8	22%	0.219	28%	0.281	C	S	.	.			trans	-60.3	128.4	176	173.9	-123.4	0	0	0	110.5	A405 H406 I443 H444 N449 D453 N454 D455	A405-F447 HydrophobicContact CB-CB 4.17Å; A405-F447 HydrophobicContact CB-CD1 3.67Å; A405-F447 HydrophobicContact CB-CD2 3.66Å; A405-F447 HydrophobicContact CB-CE1 3.91Å; A405-F447 HydrophobicContact CB-CE2 3.91Å; A405-F447 HydrophobicContact CB-CG 3.53Å; A405-F447 HydrophobicContact CB-CZ 4.04Å; H406-F447 HydrophobicContact CB-CZ 3.89Å; I443-F447 HydrophobicContact CG2-CB 3.79Å; I443-F447 HydrophobicContact CG2-CD1 3.93Å; I443-F447 HydrophobicContact CG2-CG 4.15Å; H444-F447 VanDerWaalsContact O-CB 3.27Å; H444-F447 WeakPolarHBondContact O-CB 3.33Å; H444-F447 PolarHBondContact O-N 3.14Å; F447-N449 HydrophobicContact CE1-CB 4.24Å; F447-N449 HydrophobicContact CZ-CB 4.3Å; F447-D453 WeakPolarHBondContact CA-O 3.41Å; F447-N454 WeakPolarHBondContact CD2-O 3.5Å; F447-D455 HydrophobicContact CD2-CB 4.08Å; F447-D455 HydrophobicContact CE2-CB 3.73Å; F447-D455 WeakPolarHBondContact CE2-OD1 3.29Å
448	N	95.4	Very high	95.9	Very high	64 Å²	64	53.4 Å²	53.4	34%	0.342	25%	0.253	S	S	.	.			trans	-115.9	116.9	177.9	178.5	-58.6	0	0	0	109.2	K446 E450 T451 F452 D453	K446-N448 PolarHBondContact O-N 2.8Å; N448-E450 VanDerWaalsContact C-N 3.26Å; N448-E450 PolarHBondContact O-N 3.33Å; N448-E450 WeakPolarHBondContact OD1-CB 3.31Å; N448-E450 PolarHBondContact OD1-N 2.81Å; N448-T451 WeakPolarHBondContact CB-OG1 3.39Å; N448-T451 PolarHBondContact OD1-N 3.45Å; N448-T451 PolarHBondContact OD1-OG1 2.71Å; N448-F452 WeakPolarHBondContact O-CA 3.48Å; N448-F452 PolarHBondContact O-N 3.38Å; N448-D453 PolarHBondContact N-O 2.8Å
449	N	92.1	Very high	96	Very high	115 Å²	115	53.2 Å²	53.2	62%	0.615	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.2	-174.3	87.7	19.6	0	0	0	114.1	F447 F452	F447-N449 HydrophobicContact CE1-CB 4.24Å; F447-N449 HydrophobicContact CZ-CB 4.3Å; N449-F452 WeakPolarHBondContact O-CE2 3.24Å
450	E	90.4	Very high	96.1	Very high	155 Å²	155	49.3 Å²	49.3	72%	0.724	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-44.7	-175.9	-59.9	-177.1	168.5	0	0	110.1	N448	N448-E450 VanDerWaalsContact C-N 3.26Å; N448-E450 PolarHBondContact O-N 3.33Å; N448-E450 WeakPolarHBondContact OD1-CB 3.31Å; N448-E450 PolarHBondContact OD1-N 2.81Å
451	T	92.1	Very high	96.1	Very high	49 Å²	49	44.2 Å²	44.2	30%	0.301	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-15.5	-178.5	60.8	0	0	0	0	113.3	N448 D453 M539	N448-T451 WeakPolarHBondContact CB-OG1 3.39Å; N448-T451 PolarHBondContact OD1-N 3.45Å; N448-T451 PolarHBondContact OD1-OG1 2.71Å; T451-D453 PolarHBondContact O-N 3.31Å; T451-D453 PolarHBondContact OG1-N 3.35Å; T451-M539 VanDerWaalsContact O-CE 3.31Å; T451-M539 WeakPolarHBondContact O-CE 3.38Å
452	F	94.2	Very high	95.8	Very high	41 Å²	41	47 Å²	47	18%	0.18	23%	0.225	C	C	.	.			trans	58.5	18.8	-168.3	-64.4	-101.3	0	0	0	113.6	H406 N448 N449 D455 M539 W576	H406-F452 HydrophobicContact CB-CD1 4.26Å; H406-F452 HydrophobicContact CB-CE1 3.85Å; H406-F452 AromaticContact CG-CE1 3.94Å; N448-F452 WeakPolarHBondContact O-CA 3.48Å; N448-F452 PolarHBondContact O-N 3.38Å; N449-F452 WeakPolarHBondContact O-CE2 3.24Å; F452-D455 HydrophobicContact CB-CB 4.35Å; F452-D455 VanDerWaalsContact O-CB 3.22Å; F452-D455 WeakPolarHBondContact O-CB 3.39Å; F452-D455 PolarHBondContact O-N 3.29Å; F452-M539 WeakPolarHBondContact O-CE 3.44Å; F452-W576 VanDerWaalsContact CB-CD1 3.43Å; F452-W576 HydrophobicContact CB-CG 4.42Å; F452-W576 AromaticContact CG-CD1 3.73Å; F452-W576 HydrophobicContact CG-CG 4.32Å
453	D	96.6	Very high	94.9	Very high	31 Å²	31	46.9 Å²	46.9	17%	0.166	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	139	171.5	-169.5	47.2	0	0	0	110.4	F447 N448 T451 D455 T536 N538 M539	F447-D453 WeakPolarHBondContact CA-O 3.41Å; N448-D453 PolarHBondContact N-O 2.8Å; T451-D453 PolarHBondContact O-N 3.31Å; T451-D453 PolarHBondContact OG1-N 3.35Å; D453-D455 VanDerWaalsContact C-N 3.3Å; D453-D455 PolarHBondContact O-N 3.1Å; D453-T536 HydrophobicContact CB-CG2 3.98Å; D453-T536 WeakPolarHBondContact OD1-CB 3.43Å; D453-T536 WeakPolarHBondContact OD1-CG2 3.5Å; D453-T536 PolarHBondContact OD1-OG1 3.17Å; D453-N538 WeakPolarHBondContact OD1-CB 3.32Å; D453-N538 PolarHBondContact OD1-ND2 3.27Å; D453-N538 VanDerWaalsContact OD1-ND2 3.1Å; D453-M539 HydrophobicContact CB-CE 4.09Å
454	N	97.4	Very high	92.9	Very high	15 Å²	15	51.5 Å²	51.5	8%	0.08	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	37.4	-172.1	-43.3	-79.4	0	0	0	114.7	H444 K446 F447 I456 N538 Y595	H444-N454 HydrophobicContact CB-CB 4.21Å; H444-N454 WeakPolarHBondContact ND1-CB 3.49Å; K446-N454 PolarHBondContact O-ND2 3Å; F447-N454 WeakPolarHBondContact CD2-O 3.5Å; N454-I456 PolarHBondContact O-N 3.28Å; N454-N538 PolarHBondContact OD1-ND2 3.39Å; N454-Y595 WeakPolarHBondContact CA-OH 3.44Å; N454-Y595 HydrophobicContact CB-CE1 4.2Å; N454-Y595 VanDerWaalsContact CG-OH 3.32Å; N454-Y595 PolarHBondContact OD1-OH 3Å
455	D	97.7	Very high	90.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.289	C	S	.	.			trans	-74.2	71.5	176.2	-172.5	29	0	0	0	112.6	A405 H406 F447 F452 D453 S575 T590	A405-D455 WeakPolarHBondContact CA-OD1 3.37Å; A405-D455 WeakPolarHBondContact CB-OD1 3.44Å; A405-D455 PolarHBondContact N-OD1 3.06Å; H406-D455 IonicContact CE1-OD2 2.75Å; H406-D455 PolarHBondContact CE1-OD2 2.86Å; H406-D455 IonicContact CG-OD1 2.8Å; H406-D455 IonicContact CG-OD2 3.42Å; H406-D455 PolarHBondContact N-OD1 3.24Å; H406-D455 IonicContact ND1-OD1 3.08Å; H406-D455 PolarHBondContact ND1-OD1 2.79Å; H406-D455 IonicContact ND1-OD2 3.38Å; H406-D455 PolarHBondContact ND1-OD2 2.73Å; F447-D455 HydrophobicContact CD2-CB 4.08Å; F447-D455 HydrophobicContact CE2-CB 3.73Å; F447-D455 WeakPolarHBondContact CE2-OD1 3.29Å; F452-D455 HydrophobicContact CB-CB 4.35Å; F452-D455 VanDerWaalsContact O-CB 3.22Å; F452-D455 WeakPolarHBondContact O-CB 3.39Å; F452-D455 PolarHBondContact O-N 3.29Å; D453-D455 VanDerWaalsContact C-N 3.3Å; D453-D455 PolarHBondContact O-N 3.1Å; D455-S575 VanDerWaalsContact OD2-CB 3.32Å; D455-S575 WeakPolarHBondContact OD2-CB 3.12Å; D455-S575 PolarHBondContact OD2-OG 3.25Å; D455-T590 PolarHBondContact O-OG1 3.24Å
456	I	98.3	Very high	89.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.285	C	S	.	.			trans	-143.3	138.8	177.2	-168.7	170.4	0	0	0	111.1	L402 H444 N454 T590 Y595 W598 I599	L402-I456 HydrophobicContact CD1-CD1 4.5Å; L402-I456 HydrophobicContact CD2-CD1 4.38Å; H444-I456 HydrophobicContact CB-CG2 3.83Å; H444-I456 WeakPolarHBondContact CB-O 3.3Å; H444-I456 PolarHBondContact N-O 3.01Å; H444-I456 VanDerWaalsContact N-O 3.08Å; N454-I456 PolarHBondContact O-N 3.28Å; I456-T590 HydrophobicContact CB-CG2 4.11Å; I456-Y595 HydrophobicContact CD1-CD2 4.49Å; I456-Y595 HydrophobicContact CD1-CG 4.16Å; I456-Y595 HydrophobicContact CG2-CD1 3.73Å; I456-Y595 HydrophobicContact CG2-CE1 3.92Å; I456-Y595 HydrophobicContact CG2-CG 4.08Å; I456-W598 HydrophobicContact CD1-CZ3 4.3Å; I456-W598 HydrophobicContact CG1-CZ3 4.11Å; I456-W598 HydrophobicContact CG2-CE3 4.29Å; I456-W598 HydrophobicContact CG2-CH2 4.35Å; I456-W598 HydrophobicContact CG2-CZ3 3.95Å; I456-I599 HydrophobicContact CD1-CD1 4.27Å
457	A	98.1	Very high	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.4	171.9	0	0	0	0	0	110.7	L402 S403 F408 W442 I443	L402-A457 WeakPolarHBondContact CA-O 3.43Å; S403-A457 PolarHBondContact N-O 2.94Å; S403-A457 PolarHBondContact O-N 2.95Å; F408-A457 HydrophobicContact CD2-CB 3.69Å; F408-A457 HydrophobicContact CE2-CB 3.79Å; W442-A457 VanDerWaalsContact O-CA 3.23Å; W442-A457 WeakPolarHBondContact O-CA 3.2Å; I443-A457 HydrophobicContact CG1-CB 4.47Å
458	I	98.1	Very high	87.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.5	174.9	-171.3	173.3	0	0	0	110	I396 W400 V401 L402 Y441 W442 W598 I599 K602 V603	I396-I458 HydrophobicContact CD1-CD1 4.17Å; W400-I458 HydrophobicContact CD2-CD1 4.3Å; W400-I458 HydrophobicContact CE3-CD1 3.54Å; W400-I458 HydrophobicContact CE3-CG1 3.65Å; W400-I458 HydrophobicContact CZ3-CD1 3.94Å; W400-I458 HydrophobicContact CZ3-CG1 4.06Å; V401-I458 CarbonylContact O-C 3.57Å; V401-I458 WeakPolarHBondContact O-CA 3.32Å; L402-I458 HydrophobicContact CD2-CB 3.76Å; L402-I458 HydrophobicContact CD2-CD1 4.13Å; L402-I458 HydrophobicContact CD2-CG1 3.82Å; Y441-I458 CarbonylContact C-O 3.57Å; Y441-I458 WeakPolarHBondContact CA-O 3.4Å; Y441-I458 WeakPolarHBondContact CB-O 3.36Å; W442-I458 HydrophobicContact CB-CG2 4.06Å; W442-I458 HydrophobicContact CE3-CG2 4.01Å; W442-I458 PolarHBondContact N-O 3.45Å; W442-I458 PolarHBondContact O-N 2.79Å; I458-W598 HydrophobicContact CB-CH2 4.24Å; I458-W598 HydrophobicContact CB-CZ3 4.24Å; I458-W598 HydrophobicContact CG2-CH2 3.74Å; I458-W598 HydrophobicContact CG2-CZ2 4.43Å; I458-W598 HydrophobicContact CG2-CZ3 4.07Å; I458-I599 HydrophobicContact CD1-CG2 4.11Å; I458-K602 HydrophobicContact CD1-CB 4.38Å; I458-K602 HydrophobicContact CG2-CB 3.96Å; I458-K602 HydrophobicContact CG2-CG 3.95Å; I458-V603 HydrophobicContact CD1-CG2 4.01Å
459	L	97.8	Very high	86.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.4	-177.8	-60.9	82.8	0	0	0	109	I377 W400 V401 F408 L417 V419 V438	I377-L459 HydrophobicContact CD1-CD1 4.31Å; I377-L459 HydrophobicContact CD1-CD2 4.18Å; W400-L459 WeakPolarHBondContact CA-O 3.32Å; V401-L459 HydrophobicContact CB-CB 4.41Å; V401-L459 PolarHBondContact N-O 3.25Å; V401-L459 WeakPolarHBondContact O-CD1 3.28Å; V401-L459 PolarHBondContact O-N 2.85Å; F408-L459 HydrophobicContact CE1-CD1 4.48Å; F408-L459 HydrophobicContact CE1-CD2 3.91Å; F408-L459 HydrophobicContact CE2-CD1 4.19Å; F408-L459 HydrophobicContact CZ-CD1 3.76Å; F408-L459 HydrophobicContact CZ-CD2 3.9Å; F408-L459 HydrophobicContact CZ-CG 4.25Å; L417-L459 HydrophobicContact CD1-CD2 4.46Å; V419-L459 HydrophobicContact CG2-CD2 4.23Å; V438-L459 HydrophobicContact CG1-CB 4.25Å; V438-L459 HydrophobicContact CG1-CD2 4.23Å; V438-L459 HydrophobicContact CG2-CD2 3.99Å
460	K	96.2	Very high	86.4	Confident	10 Å²	10	46.5 Å²	46.5	4%	0.043	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.5	168.2	-173.7	178.8	176.6	-160.6	0	108.8	C399 W400 E439 K440 W442 P607	C399-K460 WeakPolarHBondContact O-CA 3.49Å; W400-K460 HydrophobicContact CE3-CB 4.1Å; W400-K460 HydrophobicContact CH2-CB 3.91Å; W400-K460 HydrophobicContact CH2-CD 4.07Å; W400-K460 HydrophobicContact CH2-CG 4.09Å; W400-K460 HydrophobicContact CZ2-CB 4.46Å; W400-K460 HydrophobicContact CZ2-CD 4.14Å; W400-K460 HydrophobicContact CZ2-CG 4.18Å; W400-K460 HydrophobicContact CZ3-CB 3.71Å; W400-K460 HydrophobicContact CZ3-CG 4.31Å; E439-K460 PolarHBondContact N-O 3.32Å; E439-K460 IonicContact OE1-NZ 2.64Å; E439-K460 PolarHBondContact OE1-NZ 2.92Å; E439-K460 WeakPolarHBondContact OE2-CD 3.4Å; E439-K460 WeakPolarHBondContact OE2-CE 3.35Å; E439-K460 IonicContact OE2-NZ 3.44Å; E439-K460 PolarHBondContact OE2-NZ 2.88Å; E439-K460 VanDerWaalsContact OE2-NZ 3.08Å; K440-K460 PolarHBondContact O-N 2.9Å; W442-K460 HydrophobicContact CH2-CB 4.18Å; W442-K460 HydrophobicContact CZ3-CB 3.86Å; K460-P607 PolarHBondContact NZ-O 3.12Å
461	L	95	Very high	86.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	138.8	176.8	-56.4	-176.8	0	0	0	110	C399 V401 V419 F436	C399-L461 PolarHBondContact O-N 2.73Å; V401-L461 HydrophobicContact CG2-CD1 4.24Å; V401-L461 HydrophobicContact CG2-CD2 4.04Å; V401-L461 HydrophobicContact CG2-CG 4.33Å; V419-L461 HydrophobicContact CB-CD2 3.87Å; V419-L461 HydrophobicContact CG1-CD2 4.05Å; V419-L461 HydrophobicContact CG2-CD2 3.9Å; F436-L461 HydrophobicContact CB-CB 4.19Å; F436-L461 HydrophobicContact CB-CD1 4.27Å; F436-L461 HydrophobicContact CB-CD2 3.95Å; F436-L461 HydrophobicContact CB-CG 4.36Å; F436-L461 HydrophobicContact CD1-CB 4.32Å; F436-L461 HydrophobicContact CD1-CD1 4.34Å; F436-L461 HydrophobicContact CD2-CD1 3.9Å; F436-L461 HydrophobicContact CE2-CD1 4.34Å; F436-L461 HydrophobicContact CG-CB 4.3Å; F436-L461 HydrophobicContact CG-CD1 3.9Å; F436-L461 HydrophobicContact CG-CD2 4.48Å; F436-L461 HydrophobicContact CG-CG 4.45Å
462	Q	90.3	Very high	85.7	Confident	85 Å²	85	41.8 Å²	41.8	40%	0.397	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-70.8	131.1	172.1	-175.1	173.7	6	0	0	109.4	K437 E439	K437-Q462 HydrophobicContact CB-CB 4.05Å; K437-Q462 VanDerWaalsContact CB-OE1 3.27Å; K437-Q462 WeakPolarHBondContact O-CB 3.24Å; K437-Q462 PolarHBondContact O-N 3.21Å; E439-Q462 HydrophobicContact CB-CB 4.3Å
463	T	77.8	Confident	85.1	Confident	32 Å²	32	42.5 Å²	42.5	20%	0.196	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-98.8	135.4	-179	74.2	0	0	0	0	111.3	C468 V608	T463-C468 WeakPolarHBondContact CG2-SG 2.98Å; T463-V608 HydrophobicContact CG2-CG1 3.85Å
464	D	57	Low	84.8	Confident	127 Å²	127	43.2 Å²	43.2	68%	0.679	25%	0.247	S	C	*	.	B	Isolated β-bridge	trans	-96.9	128.5	162.1	-70.7	-28.7	0	0	0	107.4	G466 L467	D464-G466 PolarHBondContact O-N 3.43Å; D464-L467 PolarHBondContact O-N 3.49Å; D464-L467 VanDerWaalsContact O-N 3.11Å
465	I	55.1	Low	84.5	Confident	166 Å²	166	42.5 Å²	42.5	85%	0.851	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	25.7	-179.3	62.2	169	0	0	0	115.8	L467	I465-L467 HydrophobicContact CD1-CD1 4.11Å; I465-L467 HydrophobicContact CG1-CD1 4.26Å
466	G	61.1	Low	84.3	Confident	49 Å²	49	43.5 Å²	43.5	51%	0.505	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	13.3	178.7	0	0	0	0	0	114.9	D464	D464-G466 PolarHBondContact O-N 3.43Å
467	L	66.2	Low	84.2	Confident	109 Å²	109	43.8 Å²	43.8	57%	0.571	25%	0.249	S	C	*	.	B	Isolated β-bridge	trans	-106.8	134.8	175.4	-64.2	172.4	0	0	0	110.4	D464 I465	D464-L467 PolarHBondContact O-N 3.49Å; D464-L467 VanDerWaalsContact O-N 3.11Å; I465-L467 HydrophobicContact CD1-CD1 4.11Å; I465-L467 HydrophobicContact CG1-CD1 4.26Å
468	C	85.5	Confident	84.2	Confident	11 Å²	11	43.8 Å²	43.8	7%	0.074	25%	0.249	C	C	.	.			trans	-110.4	-145.7	174.2	-52.1	0	0	0	0	110.6	S398 C399 T463 V470	S398-C468 VanDerWaalsContact C-CB 3.48Å; S398-C468 WeakPolarHBondContact O-CB 3.5Å; C399-C468 HydrophobicContact CB-CB 3.77Å; C399-C468 WeakPolarHBondContact CB-SG 3.47Å; C399-C468 WeakPolarHBondContact SG-CB 3.37Å; C399-C468 CovalentContact SG-SG 2Å; C399-C468 PolarHBondContact SG-SG 3.17Å; T463-C468 WeakPolarHBondContact CG2-SG 2.98Å; C468-V470 PolarHBondContact O-N 3.26Å
469	A	87.8	Confident	84	Confident	7 Å²	7	44.2 Å²	44.2	6%	0.058	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-58.3	124.9	175.3	0	0	0	0	0	111.2	L395 S398 L421 F436 V475	L395-A469 HydrophobicContact CD1-CB 4.08Å; L395-A469 HydrophobicContact CD2-CB 4.17Å; S398-A469 WeakPolarHBondContact CB-O 3.23Å; S398-A469 WeakPolarHBondContact O-CA 3.18Å; S398-A469 WeakPolarHBondContact O-CB 3.04Å; S398-A469 PolarHBondContact O-N 2.93Å; L421-A469 HydrophobicContact CD1-CB 3.6Å; F436-A469 HydrophobicContact CE2-CB 4.09Å; F436-A469 HydrophobicContact CZ-CB 4.15Å; A469-V475 HydrophobicContact CB-CG1 4.15Å
470	V	82.6	Confident	83.9	Confident	90 Å²	90	46.5 Å²	46.5	55%	0.545	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-91.4	126.9	176.3	-179.5	0	0	0	0	108.3	Q434 C468 S472	Q434-V470 PolarHBondContact NE2-O 2.94Å; C468-V470 PolarHBondContact O-N 3.26Å; V470-S472 PolarHBondContact O-N 2.04Å
471	N	85.1	Confident	83.7	Confident	76 Å²	76	46.3 Å²	46.3	41%	0.406	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-63.1	126.5	179.7	-73.6	-13.1	0	0	0	111.5	V475 P477	N471-V475 CarbonylContact C-O 3.55Å; N471-V475 VanDerWaalsContact CA-O 3.27Å; N471-V475 WeakPolarHBondContact CA-O 3Å; N471-P477 WeakPolarHBondContact OD1-CD 3.21Å
472	S	81.3	Confident	83.3	Confident	28 Å²	28	52 Å²	52	20%	0.196	29%	0.291	C	S	.	.			trans	-138.3	174.5	172.6	85.9	0	0	0	0	110.1	V470 E474 V475	V470-S472 PolarHBondContact O-N 2.04Å; S472-E474 PolarHBondContact O-N 3.48Å; S472-E474 PolarHBondContact OG-N 3.34Å; S472-E474 VanDerWaalsContact OG-N 3.12Å; S472-E474 PolarHBondContact OG-OE2 3.46Å; S472-V475 PolarHBondContact N-O 3.22Å; S472-V475 CarbonylContact O-C 3.41Å; S472-V475 PolarHBondContact O-N 2.02Å; S472-V475 PolarHBondContact OG-N 3Å; S472-V475 VanDerWaalsContact OG-N 3.1Å
473	P	82.7	Confident	82.7	Confident	56 Å²	56	57.2 Å²	57.2	36%	0.364	31%	0.307	S	S	.	.	S	Bend	trans	-57.2	-29.2	170.8	-25.9	36.3	0	0	0	113.9	T369 P372	T369-P473 WeakPolarHBondContact CA-O 3.38Å; T369-P473 HydrophobicContact CG2-CB 4.11Å; P372-P473 WeakPolarHBondContact CB-O 3.2Å
474	E	89	Confident	82.4	Confident	46 Å²	46	58.1 Å²	58.1	22%	0.215	32%	0.323	C	S	.	.	S	Bend	trans	-91.7	-21	179.8	-58.4	77.6	-171.2	0	0	113.7	I368 T369 P372 G422 S472	I368-E474 HydrophobicContact CG2-CB 3.7Å; I368-E474 HydrophobicContact CG2-CG 3.67Å; T369-E474 HydrophobicContact CG2-CG 3.79Å; P372-E474 WeakPolarHBondContact CA-O 3.43Å; G422-E474 WeakPolarHBondContact CA-O 3.27Å; S472-E474 PolarHBondContact O-N 3.48Å; S472-E474 PolarHBondContact OG-N 3.34Å; S472-E474 VanDerWaalsContact OG-N 3.12Å; S472-E474 PolarHBondContact OG-OE2 3.46Å
475	V	92.3	Very high	83.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.302	C	S	.	.			trans	-131	105.3	-176.5	-177.5	0	0	0	0	109.4	P372 L395 L421 Q434 A469 N471 S472	P372-V475 WeakPolarHBondContact O-CA 3.3Å; L395-V475 HydrophobicContact CD2-CG1 3.77Å; L421-V475 HydrophobicContact CB-CB 4.47Å; L421-V475 HydrophobicContact CB-CG1 3.87Å; L421-V475 HydrophobicContact CB-CG2 3.77Å; L421-V475 HydrophobicContact CD1-CG1 3.84Å; L421-V475 HydrophobicContact CG-CG1 4.4Å; Q434-V475 HydrophobicContact CG-CG2 4.38Å; A469-V475 HydrophobicContact CB-CG1 4.15Å; N471-V475 CarbonylContact C-O 3.55Å; N471-V475 VanDerWaalsContact CA-O 3.27Å; N471-V475 WeakPolarHBondContact CA-O 3Å; S472-V475 PolarHBondContact N-O 3.22Å; S472-V475 CarbonylContact O-C 3.41Å; S472-V475 PolarHBondContact O-N 2.02Å; S472-V475 PolarHBondContact OG-N 3Å; S472-V475 VanDerWaalsContact OG-N 3.1Å
476	H	92.9	Very high	85.3	Confident	22 Å²	22	52.5 Å²	52.5	10%	0.102	30%	0.298	C	S	.	.			trans	-153.9	133.8	-178.3	-150.6	79.4	0	0	0	110.5	T344 P372 W373	T344-H476 PolarHBondContact O-NE2 3.27Å; T344-H476 VanDerWaalsContact O-NE2 3.13Å; P372-H476 CarbonylContact C-O 3.6Å; P372-H476 HydrophobicContact CB-CB 3.79Å; P372-H476 HydrophobicContact CG-CB 3.82Å; P372-H476 PolarHBondContact O-N 2.89Å; W373-H476 WeakPolarHBondContact CA-O 3.18Å; W373-H476 WeakPolarHBondContact CB-O 3.27Å; W373-H476 PolarHBondContact N-O 2.75Å; W373-H476 VanDerWaalsContact N-O 3.16Å
477	P	96.3	Very high	86.5	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.032	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-69	145.9	-175.8	26.8	-34.2	0	0	0	111.8	C345 G346 L395 N471	C345-P477 CarbonylContact C-O 3.48Å; C345-P477 WeakPolarHBondContact CA-O 3.47Å; G346-P477 PolarHBondContact N-O 3.29Å; L395-P477 HydrophobicContact CD2-CB 4.42Å; L395-P477 HydrophobicContact CG-CB 4.23Å; L395-P477 CarbonylContact O-C 3.57Å; L395-P477 VanDerWaalsContact O-CA 3.26Å; L395-P477 WeakPolarHBondContact O-CA 3.46Å; N471-P477 WeakPolarHBondContact OD1-CD 3.21Å
478	V	97.3	Very high	87.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-78.4	151.5	168.6	69.9	0	0	0	0	110.2	W373 I394 L395 I396 V561 M568 L570	W373-V478 HydrophobicContact CB-CB 3.82Å; W373-V478 HydrophobicContact CB-CG1 4.34Å; W373-V478 HydrophobicContact CD2-CB 3.87Å; W373-V478 HydrophobicContact CD2-CG2 4.16Å; W373-V478 HydrophobicContact CE3-CB 4.08Å; W373-V478 HydrophobicContact CE3-CG2 4.36Å; W373-V478 HydrophobicContact CG-CB 3.75Å; W373-V478 HydrophobicContact CG-CG2 4.39Å; I394-V478 HydrophobicContact CG2-CG1 3.54Å; L395-V478 PolarHBondContact O-N 2.91Å; I396-V478 HydrophobicContact CG2-CG1 4.06Å; V478-V561 HydrophobicContact CG2-CG1 3.6Å; V478-M568 VanDerWaalsContact CG2-O 3.3Å; V478-M568 WeakPolarHBondContact CG2-O 3.34Å; V478-L570 HydrophobicContact CG1-CB 3.8Å; V478-L570 HydrophobicContact CG1-CD2 4.19Å; V478-L570 HydrophobicContact CG1-CG 4.4Å; V478-L570 HydrophobicContact CG2-CB 4.01Å
479	C	95.8	Very high	87.5	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.061	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-72.7	135.3	173	-67.3	0	0	0	0	111.6	C345 M568 T569 L570	C345-C479 HydrophobicContact CB-CB 4.01Å; C345-C479 WeakPolarHBondContact CB-SG 3.46Å; C345-C479 PolarHBondContact O-SG 3.45Å; C345-C479 WeakPolarHBondContact SG-CA 3.18Å; C345-C479 WeakPolarHBondContact SG-CB 3.19Å; C345-C479 CovalentContact SG-SG 2.05Å; C345-C479 PolarHBondContact SG-SG 2.73Å; C479-M568 PolarHBondContact N-O 2.88Å; C479-T569 WeakPolarHBondContact O-CA 3.38Å; C479-L570 PolarHBondContact O-N 2.78Å
480	L	94.4	Very high	87.4	Confident	49 Å²	49	60.9 Å²	60.9	26%	0.257	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-72.2	145	162	-68.8	176.8	0	0	0	109.8	I396 L402 L570 V592 I599	I396-L480 HydrophobicContact CB-CD2 4.27Å; I396-L480 HydrophobicContact CB-CG 4.42Å; I396-L480 HydrophobicContact CD1-CD1 4.37Å; I396-L480 HydrophobicContact CG2-CD2 3.94Å; L402-L480 HydrophobicContact CD1-CD2 4.28Å; L480-L570 HydrophobicContact CD2-CD2 4.45Å; L480-V592 HydrophobicContact CD2-CG1 4.23Å; L480-I599 HydrophobicContact CD1-CG2 3.86Å; L480-I599 HydrophobicContact CD2-CD1 4.18Å
481	P	93	Very high	87.7	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.032	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-74	153.5	-179.2	30.8	-33.3	0	0	0	111.3	L485 T569 L570 M571 V592 T593 V596	P481-L485 HydrophobicContact CB-CB 4.4Å; P481-L485 HydrophobicContact CB-CD2 3.98Å; P481-T569 HydrophobicContact CB-CG2 3.7Å; P481-L570 VanDerWaalsContact CD-O 3.25Å; P481-L570 WeakPolarHBondContact CD-O 3.28Å; P481-L570 WeakPolarHBondContact CG-O 3.32Å; P481-M571 HydrophobicContact CB-SD 4.18Å; P481-V592 HydrophobicContact CG-CB 4.49Å; P481-V592 HydrophobicContact CG-CG1 3.97Å; P481-T593 HydrophobicContact CB-CG2 3.76Å; P481-T593 HydrophobicContact CG-CG2 3.64Å; P481-V596 HydrophobicContact CG-CG2 3.92Å
482	E	85.1	Confident	87.7	Confident	120 Å²	120	59.1 Å²	59.1	56%	0.561	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-61.8	148.7	166.5	-68.2	173.1	-152.9	0	0	110	G484 L485 K565	E482-G484 PolarHBondContact O-N 3.23Å; E482-L485 VanDerWaalsContact O-CB 3.31Å; E482-L485 WeakPolarHBondContact O-CB 3.3Å; E482-L485 PolarHBondContact O-N 2.77Å; E482-L485 VanDerWaalsContact O-N 3.07Å; E482-K565 IonicContact OE1-NZ 3.68Å; E482-K565 PolarHBondContact OE1-NZ 3.2Å; E482-K565 IonicContact OE2-NZ 3.46Å
483	R	78	Confident	88.2	Confident	194 Å²	194	57.9 Å²	57.9	73%	0.732	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	125.9	-179.8	-175.2	177.5	-178	-173.6	3.2	110	L485 D597	R483-L485 PolarHBondContact O-N 2.66Å; R483-D597 IonicContact CZ-OD2 3.83Å; R483-D597 IonicContact NE-OD2 4Å; R483-D597 PolarHBondContact NE-OD2 3.49Å; R483-D597 IonicContact NH1-OD2 3.96Å; R483-D597 IonicContact NH2-OD2 3.78Å
484	G	72.8	Confident	88.6	Confident	52 Å²	52	56.2 Å²	56.2	54%	0.536	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	15.8	178.6	0	0	0	0	0	114.7	E482 V486	E482-G484 PolarHBondContact O-N 3.23Å; G484-V486 PolarHBondContact O-N 3.33Å; G484-V486 VanDerWaalsContact O-N 3.15Å
485	L	86.6	Confident	88.7	Confident	47 Å²	47	54.5 Å²	54.5	25%	0.246	28%	0.28	C	S	.	.			trans	-55.6	119.6	170.8	177.5	64.1	0	0	0	110	P481 E482 R483 L487 T564 T569 M571 T593	P481-L485 HydrophobicContact CB-CB 4.4Å; P481-L485 HydrophobicContact CB-CD2 3.98Å; E482-L485 VanDerWaalsContact O-CB 3.31Å; E482-L485 WeakPolarHBondContact O-CB 3.3Å; E482-L485 PolarHBondContact O-N 2.77Å; E482-L485 VanDerWaalsContact O-N 3.07Å; R483-L485 PolarHBondContact O-N 2.66Å; L485-L487 HydrophobicContact CD1-CD2 4.22Å; L485-L487 HydrophobicContact CD2-CD2 4.43Å; L485-L487 HydrophobicContact CG-CD2 4.28Å; L485-T564 HydrophobicContact CD2-CG2 4.46Å; L485-T569 HydrophobicContact CD2-CG2 4.36Å; L485-M571 HydrophobicContact CD2-CE 4.34Å; L485-M571 HydrophobicContact CD2-SD 3.96Å; L485-M571 HydrophobicContact CG-CE 4.44Å; L485-T593 HydrophobicContact CB-CG2 4.31Å
486	V	84.7	Confident	88.7	Confident	127 Å²	127	54.7 Å²	54.7	77%	0.77	28%	0.281	S	S	*	.			trans	-111.5	122.5	173.5	-178.4	0	0	0	0	108	G484	G484-V486 PolarHBondContact O-N 3.33Å; G484-V486 VanDerWaalsContact O-N 3.15Å
487	L	87.6	Confident	88.5	Confident	36 Å²	36	53.7 Å²	53.7	19%	0.188	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-94.3	153.3	170.2	-60	-177.2	0	0	0	109.2	L485 T491 L519 C562 T564 M571	L485-L487 HydrophobicContact CD1-CD2 4.22Å; L485-L487 HydrophobicContact CD2-CD2 4.43Å; L485-L487 HydrophobicContact CG-CD2 4.28Å; L487-T491 HydrophobicContact CD1-CG2 4.38Å; L487-L519 HydrophobicContact CB-CD1 3.78Å; L487-L519 HydrophobicContact CD1-CD1 4.2Å; L487-C562 HydrophobicContact CD1-CB 3.58Å; L487-T564 HydrophobicContact CD1-CG2 4.15Å; L487-T564 HydrophobicContact CD2-CG2 3.82Å; L487-M571 HydrophobicContact CD1-CE 3.83Å; L487-M571 HydrophobicContact CD1-CG 3.78Å; L487-M571 HydrophobicContact CD1-SD 3.86Å; L487-M571 HydrophobicContact CG-CE 3.86Å; L487-M571 HydrophobicContact CG-SD 4.37Å
488	L	86	Confident	88	Confident	144 Å²	144	53.5 Å²	53.5	75%	0.754	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-64	148.6	178.6	-65.4	173	0	0	0	110.8	T491	L488-T491 VanDerWaalsContact O-CB 3.26Å; L488-T491 WeakPolarHBondContact O-CB 3.01Å; L488-T491 PolarHBondContact O-N 2.02Å; L488-T491 PolarHBondContact O-OG1 3.02Å
489	D	87.2	Confident	87.1	Confident	86 Å²	86	53.6 Å²	53.6	46%	0.46	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	147.8	169.1	-65.2	-20.4	0	0	0	110.4	T491 P521	D489-T491 PolarHBondContact O-N 2.83Å; D489-T491 VanDerWaalsContact O-N 3.16Å; D489-P521 HydrophobicContact CB-CB 4.44Å; D489-P521 HydrophobicContact CB-CG 3.92Å; D489-P521 WeakPolarHBondContact OD2-CB 3.01Å
490	W	85.1	Confident	85.8	Confident	87 Å²	87	55.2 Å²	55.2	33%	0.33	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	7.7	-177.3	-47.2	108.6	0	0	0	115.8	E492 R518 L519 W520 P521 T545	W490-E492 PolarHBondContact O-N 2.81Å; W490-R518 HydrophobicContact CE3-CB 4.28Å; W490-R518 WeakPolarHBondContact O-CD 3.27Å; W490-R518 WeakPolarHBondContact O-CG 3.21Å; W490-L519 WeakPolarHBondContact CA-O 3.46Å; W490-L519 PolarHBondContact N-O 3.02Å; W490-W520 HydrophobicContact CH2-CD2 4.44Å; W490-W520 HydrophobicContact CZ3-CD2 4.34Å; W490-W520 HydrophobicContact CZ3-CG 4.23Å; W490-P521 HydrophobicContact CD2-CG 4.49Å; W490-P521 HydrophobicContact CH2-CG 4.33Å; W490-P521 HydrophobicContact CZ2-CG 3.55Å; W490-T545 HydrophobicContact CE3-CG2 3.74Å; W490-T545 HydrophobicContact CH2-CG2 4.27Å; W490-T545 HydrophobicContact CZ3-CG2 3.35Å
491	T	87.9	Confident	84.1	Confident	39 Å²	39	56.7 Å²	56.7	24%	0.239	29%	0.291	C	S	.	.			trans	-52.8	128.7	170.3	-64.4	0	0	0	0	109.8	L487 L488 D489 R518 L519	L487-T491 HydrophobicContact CD1-CG2 4.38Å; L488-T491 VanDerWaalsContact O-CB 3.26Å; L488-T491 WeakPolarHBondContact O-CB 3.01Å; L488-T491 PolarHBondContact O-N 2.02Å; L488-T491 PolarHBondContact O-OG1 3.02Å; D489-T491 PolarHBondContact O-N 2.83Å; D489-T491 VanDerWaalsContact O-N 3.16Å; T491-R518 VanDerWaalsContact O-CA 3.29Å; T491-R518 WeakPolarHBondContact O-CA 3.44Å; T491-L519 PolarHBondContact O-N 3.08Å
492	E	86	Confident	82.4	Confident	90 Å²	90	59.1 Å²	59.1	42%	0.421	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.6	177.7	-166.8	167.7	66.2	0	0	110.2	W490 H516 R518 R546	W490-E492 PolarHBondContact O-N 2.81Å; E492-H516 HydrophobicContact CG-CB 4.34Å; E492-R518 HydrophobicContact CB-CG 4.44Å; E492-R546 IonicContact OE2-CZ 3.85Å; E492-R546 IonicContact OE2-NH1 3.82Å; E492-R546 PolarHBondContact OE2-NH1 2.78Å; E492-R546 VanDerWaalsContact OE2-NH1 3.08Å; E492-R546 IonicContact OE2-NH2 3.58Å; E492-R546 PolarHBondContact OE2-NH2 2.86Å
493	C	90.9	Very high	81	Confident	2 Å²	2	56 Å²	56	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	167.6	-177.4	-58.7	0	0	0	0	109.2	H516 V517 L560 V561 C562	C493-H516 WeakPolarHBondContact O-CA 3.46Å; C493-V517 HydrophobicContact CB-CG2 4.48Å; C493-V517 PolarHBondContact N-O 3.05Å; C493-V517 PolarHBondContact O-N 2.02Å; C493-V517 VanDerWaalsContact O-O 3.05Å; C493-L560 HydrophobicContact CB-CD1 3.81Å; C493-L560 HydrophobicContact CB-CG 4.43Å; C493-V561 CarbonylContact C-O 3.59Å; C493-V561 WeakPolarHBondContact CA-O 3.47Å; C493-V561 VanDerWaalsContact CB-O 3.31Å; C493-V561 WeakPolarHBondContact CB-O 3.02Å; C493-C562 HydrophobicContact CB-CB 4.08Å; C493-C562 WeakPolarHBondContact CB-SG 3.35Å; C493-C562 WeakPolarHBondContact SG-CB 3.18Å; C493-C562 CovalentContact SG-SG 2.03Å; C493-C562 PolarHBondContact SG-SG 3.22Å
494	E	91.3	Very high	79.9	Confident	21 Å²	21	55 Å²	55	10%	0.098	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.5	-179.2	-59.6	178.7	-174.2	0	0	111	R348 Q371 R514 G515 H516 L560 V561	R348-E494 IonicContact CZ-OE1 3.91Å; R348-E494 IonicContact CZ-OE2 2.75Å; R348-E494 IonicContact NH1-OE1 3.14Å; R348-E494 IonicContact NH1-OE2 3.83Å; R348-E494 PolarHBondContact NH1-OE2 3.41Å; R348-E494 VanDerWaalsContact NH2-CD 3.28Å; R348-E494 IonicContact NH2-OE1 3.85Å; R348-E494 PolarHBondContact NH2-OE1 2.83Å; R348-E494 IonicContact NH2-OE2 3.51Å; R348-E494 PolarHBondContact NH2-OE2 3.29Å; R348-E494 VanDerWaalsContact NH2-OE2 3.14Å; Q371-E494 PolarHBondContact NE2-OE2 3.26Å; E494-R514 HydrophobicContact CB-CG 4.46Å; E494-R514 IonicContact OE1-CZ 3.88Å; E494-R514 IonicContact OE1-NE 2.78Å; E494-R514 IonicContact OE1-NH2 3.83Å; E494-R514 WeakPolarHBondContact OE2-CD 3.05Å; E494-R514 IonicContact OE2-NE 2.76Å; E494-G515 VanDerWaalsContact CA-O 3.31Å; E494-G515 WeakPolarHBondContact CA-O 3.38Å; E494-H516 IonicContact OE1-NE2 3.47Å; E494-L560 WeakPolarHBondContact O-CA 3.42Å; E494-V561 HydrophobicContact CB-CG2 3.97Å; E494-V561 PolarHBondContact N-O 3.06Å; E494-V561 PolarHBondContact O-N 3.49Å
495	I	91.4	Very high	79.2	Confident	9 Å²	9	53.7 Å²	53.7	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.8	169.1	55.2	169.3	0	0	0	109.3	R514 G515 V517 A551 P559 L560 I574 Y589	I495-R514 CarbonylContact O-C 3.53Å; I495-R514 WeakPolarHBondContact O-CA 3.38Å; I495-G515 PolarHBondContact N-O 3.16Å; I495-G515 PolarHBondContact O-N 3.46Å; I495-V517 HydrophobicContact CD1-CG1 3.95Å; I495-V517 HydrophobicContact CG1-CG1 4.25Å; I495-V517 HydrophobicContact CG2-CG2 3.92Å; I495-A551 HydrophobicContact CD1-CB 3.87Å; I495-P559 WeakPolarHBondContact CA-O 3.41Å; I495-L560 HydrophobicContact CG2-CB 4.27Å; I495-L560 HydrophobicContact CG2-CD1 3.5Å; I495-I574 HydrophobicContact CB-CD1 4.43Å; I495-Y589 HydrophobicContact CG2-CE1 3.78Å
496	S	91.8	Very high	77.8	Confident	4 Å²	4	58.7 Å²	58.7	3%	0.028	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155.8	175.4	59.5	0	0	0	0	112.6	Q371 Q374 K513 P559	Q371-S496 PolarHBondContact OE1-OG 3.21Å; Q374-S496 PolarHBondContact OE1-O 2.95Å; Q374-S496 PolarHBondContact OE1-OG 3.45Å; S496-K513 WeakPolarHBondContact CA-O 3.27Å; S496-K513 WeakPolarHBondContact CB-O 2.98Å; S496-P559 VanDerWaalsContact OG-CG 3.25Å; S496-P559 WeakPolarHBondContact OG-CG 2.96Å
497	G	90.4	Very high	76.7	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	-173.1	177.8	0	0	0	0	0	114	K513 D555	G497-K513 PolarHBondContact N-O 2.96Å; G497-K513 PolarHBondContact O-N 3.23Å; G497-D555 VanDerWaalsContact C-OD1 3.28Å; G497-D555 VanDerWaalsContact CA-OD1 3.23Å; G497-D555 WeakPolarHBondContact CA-OD1 3.39Å
498	Y	85.8	Confident	75.9	Confident	1 Å²	1	60.5 Å²	60.5	0%	0.004	30%	0.301	C	S	.	.			trans	-120.6	21.2	-179.9	-51.8	-96.7	0	0	0	111.8	Q374 I376 Y389 R423 R426 Y508 S509 V512 D555	Q374-Y498 HydrophobicContact CG-CE2 3.74Å; I376-Y498 HydrophobicContact CD1-CD2 4.31Å; I376-Y498 HydrophobicContact CD1-CE1 4.19Å; I376-Y498 HydrophobicContact CD1-CE2 3.84Å; I376-Y498 HydrophobicContact CG1-CD2 3.77Å; I376-Y498 HydrophobicContact CG1-CE2 3.4Å; I376-Y498 VanDerWaalsContact CG1-CE2 3.4Å; Y389-Y498 HydrophobicContact CE2-CD2 4.5Å; R423-Y498 PolarHBondContact O-OH 2.84Å; R426-Y498 HydrophobicContact CB-CD1 3.81Å; R426-Y498 HydrophobicContact CB-CE1 4.34Å; R426-Y498 HydrophobicContact CB-CG 4.36Å; R426-Y498 HydrophobicContact CG-CD1 4.4Å; R426-Y498 HydrophobicContact CG-CG 4.49Å; Y498-Y508 WeakPolarHBondContact O-CB 3.39Å; Y498-S509 PolarHBondContact O-N 3.25Å; Y498-S509 VanDerWaalsContact O-N 3.13Å; Y498-V512 HydrophobicContact CD1-CB 4.19Å; Y498-V512 HydrophobicContact CE1-CB 3.56Å; Y498-V512 HydrophobicContact CE1-CG2 4.29Å; Y498-V512 HydrophobicContact CE2-CG2 4.38Å; Y498-D555 PolarHBondContact N-OD1 3.31Å
499	G	78.1	Confident	75.3	Confident	3 Å²	3	53.8 Å²	53.8	3%	0.031	27%	0.266	C	S	.	.			trans	-58.8	172.1	178.9	0	0	0	0	0	113.4	S509 K553 D555	G499-S509 VanDerWaalsContact O-CB 3.29Å; G499-S509 WeakPolarHBondContact O-CB 3.46Å; G499-S509 PolarHBondContact O-N 2.92Å; G499-K553 CarbonylContact C-O 3.52Å; G499-K553 WeakPolarHBondContact CA-O 3.02Å; G499-D555 VanDerWaalsContact CA-OD1 3.24Å; G499-D555 WeakPolarHBondContact CA-OD1 3.27Å; G499-D555 PolarHBondContact N-OD1 2.79Å
500	K	68.3	Low	74.8	Confident	42 Å²	42	52.3 Å²	52.3	18%	0.183	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-62.9	149.4	-179.7	-71.2	179.5	166.5	-153.3	0	111.1	S502 S505 Y508 C552 K553	K500-S502 WeakPolarHBondContact CB-O 3.31Å; K500-S502 PolarHBondContact O-N 3.05Å; K500-S505 WeakPolarHBondContact CD-O 3.16Å; K500-S505 WeakPolarHBondContact CE-O 3.41Å; K500-S505 PolarHBondContact NZ-O 3.05Å; K500-Y508 HydrophobicContact CG-CD1 3.94Å; K500-Y508 HydrophobicContact CG-CE1 4.06Å; K500-C552 WeakPolarHBondContact O-CB 3.24Å; K500-K553 HydrophobicContact CD-CB 3.99Å; K500-K553 WeakPolarHBondContact CG-O 3.35Å; K500-K553 PolarHBondContact N-O 3.24Å
501	N	58.8	Low	74.6	Confident	81 Å²	81	51.9 Å²	51.9	43%	0.433	26%	0.255	S	S	.	.	S	Bend	trans	-68.6	-24	178.7	-67.8	-42.1	0	0	0	113.3	K513	N501-K513 VanDerWaalsContact OD1-CE 3.22Å; N501-K513 WeakPolarHBondContact OD1-CE 3.38Å; N501-K513 PolarHBondContact OD1-NZ 2.8Å
502	S	57.8	Low	74.5	Confident	56 Å²	56	50 Å²	50	39%	0.392	24%	0.244	S	C	.	.	S	Bend	trans	-158.5	164.1	175.1	64.2	0	0	0	0	109.1	K500 F504 S505	K500-S502 WeakPolarHBondContact CB-O 3.31Å; K500-S502 PolarHBondContact O-N 3.05Å; S502-F504 PolarHBondContact O-N 3Å; S502-F504 VanDerWaalsContact O-N 3.08Å; S502-S505 WeakPolarHBondContact O-CB 3.38Å; S502-S505 PolarHBondContact O-N 2.87Å; S502-S505 PolarHBondContact OG-N 3.33Å
503	E	54.3	Low	74.4	Confident	54 Å²	54	47.4 Å²	47.4	25%	0.252	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.7	-178.1	-175.9	174.3	175.4	0	0	113.7	G579	E503-G579 VanDerWaalsContact OE2-CA 3.27Å; E503-G579 WeakPolarHBondContact OE2-CA 3.27Å
504	F	56.4	Low	74.1	Confident	172 Å²	172	48.4 Å²	48.4	75%	0.754	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.9	4.2	-176.5	-53.2	-71.8	0	0	0	114.1	S502	S502-F504 PolarHBondContact O-N 3Å; S502-F504 VanDerWaalsContact O-N 3.08Å
505	S	58.1	Low	73.7	Confident	26 Å²	26	47.7 Å²	47.7	18%	0.182	23%	0.232	C	C	.	.			trans	-70.4	135.9	177.5	-173.8	0	0	0	0	110.7	K500 S502 E507	K500-S505 WeakPolarHBondContact CD-O 3.16Å; K500-S505 WeakPolarHBondContact CE-O 3.41Å; K500-S505 PolarHBondContact NZ-O 3.05Å; S502-S505 WeakPolarHBondContact O-CB 3.38Å; S502-S505 PolarHBondContact O-N 2.87Å; S502-S505 PolarHBondContact OG-N 3.33Å; S505-E507 VanDerWaalsContact C-N 3.26Å; S505-E507 PolarHBondContact O-N 2.94Å; S505-E507 PolarHBondContact OG-N 3.12Å; S505-E507 PolarHBondContact OG-O 3.4Å
506	D	56.1	Low	73.3	Confident	152 Å²	152	49 Å²	49	81%	0.813	24%	0.238	S	C	*	.	S	Bend	trans	-75	-18.2	176	-68.5	-36.2	0	0	0	112.6
507	E	62.2	Low	73.1	Confident	126 Å²	126	48.9 Å²	48.9	59%	0.589	24%	0.237	S	C	*	.	S	Bend	trans	-118.6	136.1	-170.9	-60.8	-167.7	166.7	0	0	113.3	S505	S505-E507 VanDerWaalsContact C-N 3.26Å; S505-E507 PolarHBondContact O-N 2.94Å; S505-E507 PolarHBondContact OG-N 3.12Å; S505-E507 PolarHBondContact OG-O 3.4Å
508	Y	70.8	Confident	73	Confident	75 Å²	75	52.7 Å²	52.7	29%	0.294	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-69.4	150.1	168.7	-66.6	-75.5	0	0	0	110.9	Y389 Y498 K500 E510	Y389-Y508 HydrophobicContact CD1-CD1 4.05Å; Y389-Y508 HydrophobicContact CD1-CD2 4.42Å; Y389-Y508 HydrophobicContact CD1-CE1 4.08Å; Y389-Y508 HydrophobicContact CD1-CE2 4.42Å; Y389-Y508 HydrophobicContact CD1-CG 4.23Å; Y389-Y508 HydrophobicContact CE1-CD1 4.08Å; Y389-Y508 HydrophobicContact CE1-CE1 4.16Å; Y498-Y508 WeakPolarHBondContact O-CB 3.39Å; K500-Y508 HydrophobicContact CG-CD1 3.94Å; K500-Y508 HydrophobicContact CG-CE1 4.06Å; Y508-E510 PolarHBondContact O-N 3.27Å
509	S	72.9	Confident	73.2	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.021	26%	0.255	C	S	.	.			trans	-59.3	128.3	175.7	-172.6	0	0	0	0	110.6	R426 Y498 G499 R511	R426-S509 PolarHBondContact NE-O 3.09Å; Y498-S509 PolarHBondContact O-N 3.25Å; Y498-S509 VanDerWaalsContact O-N 3.13Å; G499-S509 VanDerWaalsContact O-CB 3.29Å; G499-S509 WeakPolarHBondContact O-CB 3.46Å; G499-S509 PolarHBondContact O-N 2.92Å; S509-R511 VanDerWaalsContact C-N 3.26Å; S509-R511 PolarHBondContact O-N 3.18Å; S509-R511 PolarHBondContact OG-N 2.88Å; S509-R511 PolarHBondContact OG-O 2.99Å
510	E	77.7	Confident	73.8	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	26%	0.259	S	S	.	.	S	Bend	trans	-73.1	-21.9	175.3	-72	-56.3	137.5	0	0	112.4	F425 R426 K427 Y508	F425-E510 CarbonylContact C-O 3.03Å; F425-E510 VanDerWaalsContact C-O 3.27Å; F425-E510 WeakPolarHBondContact CA-O 3.45Å; R426-E510 IonicContact CZ-OE1 3.83Å; R426-E510 PolarHBondContact N-O 2.85Å; R426-E510 IonicContact NH2-OE1 3.43Å; R426-E510 PolarHBondContact NH2-OE1 3.09Å; K427-E510 VanDerWaalsContact CB-OE2 3.23Å; K427-E510 WeakPolarHBondContact CB-OE2 3.45Å; K427-E510 WeakPolarHBondContact CD-OE1 3.24Å; K427-E510 VanDerWaalsContact CD-OE2 3.25Å; K427-E510 WeakPolarHBondContact CD-OE2 3.38Å; K427-E510 WeakPolarHBondContact CE-OE1 3.48Å; K427-E510 WeakPolarHBondContact CG-OE2 2.93Å; K427-E510 IonicContact NZ-OE1 2.93Å; K427-E510 PolarHBondContact NZ-OE1 2.91Å; Y508-E510 PolarHBondContact O-N 3.27Å
511	R	81.1	Confident	74.9	Confident	78 Å²	78	53.1 Å²	53.1	29%	0.294	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-120.7	142.3	-180	-177.2	173.2	176.2	175.3	7	110.3	Y365 S366 T424 F425 S509 K513	Y365-R511 HydrophobicContact CD1-CB 3.88Å; Y365-R511 HydrophobicContact CD1-CG 4.07Å; Y365-R511 HydrophobicContact CE1-CB 4.22Å; S366-R511 PolarHBondContact O-NE 3.24Å; S366-R511 PolarHBondContact O-NH2 2.98Å; T424-R511 HydrophobicContact CG2-CG 3.99Å; T424-R511 WeakPolarHBondContact O-CA 2.95Å; F425-R511 HydrophobicContact CD1-CB 3.92Å; F425-R511 HydrophobicContact CD1-CG 4.25Å; F425-R511 HydrophobicContact CE1-CB 3.95Å; F425-R511 HydrophobicContact CE1-CG 4.04Å; S509-R511 VanDerWaalsContact C-N 3.26Å; S509-R511 PolarHBondContact O-N 3.18Å; S509-R511 PolarHBondContact OG-N 2.88Å; S509-R511 PolarHBondContact OG-O 2.99Å; R511-K513 PolarHBondContact O-N 3.32Å
512	V	85.8	Confident	76.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.261	C	S	.	.			trans	-56	134.1	174.5	65.6	0	0	0	0	110.2	S366 Q374 T424 Y498	S366-V512 PolarHBondContact N-O 2.75Å; S366-V512 WeakPolarHBondContact O-CG1 3.38Å; Q374-V512 HydrophobicContact CG-CG2 4.3Å; T424-V512 HydrophobicContact CG2-CG1 4.38Å; T424-V512 PolarHBondContact O-N 3.4Å; Y498-V512 HydrophobicContact CD1-CB 4.19Å; Y498-V512 HydrophobicContact CE1-CB 3.56Å; Y498-V512 HydrophobicContact CE1-CG2 4.29Å; Y498-V512 HydrophobicContact CE2-CG2 4.38Å
513	K	83.6	Confident	77.6	Confident	34 Å²	34	60 Å²	60	15%	0.148	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	155.8	175.5	-68.2	-173.3	-179.8	-174.2	0	110.6	G362 R364 Y365 S496 G497 N501 R511	G362-K513 PolarHBondContact O-NZ 2.71Å; R364-K513 WeakPolarHBondContact O-CA 3.47Å; Y365-K513 HydrophobicContact CD1-CG 4.26Å; S496-K513 WeakPolarHBondContact CA-O 3.27Å; S496-K513 WeakPolarHBondContact CB-O 2.98Å; G497-K513 PolarHBondContact N-O 2.96Å; G497-K513 PolarHBondContact O-N 3.23Å; N501-K513 VanDerWaalsContact OD1-CE 3.22Å; N501-K513 WeakPolarHBondContact OD1-CE 3.38Å; N501-K513 PolarHBondContact OD1-NZ 2.8Å; R511-K513 PolarHBondContact O-N 3.32Å
514	R	84.8	Confident	79.3	Confident	24 Å²	24	64.7 Å²	64.7	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.3	172.2	-171.9	-176.2	97.6	-176.2	23.5	109.3	G363 R364 E370 E494 I495 H516	G363-R514 WeakPolarHBondContact CA-O 3.19Å; R364-R514 PolarHBondContact N-O 3.43Å; R364-R514 PolarHBondContact O-N 2.84Å; E370-R514 IonicContact OE2-CZ 3.88Å; E370-R514 IonicContact OE2-NH1 3.26Å; E370-R514 PolarHBondContact OE2-NH1 2.03Å; E494-R514 HydrophobicContact CB-CG 4.46Å; E494-R514 IonicContact OE1-CZ 3.88Å; E494-R514 IonicContact OE1-NE 2.78Å; E494-R514 IonicContact OE1-NH2 3.83Å; E494-R514 WeakPolarHBondContact OE2-CD 3.05Å; E494-R514 IonicContact OE2-NE 2.76Å; I495-R514 CarbonylContact O-C 3.53Å; I495-R514 WeakPolarHBondContact O-CA 3.38Å; R514-H516 PolarHBondContact NE-CE1 3.48Å; R514-H516 PolarHBondContact NH2-CE1 3Å; R514-H516 VanDerWaalsContact NH2-CE1 3.29Å; R514-H516 PolarHBondContact NH2-NE2 3.28Å
515	G	81.3	Confident	80.9	Confident	5 Å²	5	57 Å²	57	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	152	173.7	0	0	0	0	0	110.8	E494 I495	E494-G515 VanDerWaalsContact CA-O 3.31Å; E494-G515 WeakPolarHBondContact CA-O 3.38Å; I495-G515 PolarHBondContact N-O 3.16Å; I495-G515 PolarHBondContact O-N 3.46Å
516	H	84.6	Confident	82.4	Confident	38 Å²	38	57.8 Å²	57.8	18%	0.176	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.4	171.4	-56.3	76.7	0	0	0	109.8	E492 C493 E494 R514 R546 D549	E492-H516 HydrophobicContact CG-CB 4.34Å; C493-H516 WeakPolarHBondContact O-CA 3.46Å; E494-H516 IonicContact OE1-NE2 3.47Å; R514-H516 PolarHBondContact NE-CE1 3.48Å; R514-H516 PolarHBondContact NH2-CE1 3Å; R514-H516 VanDerWaalsContact NH2-CE1 3.29Å; R514-H516 PolarHBondContact NH2-NE2 3.28Å; H516-R546 PolarHBondContact O-NH2 2.94Å; H516-D549 PolarHBondContact N-OD2 3.1Å; H516-D549 VanDerWaalsContact N-OD2 3.14Å
517	V	86.6	Confident	83.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	167.3	178.7	-63.8	0	0	0	0	109.4	C493 I495 A542 L560	C493-V517 HydrophobicContact CB-CG2 4.48Å; C493-V517 PolarHBondContact N-O 3.05Å; C493-V517 PolarHBondContact O-N 2.02Å; C493-V517 VanDerWaalsContact O-O 3.05Å; I495-V517 HydrophobicContact CD1-CG1 3.95Å; I495-V517 HydrophobicContact CG1-CG1 4.25Å; I495-V517 HydrophobicContact CG2-CG2 3.92Å; V517-A542 HydrophobicContact CB-CB 4.29Å; V517-A542 HydrophobicContact CG2-CB 3.88Å; V517-L560 HydrophobicContact CG2-CD1 3.42Å; V517-L560 VanDerWaalsContact CG2-CD1 3.42Å
518	R	87.5	Confident	85.1	Confident	81 Å²	81	53.8 Å²	53.8	31%	0.306	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146.4	173.7	-70.3	178.4	178.5	172.8	-7	110.1	W490 T491 E492 W520 A542 G543 T545	W490-R518 HydrophobicContact CE3-CB 4.28Å; W490-R518 WeakPolarHBondContact O-CD 3.27Å; W490-R518 WeakPolarHBondContact O-CG 3.21Å; T491-R518 VanDerWaalsContact O-CA 3.29Å; T491-R518 WeakPolarHBondContact O-CA 3.44Å; E492-R518 HydrophobicContact CB-CG 4.44Å; R518-W520 VanDerWaalsContact O-CD1 3.3Å; R518-W520 PolarHBondContact O-N 2.97Å; R518-A542 WeakPolarHBondContact O-CA 2.95Å; R518-A542 WeakPolarHBondContact O-CB 3.49Å; R518-G543 PolarHBondContact N-O 2.76Å; R518-G543 PolarHBondContact O-N 3.26Å; R518-G543 VanDerWaalsContact O-N 3.09Å; R518-T545 PolarHBondContact NH1-OG1 2.85Å
519	L	90.8	Very high	85.7	Confident	17 Å²	17	52.6 Å²	52.6	9%	0.089	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	130.3	171.2	-60.5	-177.1	0	0	0	109.6	L487 W490 T491 L540 A542 L560	L487-L519 HydrophobicContact CB-CD1 3.78Å; L487-L519 HydrophobicContact CD1-CD1 4.2Å; W490-L519 WeakPolarHBondContact CA-O 3.46Å; W490-L519 PolarHBondContact N-O 3.02Å; T491-L519 PolarHBondContact O-N 3.08Å; L519-L540 HydrophobicContact CD2-CD1 4.17Å; L519-A542 HydrophobicContact CD2-CB 4.33Å; L519-L560 HydrophobicContact CD2-CD2 3.98Å
520	W	90.9	Very high	86.4	Confident	29 Å²	29	52.4 Å²	52.4	11%	0.11	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-89.6	141.6	178.3	-81.4	46.8	0	0	0	110.8	W490 R518 R524 I529 C541 G543 E584 P586	W490-W520 HydrophobicContact CH2-CD2 4.44Å; W490-W520 HydrophobicContact CZ3-CD2 4.34Å; W490-W520 HydrophobicContact CZ3-CG 4.23Å; R518-W520 VanDerWaalsContact O-CD1 3.3Å; R518-W520 PolarHBondContact O-N 2.97Å; W520-R524 HydrophobicContact CE3-CB 3.95Å; W520-R524 HydrophobicContact CZ3-CB 4.37Å; W520-I529 HydrophobicContact CE3-CD1 4.13Å; W520-I529 HydrophobicContact CH2-CD1 4.47Å; W520-I529 HydrophobicContact CZ3-CD1 3.62Å; W520-C541 HydrophobicContact CB-CB 3.66Å; W520-C541 HydrophobicContact CG-CB 4.18Å; W520-C541 PolarHBondContact N-O 3.25Å; W520-G543 PolarHBondContact NE1-O 3.17Å; W520-E584 WeakPolarHBondContact CH2-O 3.43Å; W520-P586 HydrophobicContact CD2-CB 3.74Å; W520-P586 HydrophobicContact CD2-CG 3.85Å; W520-P586 HydrophobicContact CE3-CB 4.21Å; W520-P586 HydrophobicContact CE3-CG 3.77Å; W520-P586 HydrophobicContact CG-CB 3.99Å; W520-P586 HydrophobicContact CG-CG 4.41Å; W520-P586 HydrophobicContact CH2-CG 4.35Å; W520-P586 HydrophobicContact CZ2-CB 4.21Å; W520-P586 HydrophobicContact CZ2-CG 4.4Å; W520-P586 HydrophobicContact CZ3-CG 4.05Å
521	P	90.3	Very high	86.7	Confident	9 Å²	9	54 Å²	54	6%	0.058	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-54	140.5	167.9	-20.8	29	0	0	0	110.8	D489 W490 E523 R524 C525	D489-P521 HydrophobicContact CB-CB 4.44Å; D489-P521 HydrophobicContact CB-CG 3.92Å; D489-P521 WeakPolarHBondContact OD2-CB 3.01Å; W490-P521 HydrophobicContact CD2-CG 4.49Å; W490-P521 HydrophobicContact CH2-CG 4.33Å; W490-P521 HydrophobicContact CZ2-CG 3.55Å; P521-E523 WeakPolarHBondContact CB-OE2 3.37Å; P521-E523 PolarHBondContact O-N 3.03Å; P521-R524 HydrophobicContact CB-CB 4.42Å; P521-R524 HydrophobicContact CB-CG 4.37Å; P521-R524 HydrophobicContact CG-CG 4.41Å; P521-R524 PolarHBondContact O-N 2.86Å; P521-C525 PolarHBondContact O-N 2.63Å
522	K	87	Confident	86.9	Confident	139 Å²	139	52.9 Å²	52.9	60%	0.604	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.5	179.4	-173.3	-178.8	176.5	-172.9	0	111.4	R524 C525	K522-R524 PolarHBondContact O-N 3.14Å; K522-C525 PolarHBondContact O-N 2.74Å
523	E	88.3	Confident	86.9	Confident	144 Å²	144	58.1 Å²	58.1	67%	0.673	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.7	-180	-55.5	68.6	-145.4	0	0	112.4	P521 V526	P521-E523 WeakPolarHBondContact CB-OE2 3.37Å; P521-E523 PolarHBondContact O-N 3.03Å; E523-V526 WeakPolarHBondContact O-CG1 3.46Å
524	R	88.8	Confident	87.2	Confident	151 Å²	151	60.7 Å²	60.7	57%	0.57	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-22.5	174.2	-69	-168.6	170.6	-154.8	-4.8	112.9	W520 P521 K522 V526 I529	W520-R524 HydrophobicContact CE3-CB 3.95Å; W520-R524 HydrophobicContact CZ3-CB 4.37Å; P521-R524 HydrophobicContact CB-CB 4.42Å; P521-R524 HydrophobicContact CB-CG 4.37Å; P521-R524 HydrophobicContact CG-CG 4.41Å; P521-R524 PolarHBondContact O-N 2.86Å; K522-R524 PolarHBondContact O-N 3.14Å; R524-V526 VanDerWaalsContact C-N 3.28Å; R524-V526 PolarHBondContact O-N 3.37Å; R524-I529 WeakPolarHBondContact O-CD1 3.41Å
525	C	89.6	Confident	87.5	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.074	31%	0.312	C	S	.	.	S	Bend	trans	-80.3	77.1	173.5	-176.3	0	0	0	0	108.6	P521 K522 I535 C541	P521-C525 PolarHBondContact O-N 2.63Å; K522-C525 PolarHBondContact O-N 2.74Å; C525-I535 WeakPolarHBondContact O-CD1 3.18Å; C525-C541 HydrophobicContact CB-CB 3.53Å; C525-C541 WeakPolarHBondContact CB-SG 3.28Å; C525-C541 WeakPolarHBondContact SG-CB 3.14Å; C525-C541 CovalentContact SG-SG 2.01Å; C525-C541 PolarHBondContact SG-SG 2.74Å
526	V	90.1	Very high	88.1	Confident	43 Å²	43	63.2 Å²	63.2	26%	0.261	32%	0.321	S	S	.	.			trans	-125	155	-172.6	-61.7	0	0	0	0	112.2	E523 R524 E528 I529	E523-V526 WeakPolarHBondContact O-CG1 3.46Å; R524-V526 VanDerWaalsContact C-N 3.28Å; R524-V526 PolarHBondContact O-N 3.37Å; V526-E528 VanDerWaalsContact CB-OE2 3.26Å; V526-E528 WeakPolarHBondContact CB-OE2 3.17Å; V526-E528 HydrophobicContact CG2-CB 4.39Å; V526-E528 VanDerWaalsContact CG2-OE2 3.22Å; V526-E528 WeakPolarHBondContact CG2-OE2 3.38Å; V526-E528 PolarHBondContact O-N 2.95Å; V526-E528 VanDerWaalsContact O-N 3.16Å; V526-I529 HydrophobicContact CG2-CG1 4.23Å; V526-I529 WeakPolarHBondContact O-CG1 3.19Å; V526-I529 PolarHBondContact O-N 2.99Å
527	P	87.4	Confident	88.4	Confident	41 Å²	41	64.6 Å²	64.6	27%	0.266	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.8	-33	-176.5	-27.5	36.9	0	0	0	114.5	I529 L530 S531 G532 R533	P527-I529 PolarHBondContact O-N 2.96Å; P527-L530 CarbonylContact O-C 3.55Å; P527-L530 VanDerWaalsContact O-C 3.27Å; P527-L530 PolarHBondContact O-N 2.99Å; P527-S531 PolarHBondContact O-N 3.09Å; P527-G532 WeakPolarHBondContact O-CA 3.35Å; P527-G532 PolarHBondContact O-N 2.86Å; P527-R533 VanDerWaalsContact CA-O 3.29Å; P527-R533 WeakPolarHBondContact CA-O 3.21Å; P527-R533 VanDerWaalsContact CB-O 3.28Å; P527-R533 WeakPolarHBondContact CB-O 3.21Å
528	E	86.9	Confident	88.8	Confident	153 Å²	153	66.1 Å²	66.1	72%	0.715	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-59.3	-32.4	-177.5	-65.3	76.2	-170.2	0	0	112.6	V526	V526-E528 VanDerWaalsContact CB-OE2 3.26Å; V526-E528 WeakPolarHBondContact CB-OE2 3.17Å; V526-E528 HydrophobicContact CG2-CB 4.39Å; V526-E528 VanDerWaalsContact CG2-OE2 3.22Å; V526-E528 WeakPolarHBondContact CG2-OE2 3.38Å; V526-E528 PolarHBondContact O-N 2.95Å; V526-E528 VanDerWaalsContact O-N 3.16Å
529	I	84.8	Confident	89.2	Confident	49 Å²	49	62.6 Å²	62.6	25%	0.251	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-91.3	-12	177.7	64.2	155.7	0	0	0	113.1	W520 R524 V526 P527 P586	W520-I529 HydrophobicContact CE3-CD1 4.13Å; W520-I529 HydrophobicContact CH2-CD1 4.47Å; W520-I529 HydrophobicContact CZ3-CD1 3.62Å; R524-I529 WeakPolarHBondContact O-CD1 3.41Å; V526-I529 HydrophobicContact CG2-CG1 4.23Å; V526-I529 WeakPolarHBondContact O-CG1 3.19Å; V526-I529 PolarHBondContact O-N 2.99Å; P527-I529 PolarHBondContact O-N 2.96Å; I529-P586 HydrophobicContact CD1-CG 3.93Å
530	L	86.3	Confident	89.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	42.5	179.9	-61.5	-173.2	0	0	0	112.1	P527 G532 R533 I535 W576 D578 P586 V588	P527-L530 CarbonylContact O-C 3.55Å; P527-L530 VanDerWaalsContact O-C 3.27Å; P527-L530 PolarHBondContact O-N 2.99Å; L530-G532 PolarHBondContact O-N 3.23Å; L530-G532 VanDerWaalsContact O-N 3.07Å; L530-R533 WeakPolarHBondContact O-CB 3.26Å; L530-R533 PolarHBondContact O-N 3.41Å; L530-I535 HydrophobicContact CD1-CD1 3.52Å; L530-I535 HydrophobicContact CD1-CG1 3.8Å; L530-I535 HydrophobicContact CG-CD1 4.35Å; L530-W576 HydrophobicContact CB-CH2 4.13Å; L530-W576 HydrophobicContact CB-CZ3 4.27Å; L530-W576 HydrophobicContact CD1-CH2 3.69Å; L530-W576 HydrophobicContact CD1-CZ2 4.47Å; L530-W576 HydrophobicContact CD1-CZ3 4.18Å; L530-W576 HydrophobicContact CG-CH2 4.5Å; L530-D578 WeakPolarHBondContact CA-OD2 3.41Å; L530-P586 HydrophobicContact CD2-CG 4.25Å; L530-V588 HydrophobicContact CD1-CG2 3.39Å
531	S	84.4	Confident	89.4	Confident	88 Å²	88	61.1 Å²	61.1	62%	0.615	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	35.2	174.9	-54.1	0	0	0	0	114.6	P527 R533 D578	P527-S531 PolarHBondContact O-N 3.09Å; S531-R533 VanDerWaalsContact C-N 3.33Å; S531-R533 PolarHBondContact O-N 3.27Å; S531-D578 WeakPolarHBondContact CB-OD2 3.15Å; S531-D578 PolarHBondContact N-OD2 3.41Å; S531-D578 PolarHBondContact OG-OD2 3.26Å
532	G	84.9	Confident	89.4	Confident	55 Å²	55	60.7 Å²	60.7	57%	0.567	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	5.6	178.1	0	0	0	0	0	114.9	P527 L530	P527-G532 WeakPolarHBondContact O-CA 3.35Å; P527-G532 PolarHBondContact O-N 2.86Å; L530-G532 PolarHBondContact O-N 3.23Å; L530-G532 VanDerWaalsContact O-N 3.07Å
533	R	86.8	Confident	89.3	Confident	109 Å²	109	54.1 Å²	54.1	41%	0.411	29%	0.294	S	S	.	.			trans	-75.8	133.5	177.5	-71.6	-177.9	162.4	-148.9	-5.7	111.5	P527 L530 S531 W576	P527-R533 VanDerWaalsContact CA-O 3.29Å; P527-R533 WeakPolarHBondContact CA-O 3.21Å; P527-R533 VanDerWaalsContact CB-O 3.28Å; P527-R533 WeakPolarHBondContact CB-O 3.21Å; L530-R533 WeakPolarHBondContact O-CB 3.26Å; L530-R533 PolarHBondContact O-N 3.41Å; S531-R533 VanDerWaalsContact C-N 3.33Å; S531-R533 PolarHBondContact O-N 3.27Å; R533-W576 HydrophobicContact CB-CH2 3.49Å; R533-W576 VanDerWaalsContact CB-CH2 3.49Å; R533-W576 HydrophobicContact CB-CZ2 4.24Å; R533-W576 HydrophobicContact CB-CZ3 4.01Å; R533-W576 VanDerWaalsContact CD-CZ3 3.43Å; R533-W576 HydrophobicContact CG-CH2 4.26Å; R533-W576 HydrophobicContact CG-CZ3 4.34Å
534	T	88.6	Confident	88.6	Confident	88 Å²	88	47.8 Å²	47.8	54%	0.54	27%	0.265	S	S	.	.			trans	-75.2	142.6	-179.4	50.5	0	0	0	0	111.5
535	I	91.6	Very high	87.4	Confident	41 Å²	41	43.2 Å²	43.2	21%	0.21	25%	0.254	C	S	.	.			trans	-116.6	119.2	-177.5	-56.7	149.5	0	0	0	107.7	C525 L530 M539	C525-I535 WeakPolarHBondContact O-CD1 3.18Å; L530-I535 HydrophobicContact CD1-CD1 3.52Å; L530-I535 HydrophobicContact CD1-CG1 3.8Å; L530-I535 HydrophobicContact CG-CD1 4.35Å; I535-M539 HydrophobicContact CG2-CB 3.89Å; I535-M539 HydrophobicContact CG2-SD 4.32Å
536	T	93.6	Very high	86	Confident	41 Å²	41	47 Å²	47	25%	0.252	27%	0.266	S	S	.	.			trans	-86.2	168.8	-178.4	75.7	0	0	0	0	111.4	D453 N538 M539	D453-T536 HydrophobicContact CB-CG2 3.98Å; D453-T536 WeakPolarHBondContact OD1-CB 3.43Å; D453-T536 WeakPolarHBondContact OD1-CG2 3.5Å; D453-T536 PolarHBondContact OD1-OG1 3.17Å; T536-N538 PolarHBondContact O-N 3.32Å; T536-N538 PolarHBondContact OG1-N 3.3Å; T536-M539 HydrophobicContact CG2-CE 4.12Å; T536-M539 PolarHBondContact O-N 2.73Å; T536-M539 VanDerWaalsContact O-N 3.14Å
537	S	91.9	Very high	84.6	Confident	67 Å²	67	46.4 Å²	46.4	47%	0.469	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-19	172.5	53.6	0	0	0	0	113.5	M539 R591 H594	S537-M539 PolarHBondContact O-N 2.83Å; S537-R591 PolarHBondContact O-NE 3.01Å; S537-H594 PolarHBondContact O-CE1 3.01Å; S537-H594 PolarHBondContact O-ND1 2.89Å
538	N	94.8	Very high	83.2	Confident	33 Å²	33	47.4 Å²	47.4	18%	0.176	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-0.5	178.8	-59.3	-32.4	0	0	0	113.3	D453 N454 T536 R591 H594 Y595	D453-N538 WeakPolarHBondContact OD1-CB 3.32Å; D453-N538 PolarHBondContact OD1-ND2 3.27Å; D453-N538 VanDerWaalsContact OD1-ND2 3.1Å; N454-N538 PolarHBondContact OD1-ND2 3.39Å; T536-N538 PolarHBondContact O-N 3.32Å; T536-N538 PolarHBondContact OG1-N 3.3Å; N538-R591 VanDerWaalsContact O-CB 3.24Å; N538-R591 WeakPolarHBondContact O-CB 3.02Å; N538-R591 PolarHBondContact O-N 2.93Å; N538-H594 PolarHBondContact OD1-ND1 3.26Å; N538-H594 VanDerWaalsContact OD1-ND1 3.15Å; N538-Y595 HydrophobicContact CB-CE2 4.13Å; N538-Y595 WeakPolarHBondContact CB-OH 3.49Å
539	M	95.3	Very high	81.9	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.03	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	159.6	177.3	-61.5	173.9	-170.6	0	0	110.4	T451 F452 D453 I535 T536 S537 W576 V588 Y589 R591	T451-M539 VanDerWaalsContact O-CE 3.31Å; T451-M539 WeakPolarHBondContact O-CE 3.38Å; F452-M539 WeakPolarHBondContact O-CE 3.44Å; D453-M539 HydrophobicContact CB-CE 4.09Å; I535-M539 HydrophobicContact CG2-CB 3.89Å; I535-M539 HydrophobicContact CG2-SD 4.32Å; T536-M539 HydrophobicContact CG2-CE 4.12Å; T536-M539 PolarHBondContact O-N 2.73Å; T536-M539 VanDerWaalsContact O-N 3.14Å; S537-M539 PolarHBondContact O-N 2.83Å; M539-W576 HydrophobicContact SD-CZ2 4.46Å; M539-V588 HydrophobicContact CB-CG1 3.9Å; M539-V588 HydrophobicContact CG-CG1 4.1Å; M539-V588 HydrophobicContact SD-CG1 3.91Å; M539-Y589 CarbonylContact C-O 3.27Å; M539-Y589 WeakPolarHBondContact CA-O 3.29Å; M539-R591 PolarHBondContact O-NE 2.04Å; M539-R591 VanDerWaalsContact O-NE 3.08Å; M539-R591 PolarHBondContact O-NH2 3.46Å
540	L	94.1	Very high	80.6	Confident	11 Å²	11	39.8 Å²	39.8	6%	0.058	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	152.9	166.5	68.7	84.3	0	0	0	109.6	L519 A542 L560 M571 Y589 R591	L519-L540 HydrophobicContact CD2-CD1 4.17Å; L540-A542 HydrophobicContact CD1-CB 4.42Å; L540-L560 HydrophobicContact CD1-CD2 3.52Å; L540-M571 WeakPolarHBondContact CD2-O 3.43Å; L540-Y589 HydrophobicContact CD1-CD2 4Å; L540-Y589 HydrophobicContact CD1-CG 4.11Å; L540-Y589 PolarHBondContact N-O 3.09Å; L540-Y589 PolarHBondContact O-N 3.24Å; L540-R591 HydrophobicContact CD2-CB 4.12Å; L540-R591 HydrophobicContact CD2-CG 4.16Å
541	C	92.9	Very high	79.2	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.1	173.1	-77.3	0	0	0	0	110.6	W520 C525 P586 G587	W520-C541 HydrophobicContact CB-CB 3.66Å; W520-C541 HydrophobicContact CG-CB 4.18Å; W520-C541 PolarHBondContact N-O 3.25Å; C525-C541 HydrophobicContact CB-CB 3.53Å; C525-C541 WeakPolarHBondContact CB-SG 3.28Å; C525-C541 WeakPolarHBondContact SG-CB 3.14Å; C525-C541 CovalentContact SG-SG 2.01Å; C525-C541 PolarHBondContact SG-SG 2.74Å; C541-P586 HydrophobicContact CB-CB 3.71Å; C541-P586 HydrophobicContact CB-CG 3.78Å; C541-P586 VanDerWaalsContact SG-CG 3.59Å; C541-G587 WeakPolarHBondContact CA-O 3.36Å
542	A	90.4	Very high	78.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	141.7	165.3	0	0	0	0	0	110.4	V517 R518 L519 L540 L560 G587 Y589	V517-A542 HydrophobicContact CB-CB 4.29Å; V517-A542 HydrophobicContact CG2-CB 3.88Å; R518-A542 WeakPolarHBondContact O-CA 2.95Å; R518-A542 WeakPolarHBondContact O-CB 3.49Å; L519-A542 HydrophobicContact CD2-CB 4.33Å; L540-A542 HydrophobicContact CD1-CB 4.42Å; A542-L560 HydrophobicContact CB-CD1 4.24Å; A542-L560 HydrophobicContact CB-CD2 4.04Å; A542-G587 PolarHBondContact N-O 2.78Å; A542-G587 PolarHBondContact O-N 2.97Å; A542-Y589 HydrophobicContact CB-CD2 4.08Å; A542-Y589 HydrophobicContact CB-CE2 3.64Å; A542-Y589 WeakPolarHBondContact O-CE2 3.5Å
543	G	84.6	Confident	77	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	159.6	-179.6	0	0	0	0	0	111.3	R518 W520 T545	R518-G543 PolarHBondContact N-O 2.76Å; R518-G543 PolarHBondContact O-N 3.26Å; R518-G543 VanDerWaalsContact O-N 3.09Å; W520-G543 PolarHBondContact NE1-O 3.17Å; G543-T545 PolarHBondContact O-N 2.81Å
544	D	72.6	Confident	75.6	Confident	12 Å²	12	35 Å²	35	6%	0.064	20%	0.199	C	C	.	.			trans	-81.5	110.5	176.9	-174.1	16.8	0	0	0	111.1	R546 G547 L548 D549	D544-R546 PolarHBondContact O-N 2.99Å; D544-R546 WeakPolarHBondContact OD1-CB 3.46Å; D544-R546 IonicContact OD1-CZ 3.44Å; D544-R546 PolarHBondContact OD1-N 3.5Å; D544-R546 IonicContact OD1-NE 3.91Å; D544-R546 PolarHBondContact OD1-NE 2.93Å; D544-R546 IonicContact OD1-NH2 3.06Å; D544-R546 PolarHBondContact OD1-NH2 2.95Å; D544-R546 IonicContact OD2-NE 2.88Å; D544-G547 PolarHBondContact O-N 2.98Å; D544-L548 WeakPolarHBondContact OD2-CA 3Å; D544-L548 VanDerWaalsContact OD2-CB 3.29Å; D544-L548 WeakPolarHBondContact OD2-CB 3.46Å; D544-L548 PolarHBondContact OD2-N 2.82Å; D544-D549 HydrophobicContact CB-CB 4.28Å; D544-D549 WeakPolarHBondContact CB-O 3.36Å; D544-D549 PolarHBondContact OD2-N 3.35Å; D544-D549 VanDerWaalsContact OD2-N 3.08Å
545	T	63	Low	75.2	Confident	55 Å²	55	31.5 Å²	31.5	34%	0.337	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.1	175.3	58.4	0	0	0	0	113.3	W490 R518 G543	W490-T545 HydrophobicContact CE3-CG2 3.74Å; W490-T545 HydrophobicContact CH2-CG2 4.27Å; W490-T545 HydrophobicContact CZ3-CG2 3.35Å; R518-T545 PolarHBondContact NH1-OG1 2.85Å; G543-T545 PolarHBondContact O-N 2.81Å
546	R	61.9	Low	75.1	Confident	89 Å²	89	30.7 Å²	30.7	34%	0.336	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-11.3	176.5	-57.8	162.4	-70.7	-145.4	-7.4	112.7	E492 H516 D544 L548	E492-R546 IonicContact OE2-CZ 3.85Å; E492-R546 IonicContact OE2-NH1 3.82Å; E492-R546 PolarHBondContact OE2-NH1 2.78Å; E492-R546 VanDerWaalsContact OE2-NH1 3.08Å; E492-R546 IonicContact OE2-NH2 3.58Å; E492-R546 PolarHBondContact OE2-NH2 2.86Å; H516-R546 PolarHBondContact O-NH2 2.94Å; D544-R546 PolarHBondContact O-N 2.99Å; D544-R546 WeakPolarHBondContact OD1-CB 3.46Å; D544-R546 IonicContact OD1-CZ 3.44Å; D544-R546 PolarHBondContact OD1-N 3.5Å; D544-R546 IonicContact OD1-NE 3.91Å; D544-R546 PolarHBondContact OD1-NE 2.93Å; D544-R546 IonicContact OD1-NH2 3.06Å; D544-R546 PolarHBondContact OD1-NH2 2.95Å; D544-R546 IonicContact OD2-NE 2.88Å; R546-L548 HydrophobicContact CB-CD1 4.02Å; R546-L548 HydrophobicContact CB-CG 4.19Å
547	G	59.7	Low	75.1	Confident	32 Å²	32	28.8 Å²	28.8	33%	0.33	16%	0.163	S	C	.	.	S	Bend	trans	73	28.2	-179.8	0	0	0	0	0	115	D544	D544-G547 PolarHBondContact O-N 2.98Å
548	L	58.8	Low	75.2	Confident	62 Å²	62	25.6 Å²	25.6	33%	0.325	14%	0.141	S	C	.	.	S	Bend	trans	-113.4	-30.4	-173.1	-57.7	170	0	0	0	113.9	V361 G362 D544 R546	V361-L548 HydrophobicContact CG2-CD2 4.21Å; G362-L548 PolarHBondContact N-O 3.5Å; D544-L548 WeakPolarHBondContact OD2-CA 3Å; D544-L548 VanDerWaalsContact OD2-CB 3.29Å; D544-L548 WeakPolarHBondContact OD2-CB 3.46Å; D544-L548 PolarHBondContact OD2-N 2.82Å; R546-L548 HydrophobicContact CB-CD1 4.02Å; R546-L548 HydrophobicContact CB-CG 4.19Å
549	D	58.7	Low	75.3	Confident	6 Å²	6	24 Å²	24	3%	0.032	13%	0.133	C	C	.	.			trans	-128	134.1	-176.3	-61.1	-35.9	0	0	0	111.8	R359 G363 H516 D544	R359-D549 IonicContact CZ-OD2 2.73Å; R359-D549 IonicContact NE-OD2 3.74Å; R359-D549 IonicContact NH2-OD2 2.85Å; R359-D549 PolarHBondContact NH2-OD2 2.94Å; G363-D549 WeakPolarHBondContact CA-OD1 2.98Å; G363-D549 PolarHBondContact N-OD1 2.91Å; H516-D549 PolarHBondContact N-OD2 3.1Å; H516-D549 VanDerWaalsContact N-OD2 3.14Å; D544-D549 HydrophobicContact CB-CB 4.28Å; D544-D549 WeakPolarHBondContact CB-O 3.36Å; D544-D549 PolarHBondContact OD2-N 3.35Å; D544-D549 VanDerWaalsContact OD2-N 3.08Å
550	D	57.5	Low	75.3	Confident	35 Å²	35	23.7 Å²	23.7	19%	0.187	13%	0.131	C	C	.	.			trans	-152	153.3	173.1	-162.8	11.9	0	0	0	111.4	C580 G581	D550-C580 WeakPolarHBondContact OD2-CA 3.44Å; D550-G581 VanDerWaalsContact CB-N 3.32Å; D550-G581 PolarHBondContact OD2-N 3.02Å
551	A	57.7	Low	75.4	Confident	14 Å²	14	23.2 Å²	23.2	12%	0.116	13%	0.128	C	C	.	.			trans	-75.1	142.1	171.5	0	0	0	0	0	109.2	I495 D555 I574	I495-A551 HydrophobicContact CD1-CB 3.87Å; A551-D555 HydrophobicContact CB-CB 4.36Å; A551-I574 HydrophobicContact CB-CD1 4.19Å; A551-I574 HydrophobicContact CB-CG1 4.48Å; A551-I574 HydrophobicContact CB-CG2 4.06Å
552	C	65.6	Low	75.4	Confident	12 Å²	12	23 Å²	23	8%	0.081	13%	0.127	C	C	.	.			trans	-129.2	176.8	-179	-159.2	0	0	0	0	113.4	K500 G554 D555 C580	K500-C552 WeakPolarHBondContact O-CB 3.24Å; C552-G554 PolarHBondContact O-N 3.05Å; C552-G554 VanDerWaalsContact O-N 3.11Å; C552-D555 PolarHBondContact N-OD2 3.28Å; C552-D555 WeakPolarHBondContact O-CB 2.98Å; C552-D555 PolarHBondContact O-N 2.98Å; C552-C580 WeakPolarHBondContact CA-SG 3.11Å; C552-C580 HydrophobicContact CB-CB 3.51Å; C552-C580 WeakPolarHBondContact CB-SG 3.36Å; C552-C580 WeakPolarHBondContact SG-CB 3.29Å; C552-C580 CovalentContact SG-SG 2.04Å; C552-C580 PolarHBondContact SG-SG 3.19Å
553	K	56.3	Low	75.4	Confident	116 Å²	116	28.8 Å²	28.8	50%	0.504	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	121.7	176.1	-73.8	-176.5	-179.1	170.1	0	110.2	G499 K500	G499-K553 CarbonylContact C-O 3.52Å; G499-K553 WeakPolarHBondContact CA-O 3.02Å; K500-K553 HydrophobicContact CD-CB 3.99Å; K500-K553 WeakPolarHBondContact CG-O 3.35Å; K500-K553 PolarHBondContact N-O 3.24Å
554	G	58.1	Low	75.3	Confident	9 Å²	9	30 Å²	30	9%	0.093	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.5	-9.6	-176.6	0	0	0	0	0	115.4	Y389 C552 S556	Y389-G554 VanDerWaalsContact CE1-O 3.3Å; Y389-G554 WeakPolarHBondContact CE1-O 3.48Å; Y389-G554 PolarHBondContact OH-O 3.41Å; C552-G554 PolarHBondContact O-N 3.05Å; C552-G554 VanDerWaalsContact O-N 3.11Å; G554-S556 VanDerWaalsContact C-N 3.33Å
555	D	79.8	Confident	75.6	Confident	16 Å²	16	37.3 Å²	37.3	9%	0.086	19%	0.187	C	C	.	.			trans	-86.6	-6.7	168.6	-62.8	-48.5	0	0	0	112.5	G497 Y498 G499 A551 C552 G557 G558 I574	G497-D555 VanDerWaalsContact C-OD1 3.28Å; G497-D555 VanDerWaalsContact CA-OD1 3.23Å; G497-D555 WeakPolarHBondContact CA-OD1 3.39Å; Y498-D555 PolarHBondContact N-OD1 3.31Å; G499-D555 VanDerWaalsContact CA-OD1 3.24Å; G499-D555 WeakPolarHBondContact CA-OD1 3.27Å; G499-D555 PolarHBondContact N-OD1 2.79Å; A551-D555 HydrophobicContact CB-CB 4.36Å; C552-D555 PolarHBondContact N-OD2 3.28Å; C552-D555 WeakPolarHBondContact O-CB 2.98Å; C552-D555 PolarHBondContact O-N 2.98Å; D555-G557 PolarHBondContact O-N 3.13Å; D555-G558 WeakPolarHBondContact O-CA 3.47Å; D555-G558 PolarHBondContact O-N 3.45Å; D555-I574 HydrophobicContact CB-CD1 3.93Å; D555-I574 HydrophobicContact CB-CG2 4.33Å; D555-I574 WeakPolarHBondContact O-CB 3.49Å; D555-I574 WeakPolarHBondContact O-CD1 3.4Å
556	S	89.2	Confident	76.3	Confident	24 Å²	24	40.5 Å²	40.5	17%	0.168	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	132.1	175.6	-65.9	0	0	0	0	112.1	C391 G392 H406 G554 G558	C391-S556 VanDerWaalsContact CB-O 3.3Å; C391-S556 WeakPolarHBondContact CB-O 3.38Å; G392-S556 PolarHBondContact N-O 2.86Å; H406-S556 WeakPolarHBondContact NE2-CB 2.71Å; H406-S556 PolarHBondContact NE2-OG 2.83Å; H406-S556 VanDerWaalsContact NE2-OG 3.09Å; G554-S556 VanDerWaalsContact C-N 3.33Å; S556-G558 PolarHBondContact O-N 2.89Å
557	G	94.1	Very high	77.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	-3.7	-175.1	0	0	0	0	0	115.1	G392 G393 I394 S403 D555 I574	G392-G557 CarbonylContact C-O 3.27Å; G392-G557 CarbonylContact O-C 3.32Å; G393-G557 WeakPolarHBondContact CA-O 3.5Å; I394-G557 WeakPolarHBondContact CG1-O 3.39Å; S403-G557 WeakPolarHBondContact OG-CA 3.48Å; D555-G557 PolarHBondContact O-N 3.13Å; G557-I574 PolarHBondContact N-O 2.89Å
558	G	94.8	Very high	79.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.			trans	-76.2	170.1	172.2	0	0	0	0	0	113.5	D555 S556 I574	D555-G558 WeakPolarHBondContact O-CA 3.47Å; D555-G558 PolarHBondContact O-N 3.45Å; S556-G558 PolarHBondContact O-N 2.89Å; G558-I574 WeakPolarHBondContact O-CG1 3.44Å; G558-I574 PolarHBondContact O-N 2.81Å
559	P	96.7	Very high	80.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	148.2	-170.4	34.9	-36.4	0	0	0	113.8	I394 I495 S496 V561 L570	I394-P559 HydrophobicContact CD1-CB 3.87Å; I394-P559 HydrophobicContact CG1-CB 3.82Å; I394-P559 HydrophobicContact CG1-CG 4.4Å; I394-P559 HydrophobicContact CG2-CB 4.14Å; I495-P559 WeakPolarHBondContact CA-O 3.41Å; S496-P559 VanDerWaalsContact OG-CG 3.25Å; S496-P559 WeakPolarHBondContact OG-CG 2.96Å; P559-V561 HydrophobicContact CB-CG1 4.06Å; P559-L570 HydrophobicContact CB-CD1 3.84Å
560	L	95.9	Very high	82.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	108.9	154.4	175.4	73.7	0	0	0	108.4	C493 E494 I495 V517 L519 L540 A542 M571 G572 Y589	C493-L560 HydrophobicContact CB-CD1 3.81Å; C493-L560 HydrophobicContact CB-CG 4.43Å; E494-L560 WeakPolarHBondContact O-CA 3.42Å; I495-L560 HydrophobicContact CG2-CB 4.27Å; I495-L560 HydrophobicContact CG2-CD1 3.5Å; V517-L560 HydrophobicContact CG2-CD1 3.42Å; V517-L560 VanDerWaalsContact CG2-CD1 3.42Å; L519-L560 HydrophobicContact CD2-CD2 3.98Å; L540-L560 HydrophobicContact CD1-CD2 3.52Å; A542-L560 HydrophobicContact CB-CD1 4.24Å; A542-L560 HydrophobicContact CB-CD2 4.04Å; L560-M571 PolarHBondContact O-N 2.04Å; L560-G572 PolarHBondContact N-O 2.83Å; L560-G572 PolarHBondContact O-N 3.49Å; L560-Y589 HydrophobicContact CB-CD1 3.64Å; L560-Y589 HydrophobicContact CB-CE1 3.81Å; L560-Y589 HydrophobicContact CB-CG 4.47Å; L560-Y589 HydrophobicContact CD1-CE1 4.19Å; L560-Y589 HydrophobicContact CD2-CD1 3.99Å; L560-Y589 HydrophobicContact CD2-CD2 4.35Å; L560-Y589 HydrophobicContact CD2-CE1 4.28Å; L560-Y589 HydrophobicContact CD2-CG 4.04Å; L560-Y589 HydrophobicContact CG-CD1 4.31Å; L560-Y589 HydrophobicContact CG-CE1 4.32Å
561	V	95.6	Very high	84.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.3	-176.8	-66.2	0	0	0	0	111.9	W373 V478 C493 E494 P559 M568 T569 L570	W373-V561 HydrophobicContact CZ2-CG1 4.35Å; W373-V561 HydrophobicContact CZ2-CG2 3.92Å; V478-V561 HydrophobicContact CG2-CG1 3.6Å; C493-V561 CarbonylContact C-O 3.59Å; C493-V561 WeakPolarHBondContact CA-O 3.47Å; C493-V561 VanDerWaalsContact CB-O 3.31Å; C493-V561 WeakPolarHBondContact CB-O 3.02Å; E494-V561 HydrophobicContact CB-CG2 3.97Å; E494-V561 PolarHBondContact N-O 3.06Å; E494-V561 PolarHBondContact O-N 3.49Å; P559-V561 HydrophobicContact CB-CG1 4.06Å; V561-M568 HydrophobicContact CB-CB 4.48Å; V561-M568 HydrophobicContact CB-CE 3.88Å; V561-M568 HydrophobicContact CG2-CE 3.4Å; V561-M568 VanDerWaalsContact CG2-CE 3.4Å; V561-T569 WeakPolarHBondContact CA-O 3.23Å; V561-L570 HydrophobicContact CG1-CD1 4.21Å
562	C	93.2	Very high	86.4	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.1	176.5	-49.8	0	0	0	0	109.1	L487 C493 T564 T569 M571	L487-C562 HydrophobicContact CD1-CB 3.58Å; C493-C562 HydrophobicContact CB-CB 4.08Å; C493-C562 WeakPolarHBondContact CB-SG 3.35Å; C493-C562 WeakPolarHBondContact SG-CB 3.18Å; C493-C562 CovalentContact SG-SG 2.03Å; C493-C562 PolarHBondContact SG-SG 3.22Å; C562-T564 PolarHBondContact O-N 3.47Å; C562-T569 PolarHBondContact N-O 2.85Å; C562-T569 PolarHBondContact O-N 2.87Å; C562-M571 HydrophobicContact CB-CG 3.83Å; C562-M571 WeakPolarHBondContact SG-CG 3.39Å
563	R	88.9	Confident	88	Confident	121 Å²	121	34.4 Å²	34.4	46%	0.457	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	121.7	177.6	-169.1	175.8	179.7	114.1	-1.6	109.8	D350 D566 R567 M568	D350-R563 IonicContact OD2-CZ 3.76Å; D350-R563 IonicContact OD2-NH1 2.77Å; D350-R563 PolarHBondContact OD2-NH1 3.25Å; R563-D566 IonicContact CZ-OD1 3.51Å; R563-D566 IonicContact NE-OD1 2.65Å; R563-D566 PolarHBondContact NE-OD1 3.02Å; R563-D566 IonicContact NH2-OD1 3.4Å; R563-D566 PolarHBondContact NH2-OD1 2.94Å; R563-R567 CarbonylContact C-O 3.39Å; R563-R567 WeakPolarHBondContact CA-O 3.46Å; R563-M568 HydrophobicContact CB-SD 3.87Å; R563-M568 HydrophobicContact CG-SD 4.21Å
564	T	84.1	Confident	89.8	Confident	26 Å²	26	29.4 Å²	29.4	16%	0.16	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.4	178.1	63.5	0	0	0	0	109.7	L485 L487 C562 D566 R567 T569	L485-T564 HydrophobicContact CD2-CG2 4.46Å; L487-T564 HydrophobicContact CD1-CG2 4.15Å; L487-T564 HydrophobicContact CD2-CG2 3.82Å; C562-T564 PolarHBondContact O-N 3.47Å; T564-D566 PolarHBondContact O-N 3.18Å; T564-D566 VanDerWaalsContact O-N 3.14Å; T564-R567 PolarHBondContact N-O 3.02Å; T564-R567 PolarHBondContact O-N 3.27Å; T564-R567 VanDerWaalsContact O-O 3.06Å; T564-T569 WeakPolarHBondContact OG1-CB 3.24Å; T564-T569 PolarHBondContact OG1-OG1 2.67Å
565	K	78.1	Confident	91.5	Very high	167 Å²	167	29.2 Å²	29.2	73%	0.726	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	42.8	178.3	-54.9	176.3	-174	170.8	0	112.6	E482 R567	E482-K565 IonicContact OE1-NZ 3.68Å; E482-K565 PolarHBondContact OE1-NZ 3.2Å; E482-K565 IonicContact OE2-NZ 3.46Å; K565-R567 VanDerWaalsContact C-N 3.28Å; K565-R567 PolarHBondContact O-N 3.02Å
566	D	77.3	Confident	91.9	Very high	122 Å²	122	29.7 Å²	29.7	65%	0.652	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	21.3	-176.4	-66.1	-52.5	0	0	0	117.5	R563 T564	R563-D566 IonicContact CZ-OD1 3.51Å; R563-D566 IonicContact NE-OD1 2.65Å; R563-D566 PolarHBondContact NE-OD1 3.02Å; R563-D566 IonicContact NH2-OD1 3.4Å; R563-D566 PolarHBondContact NH2-OD1 2.94Å; T564-D566 PolarHBondContact O-N 3.18Å; T564-D566 VanDerWaalsContact O-N 3.14Å
567	R	88.8	Confident	91.7	Very high	97 Å²	97	30.2 Å²	30.2	37%	0.366	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.4	171.5	-62.2	-175.5	178.7	-157.7	0.3	110.9	R563 T564 K565	R563-R567 CarbonylContact C-O 3.39Å; R563-R567 WeakPolarHBondContact CA-O 3.46Å; T564-R567 PolarHBondContact N-O 3.02Å; T564-R567 PolarHBondContact O-N 3.27Å; T564-R567 VanDerWaalsContact O-O 3.06Å; K565-R567 VanDerWaalsContact C-N 3.28Å; K565-R567 PolarHBondContact O-N 3.02Å
568	M	93.2	Very high	90.7	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.03	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.4	171.8	-60.2	-59.6	-65.8	0	0	108.9	G346 W373 V478 C479 V561 R563	G346-M568 WeakPolarHBondContact CA-O 3.43Å; G346-M568 PolarHBondContact O-N 2.92Å; W373-M568 HydrophobicContact CH2-CB 3.51Å; W373-M568 HydrophobicContact CH2-CG 3.55Å; W373-M568 HydrophobicContact CZ2-CB 4.08Å; W373-M568 HydrophobicContact CZ2-CG 4.28Å; W373-M568 HydrophobicContact CZ3-CB 3.91Å; W373-M568 HydrophobicContact CZ3-CG 4.23Å; V478-M568 VanDerWaalsContact CG2-O 3.3Å; V478-M568 WeakPolarHBondContact CG2-O 3.34Å; C479-M568 PolarHBondContact N-O 2.88Å; V561-M568 HydrophobicContact CB-CB 4.48Å; V561-M568 HydrophobicContact CB-CE 3.88Å; V561-M568 HydrophobicContact CG2-CE 3.4Å; V561-M568 VanDerWaalsContact CG2-CE 3.4Å; R563-M568 HydrophobicContact CB-SD 3.87Å; R563-M568 HydrophobicContact CG-SD 4.21Å
569	T	95.9	Very high	89.3	Confident	8 Å²	8	32.4 Å²	32.4	5%	0.049	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.4	-175.9	-62.2	0	0	0	0	109.7	C479 P481 L485 V561 C562 T564 M571	C479-T569 WeakPolarHBondContact O-CA 3.38Å; P481-T569 HydrophobicContact CB-CG2 3.7Å; L485-T569 HydrophobicContact CD2-CG2 4.36Å; V561-T569 WeakPolarHBondContact CA-O 3.23Å; C562-T569 PolarHBondContact N-O 2.85Å; C562-T569 PolarHBondContact O-N 2.87Å; T564-T569 WeakPolarHBondContact OG1-CB 3.24Å; T564-T569 PolarHBondContact OG1-OG1 2.67Å; T569-M571 HydrophobicContact CG2-SD 4.13Å; T569-M571 PolarHBondContact O-N 2.81Å
570	L	97.3	Very high	87.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	111.2	-178.4	-176	66.1	0	0	0	110.6	I394 I396 L402 V478 C479 L480 P481 P559 V561 G572 V592	I394-L570 HydrophobicContact CD1-CD1 3.86Å; I394-L570 HydrophobicContact CD1-CD2 4.1Å; I394-L570 HydrophobicContact CG2-CD1 4.22Å; I394-L570 HydrophobicContact CG2-CD2 4.1Å; I396-L570 HydrophobicContact CG2-CD2 4.16Å; L402-L570 HydrophobicContact CD1-CD2 3.83Å; V478-L570 HydrophobicContact CG1-CB 3.8Å; V478-L570 HydrophobicContact CG1-CD2 4.19Å; V478-L570 HydrophobicContact CG1-CG 4.4Å; V478-L570 HydrophobicContact CG2-CB 4.01Å; C479-L570 PolarHBondContact O-N 2.78Å; L480-L570 HydrophobicContact CD2-CD2 4.45Å; P481-L570 VanDerWaalsContact CD-O 3.25Å; P481-L570 WeakPolarHBondContact CD-O 3.28Å; P481-L570 WeakPolarHBondContact CG-O 3.32Å; P559-L570 HydrophobicContact CB-CD1 3.84Å; V561-L570 HydrophobicContact CG1-CD1 4.21Å; L570-G572 VanDerWaalsContact CD1-O 3.26Å; L570-G572 WeakPolarHBondContact CD1-O 3.24Å; L570-V592 HydrophobicContact CD2-CG1 4.23Å; L570-V592 HydrophobicContact CD2-CG2 4.01Å; L570-V592 HydrophobicContact CG-CB 4.5Å; L570-V592 HydrophobicContact CG-CG1 4.4Å; L570-V592 HydrophobicContact CG-CG2 3.99Å
571	M	96.3	Very high	86.3	Confident	10 Å²	10	36 Å²	36	5%	0.049	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-28.3	179.5	-62.1	-54.9	-62.2	0	0	112.4	P481 L485 L487 L540 L560 C562 T569 V592 T593	P481-M571 HydrophobicContact CB-SD 4.18Å; L485-M571 HydrophobicContact CD2-CE 4.34Å; L485-M571 HydrophobicContact CD2-SD 3.96Å; L485-M571 HydrophobicContact CG-CE 4.44Å; L487-M571 HydrophobicContact CD1-CE 3.83Å; L487-M571 HydrophobicContact CD1-CG 3.78Å; L487-M571 HydrophobicContact CD1-SD 3.86Å; L487-M571 HydrophobicContact CG-CE 3.86Å; L487-M571 HydrophobicContact CG-SD 4.37Å; L540-M571 WeakPolarHBondContact CD2-O 3.43Å; L560-M571 PolarHBondContact O-N 2.04Å; C562-M571 HydrophobicContact CB-CG 3.83Å; C562-M571 WeakPolarHBondContact SG-CG 3.39Å; T569-M571 HydrophobicContact CG2-SD 4.13Å; T569-M571 PolarHBondContact O-N 2.81Å; M571-V592 PolarHBondContact O-N 2.82Å; M571-V592 VanDerWaalsContact O-N 3.1Å; M571-T593 HydrophobicContact CE-CG2 3.83Å
572	G	96.3	Very high	85	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	159.1	-179	0	0	0	0	0	114.8	L560 L570 T590	L560-G572 PolarHBondContact N-O 2.83Å; L560-G572 PolarHBondContact O-N 3.49Å; L570-G572 VanDerWaalsContact CD1-O 3.26Å; L570-G572 WeakPolarHBondContact CD1-O 3.24Å; G572-T590 CarbonylContact C-O 3.54Å; G572-T590 WeakPolarHBondContact CA-O 3.34Å
573	V	97.8	Very high	83.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130	167.6	-177.3	0	0	0	0	108.3	I394 A404 S575 Y589 T590 V592	I394-V573 HydrophobicContact CD1-CB 4.48Å; I394-V573 HydrophobicContact CD1-CG1 4.29Å; I394-V573 HydrophobicContact CD1-CG2 3.92Å; A404-V573 HydrophobicContact CB-CG1 4.39Å; V573-S575 PolarHBondContact O-N 3.1Å; V573-Y589 CarbonylContact O-C 3.46Å; V573-Y589 WeakPolarHBondContact O-CA 3.07Å; V573-Y589 WeakPolarHBondContact O-CB 3.05Å; V573-T590 PolarHBondContact N-O 3.26Å; V573-T590 PolarHBondContact O-N 2.71Å; V573-V592 HydrophobicContact CG2-CG2 3.79Å
574	I	95.4	Very high	83.1	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.056	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	121.4	179.8	-64.3	167.1	0	0	0	109.3	I495 A551 D555 G557 G558 Y589	I495-I574 HydrophobicContact CB-CD1 4.43Å; A551-I574 HydrophobicContact CB-CD1 4.19Å; A551-I574 HydrophobicContact CB-CG1 4.48Å; A551-I574 HydrophobicContact CB-CG2 4.06Å; D555-I574 HydrophobicContact CB-CD1 3.93Å; D555-I574 HydrophobicContact CB-CG2 4.33Å; D555-I574 WeakPolarHBondContact O-CB 3.49Å; D555-I574 WeakPolarHBondContact O-CD1 3.4Å; G557-I574 PolarHBondContact N-O 2.89Å; G558-I574 WeakPolarHBondContact O-CG1 3.44Å; G558-I574 PolarHBondContact O-N 2.81Å; I574-Y589 HydrophobicContact CB-CD1 4.37Å; I574-Y589 HydrophobicContact CB-CE1 4.38Å; I574-Y589 HydrophobicContact CD1-CE1 4.5Å; I574-Y589 HydrophobicContact CG1-CD1 3.8Å; I574-Y589 HydrophobicContact CG1-CE1 3.49Å; I574-Y589 VanDerWaalsContact CG1-CE1 3.49Å
575	S	93.2	Very high	82.9	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-72.9	-173.5	178.5	0	0	0	0	112	H406 D455 V573 V588	H406-S575 PolarHBondContact CE1-O 3.13Å; D455-S575 VanDerWaalsContact OD2-CB 3.32Å; D455-S575 WeakPolarHBondContact OD2-CB 3.12Å; D455-S575 PolarHBondContact OD2-OG 3.25Å; V573-S575 PolarHBondContact O-N 3.1Å; S575-V588 WeakPolarHBondContact CB-O 3.1Å; S575-V588 PolarHBondContact N-O 3.47Å
576	W	88.3	Confident	83.3	Confident	26 Å²	26	41.5 Å²	41.5	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	170.3	-177.3	64.9	-90.5	0	0	0	112.6	F452 L530 R533 M539 V588	F452-W576 VanDerWaalsContact CB-CD1 3.43Å; F452-W576 HydrophobicContact CB-CG 4.42Å; F452-W576 AromaticContact CG-CD1 3.73Å; F452-W576 HydrophobicContact CG-CG 4.32Å; L530-W576 HydrophobicContact CB-CH2 4.13Å; L530-W576 HydrophobicContact CB-CZ3 4.27Å; L530-W576 HydrophobicContact CD1-CH2 3.69Å; L530-W576 HydrophobicContact CD1-CZ2 4.47Å; L530-W576 HydrophobicContact CD1-CZ3 4.18Å; L530-W576 HydrophobicContact CG-CH2 4.5Å; R533-W576 HydrophobicContact CB-CH2 3.49Å; R533-W576 VanDerWaalsContact CB-CH2 3.49Å; R533-W576 HydrophobicContact CB-CZ2 4.24Å; R533-W576 HydrophobicContact CB-CZ3 4.01Å; R533-W576 VanDerWaalsContact CD-CZ3 3.43Å; R533-W576 HydrophobicContact CG-CH2 4.26Å; R533-W576 HydrophobicContact CG-CZ3 4.34Å; M539-W576 HydrophobicContact SD-CZ2 4.46Å; W576-V588 HydrophobicContact CD2-CB 3.98Å; W576-V588 HydrophobicContact CD2-CG2 4.13Å; W576-V588 HydrophobicContact CE3-CG2 4.22Å; W576-V588 HydrophobicContact CG-CB 4.32Å; W576-V588 HydrophobicContact CH2-CG2 3.78Å; W576-V588 HydrophobicContact CZ2-CB 4.05Å; W576-V588 HydrophobicContact CZ2-CG1 3.99Å; W576-V588 HydrophobicContact CZ2-CG2 3.7Å; W576-V588 HydrophobicContact CZ3-CG2 4.05Å; W576-V588 PolarHBondContact N-O 3.28Å; W576-V588 WeakPolarHBondContact O-CA 3.22Å; W576-V588 WeakPolarHBondContact O-CB 3Å; W576-V588 PolarHBondContact O-N 3.23Å
577	G	83.9	Confident	83.9	Confident	35 Å²	35	36 Å²	36	36%	0.361	19%	0.194	S	C	.	.			trans	-171.4	164	176.3	0	0	0	0	0	112.1	G579	G577-G579 PolarHBondContact O-N 3.48Å
578	D	73.1	Confident	84.1	Confident	27 Å²	27	31.5 Å²	31.5	14%	0.144	18%	0.177	C	C	.	.	S	Bend	trans	-87.5	76.9	178.9	-79.4	-5.1	0	0	0	111	L530 S531 Q582 K585	L530-D578 WeakPolarHBondContact CA-OD2 3.41Å; S531-D578 WeakPolarHBondContact CB-OD2 3.15Å; S531-D578 PolarHBondContact N-OD2 3.41Å; S531-D578 PolarHBondContact OG-OD2 3.26Å; D578-Q582 PolarHBondContact O-NE2 3.48Å; D578-Q582 VanDerWaalsContact O-NE2 3.1Å; D578-K585 HydrophobicContact CB-CD 4.24Å
579	G	65.3	Low	84.2	Confident	19 Å²	19	31.3 Å²	31.3	20%	0.196	18%	0.176	C	C	.	.	S	Bend	trans	75.7	-168	-171.9	0	0	0	0	0	112	E503 G577	E503-G579 VanDerWaalsContact OE2-CA 3.27Å; E503-G579 WeakPolarHBondContact OE2-CA 3.27Å; G577-G579 PolarHBondContact O-N 3.48Å
580	C	68.1	Low	84.3	Confident	27 Å²	27	31 Å²	31	18%	0.182	18%	0.175	C	C	.	.	S	Bend	trans	-129.5	136.8	-179.2	-33.2	0	0	0	0	110.7	D550 C552	D550-C580 WeakPolarHBondContact OD2-CA 3.44Å; C552-C580 WeakPolarHBondContact CA-SG 3.11Å; C552-C580 HydrophobicContact CB-CB 3.51Å; C552-C580 WeakPolarHBondContact CB-SG 3.36Å; C552-C580 WeakPolarHBondContact SG-CB 3.29Å; C552-C580 CovalentContact SG-SG 2.04Å; C552-C580 PolarHBondContact SG-SG 3.19Å
581	G	62.8	Low	84.2	Confident	49 Å²	49	34.3 Å²	34.3	51%	0.505	19%	0.187	S	C	.	.	S	Bend	trans	77	20	171.9	0	0	0	0	0	114.2	D550	D550-G581 VanDerWaalsContact CB-N 3.32Å; D550-G581 PolarHBondContact OD2-N 3.02Å
582	Q	67.9	Low	84.2	Confident	78 Å²	78	33.8 Å²	33.8	36%	0.364	19%	0.185	S	C	.	.			trans	-78.2	129.7	176.8	-66	-172.5	24.7	0	0	110.3	D578 E584 K585	D578-Q582 PolarHBondContact O-NE2 3.48Å; D578-Q582 VanDerWaalsContact O-NE2 3.1Å; Q582-E584 PolarHBondContact O-N 2.81Å; Q582-K585 HydrophobicContact CB-CB 4.13Å; Q582-K585 HydrophobicContact CB-CD 4.26Å; Q582-K585 HydrophobicContact CB-CG 4.35Å; Q582-K585 PolarHBondContact O-N 3.11Å; Q582-K585 VanDerWaalsContact OE1-CD 3.28Å; Q582-K585 VanDerWaalsContact OE1-CE 3.31Å
583	K	68.9	Low	84.1	Confident	156 Å²	156	34.4 Å²	34.4	68%	0.678	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	133.2	176.3	-171.4	-176.7	177.2	-166.6	0	109.5	K585	K583-K585 PolarHBondContact O-N 3.39Å
584	E	72.4	Confident	84	Confident	130 Å²	130	39 Å²	39	61%	0.607	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	21.9	176.4	-69.1	167.4	-150.4	0	0	115.2	W520 Q582	W520-E584 WeakPolarHBondContact CH2-O 3.43Å; Q582-E584 PolarHBondContact O-N 2.81Å
585	K	80.6	Confident	84	Confident	62 Å²	62	38.7 Å²	38.7	27%	0.27	21%	0.208	S	C	.	.			trans	-116.9	124.1	164.1	-69.4	-164.2	-176	170.8	0	110.5	D578 Q582 K583	D578-K585 HydrophobicContact CB-CD 4.24Å; Q582-K585 HydrophobicContact CB-CB 4.13Å; Q582-K585 HydrophobicContact CB-CD 4.26Å; Q582-K585 HydrophobicContact CB-CG 4.35Å; Q582-K585 PolarHBondContact O-N 3.11Å; Q582-K585 VanDerWaalsContact OE1-CD 3.28Å; Q582-K585 VanDerWaalsContact OE1-CE 3.31Å; K583-K585 PolarHBondContact O-N 3.39Å
586	P	87.4	Confident	84.1	Confident	3 Å²	3	39 Å²	39	2%	0.019	21%	0.21	C	C	.	.			trans	-81.5	155	175.6	32.2	-31.9	0	0	0	111.6	W520 I529 L530 C541	W520-P586 HydrophobicContact CD2-CB 3.74Å; W520-P586 HydrophobicContact CD2-CG 3.85Å; W520-P586 HydrophobicContact CE3-CB 4.21Å; W520-P586 HydrophobicContact CE3-CG 3.77Å; W520-P586 HydrophobicContact CG-CB 3.99Å; W520-P586 HydrophobicContact CG-CG 4.41Å; W520-P586 HydrophobicContact CH2-CG 4.35Å; W520-P586 HydrophobicContact CZ2-CB 4.21Å; W520-P586 HydrophobicContact CZ2-CG 4.4Å; W520-P586 HydrophobicContact CZ3-CG 4.05Å; I529-P586 HydrophobicContact CD1-CG 3.93Å; L530-P586 HydrophobicContact CD2-CG 4.25Å; C541-P586 HydrophobicContact CB-CB 3.71Å; C541-P586 HydrophobicContact CB-CG 3.78Å; C541-P586 VanDerWaalsContact SG-CG 3.59Å
587	G	89.4	Confident	84.3	Confident	6 Å²	6	41.8 Å²	41.8	6%	0.062	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	155.3	158.9	0	0	0	0	0	111.1	C541 A542 Y589	C541-G587 WeakPolarHBondContact CA-O 3.36Å; A542-G587 PolarHBondContact N-O 2.78Å; A542-G587 PolarHBondContact O-N 2.97Å; G587-Y589 WeakPolarHBondContact O-CD2 3.43Å; G587-Y589 VanDerWaalsContact O-CE2 3.26Å; G587-Y589 WeakPolarHBondContact O-CE2 3.42Å
588	V	92.9	Very high	84.9	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.5	177.8	-174.4	0	0	0	0	110.3	L530 M539 S575 W576	L530-V588 HydrophobicContact CD1-CG2 3.39Å; M539-V588 HydrophobicContact CB-CG1 3.9Å; M539-V588 HydrophobicContact CG-CG1 4.1Å; M539-V588 HydrophobicContact SD-CG1 3.91Å; S575-V588 WeakPolarHBondContact CB-O 3.1Å; S575-V588 PolarHBondContact N-O 3.47Å; W576-V588 HydrophobicContact CD2-CB 3.98Å; W576-V588 HydrophobicContact CD2-CG2 4.13Å; W576-V588 HydrophobicContact CE3-CG2 4.22Å; W576-V588 HydrophobicContact CG-CB 4.32Å; W576-V588 HydrophobicContact CH2-CG2 3.78Å; W576-V588 HydrophobicContact CZ2-CB 4.05Å; W576-V588 HydrophobicContact CZ2-CG1 3.99Å; W576-V588 HydrophobicContact CZ2-CG2 3.7Å; W576-V588 HydrophobicContact CZ3-CG2 4.05Å; W576-V588 PolarHBondContact N-O 3.28Å; W576-V588 WeakPolarHBondContact O-CA 3.22Å; W576-V588 WeakPolarHBondContact O-CB 3Å; W576-V588 PolarHBondContact O-N 3.23Å
589	Y	95.6	Very high	86	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.7	-174.8	-55.3	-109.2	0	0	0	109.5	I495 M539 L540 A542 L560 V573 I574 G587 R591	I495-Y589 HydrophobicContact CG2-CE1 3.78Å; M539-Y589 CarbonylContact C-O 3.27Å; M539-Y589 WeakPolarHBondContact CA-O 3.29Å; L540-Y589 HydrophobicContact CD1-CD2 4Å; L540-Y589 HydrophobicContact CD1-CG 4.11Å; L540-Y589 PolarHBondContact N-O 3.09Å; L540-Y589 PolarHBondContact O-N 3.24Å; A542-Y589 HydrophobicContact CB-CD2 4.08Å; A542-Y589 HydrophobicContact CB-CE2 3.64Å; A542-Y589 WeakPolarHBondContact O-CE2 3.5Å; L560-Y589 HydrophobicContact CB-CD1 3.64Å; L560-Y589 HydrophobicContact CB-CE1 3.81Å; L560-Y589 HydrophobicContact CB-CG 4.47Å; L560-Y589 HydrophobicContact CD1-CE1 4.19Å; L560-Y589 HydrophobicContact CD2-CD1 3.99Å; L560-Y589 HydrophobicContact CD2-CD2 4.35Å; L560-Y589 HydrophobicContact CD2-CE1 4.28Å; L560-Y589 HydrophobicContact CD2-CG 4.04Å; L560-Y589 HydrophobicContact CG-CD1 4.31Å; L560-Y589 HydrophobicContact CG-CE1 4.32Å; V573-Y589 CarbonylContact O-C 3.46Å; V573-Y589 WeakPolarHBondContact O-CA 3.07Å; V573-Y589 WeakPolarHBondContact O-CB 3.05Å; I574-Y589 HydrophobicContact CB-CD1 4.37Å; I574-Y589 HydrophobicContact CB-CE1 4.38Å; I574-Y589 HydrophobicContact CD1-CE1 4.5Å; I574-Y589 HydrophobicContact CG1-CD1 3.8Å; I574-Y589 HydrophobicContact CG1-CE1 3.49Å; I574-Y589 VanDerWaalsContact CG1-CE1 3.49Å; G587-Y589 WeakPolarHBondContact O-CD2 3.43Å; G587-Y589 VanDerWaalsContact O-CE2 3.26Å; G587-Y589 WeakPolarHBondContact O-CE2 3.42Å; Y589-R591 PolarHBondContact O-N 2.94Å
590	T	97.2	Very high	87.3	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.1	170.3	-56.2	0	0	0	0	109.2	D455 I456 G572 V573 V592 Y595	D455-T590 PolarHBondContact O-OG1 3.24Å; I456-T590 HydrophobicContact CB-CG2 4.11Å; G572-T590 CarbonylContact C-O 3.54Å; G572-T590 WeakPolarHBondContact CA-O 3.34Å; V573-T590 PolarHBondContact N-O 3.26Å; V573-T590 PolarHBondContact O-N 2.71Å; T590-V592 PolarHBondContact O-N 2.99Å; T590-Y595 HydrophobicContact CG2-CD2 3.8Å; T590-Y595 HydrophobicContact CG2-CE2 3.36Å
591	R	95.6	Very high	88.5	Confident	68 Å²	68	43.4 Å²	43.4	26%	0.257	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	98.9	-174.6	-179.6	-174.6	-62.4	-91.1	-1	111.2	S537 N538 M539 L540 Y589 T593 H594 Y595	S537-R591 PolarHBondContact O-NE 3.01Å; N538-R591 VanDerWaalsContact O-CB 3.24Å; N538-R591 WeakPolarHBondContact O-CB 3.02Å; N538-R591 PolarHBondContact O-N 2.93Å; M539-R591 PolarHBondContact O-NE 2.04Å; M539-R591 VanDerWaalsContact O-NE 3.08Å; M539-R591 PolarHBondContact O-NH2 3.46Å; L540-R591 HydrophobicContact CD2-CB 4.12Å; L540-R591 HydrophobicContact CD2-CG 4.16Å; Y589-R591 PolarHBondContact O-N 2.94Å; R591-T593 VanDerWaalsContact CG-OG1 3.31Å; R591-T593 WeakPolarHBondContact CG-OG1 3.5Å; R591-T593 PolarHBondContact O-N 2.91Å; R591-T593 VanDerWaalsContact O-N 3.13Å; R591-H594 VanDerWaalsContact CD-CD2 3.48Å; R591-H594 WeakPolarHBondContact CD-CD2 3.26Å; R591-H594 WeakPolarHBondContact CD-NE2 3.19Å; R591-H594 PolarHBondContact O-N 3.38Å; R591-Y595 VanDerWaalsContact O-CD2 3.25Å; R591-Y595 WeakPolarHBondContact O-CD2 3.29Å
592	V	96.8	Very high	90.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60.8	-29.9	-172.1	173.2	0	0	0	0	113.1	L480 P481 L570 M571 V573 T590 H594 Y595 V596 I599	L480-V592 HydrophobicContact CD2-CG1 4.23Å; P481-V592 HydrophobicContact CG-CB 4.49Å; P481-V592 HydrophobicContact CG-CG1 3.97Å; L570-V592 HydrophobicContact CD2-CG1 4.23Å; L570-V592 HydrophobicContact CD2-CG2 4.01Å; L570-V592 HydrophobicContact CG-CB 4.5Å; L570-V592 HydrophobicContact CG-CG1 4.4Å; L570-V592 HydrophobicContact CG-CG2 3.99Å; M571-V592 PolarHBondContact O-N 2.82Å; M571-V592 VanDerWaalsContact O-N 3.1Å; V573-V592 HydrophobicContact CG2-CG2 3.79Å; T590-V592 PolarHBondContact O-N 2.99Å; V592-H594 PolarHBondContact O-N 3.34Å; V592-H594 VanDerWaalsContact O-N 3.08Å; V592-Y595 PolarHBondContact O-N 3.3Å; V592-V596 WeakPolarHBondContact O-CG2 3.24Å; V592-V596 PolarHBondContact O-N 2.76Å; V592-I599 HydrophobicContact CG1-CD1 4.17Å
593	T	94.2	Very high	91.2	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.08	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-59.7	-21.9	177.8	56.5	0	0	0	0	113.8	P481 L485 M571 R591	P481-T593 HydrophobicContact CB-CG2 3.76Å; P481-T593 HydrophobicContact CG-CG2 3.64Å; L485-T593 HydrophobicContact CB-CG2 4.31Å; M571-T593 HydrophobicContact CE-CG2 3.83Å; R591-T593 VanDerWaalsContact CG-OG1 3.31Å; R591-T593 WeakPolarHBondContact CG-OG1 3.5Å; R591-T593 PolarHBondContact O-N 2.91Å; R591-T593 VanDerWaalsContact O-N 3.13Å
594	H	94.6	Very high	92.1	Very high	97 Å²	97	40.8 Å²	40.8	45%	0.449	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-85.9	-14.1	174.8	-75.2	-154.6	0	0	0	113.5	S537 N538 R591 V592	S537-H594 PolarHBondContact O-CE1 3.01Å; S537-H594 PolarHBondContact O-ND1 2.89Å; N538-H594 PolarHBondContact OD1-ND1 3.26Å; N538-H594 VanDerWaalsContact OD1-ND1 3.15Å; R591-H594 VanDerWaalsContact CD-CD2 3.48Å; R591-H594 WeakPolarHBondContact CD-CD2 3.26Å; R591-H594 WeakPolarHBondContact CD-NE2 3.19Å; R591-H594 PolarHBondContact O-N 3.38Å; V592-H594 PolarHBondContact O-N 3.34Å; V592-H594 VanDerWaalsContact O-N 3.08Å
595	Y	96.2	Very high	92.9	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.016	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-1.4	-174.4	-64.5	-80.6	0	0	0	113.8	H444 N454 I456 N538 T590 R591 V592 D597 W598 I599	H444-Y595 AromaticContact CD2-CD1 3.67Å; H444-Y595 AromaticContact CD2-CE1 3.6Å; H444-Y595 AromaticContact NE2-CD1 3.79Å; H444-Y595 AromaticContact NE2-CE1 3.54Å; N454-Y595 WeakPolarHBondContact CA-OH 3.44Å; N454-Y595 HydrophobicContact CB-CE1 4.2Å; N454-Y595 VanDerWaalsContact CG-OH 3.32Å; N454-Y595 PolarHBondContact OD1-OH 3Å; I456-Y595 HydrophobicContact CD1-CD2 4.49Å; I456-Y595 HydrophobicContact CD1-CG 4.16Å; I456-Y595 HydrophobicContact CG2-CD1 3.73Å; I456-Y595 HydrophobicContact CG2-CE1 3.92Å; I456-Y595 HydrophobicContact CG2-CG 4.08Å; N538-Y595 HydrophobicContact CB-CE2 4.13Å; N538-Y595 WeakPolarHBondContact CB-OH 3.49Å; T590-Y595 HydrophobicContact CG2-CD2 3.8Å; T590-Y595 HydrophobicContact CG2-CE2 3.36Å; R591-Y595 VanDerWaalsContact O-CD2 3.25Å; R591-Y595 WeakPolarHBondContact O-CD2 3.29Å; V592-Y595 PolarHBondContact O-N 3.3Å; Y595-D597 VanDerWaalsContact C-N 3.26Å; Y595-D597 PolarHBondContact O-N 3.48Å; Y595-W598 WeakPolarHBondContact O-CB 3.03Å; Y595-W598 PolarHBondContact O-N 3.05Å; Y595-I599 VanDerWaalsContact O-CG1 3.25Å; Y595-I599 WeakPolarHBondContact O-CG1 3.04Å; Y595-I599 PolarHBondContact O-N 3.01Å
596	V	94.3	Very high	93.1	Very high	13 Å²	13	37.4 Å²	37.4	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-52.9	-43	-179.8	177.1	0	0	0	0	112	P481 V592 I599 N600	P481-V596 HydrophobicContact CG-CG2 3.92Å; V592-V596 WeakPolarHBondContact O-CG2 3.24Å; V592-V596 PolarHBondContact O-N 2.76Å; V596-I599 PolarHBondContact O-N 2.87Å; V596-N600 WeakPolarHBondContact CG1-ND2 3.34Å; V596-N600 VanDerWaalsContact O-CB 3.29Å; V596-N600 WeakPolarHBondContact O-CB 3.38Å; V596-N600 PolarHBondContact O-N 3.16Å; V596-N600 PolarHBondContact O-ND2 2.78Å; V596-N600 VanDerWaalsContact O-ND2 3.12Å
597	D	93	Very high	92.7	Very high	84 Å²	84	41.8 Å²	41.8	45%	0.449	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-40.9	178.7	-68.4	-25.9	0	0	0	111.7	R483 Y595 S601	R483-D597 IonicContact CZ-OD2 3.83Å; R483-D597 IonicContact NE-OD2 4Å; R483-D597 PolarHBondContact NE-OD2 3.49Å; R483-D597 IonicContact NH1-OD2 3.96Å; R483-D597 IonicContact NH2-OD2 3.78Å; Y595-D597 VanDerWaalsContact C-N 3.26Å; Y595-D597 PolarHBondContact O-N 3.48Å; D597-S601 WeakPolarHBondContact O-CB 3.39Å; D597-S601 PolarHBondContact O-N 3.25Å
598	W	95.9	Very high	91.6	Very high	27 Å²	27	46.6 Å²	46.6	10%	0.102	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-49.2	175.8	177.5	86	0	0	0	111.1	W442 H444 E445 I456 I458 Y595 N600 S601 K602	W442-W598 HydrophobicContact CB-CZ2 4.48Å; H444-W598 HydrophobicContact CB-CH2 4.38Å; H444-W598 HydrophobicContact CB-CZ2 3.97Å; H444-W598 AromaticContact CD2-CD1 3.6Å; H444-W598 AromaticContact CD2-CD2 3.6Å; H444-W598 AromaticContact CD2-CE2 3.52Å; H444-W598 AromaticContact CD2-CG 3.69Å; H444-W598 AromaticContact CD2-NE1 3.47Å; H444-W598 PolarHBondContact CD2-NE1 3.07Å; H444-W598 AromaticContact NE2-CD1 3.8Å; E445-W598 PolarHBondContact OE2-NE1 3.41Å; I456-W598 HydrophobicContact CD1-CZ3 4.3Å; I456-W598 HydrophobicContact CG1-CZ3 4.11Å; I456-W598 HydrophobicContact CG2-CE3 4.29Å; I456-W598 HydrophobicContact CG2-CH2 4.35Å; I456-W598 HydrophobicContact CG2-CZ3 3.95Å; I458-W598 HydrophobicContact CB-CH2 4.24Å; I458-W598 HydrophobicContact CB-CZ3 4.24Å; I458-W598 HydrophobicContact CG2-CH2 3.74Å; I458-W598 HydrophobicContact CG2-CZ2 4.43Å; I458-W598 HydrophobicContact CG2-CZ3 4.07Å; Y595-W598 WeakPolarHBondContact O-CB 3.03Å; Y595-W598 PolarHBondContact O-N 3.05Å; W598-N600 PolarHBondContact O-N 2.71Å; W598-S601 PolarHBondContact O-N 2.77Å; W598-S601 VanDerWaalsContact O-N 3.15Å; W598-S601 PolarHBondContact O-OG 2.89Å; W598-K602 HydrophobicContact CD2-CG 4.44Å; W598-K602 HydrophobicContact CZ2-CG 4.32Å; W598-K602 WeakPolarHBondContact O-CG 3.32Å; W598-K602 PolarHBondContact O-N 3.07Å; W598-K602 VanDerWaalsContact O-N 3.08Å
599	I	96.1	Very high	91.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.4	-54.3	175.5	-66.7	163.3	0	0	0	110	I396 L402 I456 I458 L480 V592 Y595 V596 S601 K602 V603	I396-I599 HydrophobicContact CD1-CG2 3.66Å; L402-I599 HydrophobicContact CD1-CD1 3.75Å; L402-I599 HydrophobicContact CD1-CG1 4.44Å; L402-I599 HydrophobicContact CD2-CD1 4.29Å; L402-I599 HydrophobicContact CD2-CG1 4.08Å; I456-I599 HydrophobicContact CD1-CD1 4.27Å; I458-I599 HydrophobicContact CD1-CG2 4.11Å; L480-I599 HydrophobicContact CD1-CG2 3.86Å; L480-I599 HydrophobicContact CD2-CD1 4.18Å; V592-I599 HydrophobicContact CG1-CD1 4.17Å; Y595-I599 VanDerWaalsContact O-CG1 3.25Å; Y595-I599 WeakPolarHBondContact O-CG1 3.04Å; Y595-I599 PolarHBondContact O-N 3.01Å; V596-I599 PolarHBondContact O-N 2.87Å; I599-S601 VanDerWaalsContact C-N 3.28Å; I599-S601 PolarHBondContact O-N 2.92Å; I599-K602 PolarHBondContact O-N 3.47Å; I599-K602 VanDerWaalsContact O-N 3.12Å; I599-V603 HydrophobicContact CG2-CG2 4.47Å; I599-V603 WeakPolarHBondContact O-CG2 3.21Å; I599-V603 PolarHBondContact O-N 2.98Å
600	N	93.4	Very high	91.4	Very high	56 Å²	56	51.3 Å²	51.3	30%	0.299	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-35.2	-178.9	-74.6	-30	0	0	0	112.4	V596 W598 V603 K604	V596-N600 WeakPolarHBondContact CG1-ND2 3.34Å; V596-N600 VanDerWaalsContact O-CB 3.29Å; V596-N600 WeakPolarHBondContact O-CB 3.38Å; V596-N600 PolarHBondContact O-N 3.16Å; V596-N600 PolarHBondContact O-ND2 2.78Å; V596-N600 VanDerWaalsContact O-ND2 3.12Å; W598-N600 PolarHBondContact O-N 2.71Å; N600-V603 PolarHBondContact O-N 2.75Å; N600-K604 VanDerWaalsContact O-CB 3.29Å; N600-K604 WeakPolarHBondContact O-CB 3.2Å; N600-K604 VanDerWaalsContact O-CG 3.22Å; N600-K604 WeakPolarHBondContact O-CG 3.23Å; N600-K604 PolarHBondContact O-N 3.35Å
601	S	94	Very high	91	Very high	58 Å²	58	53.9 Å²	53.9	41%	0.406	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.1	77.3	0	0	0	0	112.2	D597 W598 I599 A605	D597-S601 WeakPolarHBondContact O-CB 3.39Å; D597-S601 PolarHBondContact O-N 3.25Å; W598-S601 PolarHBondContact O-N 2.77Å; W598-S601 VanDerWaalsContact O-N 3.15Å; W598-S601 PolarHBondContact O-OG 2.89Å; I599-S601 VanDerWaalsContact C-N 3.28Å; I599-S601 PolarHBondContact O-N 2.92Å; S601-A605 WeakPolarHBondContact O-CB 3.22Å; S601-A605 PolarHBondContact O-N 3.24Å
602	K	95	Very high	90.8	Very high	30 Å²	30	53.1 Å²	53.1	13%	0.13	30%	0.297	C	S	.	.	H	α-helix	trans	-67.2	-44.4	175.9	-62.3	-55.7	179.7	-173.9	0	111.5	W442 E445 I458 W598 I599 N606	W442-K602 HydrophobicContact CB-CD 4.42Å; W442-K602 HydrophobicContact CG-CD 4.15Å; E445-K602 WeakPolarHBondContact OE1-CE 3.47Å; E445-K602 IonicContact OE1-NZ 3.45Å; E445-K602 PolarHBondContact OE1-NZ 3.47Å; I458-K602 HydrophobicContact CD1-CB 4.38Å; I458-K602 HydrophobicContact CG2-CB 3.96Å; I458-K602 HydrophobicContact CG2-CG 3.95Å; W598-K602 HydrophobicContact CD2-CG 4.44Å; W598-K602 HydrophobicContact CZ2-CG 4.32Å; W598-K602 WeakPolarHBondContact O-CG 3.32Å; W598-K602 PolarHBondContact O-N 3.07Å; W598-K602 VanDerWaalsContact O-N 3.08Å; I599-K602 PolarHBondContact O-N 3.47Å; I599-K602 VanDerWaalsContact O-N 3.12Å; K602-N606 PolarHBondContact O-N 2.83Å; K602-N606 PolarHBondContact O-ND2 3.06Å
603	V	90.7	Very high	90.4	Very high	32 Å²	32	56.4 Å²	56.4	19%	0.194	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-48.5	177	173.2	0	0	0	0	111.1	W400 I458 I599 N600 N606	W400-V603 HydrophobicContact CD2-CG2 3.8Å; W400-V603 HydrophobicContact CE3-CG2 4.27Å; W400-V603 HydrophobicContact CG-CG2 3.97Å; W400-V603 HydrophobicContact CZ2-CB 4.33Å; W400-V603 HydrophobicContact CZ2-CG1 4.5Å; W400-V603 HydrophobicContact CZ2-CG2 4.31Å; I458-V603 HydrophobicContact CD1-CG2 4.01Å; I599-V603 HydrophobicContact CG2-CG2 4.47Å; I599-V603 WeakPolarHBondContact O-CG2 3.21Å; I599-V603 PolarHBondContact O-N 2.98Å; N600-V603 PolarHBondContact O-N 2.75Å; V603-N606 CarbonylContact O-C 3.57Å; V603-N606 PolarHBondContact O-N 3.06Å
604	K	89.6	Confident	90.1	Very high	167 Å²	167	59.3 Å²	59.3	73%	0.726	33%	0.332	S	S	*	.	H	α-helix	trans	-68.8	-38.3	-178.4	-73	175.4	-178.3	-179.5	0	113.4	N600 N606	N600-K604 VanDerWaalsContact O-CB 3.29Å; N600-K604 WeakPolarHBondContact O-CB 3.2Å; N600-K604 VanDerWaalsContact O-CG 3.22Å; N600-K604 WeakPolarHBondContact O-CG 3.23Å; N600-K604 PolarHBondContact O-N 3.35Å; K604-N606 PolarHBondContact O-N 2.9Å
605	A	87.7	Confident	89.8	Confident	75 Å²	75	56.6 Å²	56.6	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-73.9	-15.2	-178.5	0	0	0	0	0	113.4	S601	S601-A605 WeakPolarHBondContact O-CB 3.22Å; S601-A605 PolarHBondContact O-N 3.24Å
606	N	86.1	Confident	89.3	Confident	45 Å²	45	60.7 Å²	60.7	24%	0.241	35%	0.347	C	S	.	.	S	Bend	trans	-134.4	66.4	-175.6	-54.7	-90	0	0	0	110.2	W400 W442 K602 V603 K604	W400-N606 HydrophobicContact CH2-CB 4.06Å; W400-N606 HydrophobicContact CZ2-CB 4.4Å; W400-N606 VanDerWaalsContact CZ2-O 3.28Å; W400-N606 WeakPolarHBondContact CZ2-O 3.24Å; W442-N606 HydrophobicContact CH2-CB 4.07Å; W442-N606 HydrophobicContact CZ2-CB 4.25Å; W442-N606 VanDerWaalsContact CZ2-CG 3.48Å; W442-N606 WeakPolarHBondContact CZ2-OD1 3.41Å; K602-N606 PolarHBondContact O-N 2.83Å; K602-N606 PolarHBondContact O-ND2 3.06Å; V603-N606 CarbonylContact O-C 3.57Å; V603-N606 PolarHBondContact O-N 3.06Å; K604-N606 PolarHBondContact O-N 2.9Å
607	P	78	Confident	88.9	Confident	96 Å²	96	64.7 Å²	64.7	62%	0.623	37%	0.369	S	S	*	.			trans	-58	158.5	-178.4	26.7	-34.7	0	0	0	112.1	K460	K460-P607 PolarHBondContact NZ-O 3.12Å
608	V	67.6	Low	88.5	Confident	106 Å²	106	62.9 Å²	62.9	64%	0.642	36%	0.362	S	S	*	.			trans	-65.5	0	-179.1	-177.5	0	0	0	0	110.4	C399 T463	C399-V608 HydrophobicContact CB-CG2 3.81Å; C399-V608 VanDerWaalsContact SG-CG1 3.56Å; C399-V608 WeakPolarHBondContact SG-CG2 3.34Å; T463-V608 HydrophobicContact CG2-CG1 3.85Å

Retrieved 608 of 608 residues in 530 ms (Link to these results)

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