A0A3Q0KUE8_SCHMA Loading...

DNA repair and recombination protein RAD54-like

AlphaFold DB , UniProt , Accession A0A3Q0KUE8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 749 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	34.5	Very low	244 Å²	244	174.2 Å²	174.2	100%	1.202	90%	0.9	S	S	*	*				0	106.6	0	-72.2	-175.8	-158.2	0	0	109.8
2	R	33.5	Very low	34.3	Very low	258 Å²	258	170.8 Å²	170.8	97%	0.974	90%	0.901	S	S	*	*			trans	-178.7	114.8	145.1	-104.4	177.2	-176.7	-175.6	1.2	107.5
3	R	35.5	Very low	33.9	Very low	250 Å²	250	167.9 Å²	167.9	94%	0.943	89%	0.894	S	S	*	*			trans	-80	143.9	-175.7	-80.4	174.3	167.5	173.9	-4.8	110.8
4	S	31.6	Very low	33.9	Very low	115 Å²	115	173.9 Å²	173.9	80%	0.804	90%	0.898	S	S	*	*			trans	-66.2	143.9	164.5	48.2	0	0	0	0	112.5
5	L	41.3	Very low	33.7	Very low	175 Å²	175	174.5 Å²	174.5	92%	0.916	90%	0.895	S	S	*	*			trans	-134.9	120.6	159.4	-74.3	171.1	0	0	0	108.6
6	A	31.8	Very low	33.8	Very low	96 Å²	96	170.2 Å²	170.2	79%	0.793	89%	0.885	S	S	*	*			trans	-116.7	138.5	161.9	0	0	0	0	0	107.4
7	P	41.8	Very low	33.8	Very low	133 Å²	133	166.8 Å²	166.8	86%	0.864	88%	0.879	S	S	*	*			trans	-100.7	153.1	173	34.2	-26	0	0	0	113
8	S	35.4	Very low	33.8	Very low	108 Å²	108	163.8 Å²	163.8	76%	0.755	88%	0.875	S	S	*	*			trans	-83.1	149.4	-173.1	48.2	0	0	0	0	115.5
9	K	31.2	Very low	34	Very low	202 Å²	202	160.5 Å²	160.5	88%	0.878	87%	0.873	S	S	*	*			trans	33	127.9	143.5	-63	-170.9	176.9	-176.2	0	120.2
10	L	36.7	Very low	34	Very low	180 Å²	180	159.1 Å²	159.1	94%	0.942	87%	0.871	S	S	*	*			trans	-158.8	133.8	137.1	-103.6	151.8	0	0	0	111.4
11	N	29.7	Very low	34.4	Very low	155 Å²	155	160.6 Å²	160.6	83%	0.829	87%	0.872	S	S	*	*			trans	-70.6	146.4	179.3	-86.1	-20.7	0	0	0	112.6
12	C	32	Very low	35	Very low	134 Å²	134	154.6 Å²	154.6	91%	0.905	85%	0.852	S	S	*	*			trans	-149.4	123.7	144	-108	0	0	0	0	111
13	T	29	Very low	35.1	Very low	133 Å²	133	148 Å²	148	82%	0.816	84%	0.842	S	S	*	*			trans	-76.5	140	176.7	37.9	0	0	0	0	112.4
14	R	33.9	Very low	35.3	Very low	251 Å²	251	144.7 Å²	144.7	95%	0.947	84%	0.842	S	S	*	*			trans	-160.8	132.9	143	-111.6	175.5	179.3	179.7	-0.4	111.6
15	E	32	Very low	35.4	Very low	184 Å²	184	148.3 Å²	148.3	86%	0.86	84%	0.844	S	S	*	*			trans	-63.4	159.8	178.3	-55.4	156.7	146.1	0	0	110.7
16	S	34.3	Very low	35.1	Very low	105 Å²	105	149.3 Å²	149.3	73%	0.734	84%	0.841	S	S	*	*			cis	-178	162.5	42.2	47	0	0	0	0	111.2
17	S	34.4	Very low	35.4	Very low	112 Å²	112	156.2 Å²	156.2	78%	0.783	85%	0.848	S	S	*	*			trans	73.1	137.8	161.5	75.6	0	0	0	0	118.6
18	S	33.7	Very low	35.1	Very low	114 Å²	114	160.3 Å²	160.3	80%	0.797	85%	0.846	S	S	*	*			cis	-177.9	120	-10.7	46.1	0	0	0	0	107.3
19	A	36.9	Very low	34.9	Very low	101 Å²	101	161.2 Å²	161.2	84%	0.835	85%	0.847	S	S	*	*			trans	159.3	118.2	151	0	0	0	0	0	110.7
20	P	35.4	Very low	35.1	Very low	131 Å²	131	157.8 Å²	157.8	85%	0.851	84%	0.843	S	S	*	*			trans	-107	121	173.6	33.6	-21.2	0	0	0	112
21	E	41.1	Very low	35	Very low	191 Å²	191	157.1 Å²	157.1	89%	0.893	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-83	140.7	158.2	-82.3	-171.5	156.7	0	0	110.1
22	P	43.9	Very low	35.4	Very low	118 Å²	118	157.7 Å²	157.7	77%	0.766	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-82	155.7	-166.4	33.6	-34.7	0	0	0	113
23	P	36.4	Very low	35.6	Very low	120 Å²	120	159 Å²	159	78%	0.779	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.1	140.7	-177.8	33.1	-32	0	0	0	112	K25	P23-K25 PolarHBondContact O-N 3.22Å
24	L	38.2	Very low	36.1	Very low	180 Å²	180	162.1 Å²	162.1	94%	0.942	83%	0.832	S	S	*	*			trans	-52	116	171	-75.3	158.8	0	0	0	111	K26	L24-K26 PolarHBondContact O-N 3.05Å
25	K	35.4	Very low	36.2	Very low	191 Å²	191	157.7 Å²	157.7	83%	0.83	83%	0.827	S	S	*	*			trans	-63.4	126.5	179.4	-82	179.6	175.1	176.4	0	111.8	P23 Y27	P23-K25 PolarHBondContact O-N 3.22Å; K25-Y27 PolarHBondContact O-N 3.07Å
26	K	34.9	Very low	36.7	Very low	197 Å²	197	155.6 Å²	155.6	86%	0.857	83%	0.826	S	S	*	*			trans	-60	122.5	156	-71.5	173.9	175.6	174.1	0	109.1	L24 R28	L24-K26 PolarHBondContact O-N 3.05Å; K26-R28 PolarHBondContact O-N 3.05Å
27	Y	36.2	Very low	36.9	Very low	241 Å²	241	156.3 Å²	156.3	95%	0.945	83%	0.829	S	S	*	*			trans	-76.6	100.8	162.2	-92.6	-92.1	0	0	0	108.7	K25	K25-Y27 PolarHBondContact O-N 3.07Å
28	R	36	Very low	36.8	Very low	219 Å²	219	158.3 Å²	158.3	83%	0.826	83%	0.831	S	S	*	*			trans	-124.2	110.9	165.8	-145.1	178.8	-174	-178.1	0.8	106.8	K26	K26-R28 PolarHBondContact O-N 3.05Å
29	T	31.2	Very low	37	Very low	127 Å²	127	161.9 Å²	161.9	78%	0.779	83%	0.834	S	S	*	*			trans	13.7	110.9	149.3	16.3	0	0	0	0	117.4
30	V	36.5	Very low	37.2	Very low	129 Å²	129	161.1 Å²	161.1	78%	0.782	82%	0.823	S	S	*	*			trans	-138.2	106.6	151.6	-177.5	0	0	0	0	107.5
31	L	33.8	Very low	37.3	Very low	167 Å²	167	161.4 Å²	161.4	87%	0.874	83%	0.825	S	S	*	*			trans	-68.3	127.1	161	-79.3	146	0	0	0	107.3
32	H	38.4	Very low	37.3	Very low	166 Å²	166	157.2 Å²	157.2	77%	0.769	81%	0.812	S	S	*	*			trans	-135.5	130	156.8	-127.3	-38.4	0	0	0	109.1
33	E	35.5	Very low	37.1	Very low	161 Å²	161	157.9 Å²	157.9	75%	0.752	81%	0.809	S	S	*	*			trans	-55.3	142	-177.1	-60.5	141.2	135.7	0	0	113.1
34	K	39.5	Very low	37	Very low	199 Å²	199	162.3 Å²	162.3	87%	0.865	82%	0.817	S	S	*	*			trans	-162.3	95.6	140	-106.7	170.6	-172.4	-174.3	0	109.7
35	N	36.5	Very low	36.8	Very low	158 Å²	158	161.3 Å²	161.3	85%	0.845	81%	0.812	S	S	*	*			trans	26.2	101.1	143.2	-63.6	-14.1	0	0	0	118.4
36	V	41.7	Very low	36.8	Very low	140 Å²	140	156.5 Å²	156.5	85%	0.848	80%	0.803	S	S	*	*			trans	-145.9	136.3	140.4	-174.9	0	0	0	0	107.5
37	P	38.5	Very low	36.7	Very low	121 Å²	121	156.6 Å²	156.6	79%	0.786	80%	0.803	S	S	*	*			trans	-79.6	150.8	-160.8	-8.8	26.7	0	0	0	114.8
38	D	33.3	Very low	36.8	Very low	154 Å²	154	157.1 Å²	157.1	82%	0.824	80%	0.804	S	S	*	*			trans	-51.5	130.4	173.7	-82.1	-43.5	0	0	0	114.2
39	H	38.6	Very low	37	Very low	189 Å²	189	155.7 Å²	155.7	88%	0.875	80%	0.803	S	S	*	*			trans	-137.4	113.7	143.3	-88.9	-62.4	0	0	0	109.9
40	S	39.8	Very low	37.4	Very low	85 Å²	85	154.7 Å²	154.7	59%	0.594	80%	0.802	S	S	*	*			trans	-63.4	151.6	173.2	46.3	0	0	0	0	112.1	V42	S40-V42 PolarHBondContact O-N 3.25Å
41	P	38.1	Very low	37.2	Very low	137 Å²	137	154.2 Å²	154.2	89%	0.89	80%	0.804	S	S	*	*			trans	-81.3	99.9	174.5	31.5	-27.9	0	0	0	108.8
42	V	40.7	Very low	37.6	Very low	102 Å²	102	152.5 Å²	152.5	62%	0.618	80%	0.803	S	S	*	*			trans	-121.8	127.8	168.8	-149.2	0	0	0	0	107.6	S40	S40-V42 PolarHBondContact O-N 3.25Å
43	D	39	Very low	37.3	Very low	132 Å²	132	148.4 Å²	148.4	71%	0.706	80%	0.798	S	S	*	*			trans	68	75.7	162.5	-56.9	-27.1	0	0	0	119.3	N45	D43-N45 PolarHBondContact O-N 2.97Å
44	F	34.4	Very low	37.4	Very low	214 Å²	214	147.2 Å²	147.2	94%	0.939	81%	0.806	S	S	*	*	S	Bend	trans	-69.4	77.7	144.9	-104	-89.6	0	0	0	109.2
45	N	35	Very low	37.3	Very low	158 Å²	158	144 Å²	144	85%	0.845	80%	0.798	S	S	*	*	S	Bend	trans	177.9	69.4	155.6	-94	-17	0	0	0	111.7	D43	D43-N45 PolarHBondContact O-N 2.97Å
46	S	34.7	Very low	37.7	Very low	91 Å²	91	147.8 Å²	147.8	64%	0.636	80%	0.802	S	S	*	*			trans	178.1	165.8	152.4	46.9	0	0	0	0	108.8
47	F	34	Very low	38.2	Very low	198 Å²	198	144.8 Å²	144.8	87%	0.868	79%	0.788	S	S	*	*			trans	80.9	49.1	-170.4	-59.8	-82.5	0	0	0	116.9
48	R	37.9	Very low	39.6	Very low	253 Å²	253	143.2 Å²	143.2	96%	0.955	77%	0.772	S	S	*	*				-111.5	94.3	128.2	-83.2	-176.6	176.2	-176	-0.8	108.3
49	K	40.1	Very low	41.7	Very low	188 Å²	188	140.8 Å²	140.8	82%	0.817	77%	0.765	S	S	*	*			trans	-123.3	114.1	160.2	-89.5	-174.6	176	179.2	0	107.7
50	S	39	Very low	43.6	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	75%	0.749	S	S	*	*			trans	26.6	110.3	147	55.3	0	0	0	0	119.8
51	S	33.8	Very low	45.4	Very low	118 Å²	118	137.5 Å²	137.5	83%	0.825	74%	0.741	S	S	*	*			trans	23.4	148.2	137.3	-40.5	0	0	0	0	120.7
52	P	40.5	Very low	47.3	Very low	131 Å²	131	134.4 Å²	134.4	85%	0.851	72%	0.717	S	S	*	*				-136.5	163	73.7	25.3	-3.5	0	0	0	115.3
53	A	32.7	Very low	49.2	Very low	80 Å²	80	134.4 Å²	134.4	66%	0.661	71%	0.713	S	S	*	*			trans	-58.8	139.7	-170.7	0	0	0	0	0	115.6
54	C	37.7	Very low	51.1	Low	136 Å²	136	131.1 Å²	131.1	92%	0.919	69%	0.694	S	S	*	*			trans	-125.6	96.2	148.9	-89.9	0	0	0	0	107.1	Y56	C54-Y56 PolarHBondContact O-N 3.32Å
55	D	37.4	Very low	53.1	Low	133 Å²	133	128.1 Å²	128.1	71%	0.711	68%	0.677	S	S	*	*			trans	-69.7	97.4	172.8	-86.3	-39.5	0	0	0	110.4
56	Y	44.4	Very low	55.3	Low	236 Å²	236	125.6 Å²	125.6	93%	0.925	66%	0.663	S	S	*	*			trans	-148.4	78.3	146.4	-80.2	-73.7	0	0	0	107	C54 D58	C54-Y56 PolarHBondContact O-N 3.32Å; Y56-D58 PolarHBondContact O-N 2.89Å
57	S	53	Low	57.3	Low	78 Å²	78	126 Å²	126	55%	0.545	66%	0.657	S	S	.	*			trans	-83.7	98.1	174.4	53.6	0	0	0	0	109.2	P59 N62	S57-P59 VanDerWaalsContact O-CD 3.32Å; S57-P59 WeakPolarHBondContact O-CD 3.32Å; S57-N62 WeakPolarHBondContact CB-ND2 3.44Å
58	D	68.6	Low	59.2	Low	87 Å²	87	123.2 Å²	123.2	47%	0.465	65%	0.651	S	S	.	*			trans	-58.7	118.1	165.1	-177.3	-4.8	0	0	0	107.7	Y56 H60 E61 N62	Y56-D58 PolarHBondContact O-N 2.89Å; D58-H60 PolarHBondContact O-N 3.24Å; D58-H60 WeakPolarHBondContact OD1-CB 3.38Å; D58-H60 PolarHBondContact OD1-N 3.03Å; D58-E61 HydrophobicContact CB-CB 4.25Å; D58-E61 PolarHBondContact O-N 3.46Å; D58-N62 PolarHBondContact O-N 3.47Å
59	P	75.9	Confident	61.1	Low	104 Å²	104	115 Å²	115	68%	0.675	63%	0.632	S	S	*	*	H	α-helix	trans	-56	-25	179.6	19.6	-30.4	0	0	0	112.1	S57 L63	S57-P59 VanDerWaalsContact O-CD 3.32Å; S57-P59 WeakPolarHBondContact O-CD 3.32Å; P59-L63 WeakPolarHBondContact O-CB 3.49Å; P59-L63 PolarHBondContact O-N 3.14Å
60	H	78.1	Confident	62.3	Low	113 Å²	113	113.4 Å²	113.4	52%	0.523	63%	0.625	S	S	.	*	H	α-helix	trans	-67.5	-44.8	173.2	-175.7	-93	0	0	0	112.7	D58 N62 L63 I64	D58-H60 PolarHBondContact O-N 3.24Å; D58-H60 WeakPolarHBondContact OD1-CB 3.38Å; D58-H60 PolarHBondContact OD1-N 3.03Å; H60-N62 PolarHBondContact O-N 3.46Å; H60-L63 PolarHBondContact O-N 3.43Å; H60-I64 WeakPolarHBondContact O-CG1 3.35Å; H60-I64 PolarHBondContact O-N 3.45Å
61	E	79	Confident	63.4	Low	92 Å²	92	113.6 Å²	113.6	43%	0.43	62%	0.624	S	S	.	*	H	α-helix	trans	-62.5	-41	177.3	-96.2	-86.5	144.3	0	0	111.9	D58 I64 R65	D58-E61 HydrophobicContact CB-CB 4.25Å; D58-E61 PolarHBondContact O-N 3.46Å; E61-I64 PolarHBondContact O-N 2.7Å; E61-R65 PolarHBondContact O-N 2.86Å; E61-R65 IonicContact OE2-CZ 3.58Å; E61-R65 IonicContact OE2-NE 3.62Å; E61-R65 IonicContact OE2-NH2 2.85Å; E61-R65 PolarHBondContact OE2-NH2 2.93Å
62	N	77.4	Confident	64.7	Low	72 Å²	72	116.5 Å²	116.5	39%	0.385	62%	0.622	S	S	.	*	H	α-helix	trans	-67.6	-36.9	175.8	-84.1	-19.2	0	0	0	112.4	S57 D58 H60 N66	S57-N62 WeakPolarHBondContact CB-ND2 3.44Å; D58-N62 PolarHBondContact O-N 3.47Å; H60-N62 PolarHBondContact O-N 3.46Å; N62-N66 WeakPolarHBondContact O-CB 3.46Å; N62-N66 PolarHBondContact O-N 2.85Å
63	L	80.9	Confident	65.6	Low	102 Å²	102	120.9 Å²	120.9	53%	0.534	62%	0.621	S	S	.	*	H	α-helix	trans	-65.1	-47.5	174	-170.3	86	0	0	0	111	P59 H60 R65 N66 I67	P59-L63 WeakPolarHBondContact O-CB 3.49Å; P59-L63 PolarHBondContact O-N 3.14Å; H60-L63 PolarHBondContact O-N 3.43Å; L63-R65 PolarHBondContact O-N 3.16Å; L63-N66 CarbonylContact O-C 3.53Å; L63-N66 PolarHBondContact O-N 2.87Å; L63-N66 VanDerWaalsContact O-N 3.14Å; L63-I67 HydrophobicContact CD2-CD1 4.17Å; L63-I67 HydrophobicContact CG-CD1 4.03Å; L63-I67 WeakPolarHBondContact O-CG1 3.18Å; L63-I67 PolarHBondContact O-N 3.15Å
64	I	78	Confident	66.6	Low	62 Å²	62	120.3 Å²	120.3	32%	0.318	61%	0.61	S	S	.	*	H	α-helix	trans	-59.9	-45.5	177.8	-66	-85.5	0	0	0	110.2	H60 E61 N66 I67 L68	H60-I64 WeakPolarHBondContact O-CG1 3.35Å; H60-I64 PolarHBondContact O-N 3.45Å; E61-I64 PolarHBondContact O-N 2.7Å; I64-N66 VanDerWaalsContact C-N 3.32Å; I64-N66 PolarHBondContact O-N 2.93Å; I64-I67 PolarHBondContact O-N 3.04Å; I64-I67 VanDerWaalsContact O-N 3.16Å; I64-L68 HydrophobicContact CG2-CD1 3.61Å; I64-L68 HydrophobicContact CG2-CG 4.19Å; I64-L68 WeakPolarHBondContact O-CB 3.21Å; I64-L68 VanDerWaalsContact O-CG 3.31Å; I64-L68 WeakPolarHBondContact O-CG 3.43Å; I64-L68 PolarHBondContact O-N 2.98Å
65	R	78.2	Confident	67.6	Low	151 Å²	151	119.6 Å²	119.6	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-60.5	-38.6	174.2	-81.2	-176.5	-155	155.8	13.3	112.9	E61 L63 S69	E61-R65 PolarHBondContact O-N 2.86Å; E61-R65 IonicContact OE2-CZ 3.58Å; E61-R65 IonicContact OE2-NE 3.62Å; E61-R65 IonicContact OE2-NH2 2.85Å; E61-R65 PolarHBondContact OE2-NH2 2.93Å; L63-R65 PolarHBondContact O-N 3.16Å; R65-S69 WeakPolarHBondContact O-CB 3.31Å; R65-S69 PolarHBondContact O-N 3.13Å; R65-S69 PolarHBondContact O-OG 3.17Å
66	N	80	Confident	68.5	Low	106 Å²	106	118 Å²	118	57%	0.567	59%	0.594	S	S	*	*	H	α-helix	trans	-70.3	-30.7	175.5	-90.1	-19.6	0	0	0	113.2	N62 L63 I64 S69 K70	N62-N66 WeakPolarHBondContact O-CB 3.46Å; N62-N66 PolarHBondContact O-N 2.85Å; L63-N66 CarbonylContact O-C 3.53Å; L63-N66 PolarHBondContact O-N 2.87Å; L63-N66 VanDerWaalsContact O-N 3.14Å; I64-N66 VanDerWaalsContact C-N 3.32Å; I64-N66 PolarHBondContact O-N 2.93Å; N66-S69 WeakPolarHBondContact CA-OG 3.33Å; N66-S69 PolarHBondContact O-OG 3.39Å; N66-K70 WeakPolarHBondContact O-CG 3.42Å
67	I	76.8	Confident	68.7	Low	99 Å²	99	114.3 Å²	114.3	51%	0.508	59%	0.588	S	S	.	*	H	α-helix	trans	-72.4	-46	174	-67.9	165.9	0	0	0	110.1	L63 I64 K70	L63-I67 HydrophobicContact CD2-CD1 4.17Å; L63-I67 HydrophobicContact CG-CD1 4.03Å; L63-I67 WeakPolarHBondContact O-CG1 3.18Å; L63-I67 PolarHBondContact O-N 3.15Å; I64-I67 PolarHBondContact O-N 3.04Å; I64-I67 VanDerWaalsContact O-N 3.16Å; I67-K70 PolarHBondContact O-N 3.35Å
68	L	74.7	Confident	68.7	Low	139 Å²	139	118 Å²	118	73%	0.728	60%	0.602	S	S	*	*	H	α-helix	trans	-73.6	-24.3	-177.8	-66.1	175.3	0	0	0	113.7	I64	I64-L68 HydrophobicContact CG2-CD1 3.61Å; I64-L68 HydrophobicContact CG2-CG 4.19Å; I64-L68 WeakPolarHBondContact O-CB 3.21Å; I64-L68 VanDerWaalsContact O-CG 3.31Å; I64-L68 WeakPolarHBondContact O-CG 3.43Å; I64-L68 PolarHBondContact O-N 2.98Å
69	S	77.1	Confident	68	Low	80 Å²	80	120.3 Å²	120.3	56%	0.559	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-8.3	176.6	58.8	0	0	0	0	114.1	R65 N66 P71	R65-S69 WeakPolarHBondContact O-CB 3.31Å; R65-S69 PolarHBondContact O-N 3.13Å; R65-S69 PolarHBondContact O-OG 3.17Å; N66-S69 WeakPolarHBondContact CA-OG 3.33Å; N66-S69 PolarHBondContact O-OG 3.39Å; S69-P71 WeakPolarHBondContact O-CD 3.49Å
70	K	65.5	Low	66.9	Low	155 Å²	155	122.9 Å²	122.9	67%	0.674	61%	0.613	S	S	*	*	S	Bend	trans	-69.2	124.2	172.6	-80.3	174.7	-177.2	-178.7	0	109.3	N66 I67 F72	N66-K70 WeakPolarHBondContact O-CG 3.42Å; I67-K70 PolarHBondContact O-N 3.35Å; K70-F72 PolarHBondContact O-N 3.49Å
71	P	62	Low	65.3	Low	111 Å²	111	119.3 Å²	119.3	72%	0.721	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-60.3	134	174.9	24.3	-31.6	0	0	0	109.5	S69 R73	S69-P71 WeakPolarHBondContact O-CD 3.49Å; P71-R73 PolarHBondContact O-N 3.25Å; P71-R73 VanDerWaalsContact O-N 3.15Å
72	F	60.6	Low	63.6	Low	179 Å²	179	118.8 Å²	118.8	79%	0.785	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-54.3	119.1	175	179.1	-97.4	0	0	0	110	K70 V74	K70-F72 PolarHBondContact O-N 3.49Å; F72-V74 HydrophobicContact CD1-CG2 4.48Å; F72-V74 HydrophobicContact CE1-CG2 3.95Å
73	R	59	Low	62.1	Low	224 Å²	224	118.9 Å²	118.9	85%	0.845	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-103	126.9	167.9	-86.9	-174.6	173.6	-177.1	-1.8	108.3	P71 P75	P71-R73 PolarHBondContact O-N 3.25Å; P71-R73 VanDerWaalsContact O-N 3.15Å; R73-P75 WeakPolarHBondContact O-CD 3.45Å
74	V	54.7	Low	60.5	Low	68 Å²	68	118.7 Å²	118.7	41%	0.412	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-61	123.4	174.8	-176.9	0	0	0	0	108.6	F72 I76 Y79	F72-V74 HydrophobicContact CD1-CG2 4.48Å; F72-V74 HydrophobicContact CE1-CG2 3.95Å; V74-I76 HydrophobicContact CG1-CB 4.49Å; V74-I76 PolarHBondContact O-N 3.17Å; V74-Y79 HydrophobicContact CG1-CD1 3.57Å; V74-Y79 HydrophobicContact CG1-CE1 4.45Å; V74-Y79 HydrophobicContact CG1-CG 3.88Å
75	P	58	Low	58.7	Low	121 Å²	121	122.5 Å²	122.5	79%	0.786	64%	0.64	S	S	*	*	S	Bend	trans	-71.7	4.8	-174.1	25.2	-32.3	0	0	0	114.8	R73	R73-P75 WeakPolarHBondContact O-CD 3.45Å
76	I	56	Low	57.1	Low	99 Å²	99	119.9 Å²	119.9	51%	0.508	64%	0.641	S	S	.	*	S	Bend	trans	-116.1	112.3	178.7	-56.9	167.3	0	0	0	107.8	V74 N78 Y79	V74-I76 HydrophobicContact CG1-CB 4.49Å; V74-I76 PolarHBondContact O-N 3.17Å; I76-N78 PolarHBondContact O-N 3.08Å; I76-Y79 HydrophobicContact CB-CG 4.46Å; I76-Y79 HydrophobicContact CD1-CD2 3.89Å; I76-Y79 HydrophobicContact CD1-CG 4.37Å; I76-Y79 PolarHBondContact O-N 3.3Å; I76-Y79 VanDerWaalsContact O-N 3.13Å
77	I	49.4	Very low	55.4	Low	159 Å²	159	126.4 Å²	126.4	82%	0.815	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	122.2	169.7	-61.7	169.5	0	0	0	106.9
78	N	53.3	Low	54	Low	156 Å²	156	126.4 Å²	126.4	83%	0.834	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.3	16.7	-174.4	-54.2	-26.2	0	0	0	118	I76 N80	I76-N78 PolarHBondContact O-N 3.08Å; N78-N80 PolarHBondContact O-N 3.29Å
79	Y	53.5	Low	52.2	Low	134 Å²	134	128.1 Å²	128.1	53%	0.525	67%	0.671	S	S	.	*			trans	-77.7	104.1	170.3	-178.3	-89.3	0	0	0	111.9	V74 I76 G81	V74-Y79 HydrophobicContact CG1-CD1 3.57Å; V74-Y79 HydrophobicContact CG1-CE1 4.45Å; V74-Y79 HydrophobicContact CG1-CG 3.88Å; I76-Y79 HydrophobicContact CB-CG 4.46Å; I76-Y79 HydrophobicContact CD1-CD2 3.89Å; I76-Y79 HydrophobicContact CD1-CG 4.37Å; I76-Y79 PolarHBondContact O-N 3.3Å; I76-Y79 VanDerWaalsContact O-N 3.13Å; Y79-G81 VanDerWaalsContact CE1-CA 3.48Å
80	N	53.3	Low	51	Low	158 Å²	158	128.4 Å²	128.4	85%	0.845	69%	0.687	S	S	*	*			trans	-89.3	106.2	160.6	-77.5	-21.4	0	0	0	107.8	N78	N78-N80 PolarHBondContact O-N 3.29Å
81	G	44.4	Very low	50.1	Low	38 Å²	38	126 Å²	126	39%	0.392	69%	0.685	S	S	.	*			trans	-56.9	140.9	172.2	0	0	0	0	0	110.5	Y79 S83	Y79-G81 VanDerWaalsContact CE1-CA 3.48Å; G81-S83 PolarHBondContact O-N 3.33Å
82	S	42.3	Very low	49.3	Very low	81 Å²	81	132.4 Å²	132.4	57%	0.566	69%	0.694	S	S	*	*			trans	-45.8	118	175.1	174.4	0	0	0	0	110.1	N84 D85	S82-N84 PolarHBondContact O-N 3.07Å; S82-D85 PolarHBondContact O-N 3.27Å
83	S	47.5	Very low	48.7	Very low	74 Å²	74	134.7 Å²	134.7	52%	0.517	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58	-8.8	-172.5	-27.8	0	0	0	0	114.4	G81 V86	G81-S83 PolarHBondContact O-N 3.33Å; S83-V86 WeakPolarHBondContact O-CG2 3.35Å
84	N	45.4	Very low	48.4	Very low	99 Å²	99	130.4 Å²	130.4	53%	0.529	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	-10.4	179.9	-72.9	-29.1	0	0	0	114.5	S82 V86 L100	S82-N84 PolarHBondContact O-N 3.07Å; N84-V86 VanDerWaalsContact C-N 3.29Å; N84-V86 PolarHBondContact O-N 3.32Å; N84-L100 PolarHBondContact ND2-O 3.38Å
85	D	40.9	Very low	48.5	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	71%	0.707	S	S	*	*			trans	-96	33.4	175	-98.8	-23.1	0	0	0	112.9	S82 R87	S82-D85 PolarHBondContact O-N 3.27Å; D85-R87 PolarHBondContact O-N 3.1Å
86	V	44.5	Very low	48.8	Very low	96 Å²	96	129 Å²	129	58%	0.582	68%	0.683	S	S	*	*			trans	-82	69.8	176.8	-168.6	0	0	0	0	109.9	S83 N84 V88	S83-V86 WeakPolarHBondContact O-CG2 3.35Å; N84-V86 VanDerWaalsContact C-N 3.29Å; N84-V86 PolarHBondContact O-N 3.32Å; V86-V88 VanDerWaalsContact C-N 3.33Å
87	R	44.5	Very low	49.6	Very low	243 Å²	243	127.7 Å²	127.7	92%	0.917	67%	0.672	S	S	*	*			trans	-99	27.3	155.3	-76.2	-166.7	-175.2	-174.4	4.4	111.9	D85 L89	D85-R87 PolarHBondContact O-N 3.1Å; R87-L89 PolarHBondContact O-N 3.33Å
88	V	46.5	Very low	51.1	Low	100 Å²	100	123.9 Å²	123.9	61%	0.606	66%	0.656	S	S	*	*			trans	-80.3	107.7	168.8	-173.6	0	0	0	0	108.3	V86 G90 V91	V86-V88 VanDerWaalsContact C-N 3.33Å; V88-G90 PolarHBondContact O-N 2.8Å; V88-V91 HydrophobicContact CG1-CG2 4.49Å
89	L	37.5	Very low	52.6	Low	174 Å²	174	117 Å²	117	91%	0.911	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	130.9	171.8	-72.7	161.9	0	0	0	109.5	R87	R87-L89 PolarHBondContact O-N 3.33Å
90	G	52	Low	54.2	Low	87 Å²	87	113.4 Å²	113.4	90%	0.897	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.7	-5.9	169.3	0	0	0	0	0	117.6	V88	V88-G90 PolarHBondContact O-N 2.8Å
91	V	47.3	Very low	55.9	Low	104 Å²	104	107.6 Å²	107.6	63%	0.63	58%	0.578	S	S	*	*			trans	-101.2	120.7	174.5	-172.9	0	0	0	0	109.9	V88 R93	V88-V91 HydrophobicContact CG1-CG2 4.49Å; V91-R93 PolarHBondContact O-N 3.32Å
92	R	44.4	Very low	58	Low	245 Å²	245	110.1 Å²	110.1	93%	0.925	58%	0.583	S	S	*	*			trans	-55.8	129.6	171.3	-94.5	-177.3	169.1	178.7	-2.6	108.7	N94	R92-N94 PolarHBondContact O-N 2.92Å
93	R	48.8	Very low	60.2	Low	228 Å²	228	107.3 Å²	107.3	86%	0.86	56%	0.563	S	S	*	*			trans	-44.7	128	176.7	-71.5	-179.6	177.1	160.8	1.6	110	V91 T95	V91-R93 PolarHBondContact O-N 3.32Å; R93-T95 PolarHBondContact O-N 3.05Å; R93-T95 VanDerWaalsContact O-N 3.1Å
94	N	51.2	Low	62.1	Low	133 Å²	133	112 Å²	112	71%	0.711	57%	0.574	S	S	*	*			trans	-61.3	116.8	167.1	-157.8	1.7	0	0	0	107.3	R92 S96	R92-N94 PolarHBondContact O-N 2.92Å; N94-S96 VanDerWaalsContact CG-OG 3.31Å; N94-S96 PolarHBondContact ND2-OG 3Å; N94-S96 PolarHBondContact O-N 3.31Å; N94-S96 PolarHBondContact OD1-OG 3.16Å
95	T	57.2	Low	64.2	Low	119 Å²	119	111.1 Å²	111.1	73%	0.73	57%	0.567	S	S	*	*			trans	-79.7	-7.3	-174.7	47.5	0	0	0	0	112.6	R93	R93-T95 PolarHBondContact O-N 3.05Å; R93-T95 VanDerWaalsContact O-N 3.1Å
96	S	64.4	Low	66.1	Low	42 Å²	42	113 Å²	113	29%	0.294	57%	0.571	S	S	.	*	S	Bend	trans	-66.5	135.7	174.8	57.6	0	0	0	0	111	N94 V98	N94-S96 VanDerWaalsContact CG-OG 3.31Å; N94-S96 PolarHBondContact ND2-OG 3Å; N94-S96 PolarHBondContact O-N 3.31Å; N94-S96 PolarHBondContact OD1-OG 3.16Å; S96-V98 PolarHBondContact O-N 3.02Å
97	R	73.6	Confident	68	Low	70 Å²	70	113.2 Å²	113.2	26%	0.264	57%	0.569	S	S	.	*			trans	-65.4	124.3	166.8	-65.3	-177	171.1	174.6	0.6	109	T128 V132 E197	R97-T128 PolarHBondContact NE-O 3.02Å; R97-T128 PolarHBondContact NH1-O 2.83Å; R97-T128 PolarHBondContact NH2-O 3.07Å; R97-V132 HydrophobicContact CB-CG2 3.58Å; R97-E197 WeakPolarHBondContact CD-O 3.4Å; R97-E197 PolarHBondContact NE-O 3.42Å; R97-E197 VanDerWaalsContact NE-O 3.12Å; R97-E197 PolarHBondContact NH1-O 3.42Å
98	V	80.5	Confident	70	Confident	79 Å²	79	103 Å²	103	48%	0.479	54%	0.537	S	S	.	.			trans	-122.9	152.5	177.4	-175.7	0	0	0	0	108.5	S96	S96-V98 PolarHBondContact O-N 3.02Å
99	A	85.2	Confident	72.2	Confident	13 Å²	13	99.2 Å²	99.2	11%	0.107	51%	0.513	C	S	.	.			trans	-61.9	146	175.8	0	0	0	0	0	109.5	H101 V132 H133	A99-H101 VanDerWaalsContact CB-O 3.29Å; A99-H101 WeakPolarHBondContact CB-O 3.18Å; A99-H101 PolarHBondContact O-N 3.38Å; A99-V132 HydrophobicContact CB-CG1 3.61Å; A99-H133 HydrophobicContact CB-CB 4.16Å; A99-H133 WeakPolarHBondContact CB-O 3.46Å
100	L	87	Confident	74.8	Confident	58 Å²	58	92.8 Å²	92.8	30%	0.304	48%	0.481	S	S	.	.	S	Bend	trans	-66	-32.8	-179.3	-176.3	64.9	0	0	0	111.6	N84 R193 Q194	N84-L100 PolarHBondContact ND2-O 3.38Å; L100-R193 HydrophobicContact CD2-CB 3.92Å; L100-Q194 HydrophobicContact CB-CG 3.76Å; L100-Q194 HydrophobicContact CD2-CG 3.67Å; L100-Q194 HydrophobicContact CG-CG 4.38Å
101	H	89.5	Confident	76.7	Confident	35 Å²	35	89.1 Å²	89.1	16%	0.162	44%	0.441	C	S	.	.	S	Bend	trans	-127.7	157.3	176.5	-54.8	-71.4	0	0	0	109.7	A99 P103 V135 D137 P138 Q194	A99-H101 VanDerWaalsContact CB-O 3.29Å; A99-H101 WeakPolarHBondContact CB-O 3.18Å; A99-H101 PolarHBondContact O-N 3.38Å; H101-P103 WeakPolarHBondContact O-CD 3.39Å; H101-V135 HydrophobicContact CB-CB 4.08Å; H101-V135 HydrophobicContact CB-CG1 4.05Å; H101-V135 PolarHBondContact CD2-O 2.86Å; H101-D137 IonicContact CE1-OD1 3.54Å; H101-P138 HydrophobicContact CB-CG 4.42Å; H101-P138 VanDerWaalsContact ND1-CD 3.34Å; H101-P138 WeakPolarHBondContact ND1-CD 3.41Å; H101-Q194 PolarHBondContact CD2-NE2 3.45Å
102	D	88.2	Confident	78.8	Confident	91 Å²	91	86.8 Å²	86.8	49%	0.487	42%	0.421	S	S	.	.			trans	-71.9	118.8	-177.9	-169.2	-11.1	0	0	0	110.5	F104 E105	D102-F104 PolarHBondContact O-N 3.26Å; D102-F104 PolarHBondContact OD1-N 3.35Å; D102-E105 HydrophobicContact CB-CB 4.43Å
103	P	87.3	Confident	80.9	Confident	23 Å²	23	78.5 Å²	78.5	15%	0.149	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.9	176.8	28.2	-34.2	0	0	0	113.9	H101 V110 H133 V135	H101-P103 WeakPolarHBondContact O-CD 3.39Å; P103-V110 HydrophobicContact CB-CG2 4Å; P103-H133 HydrophobicContact CB-CB 4.07Å; P103-H133 HydrophobicContact CG-CB 4.22Å; P103-V135 HydrophobicContact CB-CG2 3.7Å
104	F	88.7	Confident	82.7	Confident	171 Å²	171	69.2 Å²	69.2	75%	0.75	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	4	-175.6	-51.2	-69.8	0	0	0	113.7	D102	D102-F104 PolarHBondContact O-N 3.26Å; D102-F104 PolarHBondContact OD1-N 3.35Å
105	E	88	Confident	84.3	Confident	81 Å²	81	66.8 Å²	66.8	38%	0.379	36%	0.361	S	S	.	.	S	Bend	trans	-63.2	145.7	171.5	-165	-177.9	161	0	0	109.8	D102 D107 A108 K142	D102-E105 HydrophobicContact CB-CB 4.43Å; E105-D107 PolarHBondContact O-N 3.44Å; E105-A108 HydrophobicContact CB-CB 4.37Å; E105-A108 WeakPolarHBondContact O-CB 3.43Å; E105-A108 PolarHBondContact O-N 3.43Å; E105-K142 IonicContact OE1-NZ 3.03Å; E105-K142 PolarHBondContact OE1-NZ 2.89Å
106	E	82	Confident	85.3	Confident	180 Å²	180	70.8 Å²	70.8	84%	0.841	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	134.9	170.6	-66.5	-175.8	171.1	0	0	109.6	A108	E106-A108 PolarHBondContact O-N 2.99Å
107	D	83.3	Confident	86	Confident	102 Å²	102	71.6 Å²	71.6	55%	0.545	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	16.8	-174.5	-80.3	-54.8	0	0	0	116.5	E105 L109 R149	E105-D107 PolarHBondContact O-N 3.44Å; D107-L109 PolarHBondContact O-N 3.15Å; D107-R149 IonicContact OD1-CZ 3.2Å; D107-R149 IonicContact OD1-NH1 3.98Å; D107-R149 PolarHBondContact OD1-NH1 2.82Å; D107-R149 IonicContact OD1-NH2 3.5Å; D107-R149 PolarHBondContact OD1-NH2 2.84Å
108	A	88.4	Confident	86.4	Confident	29 Å²	29	72.2 Å²	72.2	24%	0.24	39%	0.386	C	S	.	.			trans	-61.8	124	170.2	0	0	0	0	0	111.1	E105 E106 V110 V135	E105-A108 HydrophobicContact CB-CB 4.37Å; E105-A108 WeakPolarHBondContact O-CB 3.43Å; E105-A108 PolarHBondContact O-N 3.43Å; E106-A108 PolarHBondContact O-N 2.99Å; A108-V110 PolarHBondContact O-N 2.93Å; A108-V135 HydrophobicContact CB-CG1 4.23Å
109	L	91.8	Very high	86.2	Confident	19 Å²	19	72.3 Å²	72.3	10%	0.099	40%	0.395	C	S	.	.			trans	-93.1	95.9	172.8	176.3	60.3	0	0	0	109.2	D107 L111 V136 L144 R149	D107-L109 PolarHBondContact O-N 3.15Å; L109-L111 HydrophobicContact CD1-CD2 4.29Å; L109-L111 HydrophobicContact CD2-CD2 4.22Å; L109-L111 HydrophobicContact CG-CD2 3.9Å; L109-V136 HydrophobicContact CB-CB 4.1Å; L109-V136 HydrophobicContact CB-CG2 4.2Å; L109-V136 HydrophobicContact CD2-CB 4.25Å; L109-V136 HydrophobicContact CD2-CG2 3.74Å; L109-V136 HydrophobicContact CG-CB 4.33Å; L109-V136 HydrophobicContact CG-CG2 3.88Å; L109-V136 PolarHBondContact O-N 2.88Å; L109-L144 HydrophobicContact CD2-CD1 4.06Å; L109-R149 HydrophobicContact CD1-CB 4.16Å; L109-R149 HydrophobicContact CD2-CB 4.06Å; L109-R149 HydrophobicContact CD2-CG 4.12Å
110	V	92.4	Very high	85.8	Confident	40 Å²	40	77 Å²	77	24%	0.242	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114.8	177.4	-172.2	0	0	0	0	109.4	P103 A108 Y112 S113 V135	P103-V110 HydrophobicContact CB-CG2 4Å; A108-V110 PolarHBondContact O-N 2.93Å; V110-Y112 WeakPolarHBondContact CG1-O 3.48Å; V110-S113 WeakPolarHBondContact CG1-OG 3.36Å; V110-V135 HydrophobicContact CG2-CG2 4.37Å
111	L	91.4	Very high	85.3	Confident	10 Å²	10	77.6 Å²	77.6	5%	0.052	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-34.1	177.5	-55	-174.3	0	0	0	112	L109 V134 V136 V152 K153 Y156 T190	L109-L111 HydrophobicContact CD1-CD2 4.29Å; L109-L111 HydrophobicContact CD2-CD2 4.22Å; L109-L111 HydrophobicContact CG-CD2 3.9Å; L111-V134 HydrophobicContact CB-CG1 4.45Å; L111-V134 PolarHBondContact N-O 2.94Å; L111-V136 HydrophobicContact CD1-CG2 3.71Å; L111-V136 HydrophobicContact CD2-CG2 3.85Å; L111-V136 HydrophobicContact CG-CG2 3.72Å; L111-V152 HydrophobicContact CD1-CG1 4.21Å; L111-V152 HydrophobicContact CD2-CG1 4.07Å; L111-K153 HydrophobicContact CD2-CB 4.33Å; L111-Y156 HydrophobicContact CB-CD1 3.73Å; L111-Y156 HydrophobicContact CB-CD2 4.33Å; L111-Y156 HydrophobicContact CB-CE1 4.02Å; L111-Y156 HydrophobicContact CB-CG 3.9Å; L111-Y156 HydrophobicContact CD1-CD1 4.39Å; L111-Y156 HydrophobicContact CD1-CD2 3.6Å; L111-Y156 HydrophobicContact CD1-CE2 4.21Å; L111-Y156 HydrophobicContact CD1-CG 3.7Å; L111-Y156 HydrophobicContact CG-CG 4.39Å; L111-T190 HydrophobicContact CD1-CG2 3.81Å
112	Y	91.2	Very high	84.4	Confident	54 Å²	54	78.3 Å²	78.3	21%	0.212	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	132.7	178.4	177.5	-96.8	0	0	0	110.2	V110 P114 P115 L131 V132 H133 V134 P196	V110-Y112 WeakPolarHBondContact CG1-O 3.48Å; Y112-P114 HydrophobicContact CE1-CB 4.48Å; Y112-P114 HydrophobicContact CE1-CG 4.22Å; Y112-P115 WeakPolarHBondContact OH-CD 3.29Å; Y112-L131 HydrophobicContact CE1-CB 4.45Å; Y112-L131 WeakPolarHBondContact OH-CD1 3.43Å; Y112-V132 WeakPolarHBondContact CD1-O 3.4Å; Y112-H133 VanDerWaalsContact O-CA 3.27Å; Y112-H133 WeakPolarHBondContact O-CA 3.27Å; Y112-V134 HydrophobicContact CD1-CG2 4.46Å; Y112-V134 PolarHBondContact N-O 3.49Å; Y112-V134 PolarHBondContact O-N 3.48Å; Y112-P196 HydrophobicContact CD1-CB 4Å; Y112-P196 HydrophobicContact CD1-CG 4.03Å; Y112-P196 HydrophobicContact CD2-CG 4.45Å; Y112-P196 HydrophobicContact CE1-CB 3.73Å; Y112-P196 HydrophobicContact CE1-CG 4.15Å; Y112-P196 HydrophobicContact CG-CG 4.19Å
113	S	89.1	Confident	83.6	Confident	71 Å²	71	81.3 Å²	81.3	50%	0.497	45%	0.445	S	S	.	.			trans	-114.7	132.1	167.7	-68.6	0	0	0	0	108.9	V110 H133	V110-S113 WeakPolarHBondContact CG1-OG 3.36Å; S113-H133 PolarHBondContact OG-ND1 3.33Å
114	P	86.3	Confident	83	Confident	33 Å²	33	87.2 Å²	87.2	21%	0.214	47%	0.468	C	S	.	.			trans	-55.2	145.7	171.9	-24.4	35.3	0	0	0	111	Y112 L131 H133	Y112-P114 HydrophobicContact CE1-CB 4.48Å; Y112-P114 HydrophobicContact CE1-CG 4.22Å; P114-L131 HydrophobicContact CB-CB 4.15Å; P114-L131 HydrophobicContact CG-CB 4.34Å; P114-L131 WeakPolarHBondContact CG-O 3.2Å; P114-H133 VanDerWaalsContact CD-CE1 3.43Å; P114-H133 WeakPolarHBondContact CD-CE1 3.4Å; P114-H133 WeakPolarHBondContact CD-ND1 3.17Å
115	P	84.5	Confident	82	Confident	82 Å²	82	83.2 Å²	83.2	53%	0.532	45%	0.452	S	S	.	.			trans	-59.9	147	174.1	26	-33.9	0	0	0	110.4	Y112 V117	Y112-P115 WeakPolarHBondContact OH-CD 3.29Å; P115-V117 WeakPolarHBondContact O-CG2 3.35Å; P115-V117 PolarHBondContact O-N 3.32Å; P115-V117 VanDerWaalsContact O-N 3.15Å
116	E	79.6	Confident	81.1	Confident	204 Å²	204	84.4 Å²	84.4	95%	0.953	46%	0.458	S	S	*	.			trans	-65	115.1	174.9	-66.4	-175.3	179.2	0	0	109.4
117	V	78.3	Confident	80.5	Confident	59 Å²	59	78.4 Å²	78.4	36%	0.358	44%	0.439	S	S	.	.			trans	-101.5	136.9	177.9	-177.2	0	0	0	0	107.9	P115 D121 A122	P115-V117 WeakPolarHBondContact O-CG2 3.35Å; P115-V117 PolarHBondContact O-N 3.32Å; P115-V117 VanDerWaalsContact O-N 3.15Å; V117-D121 HydrophobicContact CG1-CB 3.39Å; V117-A122 HydrophobicContact CG1-CB 4.24Å
118	T	81	Confident	80	Confident	82 Å²	82	77.3 Å²	77.3	50%	0.503	44%	0.436	S	S	.	.			trans	-57.9	147.8	174.7	71.2	0	0	0	0	110.3	H120 D121 A122	T118-H120 PolarHBondContact O-N 2.74Å; T118-H120 VanDerWaalsContact O-N 3.08Å; T118-D121 PolarHBondContact O-N 3.37Å; T118-D121 WeakPolarHBondContact OG1-CB 3.48Å; T118-D121 PolarHBondContact OG1-N 3.3Å; T118-D121 PolarHBondContact OG1-OD2 2.81Å; T118-A122 PolarHBondContact O-N 3.17Å
119	A	76.8	Confident	79.3	Confident	81 Å²	81	82.7 Å²	82.7	67%	0.669	45%	0.454	S	S	*	.	H	α-helix	trans	-55.4	-33.4	-177.1	0	0	0	0	0	112.9	L123	A119-L123 WeakPolarHBondContact O-CG 3.45Å; A119-L123 PolarHBondContact O-N 2.93Å
120	H	76.1	Confident	78.7	Confident	112 Å²	112	87.4 Å²	87.4	52%	0.519	47%	0.474	S	S	.	.	H	α-helix	trans	-69.4	-42.6	176.6	174.3	-99.8	0	0	0	112.7	T118 L123 K124	T118-H120 PolarHBondContact O-N 2.74Å; T118-H120 VanDerWaalsContact O-N 3.08Å; H120-L123 PolarHBondContact O-N 3.29Å; H120-K124 WeakPolarHBondContact CE1-CE 3.32Å; H120-K124 PolarHBondContact CE1-NZ 3.04Å; H120-K124 VanDerWaalsContact NE2-CE 3.35Å; H120-K124 WeakPolarHBondContact NE2-CE 3.45Å; H120-K124 PolarHBondContact O-N 2.9Å
121	D	76.5	Confident	78.4	Confident	71 Å²	71	88.6 Å²	88.6	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-72.5	-32.5	178.2	-63.8	-28.3	0	0	0	111.5	V117 T118 L123 K124 Q125	V117-D121 HydrophobicContact CG1-CB 3.39Å; T118-D121 PolarHBondContact O-N 3.37Å; T118-D121 WeakPolarHBondContact OG1-CB 3.48Å; T118-D121 PolarHBondContact OG1-N 3.3Å; T118-D121 PolarHBondContact OG1-OD2 2.81Å; D121-L123 VanDerWaalsContact C-N 3.27Å; D121-L123 PolarHBondContact O-N 3.39Å; D121-K124 PolarHBondContact O-N 3.03Å; D121-K124 VanDerWaalsContact O-N 3.16Å; D121-Q125 WeakPolarHBondContact O-CG 3.42Å; D121-Q125 PolarHBondContact O-N 2.94Å
122	A	71.2	Confident	78.3	Confident	49 Å²	49	88.6 Å²	88.6	41%	0.405	48%	0.479	S	S	.	.	H	α-helix	trans	-63.6	-32	174.5	0	0	0	0	0	112.7	V117 T118	V117-A122 HydrophobicContact CG1-CB 4.24Å; T118-A122 PolarHBondContact O-N 3.17Å
123	L	70.9	Confident	78.2	Confident	155 Å²	155	88.5 Å²	88.5	81%	0.812	48%	0.48	S	S	*	.	H	α-helix	trans	-74.9	-30.3	174.2	-73.3	167	0	0	0	112.7	A119 H120 D121	A119-L123 WeakPolarHBondContact O-CG 3.45Å; A119-L123 PolarHBondContact O-N 2.93Å; H120-L123 PolarHBondContact O-N 3.29Å; D121-L123 VanDerWaalsContact C-N 3.27Å; D121-L123 PolarHBondContact O-N 3.39Å
124	K	75.3	Confident	78.3	Confident	146 Å²	146	85.1 Å²	85.1	64%	0.635	46%	0.456	S	S	*	.	H	α-helix	trans	-79.5	-27.8	178.4	-72.5	-176.7	176.7	-174.8	0	113.5	H120 D121 E126	H120-K124 WeakPolarHBondContact CE1-CE 3.32Å; H120-K124 PolarHBondContact CE1-NZ 3.04Å; H120-K124 VanDerWaalsContact NE2-CE 3.35Å; H120-K124 WeakPolarHBondContact NE2-CE 3.45Å; H120-K124 PolarHBondContact O-N 2.9Å; D121-K124 PolarHBondContact O-N 3.03Å; D121-K124 VanDerWaalsContact O-N 3.16Å; K124-E126 PolarHBondContact O-N 3.33Å
125	Q	68	Low	78.7	Confident	88 Å²	88	83.6 Å²	83.6	41%	0.411	45%	0.446	S	S	.	.	S	Bend	trans	-67.7	130.1	-179.3	-77.8	179	9.7	0	0	111.2	D121 A127	D121-Q125 WeakPolarHBondContact O-CG 3.42Å; D121-Q125 PolarHBondContact O-N 2.94Å; Q125-A127 PolarHBondContact O-N 2.88Å
126	E	69	Low	79.1	Confident	105 Å²	105	79.7 Å²	79.7	49%	0.491	42%	0.421	S	S	.	.			trans	-56.2	127.7	169.9	-68.9	175.5	163	0	0	109.4	K124 T128 K129 K130	K124-E126 PolarHBondContact O-N 3.33Å; E126-T128 PolarHBondContact O-N 3.43Å; E126-K129 HydrophobicContact CB-CB 4.47Å; E126-K129 PolarHBondContact O-N 3.38Å; E126-K129 WeakPolarHBondContact OE2-CD 3.37Å; E126-K129 WeakPolarHBondContact OE2-CE 3.42Å; E126-K129 IonicContact OE2-NZ 2.74Å; E126-K129 PolarHBondContact OE2-NZ 3.26Å; E126-K130 PolarHBondContact O-N 3.28Å
127	A	69.5	Low	79.7	Confident	54 Å²	54	70.6 Å²	70.6	45%	0.446	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.3	179.8	0	0	0	0	0	113.4	Q125	Q125-A127 PolarHBondContact O-N 2.88Å
128	T	71.8	Confident	80.3	Confident	79 Å²	79	68.9 Å²	68.9	49%	0.485	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.4	175.6	54.3	0	0	0	0	114.1	R97 E126	R97-T128 PolarHBondContact NE-O 3.02Å; R97-T128 PolarHBondContact NH1-O 2.83Å; R97-T128 PolarHBondContact NH2-O 3.07Å; E126-T128 PolarHBondContact O-N 3.43Å
129	K	75.2	Confident	80.7	Confident	142 Å²	142	67.5 Å²	67.5	62%	0.617	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-7	176.1	-73.4	178.8	179.8	143.6	0	113.1	E126 L131	E126-K129 HydrophobicContact CB-CB 4.47Å; E126-K129 PolarHBondContact O-N 3.38Å; E126-K129 WeakPolarHBondContact OE2-CD 3.37Å; E126-K129 WeakPolarHBondContact OE2-CE 3.42Å; E126-K129 IonicContact OE2-NZ 2.74Å; E126-K129 PolarHBondContact OE2-NZ 3.26Å; K129-L131 PolarHBondContact O-N 3.05Å
130	K	79.6	Confident	81.4	Confident	119 Å²	119	63.6 Å²	63.6	52%	0.517	33%	0.326	S	S	.	.			trans	-56.1	128.6	175.1	-170	172.7	-179.2	176.8	0	110.6	E126	E126-K130 PolarHBondContact O-N 3.28Å
131	L	85.9	Confident	82.1	Confident	64 Å²	64	58.4 Å²	58.4	34%	0.335	30%	0.302	S	S	.	.			trans	-75.1	151.2	173	-62.6	176.2	0	0	0	110.1	Y112 P114 K129 P196 E197	Y112-L131 HydrophobicContact CE1-CB 4.45Å; Y112-L131 WeakPolarHBondContact OH-CD1 3.43Å; P114-L131 HydrophobicContact CB-CB 4.15Å; P114-L131 HydrophobicContact CG-CB 4.34Å; P114-L131 WeakPolarHBondContact CG-O 3.2Å; K129-L131 PolarHBondContact O-N 3.05Å; L131-P196 CarbonylContact C-O 3.55Å; L131-P196 VanDerWaalsContact CA-O 3.29Å; L131-P196 WeakPolarHBondContact CA-O 3.48Å; L131-P196 HydrophobicContact CD2-CB 4.07Å; L131-E197 HydrophobicContact CD2-CG 4.37Å
132	V	87.7	Confident	82.7	Confident	10 Å²	10	61.1 Å²	61.1	6%	0.061	31%	0.311	C	S	.	.			trans	-128.1	148.1	-169.1	-171.5	0	0	0	0	109.6	R97 A99 Y112 P196	R97-V132 HydrophobicContact CB-CG2 3.58Å; A99-V132 HydrophobicContact CB-CG1 3.61Å; Y112-V132 WeakPolarHBondContact CD1-O 3.4Å; V132-P196 PolarHBondContact N-O 2.71Å
133	H	89.7	Confident	83.6	Confident	52 Å²	52	62 Å²	62	24%	0.241	31%	0.307	C	S	.	.			trans	-59.3	142.1	171.7	-64.6	-91.8	0	0	0	111.4	A99 P103 Y112 S113 P114 V135	A99-H133 HydrophobicContact CB-CB 4.16Å; A99-H133 WeakPolarHBondContact CB-O 3.46Å; P103-H133 HydrophobicContact CB-CB 4.07Å; P103-H133 HydrophobicContact CG-CB 4.22Å; Y112-H133 VanDerWaalsContact O-CA 3.27Å; Y112-H133 WeakPolarHBondContact O-CA 3.27Å; S113-H133 PolarHBondContact OG-ND1 3.33Å; P114-H133 VanDerWaalsContact CD-CE1 3.43Å; P114-H133 WeakPolarHBondContact CD-CE1 3.4Å; P114-H133 WeakPolarHBondContact CD-ND1 3.17Å; H133-V135 HydrophobicContact CB-CG2 4.02Å
134	V	92.3	Very high	84.5	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	114.9	169.2	-179.9	0	0	0	0	107.5	L111 Y112 Y156 T190 Q194 P196	L111-V134 HydrophobicContact CB-CG1 4.45Å; L111-V134 PolarHBondContact N-O 2.94Å; Y112-V134 HydrophobicContact CD1-CG2 4.46Å; Y112-V134 PolarHBondContact N-O 3.49Å; Y112-V134 PolarHBondContact O-N 3.48Å; V134-Y156 HydrophobicContact CG1-CE2 4.02Å; V134-Y156 WeakPolarHBondContact CG2-OH 3.47Å; V134-T190 HydrophobicContact CG1-CG2 3.49Å; V134-T190 VanDerWaalsContact CG1-CG2 3.49Å; V134-Q194 HydrophobicContact CG1-CB 3.99Å; V134-P196 HydrophobicContact CG2-CG 4.39Å
135	V	93.3	Very high	85.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.8	-171.5	-176.2	0	0	0	0	107.9	H101 P103 A108 V110 H133 D137 Q194	H101-V135 HydrophobicContact CB-CB 4.08Å; H101-V135 HydrophobicContact CB-CG1 4.05Å; H101-V135 PolarHBondContact CD2-O 2.86Å; P103-V135 HydrophobicContact CB-CG2 3.7Å; A108-V135 HydrophobicContact CB-CG1 4.23Å; V110-V135 HydrophobicContact CG2-CG2 4.37Å; H133-V135 HydrophobicContact CB-CG2 4.02Å; V135-D137 PolarHBondContact O-N 3.29Å; V135-Q194 VanDerWaalsContact O-CD 3.29Å; V135-Q194 PolarHBondContact O-NE2 3.12Å; V135-Q194 PolarHBondContact O-OE1 2.99Å; V135-Q194 VanDerWaalsContact O-OE1 3.05Å
136	V	93.3	Very high	86.2	Confident	1 Å²	1	53 Å²	53	1%	0.006	27%	0.266	C	S	.	.			trans	-61	140.6	178.1	175.7	0	0	0	0	110.2	L109 L111 L140 V152 T186	L109-V136 HydrophobicContact CB-CB 4.1Å; L109-V136 HydrophobicContact CB-CG2 4.2Å; L109-V136 HydrophobicContact CD2-CB 4.25Å; L109-V136 HydrophobicContact CD2-CG2 3.74Å; L109-V136 HydrophobicContact CG-CB 4.33Å; L109-V136 HydrophobicContact CG-CG2 3.88Å; L109-V136 PolarHBondContact O-N 2.88Å; L111-V136 HydrophobicContact CD1-CG2 3.71Å; L111-V136 HydrophobicContact CD2-CG2 3.85Å; L111-V136 HydrophobicContact CG-CG2 3.72Å; V136-L140 HydrophobicContact CG1-CB 4.09Å; V136-V152 HydrophobicContact CG2-CG1 4.32Å; V136-T186 HydrophobicContact CB-CG2 4.44Å; V136-T186 HydrophobicContact CG1-CG2 3.37Å; V136-T186 HydrophobicContact CG2-CG2 4.17Å
137	D	92.5	Very high	87.2	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.064	25%	0.245	C	C	.	.			trans	-51.9	126	177.7	-171.5	-36.4	0	0	0	110.2	H101 V135 M139 L140 S141 W189 K228	H101-D137 IonicContact CE1-OD1 3.54Å; V135-D137 PolarHBondContact O-N 3.29Å; D137-M139 PolarHBondContact O-N 3.32Å; D137-M139 WeakPolarHBondContact OD1-CB 3.29Å; D137-M139 PolarHBondContact OD1-N 3.35Å; D137-L140 PolarHBondContact O-N 3.09Å; D137-S141 PolarHBondContact O-N 2.84Å; D137-W189 PolarHBondContact OD2-NE1 3.15Å; D137-K228 IonicContact OD1-NZ 3.26Å; D137-K228 IonicContact OD2-NZ 3.98Å; D137-K228 PolarHBondContact OD2-NZ 3.45Å; D137-K228 VanDerWaalsContact OD2-NZ 3.09Å
138	P	90.2	Very high	88.3	Confident	24 Å²	24	46.9 Å²	46.9	16%	0.156	23%	0.228	C	C	.	.	H	α-helix	trans	-53	-28	-178.8	-30.1	35.6	0	0	0	114.3	H101 L140 S141 K142	H101-P138 HydrophobicContact CB-CG 4.42Å; H101-P138 VanDerWaalsContact ND1-CD 3.34Å; H101-P138 WeakPolarHBondContact ND1-CD 3.41Å; P138-L140 PolarHBondContact O-N 3.03Å; P138-S141 WeakPolarHBondContact CA-OG 3.45Å; P138-K142 WeakPolarHBondContact O-CB 3.2Å; P138-K142 WeakPolarHBondContact O-CD 3.34Å; P138-K142 WeakPolarHBondContact O-CG 3.43Å; P138-K142 PolarHBondContact O-N 3.06Å
139	M	90.4	Very high	89.4	Confident	52 Å²	52	45.8 Å²	45.8	26%	0.256	22%	0.215	S	C	.	.	H	α-helix	trans	-58.5	-36.8	173.7	176.2	-172	-78.3	0	0	112.4	D137 I143 H226 K228	D137-M139 PolarHBondContact O-N 3.32Å; D137-M139 WeakPolarHBondContact OD1-CB 3.29Å; D137-M139 PolarHBondContact OD1-N 3.35Å; M139-I143 VanDerWaalsContact O-CD1 3.23Å; M139-I143 WeakPolarHBondContact O-CD1 3.33Å; M139-H226 HydrophobicContact CE-CB 4.49Å; M139-H226 WeakPolarHBondContact CE-ND1 3.29Å; M139-H226 PolarHBondContact SD-ND1 3.42Å; M139-K228 HydrophobicContact CE-CD 4.35Å
140	L	91.7	Very high	90.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-92.4	-43.5	-178.7	-59.6	179	0	0	0	110.7	V136 D137 P138 K142 I143 L144 T186 W189 W224 L225	V136-L140 HydrophobicContact CG1-CB 4.09Å; D137-L140 PolarHBondContact O-N 3.09Å; P138-L140 PolarHBondContact O-N 3.03Å; L140-K142 PolarHBondContact O-N 2.9Å; L140-I143 PolarHBondContact O-N 3.48Å; L140-L144 WeakPolarHBondContact O-CG 3.45Å; L140-L144 PolarHBondContact O-N 2.87Å; L140-T186 HydrophobicContact CB-CG2 4.31Å; L140-T186 HydrophobicContact CD1-CG2 4.11Å; L140-W189 HydrophobicContact CD1-CB 4.27Å; L140-W189 HydrophobicContact CD1-CG 4.26Å; L140-W224 HydrophobicContact CD2-CB 4.04Å; L140-L225 HydrophobicContact CD1-CD2 4.06Å; L140-L225 HydrophobicContact CD2-CD2 4.24Å
141	S	90.3	Very high	90.9	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-34.9	-175.9	72.7	0	0	0	0	113.2	D137 P138 I143 R149	D137-S141 PolarHBondContact O-N 2.84Å; P138-S141 WeakPolarHBondContact CA-OG 3.45Å; S141-I143 PolarHBondContact O-N 3.34Å; S141-R149 PolarHBondContact O-NE 2.83Å; S141-R149 PolarHBondContact O-NH2 3.31Å
142	K	89.4	Confident	91.3	Very high	128 Å²	128	36.2 Å²	36.2	56%	0.557	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.8	178	-69.9	176.2	-174.4	-176.6	0	113.5	E105 P138 L140	E105-K142 IonicContact OE1-NZ 3.03Å; E105-K142 PolarHBondContact OE1-NZ 2.89Å; P138-K142 WeakPolarHBondContact O-CB 3.2Å; P138-K142 WeakPolarHBondContact O-CD 3.34Å; P138-K142 WeakPolarHBondContact O-CG 3.43Å; P138-K142 PolarHBondContact O-N 3.06Å; L140-K142 PolarHBondContact O-N 2.9Å
143	I	89.5	Confident	91.6	Very high	66 Å²	66	40.7 Å²	40.7	34%	0.338	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-29	-176.5	-56.3	174.9	0	0	0	111.3	M139 L140 S141 R145 L182 W224	M139-I143 VanDerWaalsContact O-CD1 3.23Å; M139-I143 WeakPolarHBondContact O-CD1 3.33Å; L140-I143 PolarHBondContact O-N 3.48Å; S141-I143 PolarHBondContact O-N 3.34Å; I143-R145 PolarHBondContact O-N 3.39Å; I143-L182 HydrophobicContact CG2-CD2 4.35Å; I143-W224 HydrophobicContact CD1-CE3 3.91Å; I143-W224 HydrophobicContact CD1-CZ3 3.85Å; I143-W224 HydrophobicContact CG2-CE3 4.35Å; I143-W224 HydrophobicContact CG2-CH2 3.97Å; I143-W224 HydrophobicContact CG2-CZ3 3.58Å
144	L	90.7	Very high	91.8	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.047	19%	0.187	C	C	.	.			trans	-65.8	126.9	-175.8	-66.7	169.1	0	0	0	112	L109 L140 Q148 R149 V152 L182 T186	L109-L144 HydrophobicContact CD2-CD1 4.06Å; L140-L144 WeakPolarHBondContact O-CG 3.45Å; L140-L144 PolarHBondContact O-N 2.87Å; L144-Q148 HydrophobicContact CB-CB 4.19Å; L144-Q148 HydrophobicContact CD2-CB 3.81Å; L144-R149 HydrophobicContact CB-CG 3.77Å; L144-R149 PolarHBondContact O-NE 3.46Å; L144-V152 HydrophobicContact CD1-CG2 4.35Å; L144-L182 HydrophobicContact CD2-CD1 4.43Å; L144-L182 HydrophobicContact CD2-CD2 3.83Å; L144-L182 HydrophobicContact CD2-CG 3.72Å; L144-T186 HydrophobicContact CD1-CG2 3.96Å
145	R	88.5	Confident	91.9	Very high	113 Å²	113	39.9 Å²	39.9	43%	0.426	19%	0.187	S	C	.	.			trans	-68.5	161.5	169.8	-61	-62.5	-173.4	-148	-0.2	111.5	I143 H147 Q148 R149	I143-R145 PolarHBondContact O-N 3.39Å; R145-H147 PolarHBondContact O-N 3.04Å; R145-Q148 HydrophobicContact CB-CG 4.18Å; R145-Q148 CarbonylContact O-C 3.59Å; R145-Q148 WeakPolarHBondContact O-CA 3.24Å; R145-Q148 WeakPolarHBondContact O-CB 3.44Å; R145-Q148 PolarHBondContact O-N 3.38Å; R145-R149 PolarHBondContact O-N 3.48Å
146	P	90.4	Very high	92	Very high	79 Å²	79	39.9 Å²	39.9	51%	0.513	19%	0.187	S	C	.	.	H	α-helix	trans	-51.6	-48.7	-177.7	-29.7	36.2	0	0	0	114.1	Q148 R149 E150	P146-Q148 VanDerWaalsContact C-N 3.3Å; P146-Q148 PolarHBondContact O-N 3.35Å; P146-R149 WeakPolarHBondContact O-CB 3.43Å; P146-R149 PolarHBondContact O-N 2.94Å; P146-R149 VanDerWaalsContact O-N 3.16Å; P146-E150 PolarHBondContact O-N 2.73Å; P146-E150 VanDerWaalsContact O-N 3.09Å
147	H	89.9	Confident	92	Very high	12 Å²	12	41 Å²	41	6%	0.056	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-38.4	176.6	71.4	-76.7	0	0	0	111.3	R145 R149 E150 G151 L178 R386 L390	R145-H147 PolarHBondContact O-N 3.04Å; H147-R149 VanDerWaalsContact C-N 3.31Å; H147-R149 PolarHBondContact O-N 3Å; H147-E150 PolarHBondContact O-N 3.23Å; H147-G151 PolarHBondContact O-N 3.27Å; H147-L178 PolarHBondContact NE2-O 3.33Å; H147-R386 PolarHBondContact O-NH1 2.88Å; H147-L390 HydrophobicContact CB-CD1 3.83Å
148	Q	92.4	Very high	92	Very high	19 Å²	19	40.6 Å²	40.6	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-36.9	177.6	-60.5	173.8	-27.5	0	0	111.7	L144 R145 P146 G151 V152 L178 Q183	L144-Q148 HydrophobicContact CB-CB 4.19Å; L144-Q148 HydrophobicContact CD2-CB 3.81Å; R145-Q148 HydrophobicContact CB-CG 4.18Å; R145-Q148 CarbonylContact O-C 3.59Å; R145-Q148 WeakPolarHBondContact O-CA 3.24Å; R145-Q148 WeakPolarHBondContact O-CB 3.44Å; R145-Q148 PolarHBondContact O-N 3.38Å; P146-Q148 VanDerWaalsContact C-N 3.3Å; P146-Q148 PolarHBondContact O-N 3.35Å; Q148-G151 PolarHBondContact O-N 2.93Å; Q148-V152 WeakPolarHBondContact O-CG2 3.44Å; Q148-V152 PolarHBondContact O-N 3.49Å; Q148-L178 PolarHBondContact NE2-O 2.94Å; Q148-Q183 HydrophobicContact CB-CG 3.88Å; Q148-Q183 HydrophobicContact CG-CG 4.1Å
149	R	93.5	Very high	92.2	Very high	56 Å²	56	39.4 Å²	39.4	21%	0.211	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-47.8	174.3	-64.7	-174.9	172.4	-167.3	-2.4	111.2	D107 L109 S141 L144 R145 P146 H147 G151 V152 K153	D107-R149 IonicContact OD1-CZ 3.2Å; D107-R149 IonicContact OD1-NH1 3.98Å; D107-R149 PolarHBondContact OD1-NH1 2.82Å; D107-R149 IonicContact OD1-NH2 3.5Å; D107-R149 PolarHBondContact OD1-NH2 2.84Å; L109-R149 HydrophobicContact CD1-CB 4.16Å; L109-R149 HydrophobicContact CD2-CB 4.06Å; L109-R149 HydrophobicContact CD2-CG 4.12Å; S141-R149 PolarHBondContact O-NE 2.83Å; S141-R149 PolarHBondContact O-NH2 3.31Å; L144-R149 HydrophobicContact CB-CG 3.77Å; L144-R149 PolarHBondContact O-NE 3.46Å; R145-R149 PolarHBondContact O-N 3.48Å; P146-R149 WeakPolarHBondContact O-CB 3.43Å; P146-R149 PolarHBondContact O-N 2.94Å; P146-R149 VanDerWaalsContact O-N 3.16Å; H147-R149 VanDerWaalsContact C-N 3.31Å; H147-R149 PolarHBondContact O-N 3Å; R149-G151 VanDerWaalsContact C-N 3.3Å; R149-G151 PolarHBondContact O-N 3.2Å; R149-V152 PolarHBondContact O-N 3.02Å; R149-K153 PolarHBondContact O-N 3.21Å; R149-K153 VanDerWaalsContact O-N 3.07Å
150	E	92.5	Very high	92.2	Very high	123 Å²	123	38.6 Å²	38.6	58%	0.575	18%	0.181	S	C	*	.	H	α-helix	trans	-60.1	-40.3	175	-69.6	175.6	173.3	0	0	112.3	P146 H147 K153 F154	P146-E150 PolarHBondContact O-N 2.73Å; P146-E150 VanDerWaalsContact O-N 3.09Å; H147-E150 PolarHBondContact O-N 3.23Å; E150-K153 PolarHBondContact O-N 3.26Å; E150-F154 WeakPolarHBondContact O-CB 3.23Å; E150-F154 PolarHBondContact O-N 2.91Å
151	G	93.8	Very high	92.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.8	-36.6	-178.4	0	0	0	0	0	113.1	H147 Q148 R149 M155 R386	H147-G151 PolarHBondContact O-N 3.27Å; Q148-G151 PolarHBondContact O-N 2.93Å; R149-G151 VanDerWaalsContact C-N 3.3Å; R149-G151 PolarHBondContact O-N 3.2Å; G151-M155 WeakPolarHBondContact O-CB 3.42Å; G151-M155 WeakPolarHBondContact O-CG 3.38Å; G151-M155 PolarHBondContact O-N 3.36Å; G151-R386 VanDerWaalsContact CA-NH1 3.34Å; G151-R386 VanDerWaalsContact N-NH1 3.18Å
152	V	95.2	Very high	91.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-42.7	172.2	174	0	0	0	0	110.8	L111 V136 L144 Q148 R149 M155 Y156 Q183 T186	L111-V152 HydrophobicContact CD1-CG1 4.21Å; L111-V152 HydrophobicContact CD2-CG1 4.07Å; V136-V152 HydrophobicContact CG2-CG1 4.32Å; L144-V152 HydrophobicContact CD1-CG2 4.35Å; Q148-V152 WeakPolarHBondContact O-CG2 3.44Å; Q148-V152 PolarHBondContact O-N 3.49Å; R149-V152 PolarHBondContact O-N 3.02Å; V152-M155 HydrophobicContact CG2-CE 4.33Å; V152-M155 PolarHBondContact O-N 3.07Å; V152-Y156 WeakPolarHBondContact O-CB 3.42Å; V152-Y156 PolarHBondContact O-N 3.49Å; V152-Q183 HydrophobicContact CG2-CB 3.93Å; V152-Q183 HydrophobicContact CG2-CG 4.29Å; V152-T186 HydrophobicContact CG1-CG2 3.88Å; V152-T186 HydrophobicContact CG2-CG2 4.06Å
153	K	94.5	Very high	91.7	Very high	104 Å²	104	40.9 Å²	40.9	45%	0.452	20%	0.203	S	C	.	.	H	α-helix	trans	-60.4	-51	175.4	-173.9	178.1	179.1	180	0	111.5	L111 R149 E150 M155 Y156 D157	L111-K153 HydrophobicContact CD2-CB 4.33Å; R149-K153 PolarHBondContact O-N 3.21Å; R149-K153 VanDerWaalsContact O-N 3.07Å; E150-K153 PolarHBondContact O-N 3.26Å; K153-M155 PolarHBondContact O-N 3.22Å; K153-Y156 WeakPolarHBondContact O-CB 3.39Å; K153-Y156 PolarHBondContact O-N 2.68Å; K153-Y156 VanDerWaalsContact O-N 3.12Å; K153-D157 VanDerWaalsContact O-CG 3.25Å; K153-D157 PolarHBondContact O-N 3.27Å
154	F	93.9	Very high	91.5	Very high	35 Å²	35	38.8 Å²	38.8	15%	0.154	19%	0.193	C	C	.	.	H	α-helix	trans	-55.7	-50	177.4	-177.1	-90.5	0	0	0	112.2	E150 Y156 D157 C158 I384	E150-F154 WeakPolarHBondContact O-CB 3.23Å; E150-F154 PolarHBondContact O-N 2.91Å; F154-Y156 VanDerWaalsContact C-N 3.31Å; F154-Y156 PolarHBondContact O-N 3.09Å; F154-D157 PolarHBondContact O-N 3.3Å; F154-C158 VanDerWaalsContact CE1-SG 3.55Å; F154-C158 PolarHBondContact O-N 3.39Å; F154-C158 PolarHBondContact O-SG 3.12Å; F154-C158 VanDerWaalsContact O-SG 3.35Å; F154-I384 HydrophobicContact CB-CD1 3.97Å; F154-I384 HydrophobicContact CD1-CB 3.63Å; F154-I384 HydrophobicContact CD1-CD1 4.27Å; F154-I384 HydrophobicContact CD1-CG2 3.56Å; F154-I384 HydrophobicContact CD2-CB 4.47Å; F154-I384 HydrophobicContact CD2-CD1 4.43Å; F154-I384 HydrophobicContact CE1-CB 3.59Å; F154-I384 HydrophobicContact CE1-CG2 3.73Å; F154-I384 HydrophobicContact CE2-CB 4.43Å; F154-I384 HydrophobicContact CG-CB 4.08Å; F154-I384 HydrophobicContact CG-CD1 3.97Å; F154-I384 HydrophobicContact CG-CG2 4.34Å; F154-I384 HydrophobicContact CZ-CB 4.01Å
155	M	94.6	Very high	91.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-43	177.2	-77.6	-170.5	-65.2	0	0	112	G151 V152 K153 C158 V159 M172 Q183 L187 V312	G151-M155 WeakPolarHBondContact O-CB 3.42Å; G151-M155 WeakPolarHBondContact O-CG 3.38Å; G151-M155 PolarHBondContact O-N 3.36Å; V152-M155 HydrophobicContact CG2-CE 4.33Å; V152-M155 PolarHBondContact O-N 3.07Å; K153-M155 PolarHBondContact O-N 3.22Å; M155-C158 PolarHBondContact O-N 2.92Å; M155-V159 WeakPolarHBondContact O-CG1 3.32Å; M155-V159 VanDerWaalsContact O-CG2 3.27Å; M155-V159 WeakPolarHBondContact O-CG2 3.37Å; M155-V159 PolarHBondContact O-N 2.93Å; M155-M172 HydrophobicContact CE-CE 3.47Å; M155-M172 VanDerWaalsContact CE-CE 3.47Å; M155-M172 HydrophobicContact CG-CE 3.65Å; M155-M172 HydrophobicContact SD-CE 3.26Å; M155-M172 WeakPolarHBondContact SD-CE 3.28Å; M155-M172 HydrophobicContact SD-SD 4.36Å; M155-Q183 HydrophobicContact CE-CB 3.66Å; M155-Q183 WeakPolarHBondContact CE-O 3.39Å; M155-L187 HydrophobicContact CB-CD1 4.07Å; M155-L187 HydrophobicContact CB-CD2 3.91Å; M155-L187 HydrophobicContact CE-CB 4.16Å; M155-L187 HydrophobicContact CE-CD2 4.41Å; M155-L187 HydrophobicContact CG-CD2 4.49Å; M155-L187 HydrophobicContact SD-CD2 3.94Å; M155-V312 HydrophobicContact SD-CG1 4.19Å
156	Y	94.6	Very high	91	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-46.3	178.9	-176.4	-91.5	0	0	0	111.3	L111 V134 V152 K153 F154 C158 V159 T160 L187 L191 I201	L111-Y156 HydrophobicContact CB-CD1 3.73Å; L111-Y156 HydrophobicContact CB-CD2 4.33Å; L111-Y156 HydrophobicContact CB-CE1 4.02Å; L111-Y156 HydrophobicContact CB-CG 3.9Å; L111-Y156 HydrophobicContact CD1-CD1 4.39Å; L111-Y156 HydrophobicContact CD1-CD2 3.6Å; L111-Y156 HydrophobicContact CD1-CE2 4.21Å; L111-Y156 HydrophobicContact CD1-CG 3.7Å; L111-Y156 HydrophobicContact CG-CG 4.39Å; V134-Y156 HydrophobicContact CG1-CE2 4.02Å; V134-Y156 WeakPolarHBondContact CG2-OH 3.47Å; V152-Y156 WeakPolarHBondContact O-CB 3.42Å; V152-Y156 PolarHBondContact O-N 3.49Å; K153-Y156 WeakPolarHBondContact O-CB 3.39Å; K153-Y156 PolarHBondContact O-N 2.68Å; K153-Y156 VanDerWaalsContact O-N 3.12Å; F154-Y156 VanDerWaalsContact C-N 3.31Å; F154-Y156 PolarHBondContact O-N 3.09Å; Y156-C158 VanDerWaalsContact C-N 3.34Å; Y156-C158 PolarHBondContact O-N 3.4Å; Y156-V159 WeakPolarHBondContact O-CG2 3.29Å; Y156-V159 PolarHBondContact O-N 3.16Å; Y156-T160 HydrophobicContact CD1-CG2 4.23Å; Y156-T160 HydrophobicContact CD2-CG2 4.34Å; Y156-T160 HydrophobicContact CE1-CG2 3.85Å; Y156-T160 HydrophobicContact CE2-CG2 3.99Å; Y156-T160 HydrophobicContact CG-CG2 4.46Å; Y156-T160 WeakPolarHBondContact O-CB 3.46Å; Y156-T160 VanDerWaalsContact O-CG2 3.32Å; Y156-T160 WeakPolarHBondContact O-CG2 3.43Å; Y156-T160 PolarHBondContact O-N 2.86Å; Y156-T160 PolarHBondContact O-OG1 3.31Å; Y156-L187 HydrophobicContact CD2-CD1 4.39Å; Y156-L191 HydrophobicContact CD2-CD2 4.18Å; Y156-L191 HydrophobicContact CE2-CD2 4Å; Y156-I201 HydrophobicContact CE2-CD1 4.04Å
157	D	93.7	Very high	90.9	Very high	23 Å²	23	42.6 Å²	42.6	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-37.5	179.5	-60.5	-21.9	0	0	0	111.7	K153 F154 T160 G161 V162 Q163	K153-D157 VanDerWaalsContact O-CG 3.25Å; K153-D157 PolarHBondContact O-N 3.27Å; F154-D157 PolarHBondContact O-N 3.3Å; D157-T160 PolarHBondContact O-OG1 3.41Å; D157-G161 PolarHBondContact O-N 3.39Å; D157-V162 HydrophobicContact CB-CB 4.23Å; D157-V162 PolarHBondContact O-N 3.07Å; D157-Q163 HydrophobicContact CB-CG 3.63Å; D157-Q163 PolarHBondContact O-N 3.02Å
158	C	93	Very high	91	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.027	23%	0.231	C	C	.	.	H	α-helix	trans	-67.2	-50.3	174.1	-68.4	0	0	0	0	112.2	F154 M155 Y156 T160 G161 H168 C170	F154-C158 VanDerWaalsContact CE1-SG 3.55Å; F154-C158 PolarHBondContact O-N 3.39Å; F154-C158 PolarHBondContact O-SG 3.12Å; F154-C158 VanDerWaalsContact O-SG 3.35Å; M155-C158 PolarHBondContact O-N 2.92Å; Y156-C158 VanDerWaalsContact C-N 3.34Å; Y156-C158 PolarHBondContact O-N 3.4Å; C158-T160 PolarHBondContact O-N 3.3Å; C158-G161 PolarHBondContact O-N 3.39Å; C158-G161 VanDerWaalsContact O-N 3.15Å; C158-H168 CarbonylContact O-C 3.54Å; C158-H168 WeakPolarHBondContact O-CA 3.34Å; C158-C170 HydrophobicContact CB-CB 3.63Å
159	V	93.1	Very high	90.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-14.8	-175.3	-58.7	0	0	0	0	113.7	M155 Y156 H168 L187 L191 L283 R310 V312	M155-V159 WeakPolarHBondContact O-CG1 3.32Å; M155-V159 VanDerWaalsContact O-CG2 3.27Å; M155-V159 WeakPolarHBondContact O-CG2 3.37Å; M155-V159 PolarHBondContact O-N 2.93Å; Y156-V159 WeakPolarHBondContact O-CG2 3.29Å; Y156-V159 PolarHBondContact O-N 3.16Å; V159-H168 PolarHBondContact O-CD2 3.49Å; V159-L187 HydrophobicContact CG1-CD2 4.42Å; V159-L187 HydrophobicContact CG2-CD1 4.12Å; V159-L191 HydrophobicContact CG2-CD1 4.07Å; V159-L191 HydrophobicContact CG2-CD2 4.29Å; V159-L283 HydrophobicContact CG1-CD1 4.42Å; V159-R310 HydrophobicContact CB-CB 4.37Å; V159-R310 HydrophobicContact CB-CG 4.49Å; V159-R310 VanDerWaalsContact O-CD 3.23Å; V159-R310 WeakPolarHBondContact O-CD 3.48Å; V159-R310 PolarHBondContact O-NE 2.94Å; V159-V312 HydrophobicContact CG1-CG2 3.52Å
160	T	91.2	Very high	90.9	Very high	34 Å²	34	41 Å²	41	21%	0.209	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-4.9	172.9	55.8	0	0	0	0	113.3	Y156 D157 C158 V162 I201	Y156-T160 HydrophobicContact CD1-CG2 4.23Å; Y156-T160 HydrophobicContact CD2-CG2 4.34Å; Y156-T160 HydrophobicContact CE1-CG2 3.85Å; Y156-T160 HydrophobicContact CE2-CG2 3.99Å; Y156-T160 HydrophobicContact CG-CG2 4.46Å; Y156-T160 WeakPolarHBondContact O-CB 3.46Å; Y156-T160 VanDerWaalsContact O-CG2 3.32Å; Y156-T160 WeakPolarHBondContact O-CG2 3.43Å; Y156-T160 PolarHBondContact O-N 2.86Å; Y156-T160 PolarHBondContact O-OG1 3.31Å; D157-T160 PolarHBondContact O-OG1 3.41Å; C158-T160 PolarHBondContact O-N 3.3Å; T160-V162 VanDerWaalsContact C-N 3.35Å; T160-V162 WeakPolarHBondContact OG1-CG2 3.37Å; T160-I201 HydrophobicContact CG2-CD1 4.18Å
161	G	88.7	Confident	90.9	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	17.5	178.8	0	0	0	0	0	114.4	D157 C158 I164 N167	D157-G161 PolarHBondContact O-N 3.39Å; C158-G161 PolarHBondContact O-N 3.39Å; C158-G161 VanDerWaalsContact O-N 3.15Å; G161-I164 CarbonylContact O-C 3.54Å; G161-N167 WeakPolarHBondContact CA-O 3.33Å
162	V	87.2	Confident	90.8	Very high	93 Å²	93	35.2 Å²	35.2	56%	0.564	19%	0.191	S	C	*	.	S	Bend	trans	-75.2	-40.2	176.4	176.4	0	0	0	0	110.7	D157 T160	D157-V162 HydrophobicContact CB-CB 4.23Å; D157-V162 PolarHBondContact O-N 3.07Å; T160-V162 VanDerWaalsContact C-N 3.35Å; T160-V162 WeakPolarHBondContact OG1-CG2 3.37Å
163	Q	83.9	Confident	90.4	Very high	72 Å²	72	35.5 Å²	35.5	34%	0.336	19%	0.193	S	C	.	.	S	Bend	trans	-70.5	-46.8	178.8	-71	-62.7	-11.6	0	0	112.8	D157	D157-Q163 HydrophobicContact CB-CG 3.63Å; D157-Q163 PolarHBondContact O-N 3.02Å
164	I	85.6	Confident	90	Very high	22 Å²	22	30.5 Å²	30.5	11%	0.113	17%	0.172	C	C	.	.	S	Bend	trans	-129.3	109.8	179.4	-53.1	178.5	0	0	0	107.4	G161 N166 N167 L337 R381 C382	G161-I164 CarbonylContact O-C 3.54Å; I164-N166 PolarHBondContact O-N 2.68Å; I164-N167 HydrophobicContact CB-CB 3.87Å; I164-N167 HydrophobicContact CG2-CB 3.65Å; I164-N167 WeakPolarHBondContact CG2-ND2 3.41Å; I164-N167 PolarHBondContact O-N 3.4Å; I164-N167 VanDerWaalsContact O-N 3.11Å; I164-L337 HydrophobicContact CD1-CD2 4.25Å; I164-L337 HydrophobicContact CG2-CD1 4.3Å; I164-R381 HydrophobicContact CD1-CB 3.99Å; I164-R381 HydrophobicContact CG1-CB 4.02Å; I164-C382 HydrophobicContact CD1-CB 3.93Å
165	P	85	Confident	89.2	Confident	95 Å²	95	30.4 Å²	30.4	62%	0.617	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	138.9	177.7	-27.2	34.8	0	0	0	111.7	N167	P165-N167 PolarHBondContact O-N 2.93Å; P165-N167 VanDerWaalsContact O-N 3.08Å
166	N	84.7	Confident	88.4	Confident	152 Å²	152	31.3 Å²	31.3	81%	0.813	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	-5.4	-177.6	-53.7	-40.8	0	0	0	116.5	I164	I164-N166 PolarHBondContact O-N 2.68Å
167	N	87.7	Confident	87.4	Confident	34 Å²	34	32.6 Å²	32.6	18%	0.182	19%	0.19	C	C	.	.			trans	-111.4	133.8	-179.7	-78.3	-63.5	0	0	0	109.6	G161 I164 P165 N334	G161-N167 WeakPolarHBondContact CA-O 3.33Å; I164-N167 HydrophobicContact CB-CB 3.87Å; I164-N167 HydrophobicContact CG2-CB 3.65Å; I164-N167 WeakPolarHBondContact CG2-ND2 3.41Å; I164-N167 PolarHBondContact O-N 3.4Å; I164-N167 VanDerWaalsContact O-N 3.11Å; P165-N167 PolarHBondContact O-N 2.93Å; P165-N167 VanDerWaalsContact O-N 3.08Å; N167-N334 HydrophobicContact CB-CB 4.39Å; N167-N334 WeakPolarHBondContact CB-OD1 3.47Å
168	H	91.4	Very high	86.8	Confident	53 Å²	53	31.6 Å²	31.6	25%	0.245	19%	0.185	C	C	.	.			trans	-124.8	27.6	-172.4	-53.5	88.4	0	0	0	112.6	C158 V159 P309 R310 R311 N334	C158-H168 CarbonylContact O-C 3.54Å; C158-H168 WeakPolarHBondContact O-CA 3.34Å; V159-H168 PolarHBondContact O-CD2 3.49Å; H168-P309 WeakPolarHBondContact CB-O 3.36Å; H168-R310 HydrophobicContact CB-CB 4.43Å; H168-R310 HydrophobicContact CB-CG 3.94Å; H168-R310 WeakPolarHBondContact O-CA 3.38Å; H168-R311 PolarHBondContact O-N 3.29Å; H168-N334 PolarHBondContact N-OD1 2.91Å
169	G	91.8	Very high	86.4	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.3	-173.1	0	0	0	0	0	113.1	R311 V333 N334	G169-R311 CarbonylContact C-O 3.6Å; G169-R311 VanDerWaalsContact CA-O 3.23Å; G169-R311 WeakPolarHBondContact CA-O 3.32Å; G169-V333 WeakPolarHBondContact CA-O 3.31Å; G169-N334 WeakPolarHBondContact CA-OD1 3.48Å; G169-N334 PolarHBondContact N-OD1 3.01Å; G169-N334 PolarHBondContact O-ND2 3.44Å
170	C	93.2	Very high	86.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.5	175.9	179	0	0	0	0	111.9	C158 R311 V312 L313	C158-C170 HydrophobicContact CB-CB 3.63Å; C170-R311 PolarHBondContact N-O 3.42Å; C170-V312 HydrophobicContact CB-CG1 4.29Å; C170-V312 HydrophobicContact CB-CG2 4.24Å; C170-V312 CarbonylContact O-C 3.57Å; C170-V312 VanDerWaalsContact O-CA 3.25Å; C170-V312 WeakPolarHBondContact O-CA 3.46Å; C170-L313 PolarHBondContact O-N 2.77Å
171	I	91.9	Very high	86.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.3	167.8	-62.6	167.9	0	0	0	108.1	A173 L313 L329 V330 V333 C382 I383 I384	I171-A173 HydrophobicContact CG2-CB 4.46Å; I171-L313 CarbonylContact C-O 3.53Å; I171-L313 WeakPolarHBondContact CA-O 3.3Å; I171-L313 HydrophobicContact CG1-CB 4.26Å; I171-L313 HydrophobicContact CG2-CD2 4.34Å; I171-L329 HydrophobicContact CD1-CB 4.47Å; I171-V330 HydrophobicContact CD1-CG2 4.07Å; I171-V333 HydrophobicContact CD1-CG2 4.3Å; I171-V333 HydrophobicContact CG1-CB 4.29Å; I171-V333 HydrophobicContact CG1-CG1 4.24Å; I171-V333 HydrophobicContact CG1-CG2 3.76Å; I171-C382 PolarHBondContact N-O 2.73Å; I171-I383 HydrophobicContact CB-CB 4.47Å; I171-I383 HydrophobicContact CB-CG1 3.85Å; I171-I383 HydrophobicContact CD1-CD1 4.01Å; I171-I383 HydrophobicContact CD1-CG1 3.85Å; I171-I383 HydrophobicContact CG1-CG1 4.37Å; I171-I383 HydrophobicContact CG2-CD1 4.36Å; I171-I383 HydrophobicContact CG2-CG1 4.09Å; I171-I383 HydrophobicContact CG2-CG2 4.32Å; I171-I383 WeakPolarHBondContact O-CA 3.37Å; I171-I384 PolarHBondContact O-N 2.83Å
172	M	91.4	Very high	86.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	101.8	171.9	-178	176	-79.5	0	0	108.8	M155 D174 K180 Q183 L313 L314 S315 I384	M155-M172 HydrophobicContact CE-CE 3.47Å; M155-M172 VanDerWaalsContact CE-CE 3.47Å; M155-M172 HydrophobicContact CG-CE 3.65Å; M155-M172 HydrophobicContact SD-CE 3.26Å; M155-M172 WeakPolarHBondContact SD-CE 3.28Å; M155-M172 HydrophobicContact SD-SD 4.36Å; M172-D174 HydrophobicContact CG-CB 4.16Å; M172-K180 HydrophobicContact CG-CD 4.14Å; M172-K180 HydrophobicContact CG-CG 4.24Å; M172-K180 HydrophobicContact SD-CB 3.93Å; M172-K180 HydrophobicContact SD-CD 4.16Å; M172-K180 HydrophobicContact SD-CG 3.72Å; M172-Q183 HydrophobicContact CE-CB 4.21Å; M172-Q183 VanDerWaalsContact CE-OE1 3.22Å; M172-L313 PolarHBondContact N-O 2.99Å; M172-L314 HydrophobicContact CB-CD2 3.75Å; M172-L314 HydrophobicContact CG-CD2 4.39Å; M172-L314 WeakPolarHBondContact O-CA 3.13Å; M172-L314 HydrophobicContact SD-CD2 4.07Å; M172-S315 PolarHBondContact O-N 2.65Å; M172-I384 HydrophobicContact CB-CG2 4.35Å; M172-I384 HydrophobicContact CG-CG2 4.3Å
173	A	87.3	Confident	86.7	Confident	6 Å²	6	28.7 Å²	28.7	5%	0.05	17%	0.167	C	C	.	.			trans	-101.2	22	179.6	0	0	0	0	0	112.6	I171 E175 S315 I383 I384 R385	I171-A173 HydrophobicContact CG2-CB 4.46Å; A173-E175 PolarHBondContact O-N 2.98Å; A173-S315 CarbonylContact C-O 3.5Å; A173-S315 WeakPolarHBondContact CA-O 3.37Å; A173-I383 HydrophobicContact CB-CG2 4.14Å; A173-I384 PolarHBondContact N-O 3.42Å; A173-R385 HydrophobicContact CB-CB 4.19Å; A173-R385 HydrophobicContact CB-CG 4.45Å
174	D	86.2	Confident	87.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-49.5	136.6	172.1	-85.5	1.6	0	0	0	111.9	M172 L178 K180 Q183 R386	M172-D174 HydrophobicContact CG-CB 4.16Å; D174-L178 HydrophobicContact CB-CB 4.35Å; D174-L178 HydrophobicContact CB-CD1 3.85Å; D174-K180 HydrophobicContact CB-CD 3.99Å; D174-K180 HydrophobicContact CB-CG 3.86Å; D174-K180 PolarHBondContact O-NZ 3.4Å; D174-Q183 PolarHBondContact OD2-NE2 3.47Å; D174-R386 VanDerWaalsContact CG-NH2 3.3Å; D174-R386 IonicContact OD1-CZ 2.87Å; D174-R386 PolarHBondContact OD1-N 3.35Å; D174-R386 IonicContact OD1-NE 3.7Å; D174-R386 PolarHBondContact OD1-NE 3Å; D174-R386 IonicContact OD1-NH2 3.39Å; D174-R386 PolarHBondContact OD1-NH2 3.47Å; D174-R386 IonicContact OD2-CZ 3.09Å; D174-R386 IonicContact OD2-NE 3.24Å; D174-R386 PolarHBondContact OD2-NE 3.04Å; D174-R386 IonicContact OD2-NH2 3.42Å; D174-R386 PolarHBondContact OD2-NH2 3.38Å
175	E	77.5	Confident	87.7	Confident	32 Å²	32	24.2 Å²	24.2	15%	0.15	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-57.9	158.3	172.8	-73.3	-174.9	-179.8	0	0	112.6	A173 G177 L178 K180 R386 T387 Q388	A173-E175 PolarHBondContact O-N 2.98Å; E175-G177 PolarHBondContact O-N 3.38Å; E175-L178 HydrophobicContact CB-CD1 4.41Å; E175-K180 PolarHBondContact O-NZ 2.88Å; E175-R386 PolarHBondContact N-O 3.09Å; E175-T387 WeakPolarHBondContact OE2-CA 3.37Å; E175-Q388 HydrophobicContact CB-CG 3.93Å; E175-Q388 WeakPolarHBondContact OE2-CB 3.27Å; E175-Q388 VanDerWaalsContact OE2-CG 3.27Å; E175-Q388 WeakPolarHBondContact OE2-CG 3.3Å; E175-Q388 PolarHBondContact OE2-N 3.16Å
176	M	77.2	Confident	88.2	Confident	19 Å²	19	19.7 Å²	19.7	9%	0.094	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	133.6	-177.7	-56.6	-163.4	65.6	0	0	110.8	Q388 Q606 A609	M176-Q388 PolarHBondContact O-NE2 2.93Å; M176-Q606 HydrophobicContact CE-CB 4.45Å; M176-Q606 HydrophobicContact CE-CG 3.68Å; M176-Q606 HydrophobicContact SD-CB 3.58Å; M176-Q606 VanDerWaalsContact SD-CB 3.58Å; M176-Q606 HydrophobicContact SD-CG 3.45Å; M176-Q606 WeakPolarHBondContact SD-CG 3.48Å; M176-A609 HydrophobicContact CB-CB 4.22Å
177	G	74.2	Confident	88.7	Confident	30 Å²	30	12.4 Å²	12.4	31%	0.309	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	104	-15.5	179.7	0	0	0	0	0	115.3	E175 G179	E175-G177 PolarHBondContact O-N 3.38Å; G177-G179 PolarHBondContact O-N 3.42Å; G177-G179 VanDerWaalsContact O-N 3.08Å
178	L	81.2	Confident	89.1	Confident	1 Å²	1	10.8 Å²	10.8	1%	0.005	7%	0.069	C	C	.	.	S	Bend	trans	-71.3	-1.5	-179.1	-69.5	172.7	0	0	0	115.3	H147 Q148 D174 E175 R386 L390 L391	H147-L178 PolarHBondContact NE2-O 3.33Å; Q148-L178 PolarHBondContact NE2-O 2.94Å; D174-L178 HydrophobicContact CB-CB 4.35Å; D174-L178 HydrophobicContact CB-CD1 3.85Å; E175-L178 HydrophobicContact CB-CD1 4.41Å; L178-R386 HydrophobicContact CD1-CB 3.9Å; L178-R386 VanDerWaalsContact CD1-O 3.27Å; L178-R386 WeakPolarHBondContact CD1-O 3.28Å; L178-L390 HydrophobicContact CD2-CB 4.29Å; L178-L391 HydrophobicContact CD2-CD1 4.07Å; L178-L391 HydrophobicContact CD2-CD2 3.85Å; L178-L391 HydrophobicContact CD2-CG 3.66Å
179	G	83.5	Confident	89.2	Confident	26 Å²	26	8.9 Å²	8.9	27%	0.268	6%	0.06	S	C	.	.			trans	82.6	37.3	177.6	0	0	0	0	0	114.5	G177 T181 L182 Q183	G177-G179 PolarHBondContact O-N 3.42Å; G177-G179 VanDerWaalsContact O-N 3.08Å; G179-T181 VanDerWaalsContact C-N 3.25Å; G179-T181 PolarHBondContact O-N 3.22Å; G179-L182 PolarHBondContact O-N 2.91Å; G179-L182 VanDerWaalsContact O-N 3.12Å; G179-Q183 PolarHBondContact O-N 3.38Å
180	K	89.2	Confident	89.4	Confident	21 Å²	21	8.8 Å²	8.8	9%	0.091	6%	0.059	C	C	.	.	H	α-helix	trans	-48.3	-45.2	176.8	-66.8	-169.7	-81.1	-81.6	0	113	M172 D174 E175 L182 Q183 C184	M172-K180 HydrophobicContact CG-CD 4.14Å; M172-K180 HydrophobicContact CG-CG 4.24Å; M172-K180 HydrophobicContact SD-CB 3.93Å; M172-K180 HydrophobicContact SD-CD 4.16Å; M172-K180 HydrophobicContact SD-CG 3.72Å; D174-K180 HydrophobicContact CB-CD 3.99Å; D174-K180 HydrophobicContact CB-CG 3.86Å; D174-K180 PolarHBondContact O-NZ 3.4Å; E175-K180 PolarHBondContact O-NZ 2.88Å; K180-L182 PolarHBondContact O-N 3.2Å; K180-Q183 WeakPolarHBondContact O-CB 3.35Å; K180-Q183 PolarHBondContact O-N 2.85Å; K180-Q183 VanDerWaalsContact O-N 3.17Å; K180-C184 PolarHBondContact O-N 3.25Å; K180-C184 PolarHBondContact O-SG 3.46Å
181	T	90.9	Very high	89.4	Confident	28 Å²	28	8.8 Å²	8.8	17%	0.172	6%	0.059	C	C	.	.	H	α-helix	trans	-56.6	-45.8	179.4	-52.1	0	0	0	0	112.5	G179 C184 I185 W217 E220	G179-T181 VanDerWaalsContact C-N 3.25Å; G179-T181 PolarHBondContact O-N 3.22Å; T181-C184 PolarHBondContact O-N 3.25Å; T181-I185 HydrophobicContact CG2-CD1 3.95Å; T181-I185 VanDerWaalsContact O-CG1 3.27Å; T181-I185 WeakPolarHBondContact O-CG1 3.34Å; T181-I185 PolarHBondContact O-N 3.18Å; T181-W217 HydrophobicContact CG2-CD2 3.99Å; T181-W217 HydrophobicContact CG2-CE3 3.71Å; T181-W217 HydrophobicContact CG2-CH2 3.93Å; T181-W217 HydrophobicContact CG2-CZ2 4.17Å; T181-W217 HydrophobicContact CG2-CZ3 3.69Å; T181-E220 HydrophobicContact CG2-CB 3.97Å; T181-E220 HydrophobicContact CG2-CG 4.07Å
182	L	92.4	Very high	89.5	Confident	9 Å²	9	9.5 Å²	9.5	5%	0.047	6%	0.062	C	C	.	.	H	α-helix	trans	-64.5	-42	177.8	174.6	59	0	0	0	111.6	I143 L144 G179 K180 C184 I185 T186 W224	I143-L182 HydrophobicContact CG2-CD2 4.35Å; L144-L182 HydrophobicContact CD2-CD1 4.43Å; L144-L182 HydrophobicContact CD2-CD2 3.83Å; L144-L182 HydrophobicContact CD2-CG 3.72Å; G179-L182 PolarHBondContact O-N 2.91Å; G179-L182 VanDerWaalsContact O-N 3.12Å; K180-L182 PolarHBondContact O-N 3.2Å; L182-C184 VanDerWaalsContact C-N 3.32Å; L182-C184 PolarHBondContact O-N 3.38Å; L182-I185 PolarHBondContact O-N 2.98Å; L182-T186 WeakPolarHBondContact O-CB 3.39Å; L182-T186 PolarHBondContact O-N 3.38Å; L182-T186 PolarHBondContact O-OG1 3.41Å; L182-W224 HydrophobicContact CD1-CB 4.4Å; L182-W224 HydrophobicContact CD1-CD2 3.71Å; L182-W224 HydrophobicContact CD1-CE3 4.29Å; L182-W224 HydrophobicContact CD1-CG 3.75Å; L182-W224 HydrophobicContact CD1-CZ2 4.43Å; L182-W224 HydrophobicContact CD2-CH2 4.41Å; L182-W224 HydrophobicContact CD2-CZ2 4.17Å
183	Q	94.5	Very high	89.4	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.5	-44.8	175.3	-61	178.2	54.2	0	0	110.6	Q148 V152 M155 M172 D174 G179 K180 T186 L187	Q148-Q183 HydrophobicContact CB-CG 3.88Å; Q148-Q183 HydrophobicContact CG-CG 4.1Å; V152-Q183 HydrophobicContact CG2-CB 3.93Å; V152-Q183 HydrophobicContact CG2-CG 4.29Å; M155-Q183 HydrophobicContact CE-CB 3.66Å; M155-Q183 WeakPolarHBondContact CE-O 3.39Å; M172-Q183 HydrophobicContact CE-CB 4.21Å; M172-Q183 VanDerWaalsContact CE-OE1 3.22Å; D174-Q183 PolarHBondContact OD2-NE2 3.47Å; G179-Q183 PolarHBondContact O-N 3.38Å; K180-Q183 WeakPolarHBondContact O-CB 3.35Å; K180-Q183 PolarHBondContact O-N 2.85Å; K180-Q183 VanDerWaalsContact O-N 3.17Å; Q183-T186 WeakPolarHBondContact O-CB 3.34Å; Q183-T186 PolarHBondContact O-N 3.09Å; Q183-L187 PolarHBondContact O-N 3.06Å
184	C	95.3	Very high	89.6	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.1	-40.1	178.3	-65	0	0	0	0	113.8	K180 T181 L182 T186 L187 I188 W217 L285 L314	K180-C184 PolarHBondContact O-N 3.25Å; K180-C184 PolarHBondContact O-SG 3.46Å; T181-C184 PolarHBondContact O-N 3.25Å; L182-C184 VanDerWaalsContact C-N 3.32Å; L182-C184 PolarHBondContact O-N 3.38Å; C184-T186 VanDerWaalsContact C-N 3.28Å; C184-T186 PolarHBondContact O-N 3Å; C184-L187 WeakPolarHBondContact O-CB 3.47Å; C184-L187 PolarHBondContact O-N 2.91Å; C184-I188 WeakPolarHBondContact O-CG1 3.42Å; C184-I188 PolarHBondContact O-N 3.46Å; C184-W217 HydrophobicContact CB-CH2 3.73Å; C184-W217 HydrophobicContact CB-CZ3 4.16Å; C184-L285 HydrophobicContact CB-CD1 3.73Å; C184-L314 WeakPolarHBondContact SG-CD1 3.48Å; C184-L314 WeakPolarHBondContact SG-CD2 3.49Å
185	I	95.2	Very high	89.7	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-42.4	174.7	-70.3	169.3	0	0	0	109.8	T181 L182 I188 W189 W217 E220 F221 L225	T181-I185 HydrophobicContact CG2-CD1 3.95Å; T181-I185 VanDerWaalsContact O-CG1 3.27Å; T181-I185 WeakPolarHBondContact O-CG1 3.34Å; T181-I185 PolarHBondContact O-N 3.18Å; L182-I185 PolarHBondContact O-N 2.98Å; I185-I188 PolarHBondContact O-N 3.21Å; I185-W189 VanDerWaalsContact O-CB 3.3Å; I185-W189 WeakPolarHBondContact O-CB 3.34Å; I185-W189 PolarHBondContact O-N 3.35Å; I185-W217 HydrophobicContact CG1-CZ3 4.19Å; I185-E220 HydrophobicContact CD1-CB 3.79Å; I185-F221 HydrophobicContact CB-CE1 4.24Å; I185-F221 HydrophobicContact CD1-CD1 4.39Å; I185-F221 HydrophobicContact CD1-CE1 4.49Å; I185-F221 HydrophobicContact CD1-CG 4.44Å; I185-F221 HydrophobicContact CG1-CD1 4.06Å; I185-F221 HydrophobicContact CG1-CE1 3.71Å; I185-F221 HydrophobicContact CG1-CE2 4.28Å; I185-F221 HydrophobicContact CG1-CG 4.49Å; I185-F221 HydrophobicContact CG1-CZ 3.81Å; I185-F221 HydrophobicContact CG2-CD1 4.06Å; I185-F221 HydrophobicContact CG2-CE1 3.98Å; I185-L225 HydrophobicContact CG2-CD1 4.28Å; I185-L225 HydrophobicContact CG2-CD2 4.38Å; I185-L225 HydrophobicContact CG2-CG 4.17Å
186	T	95.4	Very high	90.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61	-44.7	176.4	-53.4	0	0	0	0	111.5	V136 L140 L144 V152 L182 Q183 C184 T190	V136-T186 HydrophobicContact CB-CG2 4.44Å; V136-T186 HydrophobicContact CG1-CG2 3.37Å; V136-T186 HydrophobicContact CG2-CG2 4.17Å; L140-T186 HydrophobicContact CB-CG2 4.31Å; L140-T186 HydrophobicContact CD1-CG2 4.11Å; L144-T186 HydrophobicContact CD1-CG2 3.96Å; V152-T186 HydrophobicContact CG1-CG2 3.88Å; V152-T186 HydrophobicContact CG2-CG2 4.06Å; L182-T186 WeakPolarHBondContact O-CB 3.39Å; L182-T186 PolarHBondContact O-N 3.38Å; L182-T186 PolarHBondContact O-OG1 3.41Å; Q183-T186 WeakPolarHBondContact O-CB 3.34Å; Q183-T186 PolarHBondContact O-N 3.09Å; C184-T186 VanDerWaalsContact C-N 3.28Å; C184-T186 PolarHBondContact O-N 3Å; T186-T190 WeakPolarHBondContact O-CB 3.36Å; T186-T190 PolarHBondContact O-N 3.44Å; T186-T190 PolarHBondContact O-OG1 2.64Å
187	L	95.7	Very high	90.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-52.8	175.1	-177.2	72.1	0	0	0	111.6	M155 Y156 V159 Q183 C184 W189 T190 L191 V312	M155-L187 HydrophobicContact CB-CD1 4.07Å; M155-L187 HydrophobicContact CB-CD2 3.91Å; M155-L187 HydrophobicContact CE-CB 4.16Å; M155-L187 HydrophobicContact CE-CD2 4.41Å; M155-L187 HydrophobicContact CG-CD2 4.49Å; M155-L187 HydrophobicContact SD-CD2 3.94Å; Y156-L187 HydrophobicContact CD2-CD1 4.39Å; V159-L187 HydrophobicContact CG1-CD2 4.42Å; V159-L187 HydrophobicContact CG2-CD1 4.12Å; Q183-L187 PolarHBondContact O-N 3.06Å; C184-L187 WeakPolarHBondContact O-CB 3.47Å; C184-L187 PolarHBondContact O-N 2.91Å; L187-W189 VanDerWaalsContact C-N 3.33Å; L187-W189 PolarHBondContact O-N 3.11Å; L187-T190 PolarHBondContact O-N 2.81Å; L187-L191 HydrophobicContact CD1-CD1 4.15Å; L187-L191 HydrophobicContact CD1-CG 4.38Å; L187-L191 HydrophobicContact CD2-CD1 4.47Å; L187-L191 HydrophobicContact CG-CD1 3.9Å; L187-L191 HydrophobicContact CG-CG 4.43Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.44Å; L187-L191 PolarHBondContact O-N 3.24Å; L187-V312 HydrophobicContact CD2-CG2 4.16Å
188	I	95.4	Very high	90.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.6	-48	-179.8	-71.3	165.5	0	0	0	110.7	C184 I185 T190 L191 L192 A205 I207 F221 I261 L283 L285	C184-I188 WeakPolarHBondContact O-CG1 3.42Å; C184-I188 PolarHBondContact O-N 3.46Å; I185-I188 PolarHBondContact O-N 3.21Å; I188-T190 VanDerWaalsContact C-N 3.31Å; I188-T190 PolarHBondContact O-N 2.89Å; I188-L191 PolarHBondContact O-N 2.59Å; I188-L192 HydrophobicContact CG2-CD1 3.5Å; I188-L192 HydrophobicContact CG2-CG 4.09Å; I188-L192 WeakPolarHBondContact O-CB 3.27Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.34Å; I188-A205 HydrophobicContact CG1-CB 4.38Å; I188-A205 HydrophobicContact CG2-CB 4.12Å; I188-I207 HydrophobicContact CD1-CD1 3.65Å; I188-I207 HydrophobicContact CD1-CG1 4.1Å; I188-F221 HydrophobicContact CD1-CZ 3.94Å; I188-I261 HydrophobicContact CG2-CD1 3.67Å; I188-I261 HydrophobicContact CG2-CG1 4.1Å; I188-L283 HydrophobicContact CG1-CD2 3.78Å; I188-L285 HydrophobicContact CD1-CD1 3.34Å; I188-L285 HydrophobicContact CD1-CG 4.18Å; I188-L285 HydrophobicContact CG1-CD1 3.98Å
189	W	94.8	Very high	91.1	Very high	12 Å²	12	26 Å²	26	5%	0.045	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-42.8	-179.6	179.7	-116	0	0	0	111.6	D137 L140 I185 L187 L192 R193 L225 K228 I229	D137-W189 PolarHBondContact OD2-NE1 3.15Å; L140-W189 HydrophobicContact CD1-CB 4.27Å; L140-W189 HydrophobicContact CD1-CG 4.26Å; I185-W189 VanDerWaalsContact O-CB 3.3Å; I185-W189 WeakPolarHBondContact O-CB 3.34Å; I185-W189 PolarHBondContact O-N 3.35Å; L187-W189 VanDerWaalsContact C-N 3.33Å; L187-W189 PolarHBondContact O-N 3.11Å; W189-L192 PolarHBondContact O-N 3.43Å; W189-R193 HydrophobicContact CD2-CG 4.04Å; W189-R193 HydrophobicContact CE3-CG 4.01Å; W189-R193 HydrophobicContact CH2-CG 4.05Å; W189-R193 HydrophobicContact CZ2-CG 4.02Å; W189-R193 HydrophobicContact CZ3-CG 4Å; W189-R193 WeakPolarHBondContact O-CB 3.44Å; W189-R193 WeakPolarHBondContact O-CG 3.23Å; W189-R193 PolarHBondContact O-N 3.31Å; W189-L225 HydrophobicContact CB-CD2 4.3Å; W189-L225 HydrophobicContact CD2-CD1 4.42Å; W189-L225 HydrophobicContact CD2-CD2 3.98Å; W189-L225 HydrophobicContact CE3-CD1 4.06Å; W189-L225 HydrophobicContact CE3-CD2 4.38Å; W189-L225 HydrophobicContact CG-CD2 3.95Å; W189-K228 HydrophobicContact CH2-CB 3.97Å; W189-K228 HydrophobicContact CH2-CD 3.94Å; W189-K228 HydrophobicContact CZ2-CD 3.83Å; W189-K228 HydrophobicContact CZ3-CB 4.44Å; W189-I229 HydrophobicContact CE3-CD1 3.38Å; W189-I229 HydrophobicContact CE3-CG1 4.05Å; W189-I229 HydrophobicContact CZ3-CD1 3.3Å; W189-I229 HydrophobicContact CZ3-CG1 3.51Å
190	T	94.1	Very high	91.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-46	178.2	-53	0	0	0	0	111.1	L111 V134 T186 L187 I188 L192 R193 Q194	L111-T190 HydrophobicContact CD1-CG2 3.81Å; V134-T190 HydrophobicContact CG1-CG2 3.49Å; V134-T190 VanDerWaalsContact CG1-CG2 3.49Å; T186-T190 WeakPolarHBondContact O-CB 3.36Å; T186-T190 PolarHBondContact O-N 3.44Å; T186-T190 PolarHBondContact O-OG1 2.64Å; L187-T190 PolarHBondContact O-N 2.81Å; I188-T190 VanDerWaalsContact C-N 3.31Å; I188-T190 PolarHBondContact O-N 2.89Å; T190-L192 PolarHBondContact O-N 2.87Å; T190-R193 PolarHBondContact O-N 3.1Å; T190-Q194 HydrophobicContact CG2-CB 4.44Å; T190-Q194 WeakPolarHBondContact O-CA 3.46Å; T190-Q194 WeakPolarHBondContact O-CB 3.37Å; T190-Q194 PolarHBondContact O-N 2.91Å
191	L	94.5	Very high	91.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68	-33.1	179.5	-64	173	0	0	0	113.5	Y156 V159 L187 I188 R193 I201 I202 L283	Y156-L191 HydrophobicContact CD2-CD2 4.18Å; Y156-L191 HydrophobicContact CE2-CD2 4Å; V159-L191 HydrophobicContact CG2-CD1 4.07Å; V159-L191 HydrophobicContact CG2-CD2 4.29Å; L187-L191 HydrophobicContact CD1-CD1 4.15Å; L187-L191 HydrophobicContact CD1-CG 4.38Å; L187-L191 HydrophobicContact CD2-CD1 4.47Å; L187-L191 HydrophobicContact CG-CD1 3.9Å; L187-L191 HydrophobicContact CG-CG 4.43Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.44Å; L187-L191 PolarHBondContact O-N 3.24Å; I188-L191 PolarHBondContact O-N 2.59Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-I201 HydrophobicContact CD2-CB 3.98Å; L191-I201 HydrophobicContact CD2-CD1 3.51Å; L191-I201 HydrophobicContact CD2-CG1 4.33Å; L191-I201 HydrophobicContact CD2-CG2 4.06Å; L191-I201 PolarHBondContact O-N 3.29Å; L191-I202 HydrophobicContact CB-CD1 3.64Å; L191-I202 HydrophobicContact CB-CG1 3.71Å; L191-I202 HydrophobicContact CD1-CD1 4.14Å; L191-I202 PolarHBondContact O-N 2.9Å; L191-L283 HydrophobicContact CD1-CD2 3.93Å
192	L	92.7	Very high	91.6	Very high	15 Å²	15	27.5 Å²	27.5	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-73.8	-19	177.5	-78	173.9	0	0	0	113.5	I188 W189 T190 P200 I202 D203 I229 P260 I261	I188-L192 HydrophobicContact CG2-CD1 3.5Å; I188-L192 HydrophobicContact CG2-CG 4.09Å; I188-L192 WeakPolarHBondContact O-CB 3.27Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.34Å; W189-L192 PolarHBondContact O-N 3.43Å; T190-L192 PolarHBondContact O-N 2.87Å; L192-P200 WeakPolarHBondContact O-CB 3.43Å; L192-P200 WeakPolarHBondContact O-CG 3.26Å; L192-I202 HydrophobicContact CD2-CD1 4.4Å; L192-I202 HydrophobicContact CD2-CG1 3.91Å; L192-I202 HydrophobicContact CG-CD1 4.35Å; L192-I202 HydrophobicContact CG-CG1 4.15Å; L192-D203 WeakPolarHBondContact CD2-O 3.5Å; L192-I229 HydrophobicContact CD1-CD1 3.91Å; L192-P260 HydrophobicContact CD1-CB 4.22Å; L192-P260 HydrophobicContact CD1-CG 4.08Å; L192-P260 HydrophobicContact CD2-CB 3.82Å; L192-P260 HydrophobicContact CD2-CG 4.46Å; L192-I261 HydrophobicContact CD1-CD1 4.02Å; L192-I261 HydrophobicContact CD1-CG1 3.89Å
193	R	90.5	Very high	91.5	Very high	119 Å²	119	32.1 Å²	32.1	45%	0.449	17%	0.169	S	C	.	.	H	α-helix	trans	-116.1	-29.8	-174	-65.1	-60.3	-172.1	-177.5	-0.8	113.6	L100 W189 T190 L191	L100-R193 HydrophobicContact CD2-CB 3.92Å; W189-R193 HydrophobicContact CD2-CG 4.04Å; W189-R193 HydrophobicContact CE3-CG 4.01Å; W189-R193 HydrophobicContact CH2-CG 4.05Å; W189-R193 HydrophobicContact CZ2-CG 4.02Å; W189-R193 HydrophobicContact CZ3-CG 4Å; W189-R193 WeakPolarHBondContact O-CB 3.44Å; W189-R193 WeakPolarHBondContact O-CG 3.23Å; W189-R193 PolarHBondContact O-N 3.31Å; T190-R193 PolarHBondContact O-N 3.1Å; L191-R193 VanDerWaalsContact C-N 3.31Å
194	Q	90.8	Very high	91.5	Very high	8 Å²	8	33 Å²	33	4%	0.037	17%	0.172	C	C	.	.			trans	-134	161.3	-168.3	-62.6	179.6	63.5	0	0	111.8	L100 H101 V134 V135 T190 K199 I201	L100-Q194 HydrophobicContact CB-CG 3.76Å; L100-Q194 HydrophobicContact CD2-CG 3.67Å; L100-Q194 HydrophobicContact CG-CG 4.38Å; H101-Q194 PolarHBondContact CD2-NE2 3.45Å; V134-Q194 HydrophobicContact CG1-CB 3.99Å; V135-Q194 VanDerWaalsContact O-CD 3.29Å; V135-Q194 PolarHBondContact O-NE2 3.12Å; V135-Q194 PolarHBondContact O-OE1 2.99Å; V135-Q194 VanDerWaalsContact O-OE1 3.05Å; T190-Q194 HydrophobicContact CG2-CB 4.44Å; T190-Q194 WeakPolarHBondContact O-CA 3.46Å; T190-Q194 WeakPolarHBondContact O-CB 3.37Å; T190-Q194 PolarHBondContact O-N 2.91Å; Q194-K199 CarbonylContact C-O 3.59Å; Q194-K199 VanDerWaalsContact C-O 3.26Å; Q194-I201 PolarHBondContact O-N 2.98Å
195	G	88.8	Confident	91.4	Very high	4 Å²	4	33 Å²	33	4%	0.041	17%	0.172	C	C	.	.			trans	-172.6	161.3	173.9	0	0	0	0	0	109.4	E197 G198 K199	G195-E197 PolarHBondContact O-N 2.89Å; G195-E197 VanDerWaalsContact O-N 3.07Å; G195-G198 PolarHBondContact O-N 3.39Å; G195-K199 VanDerWaalsContact CA-O 3.24Å; G195-K199 WeakPolarHBondContact CA-O 3.27Å; G195-K199 PolarHBondContact N-O 2.92Å
196	P	87.2	Confident	91.4	Very high	33 Å²	33	33 Å²	33	21%	0.214	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-29.3	-179.6	-28.7	36.4	0	0	0	113.3	Y112 L131 V132 V134 G198	Y112-P196 HydrophobicContact CD1-CB 4Å; Y112-P196 HydrophobicContact CD1-CG 4.03Å; Y112-P196 HydrophobicContact CD2-CG 4.45Å; Y112-P196 HydrophobicContact CE1-CB 3.73Å; Y112-P196 HydrophobicContact CE1-CG 4.15Å; Y112-P196 HydrophobicContact CG-CG 4.19Å; L131-P196 CarbonylContact C-O 3.55Å; L131-P196 VanDerWaalsContact CA-O 3.29Å; L131-P196 WeakPolarHBondContact CA-O 3.48Å; L131-P196 HydrophobicContact CD2-CB 4.07Å; V132-P196 PolarHBondContact N-O 2.71Å; V134-P196 HydrophobicContact CG2-CG 4.39Å; P196-G198 VanDerWaalsContact C-N 3.27Å; P196-G198 PolarHBondContact O-N 3.3Å
197	E	84.7	Confident	91.4	Very high	109 Å²	109	33 Å²	33	51%	0.509	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	9.4	176.5	-62.4	-172.2	-172	0	0	114.4	R97 L131 G195 K199	R97-E197 WeakPolarHBondContact CD-O 3.4Å; R97-E197 PolarHBondContact NE-O 3.42Å; R97-E197 VanDerWaalsContact NE-O 3.12Å; R97-E197 PolarHBondContact NH1-O 3.42Å; L131-E197 HydrophobicContact CD2-CG 4.37Å; G195-E197 PolarHBondContact O-N 2.89Å; G195-E197 VanDerWaalsContact O-N 3.07Å; E197-K199 PolarHBondContact O-N 3.19Å
198	G	81.1	Confident	91.4	Very high	44 Å²	44	33 Å²	33	45%	0.454	17%	0.172	S	C	.	.	S	Bend	trans	65.7	22.8	-174.9	0	0	0	0	0	113.7	G195 P196	G195-G198 PolarHBondContact O-N 3.39Å; P196-G198 VanDerWaalsContact C-N 3.27Å; P196-G198 PolarHBondContact O-N 3.3Å
199	K	86.2	Confident	91.1	Very high	117 Å²	117	33 Å²	33	51%	0.509	17%	0.172	S	C	.	.	S	Bend	trans	-130	155.4	175.5	-64.5	178.1	-173.2	169.2	0	109.5	Q194 G195 E197 I201	Q194-K199 CarbonylContact C-O 3.59Å; Q194-K199 VanDerWaalsContact C-O 3.26Å; G195-K199 VanDerWaalsContact CA-O 3.24Å; G195-K199 WeakPolarHBondContact CA-O 3.27Å; G195-K199 PolarHBondContact N-O 2.92Å; E197-K199 PolarHBondContact O-N 3.19Å; K199-I201 PolarHBondContact O-N 3.28Å
200	P	90.5	Very high	90.7	Very high	65 Å²	65	32.6 Å²	32.6	42%	0.422	17%	0.171	S	C	.	.			trans	-53.9	137	170.7	-25.8	35.9	0	0	0	111.9	L192	L192-P200 WeakPolarHBondContact O-CB 3.43Å; L192-P200 WeakPolarHBondContact O-CG 3.26Å
201	I	91.4	Very high	90.1	Very high	39 Å²	39	34.2 Å²	34.2	20%	0.2	18%	0.183	C	C	.	.	S	Bend	trans	-75.6	-32.6	173.8	-67.9	163.3	0	0	0	110.7	Y156 T160 L191 Q194 K199	Y156-I201 HydrophobicContact CE2-CD1 4.04Å; T160-I201 HydrophobicContact CG2-CD1 4.18Å; L191-I201 HydrophobicContact CD2-CB 3.98Å; L191-I201 HydrophobicContact CD2-CD1 3.51Å; L191-I201 HydrophobicContact CD2-CG1 4.33Å; L191-I201 HydrophobicContact CD2-CG2 4.06Å; L191-I201 PolarHBondContact O-N 3.29Å; Q194-I201 PolarHBondContact O-N 2.98Å; K199-I201 PolarHBondContact O-N 3.28Å
202	I	92.7	Very high	89.1	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	20%	0.195	C	C	.	.			trans	-131.1	148.1	178.5	70.1	-178	0	0	0	110.3	L191 L192 A205 L283	L191-I202 HydrophobicContact CB-CD1 3.64Å; L191-I202 HydrophobicContact CB-CG1 3.71Å; L191-I202 HydrophobicContact CD1-CD1 4.14Å; L191-I202 PolarHBondContact O-N 2.9Å; L192-I202 HydrophobicContact CD2-CD1 4.4Å; L192-I202 HydrophobicContact CD2-CG1 3.91Å; L192-I202 HydrophobicContact CG-CD1 4.35Å; L192-I202 HydrophobicContact CG-CG1 4.15Å; I202-A205 HydrophobicContact CD1-CB 4.2Å; I202-L283 HydrophobicContact CD1-CB 3.65Å; I202-L283 HydrophobicContact CD1-CD2 3.99Å; I202-L283 HydrophobicContact CG2-CB 4.45Å
203	D	90.9	Very high	88.6	Confident	105 Å²	105	35.6 Å²	35.6	56%	0.561	19%	0.193	S	C	*	.	S	Bend	trans	-94.7	-31.5	172	-67.7	-37.2	0	0	0	112.2	L192 I257 P260	L192-D203 WeakPolarHBondContact CD2-O 3.5Å; D203-I257 HydrophobicContact CB-CD1 3.8Å; D203-P260 WeakPolarHBondContact O-CB 3.48Å
204	K	92.6	Very high	88.3	Confident	18 Å²	18	30.5 Å²	30.5	8%	0.078	18%	0.175	C	C	.	.			trans	-140.9	141.7	-173.7	-61.3	-178.5	-167.3	177.2	0	112.1	F249 L250 Q252 I257 P260 G282 L283	K204-F249 HydrophobicContact CB-CE1 4.49Å; K204-F249 HydrophobicContact CB-CZ 3.93Å; K204-F249 HydrophobicContact CD-CE1 4.13Å; K204-F249 HydrophobicContact CD-CE2 4.44Å; K204-F249 HydrophobicContact CD-CZ 4.03Å; K204-F249 WeakPolarHBondContact CE-O 3.18Å; K204-F249 HydrophobicContact CG-CZ 4.23Å; K204-F249 PolarHBondContact NZ-O 2.93Å; K204-L250 VanDerWaalsContact NZ-C 3.27Å; K204-L250 PolarHBondContact NZ-O 2.75Å; K204-Q252 WeakPolarHBondContact CE-O 3.45Å; K204-Q252 PolarHBondContact NZ-O 3.14Å; K204-I257 HydrophobicContact CG-CD1 4.4Å; K204-P260 CarbonylContact C-O 3.26Å; K204-P260 VanDerWaalsContact CA-O 3.25Å; K204-P260 WeakPolarHBondContact CA-O 3.2Å; K204-G282 PolarHBondContact O-N 3.45Å; K204-L283 PolarHBondContact O-N 3.41Å
205	A	94.6	Very high	87.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.2	174.4	0	0	0	0	0	110.8	I188 I202 P260 I261 L262 L283	I188-A205 HydrophobicContact CG1-CB 4.38Å; I188-A205 HydrophobicContact CG2-CB 4.12Å; I202-A205 HydrophobicContact CD1-CB 4.2Å; A205-P260 PolarHBondContact N-O 3.44Å; A205-I261 WeakPolarHBondContact O-CA 3.42Å; A205-L262 PolarHBondContact O-N 3.28Å; A205-L283 WeakPolarHBondContact CA-O 3.42Å; A205-L283 HydrophobicContact CB-CB 4.31Å; A205-L283 HydrophobicContact CB-CD2 4.47Å
206	V	95.1	Very high	87.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.6	174.1	176	0	0	0	0	109	V208 F249 L262 I264 V281 L283 V284 L285	V206-V208 HydrophobicContact CG1-CG2 3.98Å; V206-F249 HydrophobicContact CG2-CE1 4.1Å; V206-F249 HydrophobicContact CG2-CZ 4.41Å; V206-L262 CarbonylContact C-O 3.59Å; V206-L262 WeakPolarHBondContact CA-O 3.35Å; V206-L262 HydrophobicContact CG1-CD2 4.3Å; V206-L262 HydrophobicContact CG2-CB 4.21Å; V206-L262 HydrophobicContact CG2-CD2 4.09Å; V206-I264 HydrophobicContact CG1-CG2 4.06Å; V206-V281 HydrophobicContact CB-CG1 4.08Å; V206-V281 HydrophobicContact CG2-CB 4.34Å; V206-V281 HydrophobicContact CG2-CG1 3.57Å; V206-V281 HydrophobicContact CG2-CG2 3.83Å; V206-L283 PolarHBondContact N-O 3.24Å; V206-V284 HydrophobicContact CB-CG2 4.45Å; V206-V284 CarbonylContact O-C 3.53Å; V206-V284 WeakPolarHBondContact O-CA 3.5Å; V206-L285 PolarHBondContact O-N 3.39Å
207	I	95.8	Very high	87.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.9	177.3	-55.4	175.8	0	0	0	107.3	I188 W217 F221 I261 L262 I263 I264 L285	I188-I207 HydrophobicContact CD1-CD1 3.65Å; I188-I207 HydrophobicContact CD1-CG1 4.1Å; I207-W217 HydrophobicContact CD1-CE3 3.94Å; I207-W217 HydrophobicContact CD1-CZ3 4.04Å; I207-W217 HydrophobicContact CG2-CD2 4.07Å; I207-W217 HydrophobicContact CG2-CE3 4.29Å; I207-W217 HydrophobicContact CG2-CG 4.49Å; I207-W217 HydrophobicContact CG2-CZ2 4.39Å; I207-F221 HydrophobicContact CD1-CE2 3.44Å; I207-F221 VanDerWaalsContact CD1-CE2 3.44Å; I207-F221 HydrophobicContact CD1-CZ 3.53Å; I207-I261 HydrophobicContact CD1-CG2 3.87Å; I207-I261 HydrophobicContact CG1-CG2 4.39Å; I207-L262 PolarHBondContact N-O 2.96Å; I207-I263 HydrophobicContact CB-CG1 4.42Å; I207-I263 HydrophobicContact CB-CG2 4.47Å; I207-I263 HydrophobicContact CD1-CG1 4.32Å; I207-I263 WeakPolarHBondContact O-CA 3.25Å; I207-I264 PolarHBondContact O-N 2.92Å; I207-L285 WeakPolarHBondContact CA-O 3.42Å; I207-L285 HydrophobicContact CD1-CD1 4.4Å; I207-L285 HydrophobicContact CG1-CB 4.26Å; I207-L285 HydrophobicContact CG1-CD1 4.16Å; I207-L285 HydrophobicContact CG1-CG 4.39Å; I207-L285 HydrophobicContact CG2-CB 4.42Å
208	V	94.1	Very high	88	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	118.8	177.8	-168.4	0	0	0	0	107.6	V206 I264 Y266 F269 L285 D287 L303	V206-V208 HydrophobicContact CG1-CG2 3.98Å; V208-I264 WeakPolarHBondContact CA-O 3.28Å; V208-I264 HydrophobicContact CG2-CG2 4.1Å; V208-Y266 HydrophobicContact CB-CD1 4.5Å; V208-Y266 HydrophobicContact CB-CE1 4.24Å; V208-Y266 HydrophobicContact CG1-CD1 3.3Å; V208-Y266 HydrophobicContact CG1-CD2 4.33Å; V208-Y266 HydrophobicContact CG1-CE1 3.47Å; V208-Y266 VanDerWaalsContact CG1-CE1 3.47Å; V208-Y266 HydrophobicContact CG1-CE2 4.44Å; V208-Y266 HydrophobicContact CG1-CG 3.8Å; V208-F269 HydrophobicContact CG1-CB 4.36Å; V208-F269 HydrophobicContact CG2-CD2 4.22Å; V208-L285 PolarHBondContact N-O 2.91Å; V208-D287 PolarHBondContact O-N 3.43Å; V208-L303 HydrophobicContact CG2-CD2 3.94Å
209	T	90.9	Very high	88.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	158.9	-170.7	173.7	0	0	0	0	109.9	L213 L214 I263 I264 S265 Y266	T209-L213 WeakPolarHBondContact OG1-CB 3.42Å; T209-L214 HydrophobicContact CG2-CB 4.04Å; T209-L214 HydrophobicContact CG2-CG 4.49Å; T209-I263 HydrophobicContact CG2-CG2 3.69Å; T209-I264 PolarHBondContact N-O 3.08Å; T209-S265 CarbonylContact O-C 3.57Å; T209-S265 WeakPolarHBondContact O-CA 3.47Å; T209-Y266 PolarHBondContact O-N 3.23Å; T209-Y266 VanDerWaalsContact O-N 3.09Å
210	P	85.4	Confident	88.4	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.026	17%	0.168	C	C	.	.			trans	-57.3	144.3	164.2	-24.9	35.4	0	0	0	111.2	S212 L213 L214 Y266 E288	P210-S212 PolarHBondContact O-N 3.07Å; P210-L213 HydrophobicContact CB-CD1 4.46Å; P210-L213 HydrophobicContact CG-CD1 4.05Å; P210-L213 PolarHBondContact O-N 3.02Å; P210-L214 PolarHBondContact O-N 2.98Å; P210-Y266 HydrophobicContact CG-CD2 4.42Å; P210-Y266 HydrophobicContact CG-CE2 4.38Å; P210-E288 HydrophobicContact CG-CB 4.05Å; P210-E288 HydrophobicContact CG-CG 4.05Å
211	S	80.9	Confident	88.4	Confident	35 Å²	35	29.8 Å²	29.8	25%	0.245	15%	0.148	C	C	.	.	H	α-helix	trans	-49.8	-36.4	178.5	-81	0	0	0	0	113.8	L213 L214 D235 S265	S211-L213 VanDerWaalsContact C-N 3.28Å; S211-L213 PolarHBondContact O-N 3.17Å; S211-L214 PolarHBondContact O-N 3.38Å; S211-D235 WeakPolarHBondContact CB-OD1 2.97Å; S211-D235 PolarHBondContact OG-OD1 3.33Å; S211-S265 WeakPolarHBondContact OG-CB 3.35Å; S211-S265 PolarHBondContact OG-OG 3.23Å
212	S	74.7	Confident	88.3	Confident	35 Å²	35	31.5 Å²	31.5	25%	0.245	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-26.7	179.8	60.5	0	0	0	0	114.4	P210 C582	P210-S212 PolarHBondContact O-N 3.07Å; S212-C582 WeakPolarHBondContact CB-SG 3.39Å; S212-C582 VanDerWaalsContact OG-CB 3.28Å; S212-C582 WeakPolarHBondContact OG-CB 3.32Å; S212-C582 PolarHBondContact OG-SG 3.02Å
213	L	81.1	Confident	88.1	Confident	9 Å²	9	36.6 Å²	36.6	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-94.4	-12.7	-176.3	-80.3	172.7	0	0	0	112.8	T209 P210 S211 R215 N216 W217 E288 C582 G583	T209-L213 WeakPolarHBondContact OG1-CB 3.42Å; P210-L213 HydrophobicContact CB-CD1 4.46Å; P210-L213 HydrophobicContact CG-CD1 4.05Å; P210-L213 PolarHBondContact O-N 3.02Å; S211-L213 VanDerWaalsContact C-N 3.28Å; S211-L213 PolarHBondContact O-N 3.17Å; L213-R215 PolarHBondContact O-N 3.44Å; L213-N216 HydrophobicContact CD2-CB 4.44Å; L213-N216 WeakPolarHBondContact O-CA 3.35Å; L213-N216 VanDerWaalsContact O-CB 3.32Å; L213-N216 WeakPolarHBondContact O-CB 3.47Å; L213-N216 PolarHBondContact O-N 3.24Å; L213-W217 PolarHBondContact O-N 2.89Å; L213-E288 HydrophobicContact CD1-CG 4.1Å; L213-C582 VanDerWaalsContact CD2-O 3.25Å; L213-C582 WeakPolarHBondContact CD2-O 3.24Å; L213-G583 VanDerWaalsContact CD2-CA 3.45Å
214	L	85.6	Confident	88.1	Confident	12 Å²	12	33.4 Å²	33.4	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-57.9	-44.6	-175.6	-174.9	145.4	0	0	0	113	T209 P210 S211 N216 W217 Y218 A233 I234 D235 I263	T209-L214 HydrophobicContact CG2-CB 4.04Å; T209-L214 HydrophobicContact CG2-CG 4.49Å; P210-L214 PolarHBondContact O-N 2.98Å; S211-L214 PolarHBondContact O-N 3.38Å; L214-N216 VanDerWaalsContact C-N 3.33Å; L214-W217 PolarHBondContact O-N 3.29Å; L214-Y218 PolarHBondContact O-N 2.92Å; L214-Y218 VanDerWaalsContact O-N 3.09Å; L214-A233 HydrophobicContact CD2-CB 3.54Å; L214-A233 HydrophobicContact CG-CB 4.46Å; L214-I234 WeakPolarHBondContact CD1-O 3.27Å; L214-D235 HydrophobicContact CD1-CB 3.92Å; L214-D235 HydrophobicContact CD2-CB 4.15Å; L214-I263 HydrophobicContact CB-CG2 4.49Å; L214-I263 HydrophobicContact CD1-CG2 4.25Å; L214-I263 HydrophobicContact CG-CB 4.5Å; L214-I263 HydrophobicContact CG-CG2 3.8Å
215	R	81.2	Confident	87.9	Confident	136 Å²	136	32.6 Å²	32.6	51%	0.513	15%	0.154	S	C	.	.	H	α-helix	trans	-70.6	-30.5	177	-169.9	160.5	178.9	101.2	-0.5	112.5	L213 Y218 N219	L213-R215 PolarHBondContact O-N 3.44Å; R215-Y218 PolarHBondContact O-N 3.12Å; R215-N219 WeakPolarHBondContact O-CB 3.33Å; R215-N219 PolarHBondContact O-N 3.42Å; R215-N219 PolarHBondContact O-OD1 3.37Å
216	N	84.5	Confident	87.5	Confident	59 Å²	59	38.5 Å²	38.5	32%	0.316	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-49	174.4	-171.8	63.5	0	0	0	110.6	L213 L214 Y218 N219 E220	L213-N216 HydrophobicContact CD2-CB 4.44Å; L213-N216 WeakPolarHBondContact O-CA 3.35Å; L213-N216 VanDerWaalsContact O-CB 3.32Å; L213-N216 WeakPolarHBondContact O-CB 3.47Å; L213-N216 PolarHBondContact O-N 3.24Å; L214-N216 VanDerWaalsContact C-N 3.33Å; N216-Y218 VanDerWaalsContact C-N 3.33Å; N216-Y218 PolarHBondContact O-N 2.89Å; N216-N219 PolarHBondContact O-N 3.05Å; N216-E220 WeakPolarHBondContact O-CB 3.2Å; N216-E220 VanDerWaalsContact O-CG 3.26Å; N216-E220 WeakPolarHBondContact O-CG 3.44Å; N216-E220 PolarHBondContact O-N 3.49Å
217	W	89.7	Confident	86.8	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-55.6	-46.6	173.7	-85	98.4	0	0	0	112.2	T181 C184 I185 I207 L213 L214 N219 E220 F221 I263 L285 D287 L314	T181-W217 HydrophobicContact CG2-CD2 3.99Å; T181-W217 HydrophobicContact CG2-CE3 3.71Å; T181-W217 HydrophobicContact CG2-CH2 3.93Å; T181-W217 HydrophobicContact CG2-CZ2 4.17Å; T181-W217 HydrophobicContact CG2-CZ3 3.69Å; C184-W217 HydrophobicContact CB-CH2 3.73Å; C184-W217 HydrophobicContact CB-CZ3 4.16Å; I185-W217 HydrophobicContact CG1-CZ3 4.19Å; I207-W217 HydrophobicContact CD1-CE3 3.94Å; I207-W217 HydrophobicContact CD1-CZ3 4.04Å; I207-W217 HydrophobicContact CG2-CD2 4.07Å; I207-W217 HydrophobicContact CG2-CE3 4.29Å; I207-W217 HydrophobicContact CG2-CG 4.49Å; I207-W217 HydrophobicContact CG2-CZ2 4.39Å; L213-W217 PolarHBondContact O-N 2.89Å; L214-W217 PolarHBondContact O-N 3.29Å; W217-N219 PolarHBondContact O-N 3.5Å; W217-E220 PolarHBondContact O-N 2.9Å; W217-F221 AromaticContact CE3-CE2 3.86Å; W217-F221 HydrophobicContact CE3-CE2 3.86Å; W217-F221 HydrophobicContact CE3-CZ 4.46Å; W217-F221 HydrophobicContact CZ3-CE2 4.41Å; W217-F221 WeakPolarHBondContact O-CD2 3.39Å; W217-F221 PolarHBondContact O-N 3.19Å; W217-I263 HydrophobicContact CB-CD1 3.98Å; W217-I263 HydrophobicContact CB-CG2 4.16Å; W217-L285 HydrophobicContact CH2-CD1 4.39Å; W217-D287 HydrophobicContact CZ2-CB 4.25Å; W217-D287 PolarHBondContact NE1-OD2 3.46Å; W217-L314 HydrophobicContact CH2-CD1 4.11Å; W217-L314 HydrophobicContact CZ2-CD1 3.92Å
218	Y	88.2	Confident	86.3	Confident	61 Å²	61	44.6 Å²	44.6	24%	0.239	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-47.2	177.2	-176.9	-87.8	0	0	0	112.4	L214 R215 N216 F221 Q222 P231 A233	L214-Y218 PolarHBondContact O-N 2.92Å; L214-Y218 VanDerWaalsContact O-N 3.09Å; R215-Y218 PolarHBondContact O-N 3.12Å; N216-Y218 VanDerWaalsContact C-N 3.33Å; N216-Y218 PolarHBondContact O-N 2.89Å; Y218-F221 PolarHBondContact O-N 3.5Å; Y218-Q222 VanDerWaalsContact CE1-CD 3.45Å; Y218-Q222 HydrophobicContact CE1-CG 4.21Å; Y218-Q222 PolarHBondContact O-N 3.28Å; Y218-Q222 PolarHBondContact OH-NE2 3.07Å; Y218-P231 HydrophobicContact CD2-CG 3.71Å; Y218-P231 HydrophobicContact CE2-CG 3.99Å; Y218-P231 WeakPolarHBondContact CE2-O 3.34Å; Y218-P231 HydrophobicContact CG-CG 4.48Å; Y218-A233 HydrophobicContact CD2-CB 3.9Å
219	N	86.3	Confident	85.9	Confident	70 Å²	70	45 Å²	45	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-66.3	-38.5	178.9	-69.4	-7.7	0	0	0	112.1	R215 N216 W217 F221 Q222 K223	R215-N219 WeakPolarHBondContact O-CB 3.33Å; R215-N219 PolarHBondContact O-N 3.42Å; R215-N219 PolarHBondContact O-OD1 3.37Å; N216-N219 PolarHBondContact O-N 3.05Å; W217-N219 PolarHBondContact O-N 3.5Å; N219-F221 PolarHBondContact O-N 2.67Å; N219-Q222 PolarHBondContact O-N 2.94Å; N219-K223 WeakPolarHBondContact O-CB 3.38Å; N219-K223 PolarHBondContact O-N 3.17Å
220	E	90	Very high	85.5	Confident	36 Å²	36	49.8 Å²	49.8	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-37.6	178.6	-71.6	-74.6	130.7	0	0	111.6	T181 I185 N216 W217 Q222 K223 W224	T181-E220 HydrophobicContact CG2-CB 3.97Å; T181-E220 HydrophobicContact CG2-CG 4.07Å; I185-E220 HydrophobicContact CD1-CB 3.79Å; N216-E220 WeakPolarHBondContact O-CB 3.2Å; N216-E220 VanDerWaalsContact O-CG 3.26Å; N216-E220 WeakPolarHBondContact O-CG 3.44Å; N216-E220 PolarHBondContact O-N 3.49Å; W217-E220 PolarHBondContact O-N 2.9Å; E220-Q222 PolarHBondContact O-N 3.27Å; E220-K223 PolarHBondContact O-N 2.81Å; E220-K223 IonicContact OE1-NZ 2.64Å; E220-W224 PolarHBondContact O-N 3.3Å; E220-W224 PolarHBondContact OE2-NE1 2.79Å
221	F	91.2	Very high	85.7	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-43.8	170.7	-84.2	-71	0	0	0	112.3	I185 I188 I207 W217 Y218 N219 L225 P231 I261 I263	I185-F221 HydrophobicContact CB-CE1 4.24Å; I185-F221 HydrophobicContact CD1-CD1 4.39Å; I185-F221 HydrophobicContact CD1-CE1 4.49Å; I185-F221 HydrophobicContact CD1-CG 4.44Å; I185-F221 HydrophobicContact CG1-CD1 4.06Å; I185-F221 HydrophobicContact CG1-CE1 3.71Å; I185-F221 HydrophobicContact CG1-CE2 4.28Å; I185-F221 HydrophobicContact CG1-CG 4.49Å; I185-F221 HydrophobicContact CG1-CZ 3.81Å; I185-F221 HydrophobicContact CG2-CD1 4.06Å; I185-F221 HydrophobicContact CG2-CE1 3.98Å; I188-F221 HydrophobicContact CD1-CZ 3.94Å; I207-F221 HydrophobicContact CD1-CE2 3.44Å; I207-F221 VanDerWaalsContact CD1-CE2 3.44Å; I207-F221 HydrophobicContact CD1-CZ 3.53Å; W217-F221 AromaticContact CE3-CE2 3.86Å; W217-F221 HydrophobicContact CE3-CE2 3.86Å; W217-F221 HydrophobicContact CE3-CZ 4.46Å; W217-F221 HydrophobicContact CZ3-CE2 4.41Å; W217-F221 WeakPolarHBondContact O-CD2 3.39Å; W217-F221 PolarHBondContact O-N 3.19Å; Y218-F221 PolarHBondContact O-N 3.5Å; N219-F221 PolarHBondContact O-N 2.67Å; F221-L225 HydrophobicContact CD1-CD1 3.93Å; F221-L225 WeakPolarHBondContact O-CB 3.48Å; F221-L225 PolarHBondContact O-N 2.69Å; F221-P231 HydrophobicContact CB-CG 3.91Å; F221-P231 HydrophobicContact CD2-CB 4.35Å; F221-P231 HydrophobicContact CD2-CG 4.07Å; F221-P231 HydrophobicContact CG-CG 4.12Å; F221-I261 HydrophobicContact CD1-CD1 3.94Å; F221-I261 HydrophobicContact CE1-CD1 3.37Å; F221-I261 HydrophobicContact CE2-CG2 4.16Å; F221-I261 HydrophobicContact CZ-CD1 3.79Å; F221-I261 HydrophobicContact CZ-CG2 4.03Å; F221-I263 HydrophobicContact CD2-CD1 3.98Å; F221-I263 HydrophobicContact CE2-CD1 4.11Å
222	Q	89.4	Confident	86.1	Confident	76 Å²	76	50.2 Å²	50.2	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-65.1	-42.1	177.9	-69.9	-172	-28.1	0	0	111.9	Y218 N219 E220 H226	Y218-Q222 VanDerWaalsContact CE1-CD 3.45Å; Y218-Q222 HydrophobicContact CE1-CG 4.21Å; Y218-Q222 PolarHBondContact O-N 3.28Å; Y218-Q222 PolarHBondContact OH-NE2 3.07Å; N219-Q222 PolarHBondContact O-N 2.94Å; E220-Q222 PolarHBondContact O-N 3.27Å; Q222-H226 WeakPolarHBondContact O-CA 3.17Å; Q222-H226 PolarHBondContact O-N 3.44Å; Q222-H226 VanDerWaalsContact O-N 3.09Å
223	K	88	Confident	86.8	Confident	110 Å²	110	50.3 Å²	50.3	48%	0.478	24%	0.244	S	C	.	.	H	α-helix	trans	-61.9	-52.1	179.2	177.5	-176	171	-171.4	0	112.2	N219 E220	N219-K223 WeakPolarHBondContact O-CB 3.38Å; N219-K223 PolarHBondContact O-N 3.17Å; E220-K223 PolarHBondContact O-N 2.81Å; E220-K223 IonicContact OE1-NZ 2.64Å
224	W	90.4	Very high	87.1	Confident	39 Å²	39	50.1 Å²	50.1	15%	0.148	24%	0.243	C	C	.	.	H	α-helix	trans	-84.4	-32	-172.2	-61.7	120	0	0	0	113.9	L140 I143 L182 E220 H226	L140-W224 HydrophobicContact CD2-CB 4.04Å; I143-W224 HydrophobicContact CD1-CE3 3.91Å; I143-W224 HydrophobicContact CD1-CZ3 3.85Å; I143-W224 HydrophobicContact CG2-CE3 4.35Å; I143-W224 HydrophobicContact CG2-CH2 3.97Å; I143-W224 HydrophobicContact CG2-CZ3 3.58Å; L182-W224 HydrophobicContact CD1-CB 4.4Å; L182-W224 HydrophobicContact CD1-CD2 3.71Å; L182-W224 HydrophobicContact CD1-CE3 4.29Å; L182-W224 HydrophobicContact CD1-CG 3.75Å; L182-W224 HydrophobicContact CD1-CZ2 4.43Å; L182-W224 HydrophobicContact CD2-CH2 4.41Å; L182-W224 HydrophobicContact CD2-CZ2 4.17Å; E220-W224 PolarHBondContact O-N 3.3Å; E220-W224 PolarHBondContact OE2-NE1 2.79Å; W224-H226 PolarHBondContact O-ND1 3.45Å
225	L	89.1	Confident	86.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-98.8	3.4	-179.1	-58.6	-179.4	0	0	0	113.5	L140 I185 W189 F221 G227 K228 I229	L140-L225 HydrophobicContact CD1-CD2 4.06Å; L140-L225 HydrophobicContact CD2-CD2 4.24Å; I185-L225 HydrophobicContact CG2-CD1 4.28Å; I185-L225 HydrophobicContact CG2-CD2 4.38Å; I185-L225 HydrophobicContact CG2-CG 4.17Å; W189-L225 HydrophobicContact CB-CD2 4.3Å; W189-L225 HydrophobicContact CD2-CD1 4.42Å; W189-L225 HydrophobicContact CD2-CD2 3.98Å; W189-L225 HydrophobicContact CE3-CD1 4.06Å; W189-L225 HydrophobicContact CE3-CD2 4.38Å; W189-L225 HydrophobicContact CG-CD2 3.95Å; F221-L225 HydrophobicContact CD1-CD1 3.93Å; F221-L225 WeakPolarHBondContact O-CB 3.48Å; F221-L225 PolarHBondContact O-N 2.69Å; L225-G227 PolarHBondContact O-N 3.45Å; L225-G227 VanDerWaalsContact O-N 3.07Å; L225-K228 HydrophobicContact CB-CB 4.42Å; L225-K228 VanDerWaalsContact O-CB 3.29Å; L225-K228 WeakPolarHBondContact O-CB 3.37Å; L225-K228 VanDerWaalsContact O-CG 3.28Å; L225-K228 WeakPolarHBondContact O-CG 3.46Å; L225-K228 PolarHBondContact O-N 2.76Å; L225-I229 HydrophobicContact CD1-CB 4.33Å; L225-I229 HydrophobicContact CD1-CD1 4.35Å
226	H	85.5	Confident	86.2	Confident	125 Å²	125	49.7 Å²	49.7	58%	0.579	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	39.7	175.2	-54.3	93.4	0	0	0	113.9	M139 Q222 W224 K228	M139-H226 HydrophobicContact CE-CB 4.49Å; M139-H226 WeakPolarHBondContact CE-ND1 3.29Å; M139-H226 PolarHBondContact SD-ND1 3.42Å; Q222-H226 WeakPolarHBondContact O-CA 3.17Å; Q222-H226 PolarHBondContact O-N 3.44Å; Q222-H226 VanDerWaalsContact O-N 3.09Å; W224-H226 PolarHBondContact O-ND1 3.45Å; H226-K228 PolarHBondContact O-N 3.19Å
227	G	81	Confident	85.9	Confident	34 Å²	34	49.4 Å²	49.4	35%	0.351	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	6.1	179.9	0	0	0	0	0	116.4	L225 I229	L225-G227 PolarHBondContact O-N 3.45Å; L225-G227 VanDerWaalsContact O-N 3.07Å; G227-I229 PolarHBondContact O-N 3.13Å
228	K	84.3	Confident	85.6	Confident	93 Å²	93	52 Å²	52	40%	0.404	29%	0.288	S	S	.	.	S	Bend	trans	-62	-24.8	175	-72.5	176	173.5	175.3	0	113.8	D137 M139 W189 L225 H226	D137-K228 IonicContact OD1-NZ 3.26Å; D137-K228 IonicContact OD2-NZ 3.98Å; D137-K228 PolarHBondContact OD2-NZ 3.45Å; D137-K228 VanDerWaalsContact OD2-NZ 3.09Å; M139-K228 HydrophobicContact CE-CD 4.35Å; W189-K228 HydrophobicContact CH2-CB 3.97Å; W189-K228 HydrophobicContact CH2-CD 3.94Å; W189-K228 HydrophobicContact CZ2-CD 3.83Å; W189-K228 HydrophobicContact CZ3-CB 4.44Å; L225-K228 HydrophobicContact CB-CB 4.42Å; L225-K228 VanDerWaalsContact O-CB 3.29Å; L225-K228 WeakPolarHBondContact O-CB 3.37Å; L225-K228 VanDerWaalsContact O-CG 3.28Å; L225-K228 WeakPolarHBondContact O-CG 3.46Å; L225-K228 PolarHBondContact O-N 2.76Å; H226-K228 PolarHBondContact O-N 3.19Å
229	I	85.6	Confident	85.5	Confident	8 Å²	8	56 Å²	56	4%	0.041	31%	0.307	C	S	.	.			trans	-135.4	140.6	175.2	-68.8	-175.4	0	0	0	109.4	W189 L192 L225 G227 P260 I261	W189-I229 HydrophobicContact CE3-CD1 3.38Å; W189-I229 HydrophobicContact CE3-CG1 4.05Å; W189-I229 HydrophobicContact CZ3-CD1 3.3Å; W189-I229 HydrophobicContact CZ3-CG1 3.51Å; L192-I229 HydrophobicContact CD1-CD1 3.91Å; L225-I229 HydrophobicContact CD1-CB 4.33Å; L225-I229 HydrophobicContact CD1-CD1 4.35Å; G227-I229 PolarHBondContact O-N 3.13Å; I229-P260 HydrophobicContact CD1-CG 4.23Å; I229-P260 HydrophobicContact CG2-CG 4.28Å; I229-I261 HydrophobicContact CD1-CD1 4.2Å; I229-I261 HydrophobicContact CG2-CD1 3.91Å; I229-I261 HydrophobicContact CG2-CG1 4.3Å
230	H	84	Confident	85.6	Confident	101 Å²	101	60.2 Å²	60.2	47%	0.468	32%	0.324	S	S	.	.			trans	-108.6	104.2	168.1	-63.4	-63.7	0	0	0	110.5	S259	H230-S259 PolarHBondContact O-OG 3.42Å
231	P	89.4	Confident	85.6	Confident	7 Å²	7	62.7 Å²	62.7	5%	0.045	34%	0.339	C	S	.	.			trans	-68.6	146.6	174.4	27.9	-32.6	0	0	0	110.9	Y218 F221 I261 I263	Y218-P231 HydrophobicContact CD2-CG 3.71Å; Y218-P231 HydrophobicContact CE2-CG 3.99Å; Y218-P231 WeakPolarHBondContact CE2-O 3.34Å; Y218-P231 HydrophobicContact CG-CG 4.48Å; F221-P231 HydrophobicContact CB-CG 3.91Å; F221-P231 HydrophobicContact CD2-CB 4.35Å; F221-P231 HydrophobicContact CD2-CG 4.07Å; F221-P231 HydrophobicContact CG-CG 4.12Å; P231-I261 CarbonylContact C-O 3.55Å; P231-I261 WeakPolarHBondContact CA-O 3.44Å; P231-I261 HydrophobicContact CB-CB 4.03Å; P231-I261 HydrophobicContact CB-CG2 4.05Å; P231-I263 HydrophobicContact CB-CD1 3.76Å; P231-I263 HydrophobicContact CB-CG1 4.19Å; P231-I263 HydrophobicContact CG-CD1 4.06Å
232	L	90	Very high	85.5	Confident	41 Å²	41	63 Å²	63	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.7	171.7	179.7	64.2	0	0	0	108.9	I234 F249 I261 L262 I263	L232-I234 HydrophobicContact CD2-CD1 4.22Å; L232-I234 HydrophobicContact CG-CD1 4.4Å; L232-I234 HydrophobicContact CG-CG1 4.21Å; L232-F249 HydrophobicContact CD2-CB 4.02Å; L232-I261 PolarHBondContact N-O 3.04Å; L232-L262 HydrophobicContact CB-CD1 4.43Å; L232-L262 HydrophobicContact CD2-CD1 4.13Å; L232-L262 HydrophobicContact CG-CD1 4.22Å; L232-L262 CarbonylContact O-C 3.59Å; L232-L262 WeakPolarHBondContact O-CA 3.35Å; L232-I263 PolarHBondContact O-N 3.42Å
233	A	88.9	Confident	85.5	Confident	37 Å²	37	61.5 Å²	61.5	31%	0.306	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.8	179.1	0	0	0	0	0	110.9	L214 Y218 I263	L214-A233 HydrophobicContact CD2-CB 3.54Å; L214-A233 HydrophobicContact CG-CB 4.46Å; Y218-A233 HydrophobicContact CD2-CB 3.9Å; A233-I263 WeakPolarHBondContact CA-O 3.39Å
234	I	86.6	Confident	85.6	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	107.8	179.8	-54.1	-176	0	0	0	109.4	L214 L232 I242 K245 L246 L262 I263 S265 T268	L214-I234 WeakPolarHBondContact CD1-O 3.27Å; L232-I234 HydrophobicContact CD2-CD1 4.22Å; L232-I234 HydrophobicContact CG-CD1 4.4Å; L232-I234 HydrophobicContact CG-CG1 4.21Å; I234-I242 HydrophobicContact CG2-CB 4.46Å; I234-I242 HydrophobicContact CG2-CG1 4.02Å; I234-I242 HydrophobicContact CG2-CG2 3.89Å; I234-K245 HydrophobicContact CD1-CB 3.88Å; I234-L246 HydrophobicContact CD1-CD2 3.65Å; I234-L246 HydrophobicContact CD1-CG 3.96Å; I234-L262 HydrophobicContact CD1-CD1 3.65Å; I234-L262 HydrophobicContact CG1-CD1 3.91Å; I234-I263 PolarHBondContact N-O 3.14Å; I234-S265 PolarHBondContact O-N 3.04Å; I234-T268 HydrophobicContact CG2-CG2 4.02Å
235	D	72.8	Confident	85.6	Confident	35 Å²	35	63.6 Å²	63.6	19%	0.187	36%	0.355	C	S	.	.	S	Bend	trans	-112.9	-60.5	178.9	-173.6	30.1	0	0	0	111.3	S211 L214 T268 I553	S211-D235 WeakPolarHBondContact CB-OD1 2.97Å; S211-D235 PolarHBondContact OG-OD1 3.33Å; L214-D235 HydrophobicContact CD1-CB 3.92Å; L214-D235 HydrophobicContact CD2-CB 4.15Å; D235-T268 PolarHBondContact O-OG1 2.85Å; D235-I553 VanDerWaalsContact OD2-CD1 3.28Å; D235-I553 WeakPolarHBondContact OD2-CD1 3.14Å
236	S	75.2	Confident	85.7	Confident	103 Å²	103	63.6 Å²	63.6	72%	0.72	36%	0.355	S	S	*	.	S	Bend	trans	-142	148.6	-178.2	49.3	0	0	0	0	111.5
237	G	77.9	Confident	85.9	Confident	53 Å²	53	59.9 Å²	59.9	55%	0.546	35%	0.346	S	S	.	.			trans	172.7	176.9	-176.6	0	0	0	0	0	111.1
238	S	84.5	Confident	86.2	Confident	55 Å²	55	59.6 Å²	59.6	39%	0.385	34%	0.343	S	S	.	.			trans	-63.9	149.6	169.3	80.8	0	0	0	0	109.3	E240 D241 I242	S238-E240 PolarHBondContact O-N 3.4Å; S238-D241 WeakPolarHBondContact CB-OD2 3.25Å; S238-D241 PolarHBondContact O-N 3.45Å; S238-D241 WeakPolarHBondContact OG-CB 3.23Å; S238-D241 PolarHBondContact OG-N 3.08Å; S238-D241 VanDerWaalsContact OG-N 3.14Å; S238-D241 PolarHBondContact OG-OD2 2.84Å; S238-I242 WeakPolarHBondContact O-CG1 3.5Å; S238-I242 PolarHBondContact O-N 2.99Å; S238-I242 VanDerWaalsContact O-N 3.1Å
239	K	85.7	Confident	86.5	Confident	146 Å²	146	55.1 Å²	55.1	64%	0.635	32%	0.324	S	S	*	.	H	α-helix	trans	-55	-42.8	-179.2	-170.2	-172.6	175.3	-178.7	0	111.2	I242 D243 H272	K239-I242 PolarHBondContact O-N 2.84Å; K239-D243 PolarHBondContact O-N 3.43Å; K239-H272 VanDerWaalsContact CG-CE1 3.44Å; K239-H272 WeakPolarHBondContact CG-CE1 3.48Å; K239-H272 PolarHBondContact O-CE1 3.09Å
240	E	87.6	Confident	86.6	Confident	158 Å²	158	56.4 Å²	56.4	74%	0.738	33%	0.33	S	S	*	.	H	α-helix	trans	-66.6	-41.7	-179.1	-64.9	170.3	-168.7	0	0	112.2	S238 I242 D243 S244	S238-E240 PolarHBondContact O-N 3.4Å; E240-I242 VanDerWaalsContact C-N 3.31Å; E240-I242 PolarHBondContact O-N 2.88Å; E240-D243 PolarHBondContact O-N 3.5Å; E240-S244 VanDerWaalsContact O-CB 3.28Å; E240-S244 WeakPolarHBondContact O-CB 3.45Å; E240-S244 PolarHBondContact O-N 2.61Å
241	D	89.8	Confident	86.7	Confident	89 Å²	89	56 Å²	56	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-63.9	-39.2	176.8	-67.8	-38.6	0	0	0	111.7	S238 K245	S238-D241 WeakPolarHBondContact CB-OD2 3.25Å; S238-D241 PolarHBondContact O-N 3.45Å; S238-D241 WeakPolarHBondContact OG-CB 3.23Å; S238-D241 PolarHBondContact OG-N 3.08Å; S238-D241 VanDerWaalsContact OG-N 3.14Å; S238-D241 PolarHBondContact OG-OD2 2.84Å; D241-K245 WeakPolarHBondContact O-CB 3.47Å; D241-K245 VanDerWaalsContact O-CG 3.27Å; D241-K245 WeakPolarHBondContact O-CG 3.35Å; D241-K245 PolarHBondContact O-N 3.3Å
242	I	89.4	Confident	86.5	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-67.5	-49.1	178.4	-66.7	166.4	0	0	0	109.9	I234 S238 K239 E240 S244 K245 L246 T268 H272	I234-I242 HydrophobicContact CG2-CB 4.46Å; I234-I242 HydrophobicContact CG2-CG1 4.02Å; I234-I242 HydrophobicContact CG2-CG2 3.89Å; S238-I242 WeakPolarHBondContact O-CG1 3.5Å; S238-I242 PolarHBondContact O-N 2.99Å; S238-I242 VanDerWaalsContact O-N 3.1Å; K239-I242 PolarHBondContact O-N 2.84Å; E240-I242 VanDerWaalsContact C-N 3.31Å; E240-I242 PolarHBondContact O-N 2.88Å; I242-S244 VanDerWaalsContact C-N 3.3Å; I242-S244 PolarHBondContact O-N 3.29Å; I242-K245 PolarHBondContact O-N 3.16Å; I242-L246 HydrophobicContact CG2-CD1 3.82Å; I242-L246 HydrophobicContact CG2-CG 4.27Å; I242-L246 WeakPolarHBondContact O-CB 3.44Å; I242-L246 VanDerWaalsContact O-CG 3.32Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 3.43Å; I242-T268 HydrophobicContact CD1-CG2 4.05Å; I242-T268 HydrophobicContact CG2-CG2 3.97Å; I242-H272 HydrophobicContact CG2-CB 4.36Å
243	D	89.9	Confident	86	Confident	43 Å²	43	60.2 Å²	60.2	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-41.3	178.4	-76.2	-25.5	0	0	0	111.6	K239 E240 L246 A247 H272 V275	K239-D243 PolarHBondContact O-N 3.43Å; E240-D243 PolarHBondContact O-N 3.5Å; D243-L246 PolarHBondContact O-N 3.45Å; D243-A247 VanDerWaalsContact O-CB 3.29Å; D243-A247 WeakPolarHBondContact O-CB 3.38Å; D243-A247 PolarHBondContact O-N 2.79Å; D243-H272 IonicContact OD1-CE1 2.93Å; D243-H272 IonicContact OD1-CG 3.57Å; D243-H272 IonicContact OD1-ND1 3.09Å; D243-H272 PolarHBondContact OD1-ND1 3.43Å; D243-H272 IonicContact OD2-ND1 3.57Å; D243-V275 HydrophobicContact CB-CG2 4.38Å; D243-V275 WeakPolarHBondContact OD1-CG2 3.44Å
244	S	90.2	Very high	85.4	Confident	84 Å²	84	61 Å²	61	59%	0.587	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-45.5	175.7	-177.7	0	0	0	0	112.3	E240 I242 L246 A247 G248	E240-S244 VanDerWaalsContact O-CB 3.28Å; E240-S244 WeakPolarHBondContact O-CB 3.45Å; E240-S244 PolarHBondContact O-N 2.61Å; I242-S244 VanDerWaalsContact C-N 3.3Å; I242-S244 PolarHBondContact O-N 3.29Å; S244-L246 PolarHBondContact O-N 3.32Å; S244-A247 PolarHBondContact O-N 2.87Å; S244-G248 PolarHBondContact O-N 3.11Å
245	K	90.6	Very high	84.8	Confident	109 Å²	109	73 Å²	73	47%	0.474	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-41.1	176	-75.1	172.9	-176.7	175.7	0	112.4	I234 D241 I242 G248 F249	I234-K245 HydrophobicContact CD1-CB 3.88Å; D241-K245 WeakPolarHBondContact O-CB 3.47Å; D241-K245 VanDerWaalsContact O-CG 3.27Å; D241-K245 WeakPolarHBondContact O-CG 3.35Å; D241-K245 PolarHBondContact O-N 3.3Å; I242-K245 PolarHBondContact O-N 3.16Å; K245-G248 PolarHBondContact O-N 2.98Å; K245-F249 PolarHBondContact O-N 3.04Å
246	L	90.9	Very high	85.1	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	46%	0.464	C	S	.	.	H	α-helix	trans	-67.3	-45.1	177.7	-70.6	175.4	0	0	0	111.5	I234 I242 D243 S244 G248 F249 L250 L262 I264 H272 V275 L276	I234-L246 HydrophobicContact CD1-CD2 3.65Å; I234-L246 HydrophobicContact CD1-CG 3.96Å; I242-L246 HydrophobicContact CG2-CD1 3.82Å; I242-L246 HydrophobicContact CG2-CG 4.27Å; I242-L246 WeakPolarHBondContact O-CB 3.44Å; I242-L246 VanDerWaalsContact O-CG 3.32Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 3.43Å; D243-L246 PolarHBondContact O-N 3.45Å; S244-L246 PolarHBondContact O-N 3.32Å; L246-G248 VanDerWaalsContact C-N 3.3Å; L246-G248 PolarHBondContact O-N 2.76Å; L246-F249 WeakPolarHBondContact O-CB 3.34Å; L246-F249 PolarHBondContact O-N 2.8Å; L246-L250 WeakPolarHBondContact O-CG 3.41Å; L246-L250 PolarHBondContact O-N 3.21Å; L246-L262 HydrophobicContact CD2-CD1 4.16Å; L246-L262 HydrophobicContact CD2-CD2 3.59Å; L246-I264 HydrophobicContact CD2-CD1 4.21Å; L246-H272 HydrophobicContact CD1-CB 3.54Å; L246-V275 HydrophobicContact CB-CB 4.44Å; L246-V275 HydrophobicContact CB-CG1 3.84Å; L246-L276 HydrophobicContact CD2-CD1 4.33Å; L246-L276 HydrophobicContact CD2-CD2 4.05Å; L246-L276 HydrophobicContact CD2-CG 4.29Å
247	A	88.9	Confident	85.5	Confident	47 Å²	47	79.4 Å²	79.4	39%	0.388	44%	0.437	S	S	.	.	H	α-helix	trans	-60.6	-41.9	174.3	0	0	0	0	0	111.4	D243 S244 F249 L250 S251 V275	D243-A247 VanDerWaalsContact O-CB 3.29Å; D243-A247 WeakPolarHBondContact O-CB 3.38Å; D243-A247 PolarHBondContact O-N 2.79Å; S244-A247 PolarHBondContact O-N 2.87Å; A247-F249 PolarHBondContact O-N 2.91Å; A247-L250 PolarHBondContact O-N 3.38Å; A247-S251 WeakPolarHBondContact O-CB 3.31Å; A247-S251 PolarHBondContact O-N 2.88Å; A247-S251 PolarHBondContact O-OG 2.87Å; A247-V275 HydrophobicContact CB-CG1 4.42Å
248	G	89.2	Confident	85.8	Confident	28 Å²	28	81 Å²	81	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-36.9	174.4	0	0	0	0	0	113.6	S244 K245 L246 S251 Q252	S244-G248 PolarHBondContact O-N 3.11Å; K245-G248 PolarHBondContact O-N 2.98Å; L246-G248 VanDerWaalsContact C-N 3.3Å; L246-G248 PolarHBondContact O-N 2.76Å; G248-S251 PolarHBondContact O-OG 3.29Å; G248-S251 VanDerWaalsContact O-OG 3.13Å; G248-Q252 WeakPolarHBondContact O-CG 3.3Å; G248-Q252 PolarHBondContact O-NE2 3.19Å
249	F	89.9	Confident	85.9	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-66.6	-41.8	173.3	172.4	-101.7	0	0	0	111.7	K204 V206 L232 K245 L246 A247 S259 L262	K204-F249 HydrophobicContact CB-CE1 4.49Å; K204-F249 HydrophobicContact CB-CZ 3.93Å; K204-F249 HydrophobicContact CD-CE1 4.13Å; K204-F249 HydrophobicContact CD-CE2 4.44Å; K204-F249 HydrophobicContact CD-CZ 4.03Å; K204-F249 WeakPolarHBondContact CE-O 3.18Å; K204-F249 HydrophobicContact CG-CZ 4.23Å; K204-F249 PolarHBondContact NZ-O 2.93Å; V206-F249 HydrophobicContact CG2-CE1 4.1Å; V206-F249 HydrophobicContact CG2-CZ 4.41Å; L232-F249 HydrophobicContact CD2-CB 4.02Å; K245-F249 PolarHBondContact O-N 3.04Å; L246-F249 WeakPolarHBondContact O-CB 3.34Å; L246-F249 PolarHBondContact O-N 2.8Å; A247-F249 PolarHBondContact O-N 2.91Å; F249-S259 WeakPolarHBondContact CD2-O 3.41Å; F249-S259 VanDerWaalsContact CE2-O 3.24Å; F249-S259 WeakPolarHBondContact CE2-O 3.38Å; F249-L262 HydrophobicContact CD1-CB 4.19Å; F249-L262 HydrophobicContact CD1-CD2 4.08Å; F249-L262 HydrophobicContact CD2-CB 4.14Å; F249-L262 HydrophobicContact CE1-CB 3.8Å; F249-L262 HydrophobicContact CE1-CD2 4.12Å; F249-L262 HydrophobicContact CE2-CB 3.74Å; F249-L262 HydrophobicContact CG-CB 4.34Å; F249-L262 HydrophobicContact CZ-CB 3.55Å
250	L	88	Confident	86.2	Confident	34 Å²	34	73.3 Å²	73.3	18%	0.178	40%	0.402	C	S	.	.	H	α-helix	trans	-71.2	-33.4	-179.9	-66.6	175.3	0	0	0	113.1	K204 L246 A247 Q252 V275 L276	K204-L250 VanDerWaalsContact NZ-C 3.27Å; K204-L250 PolarHBondContact NZ-O 2.75Å; L246-L250 WeakPolarHBondContact O-CG 3.41Å; L246-L250 PolarHBondContact O-N 3.21Å; A247-L250 PolarHBondContact O-N 3.38Å; L250-Q252 VanDerWaalsContact C-N 3.31Å; L250-Q252 PolarHBondContact O-N 3.01Å; L250-V275 HydrophobicContact CD1-CG1 4.18Å; L250-V275 WeakPolarHBondContact CD1-O 3.35Å; L250-L276 HydrophobicContact CD1-CD2 4.32Å; L250-L276 HydrophobicContact CD2-CD2 4.09Å; L250-L276 HydrophobicContact CG-CD2 4.34Å
251	S	86.1	Confident	86.5	Confident	93 Å²	93	65.8 Å²	65.8	65%	0.65	37%	0.367	S	S	*	.	H	α-helix	trans	-74.8	-17.9	-179.7	66.1	0	0	0	0	114.2	A247 G248 A253	A247-S251 WeakPolarHBondContact O-CB 3.31Å; A247-S251 PolarHBondContact O-N 2.88Å; A247-S251 PolarHBondContact O-OG 2.87Å; G248-S251 PolarHBondContact O-OG 3.29Å; G248-S251 VanDerWaalsContact O-OG 3.13Å; S251-A253 PolarHBondContact O-N 3.44Å
252	Q	84.3	Confident	86.7	Confident	47 Å²	47	61.6 Å²	61.6	22%	0.22	35%	0.345	C	S	.	.			trans	-63.3	121.7	176.6	-72.3	168.8	25.6	0	0	110.9	K204 G248 L250 I257 P258 S259	K204-Q252 WeakPolarHBondContact CE-O 3.45Å; K204-Q252 PolarHBondContact NZ-O 3.14Å; G248-Q252 WeakPolarHBondContact O-CG 3.3Å; G248-Q252 PolarHBondContact O-NE2 3.19Å; L250-Q252 VanDerWaalsContact C-N 3.31Å; L250-Q252 PolarHBondContact O-N 3.01Å; Q252-I257 HydrophobicContact CB-CG2 4.04Å; Q252-I257 VanDerWaalsContact OE1-CG2 3.32Å; Q252-P258 HydrophobicContact CG-CG 4.31Å; Q252-S259 PolarHBondContact OE1-O 3.16Å
253	A	79.3	Confident	86.9	Confident	89 Å²	89	61.2 Å²	61.2	74%	0.736	34%	0.343	S	S	*	.			trans	-141.3	161.5	177.3	0	0	0	0	0	110.5	S251	S251-A253 PolarHBondContact O-N 3.44Å
254	G	76.6	Confident	87.1	Confident	55 Å²	55	59.1 Å²	59.1	57%	0.567	33%	0.332	S	S	*	.	S	Bend	trans	105.8	-175.8	175.9	0	0	0	0	0	114.1	R256	G254-R256 VanDerWaalsContact C-N 3.28Å; G254-R256 PolarHBondContact O-N 2.84Å
255	R	73.7	Confident	87.2	Confident	258 Å²	258	55.1 Å²	55.1	97%	0.974	30%	0.304	S	S	*	.	S	Bend	trans	-67.9	-21.4	-170.6	-70.1	-174.1	179.5	179.3	0.9	114.9
256	R	79.8	Confident	87.1	Confident	240 Å²	240	50.2 Å²	50.2	91%	0.906	28%	0.282	S	S	*	.			trans	-129.4	88	-178.2	-70.5	-173.6	179	-178.5	-0.1	109.6	G254	G254-R256 VanDerWaalsContact C-N 3.28Å; G254-R256 PolarHBondContact O-N 2.84Å
257	I	83.9	Confident	87	Confident	31 Å²	31	54 Å²	54	16%	0.159	30%	0.3	C	S	.	.			trans	-83.9	123.2	174.2	-62.4	170.4	0	0	0	107.7	D203 K204 Q252 P260	D203-I257 HydrophobicContact CB-CD1 3.8Å; K204-I257 HydrophobicContact CG-CD1 4.4Å; Q252-I257 HydrophobicContact CB-CG2 4.04Å; Q252-I257 VanDerWaalsContact OE1-CG2 3.32Å; I257-P260 HydrophobicContact CB-CB 4.39Å; I257-P260 HydrophobicContact CG2-CB 4.01Å
258	P	83.4	Confident	87.1	Confident	88 Å²	88	52.4 Å²	52.4	57%	0.571	29%	0.285	S	S	*	.	S	Bend	trans	-68	-36.7	-176.5	25.4	-33	0	0	0	112.6	Q252	Q252-P258 HydrophobicContact CG-CG 4.31Å
259	S	86.3	Confident	87.2	Confident	26 Å²	26	51.1 Å²	51.1	18%	0.182	27%	0.272	C	S	.	.			trans	-134.5	80	-179.7	-65.2	0	0	0	0	110.6	H230 F249 Q252 I261	H230-S259 PolarHBondContact O-OG 3.42Å; F249-S259 WeakPolarHBondContact CD2-O 3.41Å; F249-S259 VanDerWaalsContact CE2-O 3.24Å; F249-S259 WeakPolarHBondContact CE2-O 3.38Å; Q252-S259 PolarHBondContact OE1-O 3.16Å; S259-I261 PolarHBondContact O-N 3.49Å
260	P	91.9	Very high	87.3	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.084	29%	0.289	C	S	.	.			trans	-74	-10.5	-177.6	28.7	-33.8	0	0	0	113.7	L192 D203 K204 A205 I229 I257	L192-P260 HydrophobicContact CD1-CB 4.22Å; L192-P260 HydrophobicContact CD1-CG 4.08Å; L192-P260 HydrophobicContact CD2-CB 3.82Å; L192-P260 HydrophobicContact CD2-CG 4.46Å; D203-P260 WeakPolarHBondContact O-CB 3.48Å; K204-P260 CarbonylContact C-O 3.26Å; K204-P260 VanDerWaalsContact CA-O 3.25Å; K204-P260 WeakPolarHBondContact CA-O 3.2Å; A205-P260 PolarHBondContact N-O 3.44Å; I229-P260 HydrophobicContact CD1-CG 4.23Å; I229-P260 HydrophobicContact CG2-CG 4.28Å; I257-P260 HydrophobicContact CB-CB 4.39Å; I257-P260 HydrophobicContact CG2-CB 4.01Å
261	I	93.9	Very high	87.4	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.9	-175.5	-54.9	178.3	0	0	0	109.3	I188 L192 A205 I207 F221 I229 P231 L232 S259 I263	I188-I261 HydrophobicContact CG2-CD1 3.67Å; I188-I261 HydrophobicContact CG2-CG1 4.1Å; L192-I261 HydrophobicContact CD1-CD1 4.02Å; L192-I261 HydrophobicContact CD1-CG1 3.89Å; A205-I261 WeakPolarHBondContact O-CA 3.42Å; I207-I261 HydrophobicContact CD1-CG2 3.87Å; I207-I261 HydrophobicContact CG1-CG2 4.39Å; F221-I261 HydrophobicContact CD1-CD1 3.94Å; F221-I261 HydrophobicContact CE1-CD1 3.37Å; F221-I261 HydrophobicContact CE2-CG2 4.16Å; F221-I261 HydrophobicContact CZ-CD1 3.79Å; F221-I261 HydrophobicContact CZ-CG2 4.03Å; I229-I261 HydrophobicContact CD1-CD1 4.2Å; I229-I261 HydrophobicContact CG2-CD1 3.91Å; I229-I261 HydrophobicContact CG2-CG1 4.3Å; P231-I261 CarbonylContact C-O 3.55Å; P231-I261 WeakPolarHBondContact CA-O 3.44Å; P231-I261 HydrophobicContact CB-CB 4.03Å; P231-I261 HydrophobicContact CB-CG2 4.05Å; L232-I261 PolarHBondContact N-O 3.04Å; S259-I261 PolarHBondContact O-N 3.49Å; I261-I263 HydrophobicContact CG2-CG1 4.33Å
262	L	94.3	Very high	87.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.6	170.5	172.1	66.8	0	0	0	109.3	A205 V206 I207 L232 I234 L246 F249 I264 L276	A205-L262 PolarHBondContact O-N 3.28Å; V206-L262 CarbonylContact C-O 3.59Å; V206-L262 WeakPolarHBondContact CA-O 3.35Å; V206-L262 HydrophobicContact CG1-CD2 4.3Å; V206-L262 HydrophobicContact CG2-CB 4.21Å; V206-L262 HydrophobicContact CG2-CD2 4.09Å; I207-L262 PolarHBondContact N-O 2.96Å; L232-L262 HydrophobicContact CB-CD1 4.43Å; L232-L262 HydrophobicContact CD2-CD1 4.13Å; L232-L262 HydrophobicContact CG-CD1 4.22Å; L232-L262 CarbonylContact O-C 3.59Å; L232-L262 WeakPolarHBondContact O-CA 3.35Å; I234-L262 HydrophobicContact CD1-CD1 3.65Å; I234-L262 HydrophobicContact CG1-CD1 3.91Å; L246-L262 HydrophobicContact CD2-CD1 4.16Å; L246-L262 HydrophobicContact CD2-CD2 3.59Å; F249-L262 HydrophobicContact CD1-CB 4.19Å; F249-L262 HydrophobicContact CD1-CD2 4.08Å; F249-L262 HydrophobicContact CD2-CB 4.14Å; F249-L262 HydrophobicContact CE1-CB 3.8Å; F249-L262 HydrophobicContact CE1-CD2 4.12Å; F249-L262 HydrophobicContact CE2-CB 3.74Å; F249-L262 HydrophobicContact CG-CB 4.34Å; F249-L262 HydrophobicContact CZ-CB 3.55Å; L262-I264 HydrophobicContact CG-CB 4.42Å; L262-L276 HydrophobicContact CD2-CD1 4.47Å; L262-L276 HydrophobicContact CD2-CD2 4.05Å
263	I	94.4	Very high	87.9	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.7	171.4	-49.4	169	0	0	0	107.3	I207 T209 L214 W217 F221 P231 L232 A233 I234 I261	I207-I263 HydrophobicContact CB-CG1 4.42Å; I207-I263 HydrophobicContact CB-CG2 4.47Å; I207-I263 HydrophobicContact CD1-CG1 4.32Å; I207-I263 WeakPolarHBondContact O-CA 3.25Å; T209-I263 HydrophobicContact CG2-CG2 3.69Å; L214-I263 HydrophobicContact CB-CG2 4.49Å; L214-I263 HydrophobicContact CD1-CG2 4.25Å; L214-I263 HydrophobicContact CG-CB 4.5Å; L214-I263 HydrophobicContact CG-CG2 3.8Å; W217-I263 HydrophobicContact CB-CD1 3.98Å; W217-I263 HydrophobicContact CB-CG2 4.16Å; F221-I263 HydrophobicContact CD2-CD1 3.98Å; F221-I263 HydrophobicContact CE2-CD1 4.11Å; P231-I263 HydrophobicContact CB-CD1 3.76Å; P231-I263 HydrophobicContact CB-CG1 4.19Å; P231-I263 HydrophobicContact CG-CD1 4.06Å; L232-I263 PolarHBondContact O-N 3.42Å; A233-I263 WeakPolarHBondContact CA-O 3.39Å; I234-I263 PolarHBondContact N-O 3.14Å; I261-I263 HydrophobicContact CG2-CG1 4.33Å
264	I	93.4	Very high	88.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145	-174.1	-170.4	166.9	0	0	0	110.8	V206 I207 V208 T209 L246 L262 T268 F269 L276	V206-I264 HydrophobicContact CG1-CG2 4.06Å; I207-I264 PolarHBondContact O-N 2.92Å; V208-I264 WeakPolarHBondContact CA-O 3.28Å; V208-I264 HydrophobicContact CG2-CG2 4.1Å; T209-I264 PolarHBondContact N-O 3.08Å; L246-I264 HydrophobicContact CD2-CD1 4.21Å; L262-I264 HydrophobicContact CG-CB 4.42Å; I264-T268 HydrophobicContact CD1-CG2 4.15Å; I264-T268 HydrophobicContact CG1-CG2 4.17Å; I264-F269 HydrophobicContact CD1-CB 4Å; I264-F269 HydrophobicContact CD1-CD2 4.42Å; I264-F269 HydrophobicContact CG1-CB 4.14Å; I264-F269 HydrophobicContact CG2-CB 4.13Å; I264-F269 HydrophobicContact CG2-CD2 4.01Å; I264-L276 HydrophobicContact CD1-CD1 4.44Å
265	S	91.5	Very high	89	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	152.8	173.9	68.2	0	0	0	0	111.9	T209 S211 I234 E267 T268 F269	T209-S265 CarbonylContact O-C 3.57Å; T209-S265 WeakPolarHBondContact O-CA 3.47Å; S211-S265 WeakPolarHBondContact OG-CB 3.35Å; S211-S265 PolarHBondContact OG-OG 3.23Å; I234-S265 PolarHBondContact O-N 3.04Å; S265-E267 PolarHBondContact O-N 3.21Å; S265-T268 PolarHBondContact O-N 2.86Å; S265-T268 WeakPolarHBondContact OG-CB 3.26Å; S265-T268 PolarHBondContact OG-N 3.09Å; S265-T268 VanDerWaalsContact OG-N 3.15Å; S265-T268 PolarHBondContact OG-OG1 2.8Å; S265-F269 VanDerWaalsContact O-CB 3.24Å; S265-F269 WeakPolarHBondContact O-CB 3.2Å; S265-F269 PolarHBondContact O-N 2.9Å
266	Y	90.4	Very high	89.8	Confident	6 Å²	6	39.6 Å²	39.6	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-55.4	-41.6	173.8	-81.5	-70.5	0	0	0	112.7	V208 T209 P210 R270 D287 L292 T299 L303	V208-Y266 HydrophobicContact CB-CD1 4.5Å; V208-Y266 HydrophobicContact CB-CE1 4.24Å; V208-Y266 HydrophobicContact CG1-CD1 3.3Å; V208-Y266 HydrophobicContact CG1-CD2 4.33Å; V208-Y266 HydrophobicContact CG1-CE1 3.47Å; V208-Y266 VanDerWaalsContact CG1-CE1 3.47Å; V208-Y266 HydrophobicContact CG1-CE2 4.44Å; V208-Y266 HydrophobicContact CG1-CG 3.8Å; T209-Y266 PolarHBondContact O-N 3.23Å; T209-Y266 VanDerWaalsContact O-N 3.09Å; P210-Y266 HydrophobicContact CG-CD2 4.42Å; P210-Y266 HydrophobicContact CG-CE2 4.38Å; Y266-R270 WeakPolarHBondContact O-CB 3.44Å; Y266-R270 PolarHBondContact O-N 3.26Å; Y266-R270 VanDerWaalsContact O-N 3.07Å; Y266-D287 WeakPolarHBondContact CE2-O 3.46Å; Y266-D287 PolarHBondContact OH-O 3.5Å; Y266-L292 HydrophobicContact CE1-CD2 4.26Å; Y266-T299 HydrophobicContact CD1-CG2 3.47Å; Y266-T299 VanDerWaalsContact CD1-CG2 3.47Å; Y266-T299 HydrophobicContact CE1-CG2 4.14Å; Y266-T299 HydrophobicContact CG-CG2 4.38Å; Y266-L303 HydrophobicContact CE1-CD1 4.27Å
267	E	88.2	Confident	90.2	Very high	79 Å²	79	30.2 Å²	30.2	37%	0.369	16%	0.164	S	C	.	.	H	α-helix	trans	-66	-46.1	-178.7	-63.7	78.3	-173	0	0	111.2	S265 R270 L271 R291	S265-E267 PolarHBondContact O-N 3.21Å; E267-R270 PolarHBondContact O-N 3.21Å; E267-L271 WeakPolarHBondContact O-CG 3.48Å; E267-L271 PolarHBondContact O-N 3.38Å; E267-R291 IonicContact OE1-NH1 3.56Å
268	T	90.4	Very high	90.4	Very high	14 Å²	14	37.3 Å²	37.3	9%	0.086	19%	0.194	C	C	.	.	H	α-helix	trans	-72.4	-37.4	179.6	-60	0	0	0	0	111.4	I234 D235 I242 I264 S265 R270 L271 H272	I234-T268 HydrophobicContact CG2-CG2 4.02Å; D235-T268 PolarHBondContact O-OG1 2.85Å; I242-T268 HydrophobicContact CD1-CG2 4.05Å; I242-T268 HydrophobicContact CG2-CG2 3.97Å; I264-T268 HydrophobicContact CD1-CG2 4.15Å; I264-T268 HydrophobicContact CG1-CG2 4.17Å; S265-T268 PolarHBondContact O-N 2.86Å; S265-T268 WeakPolarHBondContact OG-CB 3.26Å; S265-T268 PolarHBondContact OG-N 3.09Å; S265-T268 VanDerWaalsContact OG-N 3.15Å; S265-T268 PolarHBondContact OG-OG1 2.8Å; T268-R270 VanDerWaalsContact C-N 3.34Å; T268-R270 PolarHBondContact O-N 2.99Å; T268-L271 PolarHBondContact O-N 3.48Å; T268-H272 PolarHBondContact O-CD2 2.93Å; T268-H272 VanDerWaalsContact O-CD2 3.27Å; T268-H272 PolarHBondContact O-N 2.78Å; T268-H272 VanDerWaalsContact O-N 3.14Å
269	F	92.3	Very high	90.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.5	-48.2	173.2	179.9	-88.7	0	0	0	111.2	V208 I264 S265 L271 H272 A273 L276 A302 L303 L306	V208-F269 HydrophobicContact CG1-CB 4.36Å; V208-F269 HydrophobicContact CG2-CD2 4.22Å; I264-F269 HydrophobicContact CD1-CB 4Å; I264-F269 HydrophobicContact CD1-CD2 4.42Å; I264-F269 HydrophobicContact CG1-CB 4.14Å; I264-F269 HydrophobicContact CG2-CB 4.13Å; I264-F269 HydrophobicContact CG2-CD2 4.01Å; S265-F269 VanDerWaalsContact O-CB 3.24Å; S265-F269 WeakPolarHBondContact O-CB 3.2Å; S265-F269 PolarHBondContact O-N 2.9Å; F269-L271 VanDerWaalsContact C-N 3.34Å; F269-L271 PolarHBondContact O-N 3.41Å; F269-H272 CarbonylContact O-C 3.57Å; F269-H272 PolarHBondContact O-N 2.82Å; F269-A273 HydrophobicContact CE1-CB 4.45Å; F269-A273 WeakPolarHBondContact O-CA 3.48Å; F269-A273 WeakPolarHBondContact O-CB 3.5Å; F269-A273 PolarHBondContact O-N 3.47Å; F269-L276 HydrophobicContact CD2-CD1 3.53Å; F269-L276 HydrophobicContact CE2-CD1 3.46Å; F269-L276 VanDerWaalsContact CE2-CD1 3.46Å; F269-A302 HydrophobicContact CD1-CB 4.36Å; F269-A302 HydrophobicContact CE1-CB 3.87Å; F269-L303 HydrophobicContact CD1-CD2 3.92Å; F269-L303 HydrophobicContact CD1-CG 4.17Å; F269-L303 HydrophobicContact CE1-CB 4.36Å; F269-L303 HydrophobicContact CE1-CD2 3.37Å; F269-L303 HydrophobicContact CE1-CG 3.61Å; F269-L303 HydrophobicContact CE2-CD2 4.08Å; F269-L303 HydrophobicContact CZ-CD2 3.47Å; F269-L303 VanDerWaalsContact CZ-CD2 3.47Å; F269-L303 HydrophobicContact CZ-CG 4.15Å; F269-L306 HydrophobicContact CE2-CD2 4.14Å; F269-L306 HydrophobicContact CZ-CD2 4.14Å
270	R	90.6	Very high	90.6	Very high	99 Å²	99	37.1 Å²	37.1	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-58.7	-44.1	179.5	-179.1	-175.3	64.1	-171.7	-0.9	112.3	Y266 E267 T268 H272 Q298	Y266-R270 WeakPolarHBondContact O-CB 3.44Å; Y266-R270 PolarHBondContact O-N 3.26Å; Y266-R270 VanDerWaalsContact O-N 3.07Å; E267-R270 PolarHBondContact O-N 3.21Å; T268-R270 VanDerWaalsContact C-N 3.34Å; T268-R270 PolarHBondContact O-N 2.99Å; R270-H272 VanDerWaalsContact C-N 3.31Å; R270-H272 PolarHBondContact O-N 3.43Å; R270-Q298 HydrophobicContact CG-CB 4.28Å
271	L	90.4	Very high	90.6	Very high	119 Å²	119	36.7 Å²	36.7	62%	0.623	19%	0.194	S	C	*	.	H	α-helix	trans	-70	-27.3	-177.5	-68.4	174.1	0	0	0	113.3	E267 T268 F269	E267-L271 WeakPolarHBondContact O-CG 3.48Å; E267-L271 PolarHBondContact O-N 3.38Å; T268-L271 PolarHBondContact O-N 3.48Å; F269-L271 VanDerWaalsContact C-N 3.34Å; F269-L271 PolarHBondContact O-N 3.41Å
272	H	90.9	Very high	90.5	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.046	20%	0.202	C	C	.	.	H	α-helix	trans	-118.1	14.5	-172.4	-64.2	-86.4	0	0	0	113.8	K239 I242 D243 L246 T268 F269 R270 S274 V275	K239-H272 VanDerWaalsContact CG-CE1 3.44Å; K239-H272 WeakPolarHBondContact CG-CE1 3.48Å; K239-H272 PolarHBondContact O-CE1 3.09Å; I242-H272 HydrophobicContact CG2-CB 4.36Å; D243-H272 IonicContact OD1-CE1 2.93Å; D243-H272 IonicContact OD1-CG 3.57Å; D243-H272 IonicContact OD1-ND1 3.09Å; D243-H272 PolarHBondContact OD1-ND1 3.43Å; D243-H272 IonicContact OD2-ND1 3.57Å; L246-H272 HydrophobicContact CD1-CB 3.54Å; T268-H272 PolarHBondContact O-CD2 2.93Å; T268-H272 VanDerWaalsContact O-CD2 3.27Å; T268-H272 PolarHBondContact O-N 2.78Å; T268-H272 VanDerWaalsContact O-N 3.14Å; F269-H272 CarbonylContact O-C 3.57Å; F269-H272 PolarHBondContact O-N 2.82Å; R270-H272 VanDerWaalsContact C-N 3.31Å; R270-H272 PolarHBondContact O-N 3.43Å; H272-S274 PolarHBondContact O-N 2.81Å; H272-S274 VanDerWaalsContact O-N 3.16Å; H272-V275 PolarHBondContact O-N 3.44Å; H272-V275 VanDerWaalsContact O-N 3.13Å
273	A	90	Very high	90.6	Very high	8 Å²	8	37.4 Å²	37.4	7%	0.066	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-33.9	-176	0	0	0	0	0	112.7	F269 V275 L276 H277 A302	F269-A273 HydrophobicContact CE1-CB 4.45Å; F269-A273 WeakPolarHBondContact O-CA 3.48Å; F269-A273 WeakPolarHBondContact O-CB 3.5Å; F269-A273 PolarHBondContact O-N 3.47Å; A273-V275 PolarHBondContact O-N 2.97Å; A273-V275 VanDerWaalsContact O-N 3.17Å; A273-L276 PolarHBondContact O-N 3.2Å; A273-H277 PolarHBondContact O-CD2 3.27Å; A273-H277 PolarHBondContact O-N 3.44Å; A273-H277 PolarHBondContact O-ND1 3.31Å; A273-A302 HydrophobicContact CB-CB 3.84Å
274	S	90.1	Very high	90.6	Very high	79 Å²	79	37.6 Å²	37.6	55%	0.552	20%	0.203	S	C	*	.	H	α-helix	trans	-59.6	-27.5	-179.9	60.6	0	0	0	0	113.9	H272	H272-S274 PolarHBondContact O-N 2.81Å; H272-S274 VanDerWaalsContact O-N 3.16Å
275	V	90.2	Very high	90.7	Very high	19 Å²	19	37.6 Å²	37.6	12%	0.115	20%	0.203	C	C	.	.	H	α-helix	trans	-75.6	-44.9	174	-178.8	0	0	0	0	110.1	D243 L246 A247 L250 H272 A273 H277 K278	D243-V275 HydrophobicContact CB-CG2 4.38Å; D243-V275 WeakPolarHBondContact OD1-CG2 3.44Å; L246-V275 HydrophobicContact CB-CB 4.44Å; L246-V275 HydrophobicContact CB-CG1 3.84Å; A247-V275 HydrophobicContact CB-CG1 4.42Å; L250-V275 HydrophobicContact CD1-CG1 4.18Å; L250-V275 WeakPolarHBondContact CD1-O 3.35Å; H272-V275 PolarHBondContact O-N 3.44Å; H272-V275 VanDerWaalsContact O-N 3.13Å; A273-V275 PolarHBondContact O-N 2.97Å; A273-V275 VanDerWaalsContact O-N 3.17Å; V275-H277 VanDerWaalsContact C-N 3.33Å; V275-H277 PolarHBondContact O-N 2.99Å; V275-K278 WeakPolarHBondContact O-CB 3.33Å; V275-K278 PolarHBondContact O-N 2.81Å
276	L	88.8	Confident	90.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-31.6	-179.6	-71.8	172.4	0	0	0	113.1	L246 L250 L262 I264 F269 A273 K278 G279 L306	L246-L276 HydrophobicContact CD2-CD1 4.33Å; L246-L276 HydrophobicContact CD2-CD2 4.05Å; L246-L276 HydrophobicContact CD2-CG 4.29Å; L250-L276 HydrophobicContact CD1-CD2 4.32Å; L250-L276 HydrophobicContact CD2-CD2 4.09Å; L250-L276 HydrophobicContact CG-CD2 4.34Å; L262-L276 HydrophobicContact CD2-CD1 4.47Å; L262-L276 HydrophobicContact CD2-CD2 4.05Å; I264-L276 HydrophobicContact CD1-CD1 4.44Å; F269-L276 HydrophobicContact CD2-CD1 3.53Å; F269-L276 HydrophobicContact CE2-CD1 3.46Å; F269-L276 VanDerWaalsContact CE2-CD1 3.46Å; A273-L276 PolarHBondContact O-N 3.2Å; L276-K278 PolarHBondContact O-N 3.09Å; L276-G279 PolarHBondContact O-N 3.14Å; L276-G279 VanDerWaalsContact O-N 3.16Å; L276-L306 HydrophobicContact CB-CD1 4Å
277	H	90.1	Very high	90.9	Very high	43 Å²	43	37.9 Å²	37.9	20%	0.199	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.2	175.6	-62.9	162.9	0	0	0	113.9	A273 V275 G279 A302 Q305	A273-H277 PolarHBondContact O-CD2 3.27Å; A273-H277 PolarHBondContact O-N 3.44Å; A273-H277 PolarHBondContact O-ND1 3.31Å; V275-H277 VanDerWaalsContact C-N 3.33Å; V275-H277 PolarHBondContact O-N 2.99Å; H277-G279 VanDerWaalsContact C-N 3.28Å; H277-G279 PolarHBondContact O-N 2.93Å; H277-A302 PolarHBondContact NE2-O 3.4Å; H277-Q305 PolarHBondContact CE1-OE1 3.5Å; H277-Q305 WeakPolarHBondContact NE2-CB 3.47Å
278	K	87.3	Confident	90.8	Very high	180 Å²	180	34.8 Å²	34.8	78%	0.783	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-22.7	176.9	-62.7	178.6	-178.4	-180	0	112.7	V275 L276	V275-K278 WeakPolarHBondContact O-CB 3.33Å; V275-K278 PolarHBondContact O-N 2.81Å; L276-K278 PolarHBondContact O-N 3.09Å
279	G	85.2	Confident	90.4	Very high	15 Å²	15	34.1 Å²	34.1	16%	0.155	19%	0.186	C	C	.	.	S	Bend	trans	-107.6	169.7	-179.1	0	0	0	0	0	113.5	L276 H277	L276-G279 PolarHBondContact O-N 3.14Å; L276-G279 VanDerWaalsContact O-N 3.16Å; H277-G279 VanDerWaalsContact C-N 3.28Å; H277-G279 PolarHBondContact O-N 2.93Å
280	S	89.3	Confident	89.7	Confident	95 Å²	95	36 Å²	36	66%	0.664	20%	0.195	S	C	*	.			trans	-102.4	141.2	166.6	55.9	0	0	0	0	110.1
281	V	91.5	Very high	89.1	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.024	20%	0.197	C	C	.	.			trans	-123	135.9	176.9	176.4	0	0	0	0	108	V206 L283 V284 L306 K307 C308 P309	V206-V281 HydrophobicContact CB-CG1 4.08Å; V206-V281 HydrophobicContact CG2-CB 4.34Å; V206-V281 HydrophobicContact CG2-CG1 3.57Å; V206-V281 HydrophobicContact CG2-CG2 3.83Å; V281-L283 VanDerWaalsContact CG1-O 3.28Å; V281-L283 WeakPolarHBondContact CG1-O 3.49Å; V281-V284 HydrophobicContact CG1-CG2 4.32Å; V281-L306 HydrophobicContact CG2-CD1 4.36Å; V281-K307 PolarHBondContact N-O 3.09Å; V281-K307 VanDerWaalsContact N-O 3.09Å; V281-C308 WeakPolarHBondContact O-CA 3.39Å; V281-C308 PolarHBondContact O-SG 3.43Å; V281-P309 WeakPolarHBondContact O-CD 3.37Å
282	G	92.3	Very high	88.8	Confident	16 Å²	16	30.9 Å²	30.9	17%	0.165	17%	0.168	C	C	.	.	S	Bend	trans	-77.2	-31.7	-175.5	0	0	0	0	0	114.2	K204 R310	K204-G282 PolarHBondContact O-N 3.45Å; G282-R310 WeakPolarHBondContact O-CB 3.35Å
283	L	95.1	Very high	88.2	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	136.6	-179	179.1	70.5	0	0	0	111.6	V159 I188 L191 I202 K204 A205 V206 V281 L285 C308 R310 V312	V159-L283 HydrophobicContact CG1-CD1 4.42Å; I188-L283 HydrophobicContact CG1-CD2 3.78Å; L191-L283 HydrophobicContact CD1-CD2 3.93Å; I202-L283 HydrophobicContact CD1-CB 3.65Å; I202-L283 HydrophobicContact CD1-CD2 3.99Å; I202-L283 HydrophobicContact CG2-CB 4.45Å; K204-L283 PolarHBondContact O-N 3.41Å; A205-L283 WeakPolarHBondContact CA-O 3.42Å; A205-L283 HydrophobicContact CB-CB 4.31Å; A205-L283 HydrophobicContact CB-CD2 4.47Å; V206-L283 PolarHBondContact N-O 3.24Å; V281-L283 VanDerWaalsContact CG1-O 3.28Å; V281-L283 WeakPolarHBondContact CG1-O 3.49Å; L283-L285 HydrophobicContact CD1-CD2 4.29Å; L283-L285 HydrophobicContact CD2-CD2 4Å; L283-L285 HydrophobicContact CD2-CG 4.38Å; L283-L285 HydrophobicContact CG-CD2 4.12Å; L283-C308 VanDerWaalsContact C-SG 3.54Å; L283-C308 VanDerWaalsContact CA-SG 3.57Å; L283-R310 WeakPolarHBondContact CA-O 3.07Å; L283-R310 HydrophobicContact CD1-CB 3.74Å; L283-V312 HydrophobicContact CD1-CG2 3.99Å
284	V	95.3	Very high	87.8	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.018	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.5	169.4	171.2	0	0	0	0	109.4	V206 V281 L306 C308 R310 V312	V206-V284 HydrophobicContact CB-CG2 4.45Å; V206-V284 CarbonylContact O-C 3.53Å; V206-V284 WeakPolarHBondContact O-CA 3.5Å; V281-V284 HydrophobicContact CG1-CG2 4.32Å; V284-L306 HydrophobicContact CG2-CD2 3.47Å; V284-L306 VanDerWaalsContact CG2-CD2 3.47Å; V284-C308 HydrophobicContact CG2-CB 3.72Å; V284-C308 VanDerWaalsContact CG2-SG 3.58Å; V284-C308 PolarHBondContact N-SG 2.81Å; V284-C308 VanDerWaalsContact N-SG 3.44Å; V284-R310 PolarHBondContact N-O 3.2Å; V284-V312 PolarHBondContact O-N 3.47Å
285	L	95.7	Very high	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.7	168	-57.1	-169.8	0	0	0	109.4	C184 I188 V206 I207 V208 W217 L283 V312	C184-L285 HydrophobicContact CB-CD1 3.73Å; I188-L285 HydrophobicContact CD1-CD1 3.34Å; I188-L285 HydrophobicContact CD1-CG 4.18Å; I188-L285 HydrophobicContact CG1-CD1 3.98Å; V206-L285 PolarHBondContact O-N 3.39Å; I207-L285 WeakPolarHBondContact CA-O 3.42Å; I207-L285 HydrophobicContact CD1-CD1 4.4Å; I207-L285 HydrophobicContact CG1-CB 4.26Å; I207-L285 HydrophobicContact CG1-CD1 4.16Å; I207-L285 HydrophobicContact CG1-CG 4.39Å; I207-L285 HydrophobicContact CG2-CB 4.42Å; V208-L285 PolarHBondContact N-O 2.91Å; W217-L285 HydrophobicContact CH2-CD1 4.39Å; L283-L285 HydrophobicContact CD1-CD2 4.29Å; L283-L285 HydrophobicContact CD2-CD2 4Å; L283-L285 HydrophobicContact CD2-CG 4.38Å; L283-L285 HydrophobicContact CG-CD2 4.12Å; L285-V312 CarbonylContact C-O 3.55Å; L285-V312 WeakPolarHBondContact CA-O 3.48Å; L285-V312 HydrophobicContact CD2-CB 3.45Å; L285-V312 VanDerWaalsContact CD2-CB 3.45Å; L285-V312 HydrophobicContact CD2-CG1 4.09Å; L285-V312 HydrophobicContact CD2-CG2 3.78Å
286	C	93.9	Very high	86.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	105.8	173.6	-68.9	0	0	0	0	109.7	L292 V312 L314	C286-L292 HydrophobicContact CB-CD1 4.18Å; C286-V312 PolarHBondContact N-O 3.43Å; C286-L314 PolarHBondContact O-N 3.21Å
287	D	91.3	Very high	86.5	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.064	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.6	177.8	-167	19.7	0	0	0	111.7	V208 W217 Y266 G289 L314	V208-D287 PolarHBondContact O-N 3.43Å; W217-D287 HydrophobicContact CZ2-CB 4.25Å; W217-D287 PolarHBondContact NE1-OD2 3.46Å; Y266-D287 WeakPolarHBondContact CE2-O 3.46Å; Y266-D287 PolarHBondContact OH-O 3.5Å; D287-G289 VanDerWaalsContact C-N 3.27Å; D287-G289 PolarHBondContact O-N 2.88Å; D287-L314 HydrophobicContact CB-CD1 4.37Å
288	E	85.4	Confident	86.3	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.065	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	45.1	-167.9	-59.1	-66.6	-178.2	0	0	112.5	P210 L213 H290 R291 L314 Q606	P210-E288 HydrophobicContact CG-CB 4.05Å; P210-E288 HydrophobicContact CG-CG 4.05Å; L213-E288 HydrophobicContact CD1-CG 4.1Å; E288-H290 PolarHBondContact O-N 2.86Å; E288-H290 IonicContact OE2-CE1 3.3Å; E288-H290 PolarHBondContact OE2-CE1 3.23Å; E288-H290 IonicContact OE2-ND1 2.65Å; E288-H290 PolarHBondContact OE2-ND1 2.88Å; E288-H290 VanDerWaalsContact OE2-ND1 3.09Å; E288-R291 WeakPolarHBondContact O-CG 3.31Å; E288-R291 PolarHBondContact O-N 3.38Å; E288-L314 CarbonylContact C-O 3.58Å; E288-L314 WeakPolarHBondContact CA-O 3.45Å; E288-L314 PolarHBondContact N-O 2.83Å; E288-L314 VanDerWaalsContact N-O 3.11Å; E288-Q606 PolarHBondContact OE1-NE2 3.03Å
289	G	83	Confident	86.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-60.6	-12	-177.1	0	0	0	0	0	115	D287 R291 L292 L314 L329	D287-G289 VanDerWaalsContact C-N 3.27Å; D287-G289 PolarHBondContact O-N 2.88Å; G289-R291 PolarHBondContact O-N 2.8Å; G289-L292 VanDerWaalsContact O-CB 3.31Å; G289-L292 WeakPolarHBondContact O-CB 3.47Å; G289-L292 PolarHBondContact O-N 3Å; G289-L314 PolarHBondContact N-O 2.81Å; G289-L329 WeakPolarHBondContact O-CD2 3.43Å
290	H	78	Confident	86.7	Confident	41 Å²	41	39.1 Å²	39.1	19%	0.19	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-58.9	-12.1	166	74.6	-98.3	0	0	0	112.8	E288 L292 K293	E288-H290 PolarHBondContact O-N 2.86Å; E288-H290 IonicContact OE2-CE1 3.3Å; E288-H290 PolarHBondContact OE2-CE1 3.23Å; E288-H290 IonicContact OE2-ND1 2.65Å; E288-H290 PolarHBondContact OE2-ND1 2.88Å; E288-H290 VanDerWaalsContact OE2-ND1 3.09Å; H290-L292 PolarHBondContact O-N 3.14Å; H290-K293 WeakPolarHBondContact O-CD 3.43Å; H290-K293 WeakPolarHBondContact O-CE 3.33Å; H290-K293 WeakPolarHBondContact O-CG 3.29Å
291	R	78.4	Confident	86.8	Confident	110 Å²	110	39.4 Å²	39.4	42%	0.415	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-70.5	-15.2	168.4	-69.4	-177.4	171.3	-153.4	-2.1	113.8	E267 E288 G289	E267-R291 IonicContact OE1-NH1 3.56Å; E288-R291 WeakPolarHBondContact O-CG 3.31Å; E288-R291 PolarHBondContact O-N 3.38Å; G289-R291 PolarHBondContact O-N 2.8Å
292	L	82.8	Confident	86.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-97	19.1	-177	-57.4	177.5	0	0	0	113.1	Y266 C286 G289 H290 N294 T299 Y300 L303 L313 L329 F332	Y266-L292 HydrophobicContact CE1-CD2 4.26Å; C286-L292 HydrophobicContact CB-CD1 4.18Å; G289-L292 VanDerWaalsContact O-CB 3.31Å; G289-L292 WeakPolarHBondContact O-CB 3.47Å; G289-L292 PolarHBondContact O-N 3Å; H290-L292 PolarHBondContact O-N 3.14Å; L292-N294 VanDerWaalsContact C-N 3.32Å; L292-N294 PolarHBondContact O-N 3.14Å; L292-T299 HydrophobicContact CD2-CG2 4.01Å; L292-Y300 HydrophobicContact CB-CD2 4.23Å; L292-L303 HydrophobicContact CD1-CD1 3.85Å; L292-L303 HydrophobicContact CD2-CD1 3.82Å; L292-L313 HydrophobicContact CD1-CD1 4.19Å; L292-L329 HydrophobicContact CB-CD2 4.17Å; L292-F332 HydrophobicContact CD1-CD1 4.32Å; L292-F332 HydrophobicContact CD1-CE1 4.11Å; L292-F332 HydrophobicContact CD1-CZ 4.36Å
293	K	79.5	Confident	86.8	Confident	33 Å²	33	39 Å²	39	14%	0.143	19%	0.19	C	C	.	.			trans	-57.4	-38.9	179.2	-76.4	160.1	178.8	-94.4	0	114.3	H290 Q320 E325 S328	H290-K293 WeakPolarHBondContact O-CD 3.43Å; H290-K293 WeakPolarHBondContact O-CE 3.33Å; H290-K293 WeakPolarHBondContact O-CG 3.29Å; K293-Q320 VanDerWaalsContact NZ-CG 3.27Å; K293-E325 HydrophobicContact CB-CB 4.24Å; K293-E325 HydrophobicContact CB-CG 3.82Å; K293-E325 WeakPolarHBondContact CD-OE1 3.24Å; K293-E325 WeakPolarHBondContact CD-OE2 3.02Å; K293-E325 HydrophobicContact CG-CB 4.18Å; K293-E325 VanDerWaalsContact CG-CD 3.5Å; K293-E325 HydrophobicContact CG-CG 4.01Å; K293-E325 WeakPolarHBondContact CG-OE2 3.47Å; K293-E325 IonicContact NZ-OE1 3.66Å; K293-E325 IonicContact NZ-OE2 3.3Å; K293-E325 PolarHBondContact NZ-OE2 2.89Å; K293-S328 VanDerWaalsContact O-CB 3.31Å; K293-S328 WeakPolarHBondContact O-CB 3.25Å; K293-S328 PolarHBondContact O-OG 3.3Å
294	N	80.1	Confident	86.6	Confident	86 Å²	86	40.8 Å²	40.8	46%	0.46	20%	0.201	S	C	.	.			trans	-97.9	117.7	-179.1	-173.7	-9.1	0	0	0	110.2	L292 E296 N297	L292-N294 VanDerWaalsContact C-N 3.32Å; L292-N294 PolarHBondContact O-N 3.14Å; N294-E296 PolarHBondContact O-N 3.35Å; N294-E296 WeakPolarHBondContact OD1-CB 3.41Å; N294-E296 PolarHBondContact OD1-N 3.42Å; N294-N297 WeakPolarHBondContact O-CB 3.23Å; N294-N297 PolarHBondContact O-N 3.41Å; N294-N297 VanDerWaalsContact O-N 3.13Å
295	S	78	Confident	86.4	Confident	54 Å²	54	46.4 Å²	46.4	38%	0.378	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.3	176.6	55	0	0	0	0	113.9	N297 Y300	S295-N297 PolarHBondContact O-N 3.43Å; S295-Y300 WeakPolarHBondContact O-CD1 3.37Å
296	E	80.8	Confident	86.2	Confident	152 Å²	152	46.6 Å²	46.6	71%	0.71	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-10.7	177	-58.2	-177.1	162.6	0	0	112.8	N294 Q298	N294-E296 PolarHBondContact O-N 3.35Å; N294-E296 WeakPolarHBondContact OD1-CB 3.41Å; N294-E296 PolarHBondContact OD1-N 3.42Å; E296-Q298 PolarHBondContact O-N 2.68Å
297	N	83.4	Confident	86	Confident	53 Å²	53	53.3 Å²	53.3	28%	0.283	26%	0.257	S	S	.	.	S	Bend	trans	-63.4	130.8	-180	-171.6	-7.2	0	0	0	110.5	N294 S295 T299 Y300 Q301	N294-N297 WeakPolarHBondContact O-CB 3.23Å; N294-N297 PolarHBondContact O-N 3.41Å; N294-N297 VanDerWaalsContact O-N 3.13Å; S295-N297 PolarHBondContact O-N 3.43Å; N297-T299 PolarHBondContact O-N 2.74Å; N297-T299 VanDerWaalsContact O-N 3.1Å; N297-T299 PolarHBondContact OD1-N 2.87Å; N297-Y300 WeakPolarHBondContact O-CA 3.32Å; N297-Y300 VanDerWaalsContact O-CB 3.25Å; N297-Y300 WeakPolarHBondContact O-CB 3.33Å; N297-Y300 PolarHBondContact O-N 3.22Å; N297-Q301 PolarHBondContact O-N 3.31Å; N297-Q301 VanDerWaalsContact O-N 3.14Å
298	Q	86.8	Confident	86	Confident	122 Å²	122	53.3 Å²	53.3	57%	0.57	26%	0.258	S	S	*	.	H	α-helix	trans	-53.9	-34.5	176.9	-67	178.4	1.5	0	0	112.6	R270 E296 Q301 A302	R270-Q298 HydrophobicContact CG-CB 4.28Å; E296-Q298 PolarHBondContact O-N 2.68Å; Q298-Q301 PolarHBondContact O-N 3.26Å; Q298-A302 WeakPolarHBondContact O-CB 3.38Å; Q298-A302 PolarHBondContact O-N 3.31Å
299	T	89.9	Confident	86.3	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-39.5	176.2	-57.5	0	0	0	0	111.9	Y266 L292 N297 A302 L303	Y266-T299 HydrophobicContact CD1-CG2 3.47Å; Y266-T299 VanDerWaalsContact CD1-CG2 3.47Å; Y266-T299 HydrophobicContact CE1-CG2 4.14Å; Y266-T299 HydrophobicContact CG-CG2 4.38Å; L292-T299 HydrophobicContact CD2-CG2 4.01Å; N297-T299 PolarHBondContact O-N 2.74Å; N297-T299 VanDerWaalsContact O-N 3.1Å; N297-T299 PolarHBondContact OD1-N 2.87Å; T299-A302 PolarHBondContact O-N 2.94Å; T299-L303 HydrophobicContact CG2-CD1 4.1Å; T299-L303 VanDerWaalsContact O-CG 3.31Å; T299-L303 WeakPolarHBondContact O-CG 3.35Å; T299-L303 PolarHBondContact O-N 2.81Å; T299-L303 VanDerWaalsContact O-N 3.09Å
300	Y	90.8	Very high	86.9	Confident	14 Å²	14	58.4 Å²	58.4	6%	0.055	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-50.4	176.4	-175.7	-83.1	0	0	0	110.4	L292 S295 N297 A302 L303 V304 S328 H331 F332	L292-Y300 HydrophobicContact CB-CD2 4.23Å; S295-Y300 WeakPolarHBondContact O-CD1 3.37Å; N297-Y300 WeakPolarHBondContact O-CA 3.32Å; N297-Y300 VanDerWaalsContact O-CB 3.25Å; N297-Y300 WeakPolarHBondContact O-CB 3.33Å; N297-Y300 PolarHBondContact O-N 3.22Å; Y300-A302 VanDerWaalsContact C-N 3.34Å; Y300-A302 PolarHBondContact O-N 2.93Å; Y300-L303 PolarHBondContact O-N 3.32Å; Y300-L303 VanDerWaalsContact O-N 3.16Å; Y300-V304 HydrophobicContact CD1-CG2 3.83Å; Y300-V304 HydrophobicContact CE1-CG2 3.54Å; Y300-V304 WeakPolarHBondContact O-CG2 3.36Å; Y300-V304 PolarHBondContact O-N 3Å; Y300-S328 WeakPolarHBondContact CE2-O 3.1Å; Y300-S328 PolarHBondContact OH-O 3.49Å; Y300-S328 VanDerWaalsContact OH-O 3.05Å; Y300-H331 PolarHBondContact OH-CD2 3.13Å; Y300-F332 HydrophobicContact CE2-CB 3.69Å; Y300-F332 HydrophobicContact CE2-CD2 4.22Å; Y300-F332 HydrophobicContact CE2-CG 4.26Å; Y300-F332 PolarHBondContact OH-N 3.19Å
301	Q	90.3	Very high	87.7	Confident	100 Å²	100	57.3 Å²	57.3	47%	0.467	28%	0.28	S	S	.	.	H	α-helix	trans	-58.9	-43.7	178.3	-65.3	179.9	-12.5	0	0	112.2	N297 Q298 L303 V304 Q305	N297-Q301 PolarHBondContact O-N 3.31Å; N297-Q301 VanDerWaalsContact O-N 3.14Å; Q298-Q301 PolarHBondContact O-N 3.26Å; Q301-L303 VanDerWaalsContact C-N 3.33Å; Q301-L303 PolarHBondContact O-N 2.99Å; Q301-V304 PolarHBondContact O-N 2.95Å; Q301-Q305 WeakPolarHBondContact O-CG 3.27Å; Q301-Q305 PolarHBondContact O-N 3.12Å; Q301-Q305 VanDerWaalsContact O-N 3.16Å
302	A	92	Very high	88.4	Confident	9 Å²	9	52.1 Å²	52.1	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-38.1	177.7	0	0	0	0	0	112.9	F269 A273 H277 Q298 T299 Y300	F269-A302 HydrophobicContact CD1-CB 4.36Å; F269-A302 HydrophobicContact CE1-CB 3.87Å; A273-A302 HydrophobicContact CB-CB 3.84Å; H277-A302 PolarHBondContact NE2-O 3.4Å; Q298-A302 WeakPolarHBondContact O-CB 3.38Å; Q298-A302 PolarHBondContact O-N 3.31Å; T299-A302 PolarHBondContact O-N 2.94Å; Y300-A302 VanDerWaalsContact C-N 3.34Å; Y300-A302 PolarHBondContact O-N 2.93Å
303	L	92.2	Very high	89	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-74.5	-38.2	178.3	-71.6	165.2	0	0	0	112.2	V208 Y266 F269 L292 T299 Y300 Q301 Q305 L306 F332	V208-L303 HydrophobicContact CG2-CD2 3.94Å; Y266-L303 HydrophobicContact CE1-CD1 4.27Å; F269-L303 HydrophobicContact CD1-CD2 3.92Å; F269-L303 HydrophobicContact CD1-CG 4.17Å; F269-L303 HydrophobicContact CE1-CB 4.36Å; F269-L303 HydrophobicContact CE1-CD2 3.37Å; F269-L303 HydrophobicContact CE1-CG 3.61Å; F269-L303 HydrophobicContact CE2-CD2 4.08Å; F269-L303 HydrophobicContact CZ-CD2 3.47Å; F269-L303 VanDerWaalsContact CZ-CD2 3.47Å; F269-L303 HydrophobicContact CZ-CG 4.15Å; L292-L303 HydrophobicContact CD1-CD1 3.85Å; L292-L303 HydrophobicContact CD2-CD1 3.82Å; T299-L303 HydrophobicContact CG2-CD1 4.1Å; T299-L303 VanDerWaalsContact O-CG 3.31Å; T299-L303 WeakPolarHBondContact O-CG 3.35Å; T299-L303 PolarHBondContact O-N 2.81Å; T299-L303 VanDerWaalsContact O-N 3.09Å; Y300-L303 PolarHBondContact O-N 3.32Å; Y300-L303 VanDerWaalsContact O-N 3.16Å; Q301-L303 VanDerWaalsContact C-N 3.33Å; Q301-L303 PolarHBondContact O-N 2.99Å; L303-Q305 VanDerWaalsContact C-N 3.3Å; L303-Q305 PolarHBondContact O-N 2.84Å; L303-L306 VanDerWaalsContact O-CB 3.28Å; L303-L306 WeakPolarHBondContact O-CB 3.23Å; L303-L306 PolarHBondContact O-N 3.28Å; L303-L306 VanDerWaalsContact O-N 3.16Å; L303-F332 HydrophobicContact CB-CE2 3.49Å; L303-F332 VanDerWaalsContact CB-CE2 3.49Å; L303-F332 HydrophobicContact CB-CZ 3.87Å; L303-F332 HydrophobicContact CD1-CE2 4.37Å; L303-F332 HydrophobicContact CD1-CZ 4.19Å
304	V	90.5	Very high	89.6	Confident	37 Å²	37	50.5 Å²	50.5	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-39.4	177.3	169.6	0	0	0	0	111.3	Y300 Q301 L306 R311 F332 M335	Y300-V304 HydrophobicContact CD1-CG2 3.83Å; Y300-V304 HydrophobicContact CE1-CG2 3.54Å; Y300-V304 WeakPolarHBondContact O-CG2 3.36Å; Y300-V304 PolarHBondContact O-N 3Å; Q301-V304 PolarHBondContact O-N 2.95Å; V304-L306 PolarHBondContact O-N 3.16Å; V304-R311 PolarHBondContact O-NH2 2.84Å; V304-R311 VanDerWaalsContact O-NH2 3.11Å; V304-F332 HydrophobicContact CG2-CD2 3.89Å; V304-F332 HydrophobicContact CG2-CE2 4.33Å; V304-M335 HydrophobicContact CG1-CE 3.67Å; V304-M335 HydrophobicContact CG1-SD 4.17Å
305	Q	90.9	Very high	89.8	Confident	122 Å²	122	46.5 Å²	46.5	57%	0.57	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.1	177.6	-72.3	173.8	2.6	0	0	113.9	H277 Q301 L303 K307	H277-Q305 PolarHBondContact CE1-OE1 3.5Å; H277-Q305 WeakPolarHBondContact NE2-CB 3.47Å; Q301-Q305 WeakPolarHBondContact O-CG 3.27Å; Q301-Q305 PolarHBondContact O-N 3.12Å; Q301-Q305 VanDerWaalsContact O-N 3.16Å; L303-Q305 VanDerWaalsContact C-N 3.3Å; L303-Q305 PolarHBondContact O-N 2.84Å; Q305-K307 PolarHBondContact O-N 3.32Å
306	L	91.4	Very high	89.6	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.218	C	C	.	.	S	Bend	trans	-70.3	125.6	177.4	-174	63.7	0	0	0	110.4	F269 L276 V281 V284 L303 V304 C308 R311	F269-L306 HydrophobicContact CE2-CD2 4.14Å; F269-L306 HydrophobicContact CZ-CD2 4.14Å; L276-L306 HydrophobicContact CB-CD1 4Å; V281-L306 HydrophobicContact CG2-CD1 4.36Å; V284-L306 HydrophobicContact CG2-CD2 3.47Å; V284-L306 VanDerWaalsContact CG2-CD2 3.47Å; L303-L306 VanDerWaalsContact O-CB 3.28Å; L303-L306 WeakPolarHBondContact O-CB 3.23Å; L303-L306 PolarHBondContact O-N 3.28Å; L303-L306 VanDerWaalsContact O-N 3.16Å; V304-L306 PolarHBondContact O-N 3.16Å; L306-C308 VanDerWaalsContact C-N 3.28Å; L306-C308 HydrophobicContact CG-CB 4.45Å; L306-C308 PolarHBondContact O-N 3.24Å; L306-R311 PolarHBondContact O-NH2 2.72Å
307	K	91.2	Very high	88.8	Confident	141 Å²	141	37.6 Å²	37.6	61%	0.613	19%	0.188	S	C	*	.			trans	-70.9	82.9	176.1	-66.1	-179.9	-178.3	177.6	0	110.4	V281 Q305	V281-K307 PolarHBondContact N-O 3.09Å; V281-K307 VanDerWaalsContact N-O 3.09Å; Q305-K307 PolarHBondContact O-N 3.32Å
308	C	91.7	Very high	87.5	Confident	12 Å²	12	36.9 Å²	36.9	8%	0.081	19%	0.186	C	C	.	.			trans	-137.1	120.7	177.9	-172.1	0	0	0	0	111	V281 L283 V284 L306 R310	V281-C308 WeakPolarHBondContact O-CA 3.39Å; V281-C308 PolarHBondContact O-SG 3.43Å; L283-C308 VanDerWaalsContact C-SG 3.54Å; L283-C308 VanDerWaalsContact CA-SG 3.57Å; V284-C308 HydrophobicContact CG2-CB 3.72Å; V284-C308 VanDerWaalsContact CG2-SG 3.58Å; V284-C308 PolarHBondContact N-SG 2.81Å; V284-C308 VanDerWaalsContact N-SG 3.44Å; L306-C308 VanDerWaalsContact C-N 3.28Å; L306-C308 HydrophobicContact CG-CB 4.45Å; L306-C308 PolarHBondContact O-N 3.24Å; C308-R310 PolarHBondContact SG-O 3.32Å
309	P	90.9	Very high	86.3	Confident	74 Å²	74	32 Å²	32	48%	0.481	16%	0.164	S	C	.	.	S	Bend	trans	-73.3	-35	179.9	27	-30.8	0	0	0	112.5	H168 V281	H168-P309 WeakPolarHBondContact CB-O 3.36Å; V281-P309 WeakPolarHBondContact O-CD 3.37Å
310	R	94.6	Very high	84.7	Confident	47 Å²	47	34.9 Å²	34.9	18%	0.177	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.4	-171.4	-55	179.7	169.4	83.1	6	110.9	V159 H168 G282 L283 V284 C308	V159-R310 HydrophobicContact CB-CB 4.37Å; V159-R310 HydrophobicContact CB-CG 4.49Å; V159-R310 VanDerWaalsContact O-CD 3.23Å; V159-R310 WeakPolarHBondContact O-CD 3.48Å; V159-R310 PolarHBondContact O-NE 2.94Å; H168-R310 HydrophobicContact CB-CB 4.43Å; H168-R310 HydrophobicContact CB-CG 3.94Å; H168-R310 WeakPolarHBondContact O-CA 3.38Å; G282-R310 WeakPolarHBondContact O-CB 3.35Å; L283-R310 WeakPolarHBondContact CA-O 3.07Å; L283-R310 HydrophobicContact CD1-CB 3.74Å; V284-R310 PolarHBondContact N-O 3.2Å; C308-R310 PolarHBondContact SG-O 3.32Å
311	R	94.7	Very high	83.2	Confident	18 Å²	18	36.2 Å²	36.2	7%	0.068	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.9	-174.7	-62.9	178.8	-179.1	-170.2	-3.1	109.9	H168 G169 C170 V304 L306 F332	H168-R311 PolarHBondContact O-N 3.29Å; G169-R311 CarbonylContact C-O 3.6Å; G169-R311 VanDerWaalsContact CA-O 3.23Å; G169-R311 WeakPolarHBondContact CA-O 3.32Å; C170-R311 PolarHBondContact N-O 3.42Å; V304-R311 PolarHBondContact O-NH2 2.84Å; V304-R311 VanDerWaalsContact O-NH2 3.11Å; L306-R311 PolarHBondContact O-NH2 2.72Å; R311-F332 WeakPolarHBondContact CD-O 3.43Å; R311-F332 PolarHBondContact NH1-O 2.9Å
312	V	94.9	Very high	82.2	Confident	1 Å²	1	35 Å²	35	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.4	174	-176.5	0	0	0	0	108.9	M155 V159 C170 L187 L283 V284 L285 C286 L314	M155-V312 HydrophobicContact SD-CG1 4.19Å; V159-V312 HydrophobicContact CG1-CG2 3.52Å; C170-V312 HydrophobicContact CB-CG1 4.29Å; C170-V312 HydrophobicContact CB-CG2 4.24Å; C170-V312 CarbonylContact O-C 3.57Å; C170-V312 VanDerWaalsContact O-CA 3.25Å; C170-V312 WeakPolarHBondContact O-CA 3.46Å; L187-V312 HydrophobicContact CD2-CG2 4.16Å; L283-V312 HydrophobicContact CD1-CG2 3.99Å; V284-V312 PolarHBondContact O-N 3.47Å; L285-V312 CarbonylContact C-O 3.55Å; L285-V312 WeakPolarHBondContact CA-O 3.48Å; L285-V312 HydrophobicContact CD2-CB 3.45Å; L285-V312 VanDerWaalsContact CD2-CB 3.45Å; L285-V312 HydrophobicContact CD2-CG1 4.09Å; L285-V312 HydrophobicContact CD2-CG2 3.78Å; C286-V312 PolarHBondContact N-O 3.43Å; V312-L314 HydrophobicContact CG1-CD2 3.81Å
313	L	93.7	Very high	81.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.2	178.7	-169.2	147.1	0	0	0	109.3	C170 I171 M172 L292 L329 F332 V333	C170-L313 PolarHBondContact O-N 2.77Å; I171-L313 CarbonylContact C-O 3.53Å; I171-L313 WeakPolarHBondContact CA-O 3.3Å; I171-L313 HydrophobicContact CG1-CB 4.26Å; I171-L313 HydrophobicContact CG2-CD2 4.34Å; M172-L313 PolarHBondContact N-O 2.99Å; L292-L313 HydrophobicContact CD1-CD1 4.19Å; L313-L329 HydrophobicContact CD1-CD2 3.5Å; L313-L329 HydrophobicContact CD2-CD2 4.19Å; L313-F332 HydrophobicContact CD1-CD1 3.9Å; L313-F332 HydrophobicContact CD1-CE1 4.38Å; L313-V333 HydrophobicContact CB-CG2 3.77Å; L313-V333 HydrophobicContact CD1-CG2 4.3Å
314	L	92.2	Very high	80.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.4	178.8	-44	175.9	0	0	0	108.9	M172 C184 W217 C286 D287 E288 G289 V312	M172-L314 HydrophobicContact CB-CD2 3.75Å; M172-L314 HydrophobicContact CG-CD2 4.39Å; M172-L314 WeakPolarHBondContact O-CA 3.13Å; M172-L314 HydrophobicContact SD-CD2 4.07Å; C184-L314 WeakPolarHBondContact SG-CD1 3.48Å; C184-L314 WeakPolarHBondContact SG-CD2 3.49Å; W217-L314 HydrophobicContact CH2-CD1 4.11Å; W217-L314 HydrophobicContact CZ2-CD1 3.92Å; C286-L314 PolarHBondContact O-N 3.21Å; D287-L314 HydrophobicContact CB-CD1 4.37Å; E288-L314 CarbonylContact C-O 3.58Å; E288-L314 WeakPolarHBondContact CA-O 3.45Å; E288-L314 PolarHBondContact N-O 2.83Å; E288-L314 VanDerWaalsContact N-O 3.11Å; G289-L314 PolarHBondContact N-O 2.81Å; V312-L314 HydrophobicContact CG1-CD2 3.81Å
315	S	85.4	Confident	80.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.007	19%	0.191	C	C	.	.			trans	-128	136.6	171.3	-168.8	0	0	0	0	109.8	M172 A173 T317	M172-S315 PolarHBondContact O-N 2.65Å; A173-S315 CarbonylContact C-O 3.5Å; A173-S315 WeakPolarHBondContact CA-O 3.37Å; S315-T317 PolarHBondContact OG-N 2.86Å; S315-T317 PolarHBondContact OG-O 3.42Å; S315-T317 PolarHBondContact OG-OG1 3.27Å
316	G	72.5	Confident	79.8	Confident	8 Å²	8	33 Å²	33	8%	0.082	17%	0.168	C	C	.	.	S	Bend	trans	-92.8	-15.5	169.1	0	0	0	0	0	113.7
317	T	65.8	Low	79.6	Confident	12 Å²	12	33.3 Å²	33.3	7%	0.074	17%	0.17	C	C	.	.	S	Bend	trans	-104.8	138.5	-177.5	58.3	0	0	0	0	108.3	S315 I319 A602	S315-T317 PolarHBondContact OG-N 2.86Å; S315-T317 PolarHBondContact OG-O 3.42Å; S315-T317 PolarHBondContact OG-OG1 3.27Å; T317-I319 PolarHBondContact O-N 2.69Å; T317-A602 HydrophobicContact CG2-CB 3.61Å
318	P	56	Low	79.4	Confident	37 Å²	37	27 Å²	27	24%	0.24	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-60.7	139	175.5	29.5	-35.2	0	0	0	108.5	Q320 S646	P318-Q320 PolarHBondContact O-N 2.84Å; P318-S646 VanDerWaalsContact CB-OG 3.28Å; P318-S646 WeakPolarHBondContact CB-OG 3.42Å
319	I	61.1	Low	79.2	Confident	20 Å²	20	26.5 Å²	26.5	10%	0.103	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-58.4	126.2	179.1	-58.6	168.3	0	0	0	106.3	T317 Y326 L329 I383	T317-I319 PolarHBondContact O-N 2.69Å; I319-Y326 HydrophobicContact CB-CD2 4.18Å; I319-Y326 HydrophobicContact CD1-CD2 3.68Å; I319-Y326 HydrophobicContact CD1-CE2 3.77Å; I319-Y326 HydrophobicContact CG2-CD2 3.86Å; I319-L329 HydrophobicContact CB-CD1 4.37Å; I319-L329 HydrophobicContact CD1-CD1 3.75Å; I319-L329 HydrophobicContact CG1-CD1 3.72Å; I319-L329 HydrophobicContact CG2-CD1 3.75Å; I319-I383 HydrophobicContact CD1-CD1 4.02Å
320	Q	56.7	Low	79	Confident	73 Å²	73	23 Å²	23	34%	0.341	12%	0.117	S	C	.	.	P	Polyproline II helix	trans	-65.5	155.1	-174	-71.4	172.9	-25	0	0	108.9	K293 P318 D322 E325 N600	K293-Q320 VanDerWaalsContact NZ-CG 3.27Å; P318-Q320 PolarHBondContact O-N 2.84Å; Q320-D322 PolarHBondContact O-N 2.79Å; Q320-E325 WeakPolarHBondContact CB-OE2 3.35Å; Q320-N600 PolarHBondContact NE2-OD1 3.11Å
321	N	58.9	Low	78.8	Confident	43 Å²	43	22.7 Å²	22.7	23%	0.23	12%	0.118	C	C	.	.	S	Bend	trans	-62.9	15.6	-171.6	-87.5	-58.7	0	0	0	117.3	L645 S646 V649 R658	N321-L645 WeakPolarHBondContact ND2-CB 3.37Å; N321-L645 PolarHBondContact ND2-O 3.22Å; N321-L645 PolarHBondContact OD1-O 3.07Å; N321-S646 VanDerWaalsContact ND2-CA 3.32Å; N321-S646 WeakPolarHBondContact ND2-CA 3.18Å; N321-S646 PolarHBondContact ND2-N 3.07Å; N321-V649 WeakPolarHBondContact OD1-CG2 3.41Å; N321-R658 PolarHBondContact OD1-NH2 3.15Å
322	D	70.1	Confident	78.5	Confident	75 Å²	75	21.9 Å²	21.9	40%	0.401	12%	0.115	S	C	.	.			trans	-92.9	114.1	173.3	-172.3	-8.8	0	0	0	109.2	Q320 L324 E325 Y326	Q320-D322 PolarHBondContact O-N 2.79Å; D322-L324 PolarHBondContact O-N 2.82Å; D322-L324 WeakPolarHBondContact OD1-CB 3.2Å; D322-L324 PolarHBondContact OD1-N 3.11Å; D322-E325 HydrophobicContact CB-CB 4.34Å; D322-E325 HydrophobicContact CB-CG 3.88Å; D322-E325 WeakPolarHBondContact O-CB 3.22Å; D322-E325 PolarHBondContact O-N 2.9Å; D322-E325 VanDerWaalsContact O-N 3.09Å; D322-Y326 PolarHBondContact O-N 3.5Å
323	L	77.2	Confident	78.2	Confident	14 Å²	14	22.1 Å²	22.1	7%	0.073	12%	0.116	C	C	.	.	H	α-helix	trans	-60.1	-26.9	179.1	-67.9	173	0	0	0	111.8	Y326 F327 F344 I352 L375	L323-Y326 WeakPolarHBondContact O-CB 3.44Å; L323-Y326 PolarHBondContact O-N 2.67Å; L323-F327 PolarHBondContact O-N 3.45Å; L323-F344 HydrophobicContact CB-CE1 4.18Å; L323-F344 HydrophobicContact CB-CZ 4.23Å; L323-F344 WeakPolarHBondContact O-CE1 3.32Å; L323-I352 HydrophobicContact CD1-CB 3.87Å; L323-I352 HydrophobicContact CD1-CD1 3.8Å; L323-I352 HydrophobicContact CD1-CG1 4.45Å; L323-I352 HydrophobicContact CD1-CG2 3.81Å; L323-L375 HydrophobicContact CD2-CD2 4.08Å
324	L	79.1	Confident	78	Confident	57 Å²	57	22.3 Å²	22.3	30%	0.298	12%	0.117	S	C	.	.	H	α-helix	trans	-70.4	-35.5	176.3	-71	174.8	0	0	0	112.6	D322 Y326 F327 S328 E349	D322-L324 PolarHBondContact O-N 2.82Å; D322-L324 WeakPolarHBondContact OD1-CB 3.2Å; D322-L324 PolarHBondContact OD1-N 3.11Å; L324-Y326 VanDerWaalsContact C-N 3.32Å; L324-F327 PolarHBondContact O-N 2.8Å; L324-S328 WeakPolarHBondContact O-CB 3.43Å; L324-S328 PolarHBondContact O-N 2.8Å; L324-S328 PolarHBondContact O-OG 3.46Å; L324-E349 WeakPolarHBondContact CD2-OE2 3.31Å
325	E	79	Confident	77.7	Confident	31 Å²	31	27 Å²	27	15%	0.145	14%	0.14	C	C	.	.	H	α-helix	trans	-66.4	-40.9	173	-65.4	-169.8	166.2	0	0	110.6	K293 Q320 D322 S328 L329	K293-E325 HydrophobicContact CB-CB 4.24Å; K293-E325 HydrophobicContact CB-CG 3.82Å; K293-E325 WeakPolarHBondContact CD-OE1 3.24Å; K293-E325 WeakPolarHBondContact CD-OE2 3.02Å; K293-E325 HydrophobicContact CG-CB 4.18Å; K293-E325 VanDerWaalsContact CG-CD 3.5Å; K293-E325 HydrophobicContact CG-CG 4.01Å; K293-E325 WeakPolarHBondContact CG-OE2 3.47Å; K293-E325 IonicContact NZ-OE1 3.66Å; K293-E325 IonicContact NZ-OE2 3.3Å; K293-E325 PolarHBondContact NZ-OE2 2.89Å; Q320-E325 WeakPolarHBondContact CB-OE2 3.35Å; D322-E325 HydrophobicContact CB-CB 4.34Å; D322-E325 HydrophobicContact CB-CG 3.88Å; D322-E325 WeakPolarHBondContact O-CB 3.22Å; D322-E325 PolarHBondContact O-N 2.9Å; D322-E325 VanDerWaalsContact O-N 3.09Å; E325-S328 PolarHBondContact O-N 3.39Å; E325-L329 WeakPolarHBondContact O-CG 3.39Å; E325-L329 PolarHBondContact O-N 3.28Å
326	Y	80	Confident	77.5	Confident	26 Å²	26	29.4 Å²	29.4	10%	0.102	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-46.2	176.2	-162.7	-109	0	0	0	111.7	I319 D322 L323 L324 S328 L329 V330 L375 V379 I383	I319-Y326 HydrophobicContact CB-CD2 4.18Å; I319-Y326 HydrophobicContact CD1-CD2 3.68Å; I319-Y326 HydrophobicContact CD1-CE2 3.77Å; I319-Y326 HydrophobicContact CG2-CD2 3.86Å; D322-Y326 PolarHBondContact O-N 3.5Å; L323-Y326 WeakPolarHBondContact O-CB 3.44Å; L323-Y326 PolarHBondContact O-N 2.67Å; L324-Y326 VanDerWaalsContact C-N 3.32Å; Y326-S328 VanDerWaalsContact C-N 3.34Å; Y326-S328 PolarHBondContact O-N 3.45Å; Y326-L329 PolarHBondContact O-N 2.88Å; Y326-V330 HydrophobicContact CD1-CG2 4.19Å; Y326-V330 HydrophobicContact CE1-CG2 4.23Å; Y326-V330 WeakPolarHBondContact O-CG2 3.1Å; Y326-V330 PolarHBondContact O-N 3.37Å; Y326-L375 HydrophobicContact CE1-CG 4.47Å; Y326-V379 HydrophobicContact CE1-CB 3.7Å; Y326-V379 HydrophobicContact CE1-CG1 3.53Å; Y326-V379 HydrophobicContact CE1-CG2 3.61Å; Y326-V379 HydrophobicContact CE2-CG1 4.2Å; Y326-V379 VanDerWaalsContact OH-CB 3.23Å; Y326-V379 WeakPolarHBondContact OH-CB 3.25Å; Y326-V379 WeakPolarHBondContact OH-CG1 3.33Å; Y326-I383 HydrophobicContact CD2-CD1 4.49Å; Y326-I383 HydrophobicContact CE2-CD1 3.43Å; Y326-I383 VanDerWaalsContact CE2-CD1 3.43Å; Y326-I383 WeakPolarHBondContact OH-CD1 3.04Å
327	F	86.5	Confident	78.1	Confident	10 Å²	10	31.1 Å²	31.1	4%	0.044	17%	0.172	C	C	.	.	H	α-helix	trans	-55.9	-48.1	173.2	171	-97	0	0	0	111.7	L323 L324 L329 V330 H331 L338 A341 F344	L323-F327 PolarHBondContact O-N 3.45Å; L324-F327 PolarHBondContact O-N 2.8Å; F327-L329 VanDerWaalsContact C-N 3.32Å; F327-L329 PolarHBondContact O-N 2.85Å; F327-V330 PolarHBondContact O-N 2.93Å; F327-H331 HydrophobicContact CE1-CB 4.26Å; F327-H331 HydrophobicContact CE2-CB 4.33Å; F327-H331 HydrophobicContact CZ-CB 4.08Å; F327-H331 AromaticContact CZ-ND1 3.83Å; F327-H331 WeakPolarHBondContact O-CB 3.4Å; F327-H331 PolarHBondContact O-N 2.98Å; F327-L338 HydrophobicContact CD2-CB 4.15Å; F327-L338 HydrophobicContact CD2-CD1 4.25Å; F327-L338 HydrophobicContact CE2-CB 4.16Å; F327-A341 HydrophobicContact CD1-CB 4.34Å; F327-A341 HydrophobicContact CE1-CB 3.54Å; F327-A341 HydrophobicContact CZ-CB 3.89Å; F327-A341 VanDerWaalsContact CZ-N 3.33Å; F327-F344 HydrophobicContact CB-CD1 3.63Å; F327-F344 HydrophobicContact CB-CD2 4.31Å; F327-F344 HydrophobicContact CB-CE1 3.59Å; F327-F344 HydrophobicContact CB-CE2 4.26Å; F327-F344 HydrophobicContact CB-CG 4.01Å; F327-F344 HydrophobicContact CB-CZ 3.91Å; F327-F344 HydrophobicContact CD2-CB 3.46Å; F327-F344 VanDerWaalsContact CD2-CB 3.46Å; F327-F344 AromaticContact CD2-CD1 3.78Å; F327-F344 HydrophobicContact CD2-CD1 3.78Å; F327-F344 AromaticContact CD2-CD2 3.63Å; F327-F344 HydrophobicContact CD2-CD2 3.63Å; F327-F344 HydrophobicContact CD2-CE1 4.46Å; F327-F344 HydrophobicContact CD2-CE2 4.32Å; F327-F344 AromaticContact CD2-CG 3.3Å; F327-F344 HydrophobicContact CD2-CG 3.3Å; F327-F344 HydrophobicContact CE2-CB 3.62Å; F327-F344 HydrophobicContact CE2-CD2 4.45Å; F327-F344 HydrophobicContact CE2-CG 4.02Å; F327-F344 HydrophobicContact CG-CB 4.21Å; F327-F344 AromaticContact CG-CD1 3.79Å; F327-F344 HydrophobicContact CG-CD1 3.79Å; F327-F344 HydrophobicContact CG-CD2 4.35Å; F327-F344 HydrophobicContact CG-CE1 4.27Å; F327-F344 AromaticContact CG-CG 3.84Å; F327-F344 HydrophobicContact CG-CG 3.84Å
328	S	86.5	Confident	79.1	Confident	7 Å²	7	31.1 Å²	31.1	5%	0.049	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-42.8	-179.2	-61.3	0	0	0	0	111.6	K293 Y300 L324 E325 Y326 F332	K293-S328 VanDerWaalsContact O-CB 3.31Å; K293-S328 WeakPolarHBondContact O-CB 3.25Å; K293-S328 PolarHBondContact O-OG 3.3Å; Y300-S328 WeakPolarHBondContact CE2-O 3.1Å; Y300-S328 PolarHBondContact OH-O 3.49Å; Y300-S328 VanDerWaalsContact OH-O 3.05Å; L324-S328 WeakPolarHBondContact O-CB 3.43Å; L324-S328 PolarHBondContact O-N 2.8Å; L324-S328 PolarHBondContact O-OG 3.46Å; E325-S328 PolarHBondContact O-N 3.39Å; Y326-S328 VanDerWaalsContact C-N 3.34Å; Y326-S328 PolarHBondContact O-N 3.45Å; S328-F332 VanDerWaalsContact O-CB 3.31Å; S328-F332 WeakPolarHBondContact O-CB 3.49Å; S328-F332 PolarHBondContact O-N 3.05Å
329	L	87.5	Confident	80.5	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-68.8	-45	178.3	-65.8	171.6	0	0	0	112.4	I171 G289 L292 L313 I319 E325 Y326 F327 F332 V333	I171-L329 HydrophobicContact CD1-CB 4.47Å; G289-L329 WeakPolarHBondContact O-CD2 3.43Å; L292-L329 HydrophobicContact CB-CD2 4.17Å; L313-L329 HydrophobicContact CD1-CD2 3.5Å; L313-L329 HydrophobicContact CD2-CD2 4.19Å; I319-L329 HydrophobicContact CB-CD1 4.37Å; I319-L329 HydrophobicContact CD1-CD1 3.75Å; I319-L329 HydrophobicContact CG1-CD1 3.72Å; I319-L329 HydrophobicContact CG2-CD1 3.75Å; E325-L329 WeakPolarHBondContact O-CG 3.39Å; E325-L329 PolarHBondContact O-N 3.28Å; Y326-L329 PolarHBondContact O-N 2.88Å; F327-L329 VanDerWaalsContact C-N 3.32Å; F327-L329 PolarHBondContact O-N 2.85Å; L329-F332 PolarHBondContact O-N 2.8Å; L329-V333 WeakPolarHBondContact O-CG2 3.33Å; L329-V333 PolarHBondContact O-N 3.16Å
330	V	87.7	Confident	81.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.6	-43.1	179.6	175.7	0	0	0	0	110.8	I171 Y326 F327 F332 V333 N334 L337 L338 V379	I171-V330 HydrophobicContact CD1-CG2 4.07Å; Y326-V330 HydrophobicContact CD1-CG2 4.19Å; Y326-V330 HydrophobicContact CE1-CG2 4.23Å; Y326-V330 WeakPolarHBondContact O-CG2 3.1Å; Y326-V330 PolarHBondContact O-N 3.37Å; F327-V330 PolarHBondContact O-N 2.93Å; V330-F332 VanDerWaalsContact C-N 3.32Å; V330-F332 PolarHBondContact O-N 3.3Å; V330-V333 PolarHBondContact O-N 3.25Å; V330-N334 PolarHBondContact O-N 3.21Å; V330-L337 HydrophobicContact CG1-CD2 4.05Å; V330-L338 HydrophobicContact CB-CD1 3.89Å; V330-L338 HydrophobicContact CG1-CD1 3.62Å; V330-L338 HydrophobicContact CG1-CG 4.03Å; V330-V379 HydrophobicContact CG1-CG2 4.42Å; V330-V379 HydrophobicContact CG2-CG1 3.72Å; V330-V379 HydrophobicContact CG2-CG2 4.13Å
331	H	89.4	Confident	83.2	Confident	42 Å²	42	31.7 Å²	31.7	19%	0.194	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-38.8	176.6	-176.9	92.4	0	0	0	111.9	Y300 F327 V333 N334 M335	Y300-H331 PolarHBondContact OH-CD2 3.13Å; F327-H331 HydrophobicContact CE1-CB 4.26Å; F327-H331 HydrophobicContact CE2-CB 4.33Å; F327-H331 HydrophobicContact CZ-CB 4.08Å; F327-H331 AromaticContact CZ-ND1 3.83Å; F327-H331 WeakPolarHBondContact O-CB 3.4Å; F327-H331 PolarHBondContact O-N 2.98Å; H331-V333 VanDerWaalsContact C-N 3.29Å; H331-V333 PolarHBondContact O-N 3.23Å; H331-N334 CarbonylContact O-C 3.55Å; H331-M335 WeakPolarHBondContact O-CA 3.43Å; H331-M335 WeakPolarHBondContact O-CG 3.32Å; H331-M335 PolarHBondContact O-N 2.93Å
332	F	88.8	Confident	84.6	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-42.7	175	175.1	-107.1	0	0	0	112.2	L292 Y300 L303 V304 R311 L313 S328 L329 V330	L292-F332 HydrophobicContact CD1-CD1 4.32Å; L292-F332 HydrophobicContact CD1-CE1 4.11Å; L292-F332 HydrophobicContact CD1-CZ 4.36Å; Y300-F332 HydrophobicContact CE2-CB 3.69Å; Y300-F332 HydrophobicContact CE2-CD2 4.22Å; Y300-F332 HydrophobicContact CE2-CG 4.26Å; Y300-F332 PolarHBondContact OH-N 3.19Å; L303-F332 HydrophobicContact CB-CE2 3.49Å; L303-F332 VanDerWaalsContact CB-CE2 3.49Å; L303-F332 HydrophobicContact CB-CZ 3.87Å; L303-F332 HydrophobicContact CD1-CE2 4.37Å; L303-F332 HydrophobicContact CD1-CZ 4.19Å; V304-F332 HydrophobicContact CG2-CD2 3.89Å; V304-F332 HydrophobicContact CG2-CE2 4.33Å; R311-F332 WeakPolarHBondContact CD-O 3.43Å; R311-F332 PolarHBondContact NH1-O 2.9Å; L313-F332 HydrophobicContact CD1-CD1 3.9Å; L313-F332 HydrophobicContact CD1-CE1 4.38Å; S328-F332 VanDerWaalsContact O-CB 3.31Å; S328-F332 WeakPolarHBondContact O-CB 3.49Å; S328-F332 PolarHBondContact O-N 3.05Å; L329-F332 PolarHBondContact O-N 2.8Å; V330-F332 VanDerWaalsContact C-N 3.32Å; V330-F332 PolarHBondContact O-N 3.3Å
333	V	89.2	Confident	85.6	Confident	6 Å²	6	35.5 Å²	35.5	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-78.8	-46.6	-174.3	169.8	0	0	0	0	111.4	G169 I171 L313 L329 V330 H331	G169-V333 WeakPolarHBondContact CA-O 3.31Å; I171-V333 HydrophobicContact CD1-CG2 4.3Å; I171-V333 HydrophobicContact CG1-CB 4.29Å; I171-V333 HydrophobicContact CG1-CG1 4.24Å; I171-V333 HydrophobicContact CG1-CG2 3.76Å; L313-V333 HydrophobicContact CB-CG2 3.77Å; L313-V333 HydrophobicContact CD1-CG2 4.3Å; L329-V333 WeakPolarHBondContact O-CG2 3.33Å; L329-V333 PolarHBondContact O-N 3.16Å; V330-V333 PolarHBondContact O-N 3.25Å; H331-V333 VanDerWaalsContact C-N 3.29Å; H331-V333 PolarHBondContact O-N 3.23Å
334	N	88.5	Confident	86.2	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.016	21%	0.211	C	C	.	.	S	Bend	trans	-127.3	91.7	178.5	-69.9	-46.1	0	0	0	109.6	N167 H168 G169 V330 H331 G336 L337	N167-N334 HydrophobicContact CB-CB 4.39Å; N167-N334 WeakPolarHBondContact CB-OD1 3.47Å; H168-N334 PolarHBondContact N-OD1 2.91Å; G169-N334 WeakPolarHBondContact CA-OD1 3.48Å; G169-N334 PolarHBondContact N-OD1 3.01Å; G169-N334 PolarHBondContact O-ND2 3.44Å; V330-N334 PolarHBondContact O-N 3.21Å; H331-N334 CarbonylContact O-C 3.55Å; N334-G336 PolarHBondContact O-N 3.24Å; N334-L337 HydrophobicContact CB-CB 3.91Å; N334-L337 HydrophobicContact CB-CD2 4.04Å; N334-L337 PolarHBondContact O-N 3.03Å
335	M	84.9	Confident	86.6	Confident	98 Å²	98	37.9 Å²	37.9	48%	0.483	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	121.2	-179.1	-64.7	-174	73.7	0	0	110.2	V304 H331	V304-M335 HydrophobicContact CG1-CE 3.67Å; V304-M335 HydrophobicContact CG1-SD 4.17Å; H331-M335 WeakPolarHBondContact O-CA 3.43Å; H331-M335 WeakPolarHBondContact O-CG 3.32Å; H331-M335 PolarHBondContact O-N 2.93Å
336	G	82.9	Confident	87.1	Confident	52 Å²	52	46.2 Å²	46.2	54%	0.536	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-8	178	0	0	0	0	0	115.7	N334 L338 G339	N334-G336 PolarHBondContact O-N 3.24Å; G336-L338 VanDerWaalsContact C-N 3.3Å; G336-L338 PolarHBondContact O-N 2.99Å; G336-G339 PolarHBondContact O-N 3.26Å
337	L	85.3	Confident	87.6	Confident	44 Å²	44	49.4 Å²	49.4	23%	0.23	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-38.6	-179.1	-176.6	65.6	0	0	0	113.2	I164 V330 N334 I378	I164-L337 HydrophobicContact CD1-CD2 4.25Å; I164-L337 HydrophobicContact CG2-CD1 4.3Å; V330-L337 HydrophobicContact CG1-CD2 4.05Å; N334-L337 HydrophobicContact CB-CB 3.91Å; N334-L337 HydrophobicContact CB-CD2 4.04Å; N334-L337 PolarHBondContact O-N 3.03Å; L337-I378 HydrophobicContact CD1-CG2 4.23Å; L337-I378 HydrophobicContact CD2-CG2 3.96Å; L337-I378 HydrophobicContact CG-CG2 4Å
338	L	85.2	Confident	87.7	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.063	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	11.5	-179.7	-63.2	177	0	0	0	113.1	F327 V330 G336 F344 Y348 L375 I378	F327-L338 HydrophobicContact CD2-CB 4.15Å; F327-L338 HydrophobicContact CD2-CD1 4.25Å; F327-L338 HydrophobicContact CE2-CB 4.16Å; V330-L338 HydrophobicContact CB-CD1 3.89Å; V330-L338 HydrophobicContact CG1-CD1 3.62Å; V330-L338 HydrophobicContact CG1-CG 4.03Å; G336-L338 VanDerWaalsContact C-N 3.3Å; G336-L338 PolarHBondContact O-N 2.99Å; L338-F344 HydrophobicContact CB-CD2 4.18Å; L338-F344 HydrophobicContact CD1-CD2 4.08Å; L338-F344 HydrophobicContact CD1-CE2 4.01Å; L338-Y348 HydrophobicContact CD2-CE2 4.47Å; L338-L375 HydrophobicContact CD1-CD1 4.24Å; L338-L375 HydrophobicContact CD2-CD1 3.85Å; L338-I378 HydrophobicContact CD2-CG2 4.27Å
339	G	86.7	Confident	87.7	Confident	24 Å²	24	50 Å²	50	25%	0.247	27%	0.266	C	S	.	.			trans	72.1	-155.1	-173.1	0	0	0	0	0	114.1	G336	G336-G339 PolarHBondContact O-N 3.26Å
340	T	88.1	Confident	87.7	Confident	65 Å²	65	53 Å²	53	40%	0.399	28%	0.281	S	S	.	.			trans	-80.6	160.4	176.9	62.6	0	0	0	0	111.9	S342 E343 F344	T340-S342 PolarHBondContact O-N 3.33Å; T340-S342 PolarHBondContact OG1-OG 3.43Å; T340-S342 VanDerWaalsContact OG1-OG 3.07Å; T340-E343 PolarHBondContact N-OE2 3.35Å; T340-E343 PolarHBondContact O-N 2.87Å; T340-E343 VanDerWaalsContact O-N 3.12Å; T340-E343 WeakPolarHBondContact OG1-CB 3.47Å; T340-E343 VanDerWaalsContact OG1-CG 3.22Å; T340-E343 WeakPolarHBondContact OG1-CG 3.2Å; T340-E343 PolarHBondContact OG1-N 3.47Å; T340-E343 PolarHBondContact OG1-OE2 2.96Å; T340-F344 PolarHBondContact O-N 3.46Å
341	A	85.6	Confident	87.7	Confident	54 Å²	54	54 Å²	54	45%	0.446	29%	0.288	S	S	.	.	H	α-helix	trans	-57.5	-36.6	178.5	0	0	0	0	0	112.7	F327 R345	F327-A341 HydrophobicContact CD1-CB 4.34Å; F327-A341 HydrophobicContact CE1-CB 3.54Å; F327-A341 HydrophobicContact CZ-CB 3.89Å; F327-A341 VanDerWaalsContact CZ-N 3.33Å; A341-R345 WeakPolarHBondContact O-CB 3.49Å; A341-R345 PolarHBondContact O-N 3.31Å
342	S	87.5	Confident	87.5	Confident	87 Å²	87	52.1 Å²	52.1	61%	0.608	28%	0.279	S	S	*	.	H	α-helix	trans	-68	-40.6	176.3	40.5	0	0	0	0	113.1	T340 R346	T340-S342 PolarHBondContact O-N 3.33Å; T340-S342 PolarHBondContact OG1-OG 3.43Å; T340-S342 VanDerWaalsContact OG1-OG 3.07Å; S342-R346 WeakPolarHBondContact O-CB 3.34Å; S342-R346 PolarHBondContact O-N 3.46Å
343	E	90.9	Very high	87.2	Confident	110 Å²	110	55.6 Å²	55.6	51%	0.514	30%	0.297	S	S	.	.	H	α-helix	trans	-67.7	-44.6	176.5	-72.8	161.8	163.7	0	0	110.4	T340 R345 R346 H347	T340-E343 PolarHBondContact N-OE2 3.35Å; T340-E343 PolarHBondContact O-N 2.87Å; T340-E343 VanDerWaalsContact O-N 3.12Å; T340-E343 WeakPolarHBondContact OG1-CB 3.47Å; T340-E343 VanDerWaalsContact OG1-CG 3.22Å; T340-E343 WeakPolarHBondContact OG1-CG 3.2Å; T340-E343 PolarHBondContact OG1-N 3.47Å; T340-E343 PolarHBondContact OG1-OE2 2.96Å; E343-R345 VanDerWaalsContact C-N 3.35Å; E343-R345 PolarHBondContact O-N 2.79Å; E343-R346 PolarHBondContact O-N 2.97Å; E343-H347 VanDerWaalsContact O-CB 3.29Å; E343-H347 WeakPolarHBondContact O-CB 3.34Å; E343-H347 PolarHBondContact O-N 3.47Å
344	F	90.2	Very high	86.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-47.1	175.7	177.4	-94.2	0	0	0	111.7	L323 F327 L338 T340 R346 H347 Y348 E349 L375	L323-F344 HydrophobicContact CB-CE1 4.18Å; L323-F344 HydrophobicContact CB-CZ 4.23Å; L323-F344 WeakPolarHBondContact O-CE1 3.32Å; F327-F344 HydrophobicContact CB-CD1 3.63Å; F327-F344 HydrophobicContact CB-CD2 4.31Å; F327-F344 HydrophobicContact CB-CE1 3.59Å; F327-F344 HydrophobicContact CB-CE2 4.26Å; F327-F344 HydrophobicContact CB-CG 4.01Å; F327-F344 HydrophobicContact CB-CZ 3.91Å; F327-F344 HydrophobicContact CD2-CB 3.46Å; F327-F344 VanDerWaalsContact CD2-CB 3.46Å; F327-F344 AromaticContact CD2-CD1 3.78Å; F327-F344 HydrophobicContact CD2-CD1 3.78Å; F327-F344 AromaticContact CD2-CD2 3.63Å; F327-F344 HydrophobicContact CD2-CD2 3.63Å; F327-F344 HydrophobicContact CD2-CE1 4.46Å; F327-F344 HydrophobicContact CD2-CE2 4.32Å; F327-F344 AromaticContact CD2-CG 3.3Å; F327-F344 HydrophobicContact CD2-CG 3.3Å; F327-F344 HydrophobicContact CE2-CB 3.62Å; F327-F344 HydrophobicContact CE2-CD2 4.45Å; F327-F344 HydrophobicContact CE2-CG 4.02Å; F327-F344 HydrophobicContact CG-CB 4.21Å; F327-F344 AromaticContact CG-CD1 3.79Å; F327-F344 HydrophobicContact CG-CD1 3.79Å; F327-F344 HydrophobicContact CG-CD2 4.35Å; F327-F344 HydrophobicContact CG-CE1 4.27Å; F327-F344 AromaticContact CG-CG 3.84Å; F327-F344 HydrophobicContact CG-CG 3.84Å; L338-F344 HydrophobicContact CB-CD2 4.18Å; L338-F344 HydrophobicContact CD1-CD2 4.08Å; L338-F344 HydrophobicContact CD1-CE2 4.01Å; T340-F344 PolarHBondContact O-N 3.46Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 2.99Å; F344-H347 PolarHBondContact O-N 3.14Å; F344-Y348 AromaticContact CD2-CD2 3.44Å; F344-Y348 HydrophobicContact CD2-CD2 3.44Å; F344-Y348 VanDerWaalsContact CD2-CD2 3.44Å; F344-Y348 HydrophobicContact CD2-CE2 4.19Å; F344-Y348 HydrophobicContact CD2-CG 4.04Å; F344-Y348 AromaticContact CE2-CD2 3.76Å; F344-Y348 HydrophobicContact CE2-CD2 3.76Å; F344-Y348 AromaticContact CE2-CG 3.9Å; F344-Y348 HydrophobicContact CE2-CG 3.9Å; F344-Y348 HydrophobicContact CG-CD2 4.26Å; F344-Y348 WeakPolarHBondContact O-CA 3.25Å; F344-Y348 WeakPolarHBondContact O-CB 3.27Å; F344-Y348 PolarHBondContact O-N 2.9Å; F344-E349 HydrophobicContact CE1-CB 4.41Å; F344-E349 PolarHBondContact O-N 3.16Å; F344-L375 HydrophobicContact CE2-CD1 3.88Å; F344-L375 HydrophobicContact CE2-CD2 4.22Å; F344-L375 HydrophobicContact CZ-CD2 4.29Å
345	R	88.1	Confident	86.5	Confident	122 Å²	122	62.9 Å²	62.9	46%	0.46	33%	0.327	S	S	.	.	I	π-helix	trans	-59.2	-44.1	177.6	170.1	168.1	-97.5	-164.5	-14	112.1	A341 E343 E349 I350	A341-R345 WeakPolarHBondContact O-CB 3.49Å; A341-R345 PolarHBondContact O-N 3.31Å; E343-R345 VanDerWaalsContact C-N 3.35Å; E343-R345 PolarHBondContact O-N 2.79Å; R345-E349 HydrophobicContact CB-CB 4.46Å; R345-E349 VanDerWaalsContact CB-OE2 3.29Å; R345-E349 WeakPolarHBondContact CB-OE2 2.94Å; R345-E349 HydrophobicContact CG-CB 4.46Å; R345-E349 WeakPolarHBondContact CG-OE2 3.37Å; R345-E349 IonicContact CZ-OE1 3.42Å; R345-E349 IonicContact CZ-OE2 3.96Å; R345-E349 IonicContact NE-OE1 2.65Å; R345-E349 PolarHBondContact NE-OE1 3.38Å; R345-E349 IonicContact NE-OE2 2.84Å; R345-E349 PolarHBondContact NE-OE2 2.86Å; R345-E349 IonicContact NH2-OE1 2.7Å; R345-E349 PolarHBondContact NH2-OE1 2.91Å; R345-E349 IonicContact NH2-OE2 3.88Å; R345-E349 PolarHBondContact O-N 3.05Å; R345-I350 HydrophobicContact CG-CD1 3.85Å; R345-I350 HydrophobicContact CG-CG1 4.02Å; R345-I350 WeakPolarHBondContact O-CG1 3.44Å; R345-I350 PolarHBondContact O-N 3.05Å
346	R	90.5	Very high	85.9	Confident	206 Å²	206	61.6 Å²	61.6	78%	0.777	32%	0.317	S	S	*	.	I	π-helix	trans	-69.1	-40	-179.3	-177.2	179.5	176	-176.9	-1	112.5	S342 E343 F344	S342-R346 WeakPolarHBondContact O-CB 3.34Å; S342-R346 PolarHBondContact O-N 3.46Å; E343-R346 PolarHBondContact O-N 2.97Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 2.99Å
347	H	90	Very high	85.4	Confident	93 Å²	93	62.3 Å²	62.3	43%	0.431	31%	0.308	S	S	.	.	I	π-helix	trans	-89.9	-37.4	-171.3	-167.5	45.6	0	0	0	113.3	E343 F344 P351 I371	E343-H347 VanDerWaalsContact O-CB 3.29Å; E343-H347 WeakPolarHBondContact O-CB 3.34Å; E343-H347 PolarHBondContact O-N 3.47Å; F344-H347 PolarHBondContact O-N 3.14Å; H347-P351 WeakPolarHBondContact O-CG 3.35Å; H347-I371 WeakPolarHBondContact O-CG2 3.32Å
348	Y	87.9	Confident	84.6	Confident	17 Å²	17	64.6 Å²	64.6	7%	0.067	33%	0.334	C	S	.	.	I	π-helix	trans	-110.7	-60.6	-175.9	-61.7	-80.1	0	0	0	112.6	L338 F344 I350 P351 I352 I371 L375	L338-Y348 HydrophobicContact CD2-CE2 4.47Å; F344-Y348 AromaticContact CD2-CD2 3.44Å; F344-Y348 HydrophobicContact CD2-CD2 3.44Å; F344-Y348 VanDerWaalsContact CD2-CD2 3.44Å; F344-Y348 HydrophobicContact CD2-CE2 4.19Å; F344-Y348 HydrophobicContact CD2-CG 4.04Å; F344-Y348 AromaticContact CE2-CD2 3.76Å; F344-Y348 HydrophobicContact CE2-CD2 3.76Å; F344-Y348 AromaticContact CE2-CG 3.9Å; F344-Y348 HydrophobicContact CE2-CG 3.9Å; F344-Y348 HydrophobicContact CG-CD2 4.26Å; F344-Y348 WeakPolarHBondContact O-CA 3.25Å; F344-Y348 WeakPolarHBondContact O-CB 3.27Å; F344-Y348 PolarHBondContact O-N 2.9Å; Y348-I350 PolarHBondContact O-N 3.39Å; Y348-P351 WeakPolarHBondContact O-CD 3.47Å; Y348-I352 WeakPolarHBondContact O-CB 3.28Å; Y348-I352 WeakPolarHBondContact O-CD1 3.4Å; Y348-I352 WeakPolarHBondContact O-CG1 3.36Å; Y348-I352 PolarHBondContact O-N 3.21Å; Y348-I371 HydrophobicContact CD1-CG2 3.56Å; Y348-I371 HydrophobicContact CE1-CG2 4.28Å; Y348-I371 HydrophobicContact CG-CG2 4.29Å; Y348-L375 HydrophobicContact CD1-CB 3.76Å; Y348-L375 HydrophobicContact CD1-CD1 4.07Å; Y348-L375 HydrophobicContact CD1-CD2 4.36Å; Y348-L375 HydrophobicContact CD1-CG 4.27Å; Y348-L375 HydrophobicContact CE1-CB 3.84Å; Y348-L375 HydrophobicContact CE1-CD1 4.1Å; Y348-L375 HydrophobicContact CG-CD1 4.35Å
349	E	86.1	Confident	84	Confident	13 Å²	13	71.7 Å²	71.7	6%	0.061	37%	0.372	C	S	.	.	I	π-helix	trans	-59.3	-55.2	-169.9	-171.6	-166.7	159.4	0	0	112.7	L324 F344 R345 I352 L353	L324-E349 WeakPolarHBondContact CD2-OE2 3.31Å; F344-E349 HydrophobicContact CE1-CB 4.41Å; F344-E349 PolarHBondContact O-N 3.16Å; R345-E349 HydrophobicContact CB-CB 4.46Å; R345-E349 VanDerWaalsContact CB-OE2 3.29Å; R345-E349 WeakPolarHBondContact CB-OE2 2.94Å; R345-E349 HydrophobicContact CG-CB 4.46Å; R345-E349 WeakPolarHBondContact CG-OE2 3.37Å; R345-E349 IonicContact CZ-OE1 3.42Å; R345-E349 IonicContact CZ-OE2 3.96Å; R345-E349 IonicContact NE-OE1 2.65Å; R345-E349 PolarHBondContact NE-OE1 3.38Å; R345-E349 IonicContact NE-OE2 2.84Å; R345-E349 PolarHBondContact NE-OE2 2.86Å; R345-E349 IonicContact NH2-OE1 2.7Å; R345-E349 PolarHBondContact NH2-OE1 2.91Å; R345-E349 IonicContact NH2-OE2 3.88Å; R345-E349 PolarHBondContact O-N 3.05Å; E349-I352 PolarHBondContact O-N 3.4Å; E349-L353 HydrophobicContact CG-CD1 3.88Å; E349-L353 HydrophobicContact CG-CG 4.49Å; E349-L353 WeakPolarHBondContact O-CB 3.29Å; E349-L353 VanDerWaalsContact O-CG 3.28Å; E349-L353 WeakPolarHBondContact O-CG 3.43Å; E349-L353 PolarHBondContact O-N 3.14Å
350	I	87.3	Confident	83.4	Confident	63 Å²	63	71.3 Å²	71.3	32%	0.323	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-48.1	-175.3	-67.8	168	0	0	0	111.5	R345 Y348 L353 R354	R345-I350 HydrophobicContact CG-CD1 3.85Å; R345-I350 HydrophobicContact CG-CG1 4.02Å; R345-I350 WeakPolarHBondContact O-CG1 3.44Å; R345-I350 PolarHBondContact O-N 3.05Å; Y348-I350 PolarHBondContact O-N 3.39Å; I350-L353 PolarHBondContact O-N 2.96Å; I350-R354 HydrophobicContact CG2-CG 4.37Å; I350-R354 WeakPolarHBondContact O-CB 3.26Å; I350-R354 VanDerWaalsContact O-CG 3.3Å; I350-R354 WeakPolarHBondContact O-CG 3.31Å; I350-R354 PolarHBondContact O-N 2.74Å
351	P	87.5	Confident	83.2	Confident	23 Å²	23	71.8 Å²	71.8	15%	0.149	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-40	176.8	-27	38.1	0	0	0	113.9	H347 Y348 R354 G355 I371	H347-P351 WeakPolarHBondContact O-CG 3.35Å; Y348-P351 WeakPolarHBondContact O-CD 3.47Å; P351-R354 PolarHBondContact O-N 3.45Å; P351-G355 PolarHBondContact O-N 3.03Å; P351-I371 HydrophobicContact CB-CD1 3.42Å; P351-I371 VanDerWaalsContact CB-CD1 3.42Å; P351-I371 HydrophobicContact CG-CD1 3.91Å
352	I	85.8	Confident	83.2	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-67.8	-40.9	179.2	-66.2	165.7	0	0	0	110.9	L323 Y348 E349 R356 I371 L372 L375	L323-I352 HydrophobicContact CD1-CB 3.87Å; L323-I352 HydrophobicContact CD1-CD1 3.8Å; L323-I352 HydrophobicContact CD1-CG1 4.45Å; L323-I352 HydrophobicContact CD1-CG2 3.81Å; Y348-I352 WeakPolarHBondContact O-CB 3.28Å; Y348-I352 WeakPolarHBondContact O-CD1 3.4Å; Y348-I352 WeakPolarHBondContact O-CG1 3.36Å; Y348-I352 PolarHBondContact O-N 3.21Å; E349-I352 PolarHBondContact O-N 3.4Å; I352-R356 WeakPolarHBondContact O-CB 3.17Å; I352-R356 VanDerWaalsContact O-CG 3.28Å; I352-R356 WeakPolarHBondContact O-CG 3.42Å; I352-R356 PolarHBondContact O-N 3.31Å; I352-I371 HydrophobicContact CD1-CG2 4.11Å; I352-I371 HydrophobicContact CG1-CB 4.46Å; I352-I371 HydrophobicContact CG1-CG2 4.01Å; I352-L372 HydrophobicContact CD1-CB 4.24Å; I352-L372 HydrophobicContact CD1-CD1 4.16Å; I352-L372 HydrophobicContact CG1-CB 4.3Å; I352-L375 HydrophobicContact CD1-CD2 4.34Å
353	L	83.6	Confident	83.2	Confident	74 Å²	74	79.2 Å²	79.2	39%	0.387	39%	0.389	S	S	.	.	H	α-helix	trans	-65.8	-45.5	176.1	-70.6	177.2	0	0	0	111	E349 I350 G355 R356 D357	E349-L353 HydrophobicContact CG-CD1 3.88Å; E349-L353 HydrophobicContact CG-CG 4.49Å; E349-L353 WeakPolarHBondContact O-CB 3.29Å; E349-L353 VanDerWaalsContact O-CG 3.28Å; E349-L353 WeakPolarHBondContact O-CG 3.43Å; E349-L353 PolarHBondContact O-N 3.14Å; I350-L353 PolarHBondContact O-N 2.96Å; L353-G355 VanDerWaalsContact C-N 3.35Å; L353-G355 PolarHBondContact O-N 3.33Å; L353-R356 CarbonylContact O-C 3.54Å; L353-R356 WeakPolarHBondContact O-CA 3.48Å; L353-R356 PolarHBondContact O-N 2.8Å; L353-D357 PolarHBondContact O-N 3.47Å
354	R	81	Confident	83	Confident	151 Å²	151	76.9 Å²	76.9	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-61	-41	176.5	-76.4	-179.6	-175.9	-179.7	1.2	113.1	I350 P351 R356 D357 A360	I350-R354 HydrophobicContact CG2-CG 4.37Å; I350-R354 WeakPolarHBondContact O-CB 3.26Å; I350-R354 VanDerWaalsContact O-CG 3.3Å; I350-R354 WeakPolarHBondContact O-CG 3.31Å; I350-R354 PolarHBondContact O-N 2.74Å; P351-R354 PolarHBondContact O-N 3.45Å; R354-R356 PolarHBondContact O-N 3.03Å; R354-D357 PolarHBondContact O-N 3.48Å; R354-A360 WeakPolarHBondContact O-CB 3.22Å
355	G	80.9	Confident	82.6	Confident	10 Å²	10	81.1 Å²	81.1	10%	0.103	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.4	175.9	0	0	0	0	0	113.8	P351 L353 D364 Q365	P351-G355 PolarHBondContact O-N 3.03Å; L353-G355 VanDerWaalsContact C-N 3.35Å; L353-G355 PolarHBondContact O-N 3.33Å; G355-D364 VanDerWaalsContact CA-O 3.23Å; G355-D364 WeakPolarHBondContact CA-O 2.88Å; G355-Q365 WeakPolarHBondContact O-CG 3.34Å
356	R	72.9	Confident	82.6	Confident	71 Å²	71	81.8 Å²	81.8	27%	0.268	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-8.7	177.1	-72.8	178	174.3	-179.7	-2.5	113.6	I352 L353 R354	I352-R356 WeakPolarHBondContact O-CB 3.17Å; I352-R356 VanDerWaalsContact O-CG 3.28Å; I352-R356 WeakPolarHBondContact O-CG 3.42Å; I352-R356 PolarHBondContact O-N 3.31Å; L353-R356 CarbonylContact O-C 3.54Å; L353-R356 WeakPolarHBondContact O-CA 3.48Å; L353-R356 PolarHBondContact O-N 2.8Å; R354-R356 PolarHBondContact O-N 3.03Å
357	D	71.6	Confident	82.6	Confident	68 Å²	68	77.6 Å²	77.6	36%	0.364	39%	0.394	S	S	.	.	S	Bend	trans	-62.1	142.9	174	-76.5	-38.5	0	0	0	109.2	L353 R354 D359 A360 H659	L353-D357 PolarHBondContact O-N 3.47Å; R354-D357 PolarHBondContact O-N 3.48Å; D357-D359 PolarHBondContact O-N 3.34Å; D357-A360 WeakPolarHBondContact O-CB 3.38Å; D357-A360 PolarHBondContact O-N 2.91Å; D357-H659 IonicContact OD1-CD2 2.87Å; D357-H659 IonicContact OD1-CE1 3.79Å; D357-H659 IonicContact OD1-NE2 3.85Å; D357-H659 PolarHBondContact OD1-NE2 3.29Å
358	A	68.7	Low	82.4	Confident	92 Å²	92	73.4 Å²	73.4	76%	0.76	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.9	-178.3	0	0	0	0	0	112.8	A360	A358-A360 VanDerWaalsContact C-N 3.3Å
359	D	73.2	Confident	82.3	Confident	161 Å²	161	76.1 Å²	76.1	86%	0.861	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	9.2	179.1	-58.6	-37.8	0	0	0	112.9	D357	D357-D359 PolarHBondContact O-N 3.34Å
360	A	74.5	Confident	82.5	Confident	16 Å²	16	80.9 Å²	80.9	13%	0.132	41%	0.411	C	S	.	.			trans	-63.6	135.9	-177.7	0	0	0	0	0	111.7	R354 D357 A358 D364 Q365	R354-A360 WeakPolarHBondContact O-CB 3.22Å; D357-A360 WeakPolarHBondContact O-CB 3.38Å; D357-A360 PolarHBondContact O-N 2.91Å; A358-A360 VanDerWaalsContact C-N 3.3Å; A360-D364 HydrophobicContact CB-CB 4.23Å; A360-Q365 HydrophobicContact CB-CG 3.83Å
361	T	83.3	Confident	82.6	Confident	74 Å²	74	78.7 Å²	78.7	45%	0.454	40%	0.4	S	S	.	.			trans	-67.4	155	170	67	0	0	0	0	110.2	E363 D364 Q365	T361-E363 PolarHBondContact O-N 3.37Å; T361-E363 VanDerWaalsContact O-N 3.08Å; T361-D364 PolarHBondContact O-N 3.15Å; T361-D364 VanDerWaalsContact OG1-CG 3.23Å; T361-D364 PolarHBondContact OG1-N 3.13Å; T361-D364 VanDerWaalsContact OG1-N 3.16Å; T361-D364 PolarHBondContact OG1-OD2 3.35Å; T361-Q365 PolarHBondContact O-N 3.02Å
362	N	85.9	Confident	82.5	Confident	134 Å²	134	77.9 Å²	77.9	72%	0.717	39%	0.394	S	S	*	.	H	α-helix	trans	-54.8	-29.8	174.3	-69	-17.7	0	0	0	112.3	K366	N362-K366 WeakPolarHBondContact O-CB 3.1Å; N362-K366 PolarHBondContact O-N 3.03Å; N362-K366 VanDerWaalsContact O-N 3.15Å
363	E	87.5	Confident	82.5	Confident	163 Å²	163	81.1 Å²	81.1	76%	0.762	41%	0.41	S	S	*	.	H	α-helix	trans	-69.7	-43.1	174.5	-64	-171.2	169.2	0	0	112.1	T361 K366 K367	T361-E363 PolarHBondContact O-N 3.37Å; T361-E363 VanDerWaalsContact O-N 3.08Å; E363-K366 PolarHBondContact O-N 3Å; E363-K367 VanDerWaalsContact O-CB 3.32Å; E363-K367 WeakPolarHBondContact O-CB 3.34Å; E363-K367 PolarHBondContact O-N 2.72Å
364	D	86.7	Confident	82.8	Confident	61 Å²	61	82 Å²	82	33%	0.326	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.5	-68.7	-51.4	0	0	0	111.7	G355 A360 T361 K367 G368	G355-D364 VanDerWaalsContact CA-O 3.23Å; G355-D364 WeakPolarHBondContact CA-O 2.88Å; A360-D364 HydrophobicContact CB-CB 4.23Å; T361-D364 PolarHBondContact O-N 3.15Å; T361-D364 VanDerWaalsContact OG1-CG 3.23Å; T361-D364 PolarHBondContact OG1-N 3.13Å; T361-D364 VanDerWaalsContact OG1-N 3.16Å; T361-D364 PolarHBondContact OG1-OD2 3.35Å; D364-K367 PolarHBondContact O-N 3.41Å; D364-G368 PolarHBondContact O-N 3.21Å
365	Q	80.9	Confident	83.1	Confident	89 Å²	89	74.9 Å²	74.9	42%	0.416	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-50.9	176	-68.1	-177.5	-0.3	0	0	111.1	G355 A360 T361 K367 G368 E369	G355-Q365 WeakPolarHBondContact O-CG 3.34Å; A360-Q365 HydrophobicContact CB-CG 3.83Å; T361-Q365 PolarHBondContact O-N 3.02Å; Q365-K367 VanDerWaalsContact C-N 3.34Å; Q365-K367 PolarHBondContact O-N 3.03Å; Q365-G368 PolarHBondContact O-N 2.9Å; Q365-E369 PolarHBondContact O-N 3.23Å
366	K	89.2	Confident	83.2	Confident	137 Å²	137	75 Å²	75	60%	0.596	38%	0.383	S	S	*	.	H	α-helix	trans	-60.1	-44.9	179.2	-170.4	-176.4	-179	-165.5	0	111.6	N362 E363 E369 E370	N362-K366 WeakPolarHBondContact O-CB 3.1Å; N362-K366 PolarHBondContact O-N 3.03Å; N362-K366 VanDerWaalsContact O-N 3.15Å; E363-K366 PolarHBondContact O-N 3Å; K366-E369 PolarHBondContact O-N 3.43Å; K366-E370 WeakPolarHBondContact CE-OE1 3.24Å; K366-E370 IonicContact NZ-OE1 4Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 2.83Å
367	K	89.9	Confident	83.8	Confident	118 Å²	118	73.5 Å²	73.5	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-40.3	177.8	-175.4	176.5	-178	175.1	0	112.3	E363 D364 Q365 E369 I371	E363-K367 VanDerWaalsContact O-CB 3.32Å; E363-K367 WeakPolarHBondContact O-CB 3.34Å; E363-K367 PolarHBondContact O-N 2.72Å; D364-K367 PolarHBondContact O-N 3.41Å; Q365-K367 VanDerWaalsContact C-N 3.34Å; Q365-K367 PolarHBondContact O-N 3.03Å; K367-E369 VanDerWaalsContact C-N 3.33Å; K367-I371 HydrophobicContact CG-CD1 3.88Å; K367-I371 WeakPolarHBondContact O-CB 3.1Å; K367-I371 WeakPolarHBondContact O-CD1 3.47Å; K367-I371 VanDerWaalsContact O-CG1 3.28Å; K367-I371 WeakPolarHBondContact O-CG1 3.44Å; K367-I371 PolarHBondContact O-N 3.04Å; K367-I371 VanDerWaalsContact O-N 3.13Å
368	G	85.9	Confident	84.4	Confident	5 Å²	5	72.4 Å²	72.4	5%	0.052	38%	0.384	C	S	.	.	H	α-helix	trans	-61.1	-42.3	175.7	0	0	0	0	0	112	D364 Q365 L372	D364-G368 PolarHBondContact O-N 3.21Å; Q365-G368 PolarHBondContact O-N 2.9Å; G368-L372 WeakPolarHBondContact O-CB 3.47Å; G368-L372 PolarHBondContact O-N 3.42Å
369	E	85	Confident	85.1	Confident	74 Å²	74	68 Å²	68	35%	0.346	35%	0.347	S	S	.	.	H	α-helix	trans	-70.1	-43.9	178	-170.3	55.4	-141.1	0	0	112.5	Q365 K366 K367 I371 L372 Q373	Q365-E369 PolarHBondContact O-N 3.23Å; K366-E369 PolarHBondContact O-N 3.43Å; K367-E369 VanDerWaalsContact C-N 3.33Å; E369-I371 VanDerWaalsContact C-N 3.33Å; E369-I371 PolarHBondContact O-N 3.21Å; E369-L372 WeakPolarHBondContact O-CB 3.29Å; E369-L372 PolarHBondContact O-N 3.38Å; E369-L372 VanDerWaalsContact O-N 3.15Å; E369-Q373 WeakPolarHBondContact O-CG 3.39Å; E369-Q373 PolarHBondContact O-N 3.34Å; E369-Q373 PolarHBondContact OE1-NE2 3.23Å
370	E	90.6	Very high	85.7	Confident	112 Å²	112	64.8 Å²	64.8	52%	0.523	33%	0.333	S	S	.	.	H	α-helix	trans	-56.5	-46.5	176	-75.5	173.6	-177.8	0	0	111.7	K366 L372 Q373 E374	K366-E370 WeakPolarHBondContact CE-OE1 3.24Å; K366-E370 IonicContact NZ-OE1 4Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 2.83Å; E370-L372 VanDerWaalsContact C-N 3.34Å; E370-Q373 PolarHBondContact O-N 2.79Å; E370-E374 PolarHBondContact O-N 3.09Å
371	I	89.5	Confident	86.3	Confident	17 Å²	17	71.3 Å²	71.3	9%	0.087	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-35.3	178.6	-69.7	170.3	0	0	0	111.4	H347 Y348 P351 I352 K367 E369 E374 L375	H347-I371 WeakPolarHBondContact O-CG2 3.32Å; Y348-I371 HydrophobicContact CD1-CG2 3.56Å; Y348-I371 HydrophobicContact CE1-CG2 4.28Å; Y348-I371 HydrophobicContact CG-CG2 4.29Å; P351-I371 HydrophobicContact CB-CD1 3.42Å; P351-I371 VanDerWaalsContact CB-CD1 3.42Å; P351-I371 HydrophobicContact CG-CD1 3.91Å; I352-I371 HydrophobicContact CD1-CG2 4.11Å; I352-I371 HydrophobicContact CG1-CB 4.46Å; I352-I371 HydrophobicContact CG1-CG2 4.01Å; K367-I371 HydrophobicContact CG-CD1 3.88Å; K367-I371 WeakPolarHBondContact O-CB 3.1Å; K367-I371 WeakPolarHBondContact O-CD1 3.47Å; K367-I371 VanDerWaalsContact O-CG1 3.28Å; K367-I371 WeakPolarHBondContact O-CG1 3.44Å; K367-I371 PolarHBondContact O-N 3.04Å; K367-I371 VanDerWaalsContact O-N 3.13Å; E369-I371 VanDerWaalsContact C-N 3.33Å; E369-I371 PolarHBondContact O-N 3.21Å; I371-E374 PolarHBondContact O-N 3.01Å; I371-L375 PolarHBondContact O-N 3.34Å
372	L	85.8	Confident	86.5	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-45.3	174.3	179.5	66.1	0	0	0	111.2	I352 G368 E369 E370 E374 L375 L376	I352-L372 HydrophobicContact CD1-CB 4.24Å; I352-L372 HydrophobicContact CD1-CD1 4.16Å; I352-L372 HydrophobicContact CG1-CB 4.3Å; G368-L372 WeakPolarHBondContact O-CB 3.47Å; G368-L372 PolarHBondContact O-N 3.42Å; E369-L372 WeakPolarHBondContact O-CB 3.29Å; E369-L372 PolarHBondContact O-N 3.38Å; E369-L372 VanDerWaalsContact O-N 3.15Å; E370-L372 VanDerWaalsContact C-N 3.34Å; L372-E374 VanDerWaalsContact C-N 3.33Å; L372-E374 PolarHBondContact O-N 3.45Å; L372-L375 WeakPolarHBondContact O-CB 3.31Å; L372-L375 PolarHBondContact O-N 2.92Å; L372-L376 HydrophobicContact CD1-CD1 4.47Å; L372-L376 HydrophobicContact CD1-CG 4.42Å; L372-L376 HydrophobicContact CG-CD1 4.17Å; L372-L376 HydrophobicContact CG-CG 4.49Å; L372-L376 VanDerWaalsContact O-CG 3.31Å; L372-L376 WeakPolarHBondContact O-CG 2.72Å; L372-L376 PolarHBondContact O-N 3.42Å
373	Q	86.5	Confident	86.6	Confident	70 Å²	70	62.5 Å²	62.5	33%	0.327	30%	0.304	S	S	.	.	H	α-helix	trans	-63.8	-38.2	177.6	-67.6	-60.7	-27.7	0	0	112	E369 E370 L376 G377	E369-Q373 WeakPolarHBondContact O-CG 3.39Å; E369-Q373 PolarHBondContact O-N 3.34Å; E369-Q373 PolarHBondContact OE1-NE2 3.23Å; E370-Q373 PolarHBondContact O-N 2.79Å; Q373-L376 PolarHBondContact O-N 3.09Å; Q373-G377 PolarHBondContact O-N 2.79Å
374	E	89.4	Confident	86.7	Confident	93 Å²	93	55.8 Å²	55.8	44%	0.435	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-48.9	172.1	-176.8	178	179.1	0	0	111.4	E370 I371 L372 L376 G377 I378	E370-E374 PolarHBondContact O-N 3.09Å; I371-E374 PolarHBondContact O-N 3.01Å; L372-E374 VanDerWaalsContact C-N 3.33Å; L372-E374 PolarHBondContact O-N 3.45Å; E374-L376 VanDerWaalsContact C-N 3.34Å; E374-L376 PolarHBondContact O-N 2.93Å; E374-G377 PolarHBondContact O-N 3.38Å; E374-I378 HydrophobicContact CG-CD1 4.49Å; E374-I378 PolarHBondContact O-N 3.49Å; E374-I378 VanDerWaalsContact O-N 3.14Å
375	L	86.9	Confident	86.7	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-44.5	177.6	-177.8	62.4	0	0	0	111.7	L323 Y326 L338 F344 Y348 I352 I371 L372 I378 V379	L323-L375 HydrophobicContact CD2-CD2 4.08Å; Y326-L375 HydrophobicContact CE1-CG 4.47Å; L338-L375 HydrophobicContact CD1-CD1 4.24Å; L338-L375 HydrophobicContact CD2-CD1 3.85Å; F344-L375 HydrophobicContact CE2-CD1 3.88Å; F344-L375 HydrophobicContact CE2-CD2 4.22Å; F344-L375 HydrophobicContact CZ-CD2 4.29Å; Y348-L375 HydrophobicContact CD1-CB 3.76Å; Y348-L375 HydrophobicContact CD1-CD1 4.07Å; Y348-L375 HydrophobicContact CD1-CD2 4.36Å; Y348-L375 HydrophobicContact CD1-CG 4.27Å; Y348-L375 HydrophobicContact CE1-CB 3.84Å; Y348-L375 HydrophobicContact CE1-CD1 4.1Å; Y348-L375 HydrophobicContact CG-CD1 4.35Å; I352-L375 HydrophobicContact CD1-CD2 4.34Å; I371-L375 PolarHBondContact O-N 3.34Å; L372-L375 WeakPolarHBondContact O-CB 3.31Å; L372-L375 PolarHBondContact O-N 2.92Å; L375-I378 PolarHBondContact O-N 3.43Å; L375-V379 HydrophobicContact CD1-CG2 4.11Å; L375-V379 WeakPolarHBondContact O-CG2 3.28Å; L375-V379 PolarHBondContact O-N 2.9Å
376	L	83.6	Confident	86.9	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-37.7	178.2	-68.7	177.1	0	0	0	112.1	L372 Q373 E374 I378 V379 T380 V649	L372-L376 HydrophobicContact CD1-CD1 4.47Å; L372-L376 HydrophobicContact CD1-CG 4.42Å; L372-L376 HydrophobicContact CG-CD1 4.17Å; L372-L376 HydrophobicContact CG-CG 4.49Å; L372-L376 VanDerWaalsContact O-CG 3.31Å; L372-L376 WeakPolarHBondContact O-CG 2.72Å; L372-L376 PolarHBondContact O-N 3.42Å; Q373-L376 PolarHBondContact O-N 3.09Å; E374-L376 VanDerWaalsContact C-N 3.34Å; E374-L376 PolarHBondContact O-N 2.93Å; L376-I378 VanDerWaalsContact C-N 3.3Å; L376-I378 PolarHBondContact O-N 3.19Å; L376-V379 PolarHBondContact O-N 3.28Å; L376-T380 WeakPolarHBondContact O-CB 3.49Å; L376-T380 PolarHBondContact O-N 3.42Å; L376-T380 PolarHBondContact O-OG1 3.01Å; L376-V649 VanDerWaalsContact CD2-O 3.22Å; L376-V649 WeakPolarHBondContact CD2-O 3.34Å
377	G	85.3	Confident	86.5	Confident	40 Å²	40	48.4 Å²	48.4	41%	0.412	24%	0.239	S	C	.	.	H	α-helix	trans	-62.8	-34.4	176	0	0	0	0	0	113.4	Q373 E374 R381	Q373-G377 PolarHBondContact O-N 2.79Å; E374-G377 PolarHBondContact O-N 3.38Å; G377-R381 PolarHBondContact O-NE 3.43Å
378	I	85	Confident	85.8	Confident	45 Å²	45	43.8 Å²	43.8	23%	0.231	22%	0.22	C	C	.	.	H	α-helix	trans	-73.8	-48	174	-64.9	168.8	0	0	0	110.1	L337 L338 E374 L375 L376 R381	L337-I378 HydrophobicContact CD1-CG2 4.23Å; L337-I378 HydrophobicContact CD2-CG2 3.96Å; L337-I378 HydrophobicContact CG-CG2 4Å; L338-I378 HydrophobicContact CD2-CG2 4.27Å; E374-I378 HydrophobicContact CG-CD1 4.49Å; E374-I378 PolarHBondContact O-N 3.49Å; E374-I378 VanDerWaalsContact O-N 3.14Å; L375-I378 PolarHBondContact O-N 3.43Å; L376-I378 VanDerWaalsContact C-N 3.3Å; L376-I378 PolarHBondContact O-N 3.19Å; I378-R381 WeakPolarHBondContact O-CB 3.31Å; I378-R381 PolarHBondContact O-N 3.46Å
379	V	83.5	Confident	85.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-82.4	-29	-166.9	-175	0	0	0	0	113.3	Y326 V330 L375 L376 R381 C382 I383	Y326-V379 HydrophobicContact CE1-CB 3.7Å; Y326-V379 HydrophobicContact CE1-CG1 3.53Å; Y326-V379 HydrophobicContact CE1-CG2 3.61Å; Y326-V379 HydrophobicContact CE2-CG1 4.2Å; Y326-V379 VanDerWaalsContact OH-CB 3.23Å; Y326-V379 WeakPolarHBondContact OH-CB 3.25Å; Y326-V379 WeakPolarHBondContact OH-CG1 3.33Å; V330-V379 HydrophobicContact CG1-CG2 4.42Å; V330-V379 HydrophobicContact CG2-CG1 3.72Å; V330-V379 HydrophobicContact CG2-CG2 4.13Å; L375-V379 HydrophobicContact CD1-CG2 4.11Å; L375-V379 WeakPolarHBondContact O-CG2 3.28Å; L375-V379 PolarHBondContact O-N 2.9Å; L376-V379 PolarHBondContact O-N 3.28Å; V379-R381 PolarHBondContact O-N 3.05Å; V379-C382 PolarHBondContact O-N 2.98Å; V379-C382 PolarHBondContact O-SG 3.41Å; V379-I383 HydrophobicContact CG1-CB 4.46Å; V379-I383 HydrophobicContact CG1-CD1 3.26Å; V379-I383 HydrophobicContact CG1-CG1 3.46Å; V379-I383 VanDerWaalsContact CG1-CG1 3.46Å; V379-I383 PolarHBondContact O-N 2.83Å
380	T	84.6	Confident	85	Confident	92 Å²	92	44.9 Å²	44.9	56%	0.564	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.3	171	-59.8	0	0	0	0	112.6	L376 C382	L376-T380 WeakPolarHBondContact O-CB 3.49Å; L376-T380 PolarHBondContact O-N 3.42Å; L376-T380 PolarHBondContact O-OG1 3.01Å; T380-C382 VanDerWaalsContact C-N 3.31Å; T380-C382 PolarHBondContact O-N 3.03Å
381	R	86.8	Confident	84.2	Confident	154 Å²	154	40.5 Å²	40.5	58%	0.581	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.3	175.3	-59.8	-178.2	-172.3	-166.3	0.1	114.1	I164 G377 I378 V379	I164-R381 HydrophobicContact CD1-CB 3.99Å; I164-R381 HydrophobicContact CG1-CB 4.02Å; G377-R381 PolarHBondContact O-NE 3.43Å; I378-R381 WeakPolarHBondContact O-CB 3.31Å; I378-R381 PolarHBondContact O-N 3.46Å; V379-R381 PolarHBondContact O-N 3.05Å
382	C	88.1	Confident	83.6	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-13.6	-179.6	65	0	0	0	0	113.9	I164 I171 V379 T380	I164-C382 HydrophobicContact CD1-CB 3.93Å; I171-C382 PolarHBondContact N-O 2.73Å; V379-C382 PolarHBondContact O-N 2.98Å; V379-C382 PolarHBondContact O-SG 3.41Å; T380-C382 VanDerWaalsContact C-N 3.31Å; T380-C382 PolarHBondContact O-N 3.03Å
383	I	88.6	Confident	83.2	Confident	22 Å²	22	48.7 Å²	48.7	11%	0.113	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.7	175.1	-58.9	-168.5	0	0	0	110	I171 A173 I319 Y326 V379	I171-I383 HydrophobicContact CB-CB 4.47Å; I171-I383 HydrophobicContact CB-CG1 3.85Å; I171-I383 HydrophobicContact CD1-CD1 4.01Å; I171-I383 HydrophobicContact CD1-CG1 3.85Å; I171-I383 HydrophobicContact CG1-CG1 4.37Å; I171-I383 HydrophobicContact CG2-CD1 4.36Å; I171-I383 HydrophobicContact CG2-CG1 4.09Å; I171-I383 HydrophobicContact CG2-CG2 4.32Å; I171-I383 WeakPolarHBondContact O-CA 3.37Å; A173-I383 HydrophobicContact CB-CG2 4.14Å; I319-I383 HydrophobicContact CD1-CD1 4.02Å; Y326-I383 HydrophobicContact CD2-CD1 4.49Å; Y326-I383 HydrophobicContact CE2-CD1 3.43Å; Y326-I383 VanDerWaalsContact CE2-CD1 3.43Å; Y326-I383 WeakPolarHBondContact OH-CD1 3.04Å; V379-I383 HydrophobicContact CG1-CB 4.46Å; V379-I383 HydrophobicContact CG1-CD1 3.26Å; V379-I383 HydrophobicContact CG1-CG1 3.46Å; V379-I383 VanDerWaalsContact CG1-CG1 3.46Å; V379-I383 PolarHBondContact O-N 2.83Å
384	I	89.3	Confident	82.9	Confident	22 Å²	22	51 Å²	51	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.1	162.2	-173.3	167.6	0	0	0	109.5	F154 I171 M172 A173 R386	F154-I384 HydrophobicContact CB-CD1 3.97Å; F154-I384 HydrophobicContact CD1-CB 3.63Å; F154-I384 HydrophobicContact CD1-CD1 4.27Å; F154-I384 HydrophobicContact CD1-CG2 3.56Å; F154-I384 HydrophobicContact CD2-CB 4.47Å; F154-I384 HydrophobicContact CD2-CD1 4.43Å; F154-I384 HydrophobicContact CE1-CB 3.59Å; F154-I384 HydrophobicContact CE1-CG2 3.73Å; F154-I384 HydrophobicContact CE2-CB 4.43Å; F154-I384 HydrophobicContact CG-CB 4.08Å; F154-I384 HydrophobicContact CG-CD1 3.97Å; F154-I384 HydrophobicContact CG-CG2 4.34Å; F154-I384 HydrophobicContact CZ-CB 4.01Å; I171-I384 PolarHBondContact O-N 2.83Å; M172-I384 HydrophobicContact CB-CG2 4.35Å; M172-I384 HydrophobicContact CG-CG2 4.3Å; A173-I384 PolarHBondContact N-O 3.42Å; I384-R386 HydrophobicContact CG1-CG 4.5Å
385	R	85.8	Confident	82.7	Confident	56 Å²	56	47 Å²	47	21%	0.211	24%	0.237	C	C	.	.			trans	-130.1	129.3	173.9	-178.6	177.7	-178.8	-170.1	-8.3	109.5	A173 S646 V650	A173-R385 HydrophobicContact CB-CB 4.19Å; A173-R385 HydrophobicContact CB-CG 4.45Å; R385-S646 PolarHBondContact NH1-O 3.22Å; R385-V650 VanDerWaalsContact NH1-CB 3.3Å
386	R	85.6	Confident	82.7	Confident	23 Å²	23	48.4 Å²	48.4	9%	0.087	25%	0.246	C	C	.	.			trans	-134.2	148.2	174.5	-66.3	167.6	-68.3	-160.7	6.8	109.8	H147 G151 D174 E175 L178 I384 L390	H147-R386 PolarHBondContact O-NH1 2.88Å; G151-R386 VanDerWaalsContact CA-NH1 3.34Å; G151-R386 VanDerWaalsContact N-NH1 3.18Å; D174-R386 VanDerWaalsContact CG-NH2 3.3Å; D174-R386 IonicContact OD1-CZ 2.87Å; D174-R386 PolarHBondContact OD1-N 3.35Å; D174-R386 IonicContact OD1-NE 3.7Å; D174-R386 PolarHBondContact OD1-NE 3Å; D174-R386 IonicContact OD1-NH2 3.39Å; D174-R386 PolarHBondContact OD1-NH2 3.47Å; D174-R386 IonicContact OD2-CZ 3.09Å; D174-R386 IonicContact OD2-NE 3.24Å; D174-R386 PolarHBondContact OD2-NE 3.04Å; D174-R386 IonicContact OD2-NH2 3.42Å; D174-R386 PolarHBondContact OD2-NH2 3.38Å; E175-R386 PolarHBondContact N-O 3.09Å; L178-R386 HydrophobicContact CD1-CB 3.9Å; L178-R386 VanDerWaalsContact CD1-O 3.27Å; L178-R386 WeakPolarHBondContact CD1-O 3.28Å; I384-R386 HydrophobicContact CG1-CG 4.5Å; R386-L390 HydrophobicContact CB-CD1 3.85Å; R386-L390 HydrophobicContact CG-CD1 4.22Å
387	T	81.1	Confident	83.1	Confident	53 Å²	53	48.4 Å²	48.4	33%	0.325	25%	0.246	S	C	.	.			trans	-97.1	161.1	-175.1	61.3	0	0	0	0	112.2	E175 A389 L390	E175-T387 WeakPolarHBondContact OE2-CA 3.37Å; T387-A389 PolarHBondContact O-N 3.43Å; T387-A389 VanDerWaalsContact O-N 3.16Å; T387-A389 WeakPolarHBondContact OG1-CB 3.41Å; T387-L390 PolarHBondContact O-N 3.3Å
388	Q	75.2	Confident	83.4	Confident	22 Å²	22	47 Å²	47	10%	0.103	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-63.1	-12.7	173.8	-77.4	177.2	8.1	0	0	113.1	E175 M176 L390 L391 W612	E175-Q388 HydrophobicContact CB-CG 3.93Å; E175-Q388 WeakPolarHBondContact OE2-CB 3.27Å; E175-Q388 VanDerWaalsContact OE2-CG 3.27Å; E175-Q388 WeakPolarHBondContact OE2-CG 3.3Å; E175-Q388 PolarHBondContact OE2-N 3.16Å; M176-Q388 PolarHBondContact O-NE2 2.93Å; Q388-L390 PolarHBondContact O-N 3.39Å; Q388-L390 VanDerWaalsContact O-N 3.11Å; Q388-L391 HydrophobicContact CG-CD1 4.32Å; Q388-L391 WeakPolarHBondContact O-CB 3.48Å; Q388-L391 PolarHBondContact O-N 3.16Å; Q388-W612 HydrophobicContact CB-CZ3 4.12Å
389	A	75.9	Confident	83.7	Confident	36 Å²	36	44.9 Å²	44.9	30%	0.298	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-53.4	-30.8	172.3	0	0	0	0	0	111.7	T387 L391 T392	T387-A389 PolarHBondContact O-N 3.43Å; T387-A389 VanDerWaalsContact O-N 3.16Å; T387-A389 WeakPolarHBondContact OG1-CB 3.41Å; A389-L391 VanDerWaalsContact C-N 3.26Å; A389-L391 PolarHBondContact O-N 3.16Å; A389-T392 WeakPolarHBondContact O-CB 3.34Å; A389-T392 WeakPolarHBondContact O-CG2 3.49Å; A389-T392 PolarHBondContact O-N 3.22Å; A389-T392 PolarHBondContact O-OG1 3.08Å
390	L	78.3	Confident	84.2	Confident	65 Å²	65	45.5 Å²	45.5	34%	0.34	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.5	-25.6	175.1	-62	177.6	0	0	0	113.9	H147 L178 R386 T387 Q388	H147-L390 HydrophobicContact CB-CD1 3.83Å; L178-L390 HydrophobicContact CD2-CB 4.29Å; R386-L390 HydrophobicContact CB-CD1 3.85Å; R386-L390 HydrophobicContact CG-CD1 4.22Å; T387-L390 PolarHBondContact O-N 3.3Å; Q388-L390 PolarHBondContact O-N 3.39Å; Q388-L390 VanDerWaalsContact O-N 3.11Å
391	L	74.1	Confident	84.7	Confident	20 Å²	20	41.1 Å²	41.1	11%	0.105	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-81.7	-18.8	179.6	-62.5	175.7	0	0	0	113	L178 Q388 A389 K393 Y394 L395 W612	L178-L391 HydrophobicContact CD2-CD1 4.07Å; L178-L391 HydrophobicContact CD2-CD2 3.85Å; L178-L391 HydrophobicContact CD2-CG 3.66Å; Q388-L391 HydrophobicContact CG-CD1 4.32Å; Q388-L391 WeakPolarHBondContact O-CB 3.48Å; Q388-L391 PolarHBondContact O-N 3.16Å; A389-L391 VanDerWaalsContact C-N 3.26Å; A389-L391 PolarHBondContact O-N 3.16Å; L391-K393 PolarHBondContact O-N 2.56Å; L391-K393 VanDerWaalsContact O-N 3.1Å; L391-Y394 PolarHBondContact O-N 3.02Å; L391-L395 HydrophobicContact CB-CD1 3.75Å; L391-L395 HydrophobicContact CB-CG 4.16Å; L391-L395 HydrophobicContact CD1-CD1 4.09Å; L391-L395 HydrophobicContact CG-CD1 4.43Å; L391-L395 PolarHBondContact O-N 3.12Å; L391-W612 HydrophobicContact CB-CH2 4.34Å
392	T	75.4	Confident	85.1	Confident	29 Å²	29	33.8 Å²	33.8	18%	0.178	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.5	-179.8	60.3	0	0	0	0	112.4	A389 Y394 W612 H742	A389-T392 WeakPolarHBondContact O-CB 3.34Å; A389-T392 WeakPolarHBondContact O-CG2 3.49Å; A389-T392 PolarHBondContact O-N 3.22Å; A389-T392 PolarHBondContact O-OG1 3.08Å; T392-Y394 PolarHBondContact O-N 3.46Å; T392-W612 HydrophobicContact CG2-CH2 4.25Å; T392-H742 HydrophobicContact CG2-CB 4.35Å; T392-H742 PolarHBondContact O-CE1 3.12Å; T392-H742 VanDerWaalsContact O-CE1 3.29Å; T392-H742 PolarHBondContact O-NE2 3.31Å
393	K	79.1	Confident	85.5	Confident	168 Å²	168	33.8 Å²	33.8	73%	0.73	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.5	176.7	-61.3	-176.2	-179.6	-178	0	114.4	L391	L391-K393 PolarHBondContact O-N 2.56Å; L391-K393 VanDerWaalsContact O-N 3.1Å
394	Y	80.1	Confident	85.8	Confident	117 Å²	117	32.7 Å²	32.7	46%	0.459	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-20.4	-170.7	-53.3	-75	0	0	0	114	L391 T392	L391-Y394 PolarHBondContact O-N 3.02Å; T392-Y394 PolarHBondContact O-N 3.46Å
395	L	83.6	Confident	86	Confident	11 Å²	11	31.7 Å²	31.7	6%	0.058	16%	0.156	C	C	.	.	S	Bend	trans	-100.7	152.2	-178.5	-65.6	-177	0	0	0	111.2	L391 W612 R613 H742	L391-L395 HydrophobicContact CB-CD1 3.75Å; L391-L395 HydrophobicContact CB-CG 4.16Å; L391-L395 HydrophobicContact CD1-CD1 4.09Å; L391-L395 HydrophobicContact CG-CD1 4.43Å; L391-L395 PolarHBondContact O-N 3.12Å; L395-W612 HydrophobicContact CB-CZ2 3.73Å; L395-W612 HydrophobicContact CD1-CD2 3.88Å; L395-W612 HydrophobicContact CD1-CE3 4.19Å; L395-W612 HydrophobicContact CD1-CG 4.43Å; L395-W612 HydrophobicContact CD1-CH2 4.18Å; L395-W612 HydrophobicContact CD1-CZ2 3.85Å; L395-W612 HydrophobicContact CD1-CZ3 4.33Å; L395-W612 HydrophobicContact CG-CZ2 4.41Å; L395-R613 WeakPolarHBondContact CD2-O 3.48Å; L395-H742 PolarHBondContact O-CE1 3.42Å; L395-H742 PolarHBondContact O-NE2 2.72Å
396	P	88.7	Confident	86.4	Confident	30 Å²	30	31.3 Å²	31.3	20%	0.195	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-57.7	162.4	171.3	-24.5	35.4	0	0	0	112.5	K398 W612 Q616 K618	P396-K398 PolarHBondContact O-N 2.83Å; P396-W612 PolarHBondContact O-NE1 2.92Å; P396-Q616 WeakPolarHBondContact CD-O 3.46Å; P396-Q616 HydrophobicContact CG-CG 4.21Å; P396-Q616 WeakPolarHBondContact CG-O 3.15Å; P396-K618 VanDerWaalsContact CB-O 3.31Å; P396-K618 WeakPolarHBondContact CB-O 3.48Å
397	V	90.8	Very high	86.8	Confident	12 Å²	12	30.4 Å²	30.4	7%	0.073	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-57.1	135.1	174.9	-179.1	0	0	0	0	110.4	I399 Q619 C620 E744	V397-I399 HydrophobicContact CG1-CG1 4.26Å; V397-Q619 HydrophobicContact CB-CG 4.22Å; V397-Q619 WeakPolarHBondContact O-CA 3.45Å; V397-Q619 WeakPolarHBondContact O-CG 3.45Å; V397-C620 PolarHBondContact O-N 3.37Å; V397-E744 HydrophobicContact CG2-CB 3.84Å; V397-E744 HydrophobicContact CG2-CG 4.34Å
398	K	90.9	Very high	87.3	Confident	9 Å²	9	29.5 Å²	29.5	4%	0.039	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.7	170	175.7	-173.2	64.7	163.2	0	107.3	P396 E400 W612 C620 I622 Y740 S741	P396-K398 PolarHBondContact O-N 2.83Å; K398-E400 HydrophobicContact CD-CG 4.11Å; K398-E400 WeakPolarHBondContact CD-OE1 3.31Å; K398-E400 WeakPolarHBondContact CE-OE1 3.33Å; K398-E400 HydrophobicContact CG-CG 4.15Å; K398-E400 IonicContact NZ-OE1 2.76Å; K398-E400 PolarHBondContact NZ-OE1 2.83Å; K398-W612 HydrophobicContact CB-CD2 3.98Å; K398-W612 HydrophobicContact CB-CG 4.01Å; K398-W612 HydrophobicContact CB-CZ2 4.4Å; K398-W612 HydrophobicContact CD-CB 4.23Å; K398-W612 HydrophobicContact CD-CD2 3.88Å; K398-W612 HydrophobicContact CD-CE3 3.91Å; K398-W612 HydrophobicContact CD-CG 4.04Å; K398-W612 HydrophobicContact CG-CD2 4.4Å; K398-W612 HydrophobicContact CG-CG 4.28Å; K398-C620 CarbonylContact C-O 3.56Å; K398-C620 WeakPolarHBondContact CA-O 3.18Å; K398-C620 HydrophobicContact CB-CB 4.45Å; K398-C620 HydrophobicContact CG-CB 4.47Å; K398-I622 HydrophobicContact CD-CD1 3.74Å; K398-I622 HydrophobicContact CG-CD1 4.04Å; K398-I622 HydrophobicContact CG-CG1 4.4Å; K398-Y740 CarbonylContact O-C 3.54Å; K398-Y740 VanDerWaalsContact O-CA 3.23Å; K398-Y740 WeakPolarHBondContact O-CA 3.37Å; K398-S741 PolarHBondContact N-OG 3.45Å; K398-S741 PolarHBondContact O-N 2.98Å
399	I	92.9	Very high	88	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123	171.2	-62.6	-178	0	0	0	107.6	V397 Q401 C620 Y621 I622 N720 W738 H739	V397-I399 HydrophobicContact CG1-CG1 4.26Å; I399-Q401 HydrophobicContact CG2-CG 3.76Å; I399-C620 PolarHBondContact N-O 3.38Å; I399-Y621 HydrophobicContact CB-CD1 4.23Å; I399-Y621 HydrophobicContact CD1-CD1 4.35Å; I399-Y621 HydrophobicContact CD1-CE1 3.85Å; I399-Y621 WeakPolarHBondContact O-CA 3.42Å; I399-I622 PolarHBondContact O-N 3.06Å; I399-N720 HydrophobicContact CD1-CB 4.36Å; I399-W738 HydrophobicContact CG2-CE3 4.16Å; I399-H739 WeakPolarHBondContact CA-O 3.48Å
400	E	93.9	Very high	88.7	Confident	13 Å²	13	29.8 Å²	29.8	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.2	173.1	-62.7	-162.9	-172.4	0	0	110.3	K398 I622 C703 W710 W738 H739	K398-E400 HydrophobicContact CD-CG 4.11Å; K398-E400 WeakPolarHBondContact CD-OE1 3.31Å; K398-E400 WeakPolarHBondContact CE-OE1 3.33Å; K398-E400 HydrophobicContact CG-CG 4.15Å; K398-E400 IonicContact NZ-OE1 2.76Å; K398-E400 PolarHBondContact NZ-OE1 2.83Å; E400-I622 HydrophobicContact CG-CB 4.13Å; E400-I622 HydrophobicContact CG-CD1 4.22Å; E400-I622 HydrophobicContact CG-CG1 4.5Å; E400-C703 HydrophobicContact CB-CB 4.48Å; E400-C703 HydrophobicContact CG-CB 4.03Å; E400-W710 HydrophobicContact CB-CH2 3.58Å; E400-W710 HydrophobicContact CB-CZ3 3.94Å; E400-W738 CarbonylContact O-C 3.49Å; E400-W738 WeakPolarHBondContact O-CA 3.5Å; E400-W738 WeakPolarHBondContact O-CB 3.49Å; E400-H739 PolarHBondContact N-O 3.15Å; E400-H739 PolarHBondContact O-N 3.31Å
401	Q	94.5	Very high	89.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	114.4	-173.6	-56.5	-177.8	-41.5	0	0	109.4	I399 V403 I622 Y623 R624 L724 V736 F737 W738	I399-Q401 HydrophobicContact CG2-CG 3.76Å; Q401-V403 HydrophobicContact CB-CG2 4.43Å; Q401-I622 PolarHBondContact N-O 3.09Å; Q401-Y623 HydrophobicContact CB-CD1 4.43Å; Q401-Y623 CarbonylContact O-C 3.46Å; Q401-Y623 WeakPolarHBondContact O-CA 3.47Å; Q401-R624 PolarHBondContact O-N 3.08Å; Q401-L724 HydrophobicContact CB-CD2 4.2Å; Q401-L724 HydrophobicContact CG-CD2 4.41Å; Q401-L724 VanDerWaalsContact OE1-CD2 3.24Å; Q401-V736 HydrophobicContact CB-CG1 4.38Å; Q401-F737 CarbonylContact C-O 3.45Å; Q401-F737 WeakPolarHBondContact CA-O 3.38Å; Q401-W738 HydrophobicContact CB-CB 4.38Å; Q401-W738 HydrophobicContact CG-CB 3.82Å
402	V	95.3	Very high	90.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	115.5	169	-175.5	0	0	0	0	107.8	R624 I626 L636 F707 W710 V736 F737	V402-R624 CarbonylContact C-O 3.58Å; V402-R624 WeakPolarHBondContact CA-O 3.16Å; V402-R624 HydrophobicContact CG2-CB 4.33Å; V402-I626 HydrophobicContact CG1-CG1 3.9Å; V402-L636 HydrophobicContact CG1-CD2 3.73Å; V402-F707 HydrophobicContact CG2-CE1 3.89Å; V402-F707 HydrophobicContact CG2-CZ 4.28Å; V402-W710 HydrophobicContact CG2-CZ3 4.22Å; V402-V736 VanDerWaalsContact O-CA 3.26Å; V402-V736 WeakPolarHBondContact O-CA 3.49Å; V402-F737 HydrophobicContact CB-CB 4.14Å; V402-F737 HydrophobicContact CB-CD2 4.25Å; V402-F737 HydrophobicContact CG1-CD2 4.42Å; V402-F737 PolarHBondContact N-O 3.15Å; V402-F737 PolarHBondContact O-N 3.27Å
403	V	95.7	Very high	91	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	108.5	-173.7	-173.4	0	0	0	0	109.6	Q401 C405 V504 R624 L625 I626 L724 I733 V736	Q401-V403 HydrophobicContact CB-CG2 4.43Å; V403-C405 PolarHBondContact O-SG 3.37Å; V403-V504 HydrophobicContact CG1-CG1 4.49Å; V403-R624 PolarHBondContact N-O 2.76Å; V403-L625 HydrophobicContact CB-CD2 3.83Å; V403-L625 HydrophobicContact CG1-CD2 4.3Å; V403-L625 HydrophobicContact CG2-CD2 4.22Å; V403-I626 PolarHBondContact O-N 3.35Å; V403-L724 HydrophobicContact CG1-CD1 4.33Å; V403-L724 HydrophobicContact CG2-CD1 3.87Å; V403-L724 HydrophobicContact CG2-CD2 3.96Å; V403-I733 HydrophobicContact CG1-CB 4.49Å; V403-I733 HydrophobicContact CG1-CD1 3.81Å; V403-I733 HydrophobicContact CG1-CG1 3.96Å; V403-I733 HydrophobicContact CG1-CG2 3.81Å; V403-V736 HydrophobicContact CB-CG2 4.35Å; V403-V736 HydrophobicContact CG1-CG2 4.09Å; V403-V736 HydrophobicContact CG2-CG2 4.22Å
404	C	95.3	Very high	91.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.2	174.9	-59.1	0	0	0	0	109.3	I626 T628 I733 S734 F735	C404-I626 CarbonylContact C-O 3.42Å; C404-I626 WeakPolarHBondContact CA-O 3.36Å; C404-T628 WeakPolarHBondContact CB-OG1 3.11Å; C404-I733 WeakPolarHBondContact O-CA 3.33Å; C404-S734 WeakPolarHBondContact CB-OG 3.31Å; C404-S734 PolarHBondContact O-N 3.23Å; C404-S734 PolarHBondContact O-OG 3.39Å; C404-F735 HydrophobicContact CB-CB 4.04Å; C404-F735 VanDerWaalsContact CB-O 3.3Å; C404-F735 WeakPolarHBondContact CB-O 3.42Å; C404-F735 PolarHBondContact N-O 3.26Å
405	C	94.7	Very high	92.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.3	-176.2	-54.4	0	0	0	0	109.7	V403 K501 I626 S627 T628 C732	V403-C405 PolarHBondContact O-SG 3.37Å; C405-K501 HydrophobicContact CB-CG 3.94Å; C405-I626 PolarHBondContact N-O 3.48Å; C405-S627 CarbonylContact O-C 3.6Å; C405-S627 WeakPolarHBondContact O-CA 3.45Å; C405-T628 VanDerWaalsContact C-OG1 3.31Å; C405-T628 PolarHBondContact N-OG1 3.27Å; C405-T628 PolarHBondContact O-N 3.03Å; C405-T628 PolarHBondContact O-OG1 3.21Å; C405-C732 CarbonylContact C-O 3.6Å; C405-C732 WeakPolarHBondContact CA-O 3.36Å
406	N	94.1	Very high	92.5	Very high	49 Å²	49	20 Å²	20	26%	0.262	11%	0.114	S	C	.	.	P	Polyproline II helix	trans	-65.1	141.2	174.9	-74.5	-32.2	0	0	0	111.5	G500 C732 S734	N406-G500 WeakPolarHBondContact O-CA 3.47Å; N406-C732 PolarHBondContact N-O 3.11Å; N406-S734 WeakPolarHBondContact OD1-CB 3.4Å
407	L	92.9	Very high	92.5	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	11%	0.11	C	C	.	.	P	Polyproline II helix	trans	-67.5	138.6	167.9	-61.1	-179.7	0	0	0	110.2	Q411 R412 Y415 T630 Y671	L407-Q411 HydrophobicContact CB-CB 4.41Å; L407-Q411 HydrophobicContact CB-CG 4.45Å; L407-Q411 VanDerWaalsContact CD2-CD 3.43Å; L407-Q411 HydrophobicContact CD2-CG 3.98Å; L407-R412 HydrophobicContact CB-CB 4.26Å; L407-R412 PolarHBondContact O-NH2 2.63Å; L407-Y415 HydrophobicContact CD1-CD2 4.09Å; L407-Y415 HydrophobicContact CD1-CG 3.99Å; L407-T630 HydrophobicContact CD1-CG2 3.73Å; L407-T630 HydrophobicContact CD2-CG2 4.15Å; L407-T630 HydrophobicContact CG-CG2 4.01Å; L407-Y671 HydrophobicContact CD1-CE2 3.72Å
408	V	92.2	Very high	92.5	Very high	34 Å²	34	19.3 Å²	19.3	21%	0.206	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-66.2	154	172.7	174.3	0	0	0	0	109.6	S410 Q411 R412 E497	V408-S410 PolarHBondContact O-N 3.36Å; V408-Q411 HydrophobicContact CB-CB 4.29Å; V408-Q411 CarbonylContact O-C 3.57Å; V408-Q411 WeakPolarHBondContact O-CA 3.17Å; V408-Q411 WeakPolarHBondContact O-CB 3.4Å; V408-Q411 PolarHBondContact O-N 3.29Å; V408-R412 WeakPolarHBondContact O-CB 3.38Å; V408-R412 PolarHBondContact O-N 3.09Å; V408-E497 WeakPolarHBondContact CG1-O 3.41Å; V408-E497 WeakPolarHBondContact CG2-O 3.08Å
409	G	90.7	Very high	92.3	Very high	44 Å²	44	19.8 Å²	19.8	45%	0.454	11%	0.111	S	C	.	.	H	α-helix	trans	-48.9	-51.7	-176.1	0	0	0	0	0	114.4	Q411 R412 E413	G409-Q411 PolarHBondContact O-N 3.23Å; G409-R412 WeakPolarHBondContact O-CB 3.43Å; G409-R412 PolarHBondContact O-N 2.93Å; G409-E413 PolarHBondContact O-N 2.83Å; G409-E413 VanDerWaalsContact O-N 3.11Å
410	S	90.1	Very high	92	Very high	19 Å²	19	25.5 Å²	25.5	13%	0.133	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-42.9	176.9	53	0	0	0	0	112.7	V408 R412 E413 V414 Y479	V408-S410 PolarHBondContact O-N 3.36Å; S410-R412 VanDerWaalsContact C-N 3.32Å; S410-R412 PolarHBondContact O-N 3.06Å; S410-E413 PolarHBondContact O-N 3.39Å; S410-V414 VanDerWaalsContact O-CG2 3.3Å; S410-V414 WeakPolarHBondContact O-CG2 3.24Å; S410-V414 PolarHBondContact O-N 2.94Å; S410-Y479 VanDerWaalsContact CB-O 3.3Å; S410-Y479 WeakPolarHBondContact CB-O 3.46Å
411	Q	91.5	Very high	91.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-38.9	177.7	-164.8	-176.8	18.6	0	0	111.7	L407 V408 G409 Y415 L455 C456 P459	L407-Q411 HydrophobicContact CB-CB 4.41Å; L407-Q411 HydrophobicContact CB-CG 4.45Å; L407-Q411 VanDerWaalsContact CD2-CD 3.43Å; L407-Q411 HydrophobicContact CD2-CG 3.98Å; V408-Q411 HydrophobicContact CB-CB 4.29Å; V408-Q411 CarbonylContact O-C 3.57Å; V408-Q411 WeakPolarHBondContact O-CA 3.17Å; V408-Q411 WeakPolarHBondContact O-CB 3.4Å; V408-Q411 PolarHBondContact O-N 3.29Å; G409-Q411 PolarHBondContact O-N 3.23Å; Q411-Y415 VanDerWaalsContact O-CB 3.31Å; Q411-Y415 WeakPolarHBondContact O-CB 3.17Å; Q411-Y415 PolarHBondContact O-N 2.85Å; Q411-L455 HydrophobicContact CG-CD1 4.23Å; Q411-L455 HydrophobicContact CG-CG 4.4Å; Q411-L455 PolarHBondContact NE2-O 3.42Å; Q411-C456 PolarHBondContact NE2-O 2.68Å; Q411-C456 VanDerWaalsContact NE2-O 3.12Å; Q411-P459 HydrophobicContact CG-CG 4.44Å
412	R	92.4	Very high	90.7	Very high	88 Å²	88	28.2 Å²	28.2	33%	0.332	15%	0.147	S	C	.	.	H	α-helix	trans	-64.9	-46.9	178	-177.4	-178	-58.6	162.2	6.7	112	L407 V408 G409 S410 Y415 S416 Y671	L407-R412 HydrophobicContact CB-CB 4.26Å; L407-R412 PolarHBondContact O-NH2 2.63Å; V408-R412 WeakPolarHBondContact O-CB 3.38Å; V408-R412 PolarHBondContact O-N 3.09Å; G409-R412 WeakPolarHBondContact O-CB 3.43Å; G409-R412 PolarHBondContact O-N 2.93Å; S410-R412 VanDerWaalsContact C-N 3.32Å; S410-R412 PolarHBondContact O-N 3.06Å; R412-Y415 PolarHBondContact O-N 3.47Å; R412-S416 VanDerWaalsContact O-CB 3.32Å; R412-S416 WeakPolarHBondContact O-CB 3.36Å; R412-S416 PolarHBondContact O-N 3.35Å; R412-Y671 HydrophobicContact CG-CE1 3.76Å
413	E	91.4	Very high	89.8	Confident	88 Å²	88	30.4 Å²	30.4	41%	0.411	17%	0.165	S	C	.	.	H	α-helix	trans	-62.1	-46.1	179.3	-68	-51.9	138	0	0	111.3	G409 S410 Y415 S416 D417 Y479	G409-E413 PolarHBondContact O-N 2.83Å; G409-E413 VanDerWaalsContact O-N 3.11Å; S410-E413 PolarHBondContact O-N 3.39Å; E413-Y415 VanDerWaalsContact C-N 3.34Å; E413-Y415 PolarHBondContact O-N 3.05Å; E413-S416 PolarHBondContact O-N 3.39Å; E413-D417 VanDerWaalsContact O-CB 3.29Å; E413-D417 WeakPolarHBondContact O-CB 3.43Å; E413-D417 PolarHBondContact O-N 2.93Å; E413-Y479 HydrophobicContact CB-CD1 3.57Å; E413-Y479 HydrophobicContact CB-CD2 4.24Å; E413-Y479 HydrophobicContact CB-CE1 3.79Å; E413-Y479 HydrophobicContact CB-CE2 4.42Å; E413-Y479 HydrophobicContact CB-CG 3.81Å; E413-Y479 HydrophobicContact CG-CD1 4Å; E413-Y479 HydrophobicContact CG-CE1 4.22Å
414	V	91.5	Very high	88.9	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-44.6	175.4	176.2	0	0	0	0	111.1	S410 F418 L455 M466 F473 A476 Y479 F480	S410-V414 VanDerWaalsContact O-CG2 3.3Å; S410-V414 WeakPolarHBondContact O-CG2 3.24Å; S410-V414 PolarHBondContact O-N 2.94Å; V414-F418 VanDerWaalsContact O-CB 3.25Å; V414-F418 WeakPolarHBondContact O-CB 3.42Å; V414-F418 PolarHBondContact O-N 3.34Å; V414-L455 HydrophobicContact CB-CD1 4.44Å; V414-L455 HydrophobicContact CB-CD2 4.26Å; V414-L455 HydrophobicContact CG1-CD1 3.96Å; V414-L455 HydrophobicContact CG1-CD2 3.68Å; V414-M466 HydrophobicContact CB-CE 4.47Å; V414-M466 HydrophobicContact CG1-CE 3.6Å; V414-M466 HydrophobicContact CG2-CE 4.17Å; V414-F473 HydrophobicContact CG1-CD1 4.02Å; V414-F473 HydrophobicContact CG1-CE1 3.92Å; V414-A476 HydrophobicContact CG1-CB 4.28Å; V414-A476 HydrophobicContact CG2-CB 4.29Å; V414-Y479 HydrophobicContact CG2-CD2 3.91Å; V414-Y479 HydrophobicContact CG2-CG 4.5Å; V414-F480 HydrophobicContact CG2-CE2 3.68Å; V414-F480 HydrophobicContact CG2-CZ 4.09Å
415	Y	92.1	Very high	87.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-47	-179.7	-162.9	-78.5	0	0	0	111.3	L407 Q411 R412 E413 F418 V419 L452 L455 C456 T630 I631 Y671	L407-Y415 HydrophobicContact CD1-CD2 4.09Å; L407-Y415 HydrophobicContact CD1-CG 3.99Å; Q411-Y415 VanDerWaalsContact O-CB 3.31Å; Q411-Y415 WeakPolarHBondContact O-CB 3.17Å; Q411-Y415 PolarHBondContact O-N 2.85Å; R412-Y415 PolarHBondContact O-N 3.47Å; E413-Y415 VanDerWaalsContact C-N 3.34Å; E413-Y415 PolarHBondContact O-N 3.05Å; Y415-F418 PolarHBondContact O-N 2.98Å; Y415-V419 HydrophobicContact CD1-CG2 3.79Å; Y415-V419 HydrophobicContact CE1-CG2 3.58Å; Y415-V419 WeakPolarHBondContact O-CB 3.36Å; Y415-V419 WeakPolarHBondContact O-CG2 3.35Å; Y415-V419 PolarHBondContact O-N 3.07Å; Y415-L452 HydrophobicContact CD2-CD2 3.9Å; Y415-L452 HydrophobicContact CE1-CD2 4.34Å; Y415-L452 HydrophobicContact CE2-CB 4.1Å; Y415-L452 HydrophobicContact CE2-CD2 3.62Å; Y415-L452 HydrophobicContact CE2-CG 4.34Å; Y415-L452 HydrophobicContact CG-CD2 4.37Å; Y415-L455 HydrophobicContact CD2-CD2 3.83Å; Y415-L455 HydrophobicContact CD2-CG 4.43Å; Y415-L455 HydrophobicContact CG-CD2 4.32Å; Y415-C456 VanDerWaalsContact CE2-SG 3.56Å; Y415-T630 HydrophobicContact CE2-CG2 4.18Å; Y415-I631 PolarHBondContact OH-N 3.34Å; Y415-Y671 HydrophobicContact CD1-CD1 4.31Å; Y415-Y671 AromaticContact CD1-CD2 3.8Å; Y415-Y671 HydrophobicContact CD1-CD2 3.8Å; Y415-Y671 AromaticContact CD1-CG 3.72Å; Y415-Y671 HydrophobicContact CD1-CG 3.72Å; Y415-Y671 AromaticContact CE1-CD2 3.8Å; Y415-Y671 HydrophobicContact CE1-CD2 3.8Å; Y415-Y671 AromaticContact CE1-CG 3.94Å; Y415-Y671 HydrophobicContact CE1-CG 3.94Å
416	S	90.7	Very high	86.6	Confident	27 Å²	27	42.1 Å²	42.1	19%	0.189	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-46.3	178.8	-175.9	0	0	0	0	111.7	R412 E413 V419 K420	R412-S416 VanDerWaalsContact O-CB 3.32Å; R412-S416 WeakPolarHBondContact O-CB 3.36Å; R412-S416 PolarHBondContact O-N 3.35Å; E413-S416 PolarHBondContact O-N 3.39Å; S416-V419 PolarHBondContact O-N 3.06Å; S416-K420 WeakPolarHBondContact O-CB 3.49Å; S416-K420 VanDerWaalsContact O-CG 3.22Å; S416-K420 WeakPolarHBondContact O-CG 3.45Å; S416-K420 PolarHBondContact O-N 3.39Å; S416-K420 WeakPolarHBondContact OG-CE 3.28Å
417	D	89.6	Confident	85.4	Confident	23 Å²	23	42.6 Å²	42.6	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-43.6	178	-173.6	34.1	0	0	0	111.8	E413 K420 R421	E413-D417 VanDerWaalsContact O-CB 3.29Å; E413-D417 WeakPolarHBondContact O-CB 3.43Å; E413-D417 PolarHBondContact O-N 2.93Å; D417-K420 PolarHBondContact O-N 2.89Å; D417-R421 VanDerWaalsContact CG-NH1 3.28Å; D417-R421 VanDerWaalsContact CG-NH2 3.25Å; D417-R421 WeakPolarHBondContact O-CG 3.27Å; D417-R421 PolarHBondContact O-N 3.16Å; D417-R421 IonicContact OD1-CZ 3.24Å; D417-R421 VanDerWaalsContact OD1-CZ 3.24Å; D417-R421 IonicContact OD1-NE 3.78Å; D417-R421 IonicContact OD1-NH1 3.57Å; D417-R421 IonicContact OD1-NH2 3.07Å; D417-R421 PolarHBondContact OD1-NH2 3.09Å; D417-R421 IonicContact OD2-CZ 2.98Å; D417-R421 IonicContact OD2-NH1 2.68Å; D417-R421 PolarHBondContact OD2-NH1 3.32Å; D417-R421 IonicContact OD2-NH2 2.71Å; D417-R421 PolarHBondContact OD2-NH2 2.83Å
418	F	89.8	Confident	84.2	Confident	5 Å²	5	47.8 Å²	47.8	2%	0.022	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-49.1	175.4	-172.4	-80.4	0	0	0	111.9	V414 Y415 K420 R421 M422 H451 L452 D471 F473	V414-F418 VanDerWaalsContact O-CB 3.25Å; V414-F418 WeakPolarHBondContact O-CB 3.42Å; V414-F418 PolarHBondContact O-N 3.34Å; Y415-F418 PolarHBondContact O-N 2.98Å; F418-K420 PolarHBondContact O-N 3.07Å; F418-R421 PolarHBondContact O-N 3.48Å; F418-M422 PolarHBondContact O-N 3.44Å; F418-H451 HydrophobicContact CE2-CB 4.24Å; F418-H451 HydrophobicContact CZ-CB 4.04Å; F418-L452 HydrophobicContact CB-CD2 4.41Å; F418-L452 HydrophobicContact CD1-CD1 4.33Å; F418-L452 HydrophobicContact CD1-CD2 3.34Å; F418-L452 HydrophobicContact CD1-CG 3.85Å; F418-L452 HydrophobicContact CE1-CD1 4.24Å; F418-L452 HydrophobicContact CE1-CD2 3.77Å; F418-L452 HydrophobicContact CE1-CG 3.74Å; F418-L452 HydrophobicContact CG-CD2 4.01Å; F418-D471 VanDerWaalsContact CE2-O 3.25Å; F418-D471 WeakPolarHBondContact CE2-O 3.5Å; F418-F473 HydrophobicContact CD2-CD1 4.14Å; F418-F473 HydrophobicContact CD2-CD2 4.35Å; F418-F473 AromaticContact CD2-CE1 3.82Å; F418-F473 HydrophobicContact CD2-CE1 3.82Å; F418-F473 HydrophobicContact CD2-CE2 4.05Å; F418-F473 HydrophobicContact CD2-CG 4.39Å; F418-F473 AromaticContact CD2-CZ 3.78Å; F418-F473 HydrophobicContact CD2-CZ 3.78Å; F418-F473 HydrophobicContact CE2-CD2 4.12Å; F418-F473 HydrophobicContact CE2-CE1 4.27Å; F418-F473 AromaticContact CE2-CE2 3.67Å; F418-F473 HydrophobicContact CE2-CE2 3.67Å; F418-F473 AromaticContact CE2-CZ 3.75Å; F418-F473 HydrophobicContact CE2-CZ 3.75Å
419	V	87.4	Confident	82.9	Confident	18 Å²	18	49.6 Å²	49.6	11%	0.109	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-45.7	177.5	162.3	0	0	0	0	111.2	Y415 S416 R421 M422 A423 L452 F669	Y415-V419 HydrophobicContact CD1-CG2 3.79Å; Y415-V419 HydrophobicContact CE1-CG2 3.58Å; Y415-V419 WeakPolarHBondContact O-CB 3.36Å; Y415-V419 WeakPolarHBondContact O-CG2 3.35Å; Y415-V419 PolarHBondContact O-N 3.07Å; S416-V419 PolarHBondContact O-N 3.06Å; V419-R421 VanDerWaalsContact C-N 3.29Å; V419-R421 PolarHBondContact O-N 3.17Å; V419-M422 PolarHBondContact O-N 3.37Å; V419-A423 WeakPolarHBondContact O-CB 3.12Å; V419-A423 PolarHBondContact O-N 3.26Å; V419-L452 HydrophobicContact CG2-CD1 4.48Å; V419-L452 HydrophobicContact CG2-CD2 4.44Å; V419-F669 WeakPolarHBondContact CG1-O 3.14Å; V419-F669 WeakPolarHBondContact CG2-O 3.39Å
420	K	85.7	Confident	81.4	Confident	121 Å²	121	50 Å²	50	53%	0.526	25%	0.245	S	C	.	.	H	α-helix	trans	-61.3	-36.5	178.1	-76.2	171	-176.3	173.4	0	112.5	S416 D417 F418 R424	S416-K420 WeakPolarHBondContact O-CB 3.49Å; S416-K420 VanDerWaalsContact O-CG 3.22Å; S416-K420 WeakPolarHBondContact O-CG 3.45Å; S416-K420 PolarHBondContact O-N 3.39Å; S416-K420 WeakPolarHBondContact OG-CE 3.28Å; D417-K420 PolarHBondContact O-N 2.89Å; F418-K420 PolarHBondContact O-N 3.07Å; K420-R424 WeakPolarHBondContact O-CG 3.29Å; K420-R424 PolarHBondContact O-N 3.27Å; K420-R424 PolarHBondContact O-NE 3.39Å
421	R	83.6	Confident	79.8	Confident	61 Å²	61	55.8 Å²	55.8	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-70.7	-44.6	175	-73.1	-172.4	-173.8	110.5	14	111.3	D417 F418 V419 R424 E425 G472 H474	D417-R421 VanDerWaalsContact CG-NH1 3.28Å; D417-R421 VanDerWaalsContact CG-NH2 3.25Å; D417-R421 WeakPolarHBondContact O-CG 3.27Å; D417-R421 PolarHBondContact O-N 3.16Å; D417-R421 IonicContact OD1-CZ 3.24Å; D417-R421 VanDerWaalsContact OD1-CZ 3.24Å; D417-R421 IonicContact OD1-NE 3.78Å; D417-R421 IonicContact OD1-NH1 3.57Å; D417-R421 IonicContact OD1-NH2 3.07Å; D417-R421 PolarHBondContact OD1-NH2 3.09Å; D417-R421 IonicContact OD2-CZ 2.98Å; D417-R421 IonicContact OD2-NH1 2.68Å; D417-R421 PolarHBondContact OD2-NH1 3.32Å; D417-R421 IonicContact OD2-NH2 2.71Å; D417-R421 PolarHBondContact OD2-NH2 2.83Å; F418-R421 PolarHBondContact O-N 3.48Å; V419-R421 VanDerWaalsContact C-N 3.29Å; V419-R421 PolarHBondContact O-N 3.17Å; R421-R424 WeakPolarHBondContact O-CB 3.15Å; R421-R424 PolarHBondContact O-N 3.09Å; R421-E425 PolarHBondContact O-N 2.94Å; R421-G472 PolarHBondContact NH1-O 2.9Å; R421-H474 PolarHBondContact NH1-O 2.89Å; R421-H474 PolarHBondContact NH2-O 2.77Å
422	M	78.8	Confident	78.1	Confident	10 Å²	10	62.7 Å²	62.7	5%	0.049	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-42.2	179.1	-168.4	62.1	-164.4	0	0	111.8	F418 V419 R424 E425 V426 F669	F418-M422 PolarHBondContact O-N 3.44Å; V419-M422 PolarHBondContact O-N 3.37Å; M422-R424 PolarHBondContact O-N 3.36Å; M422-E425 PolarHBondContact O-N 3.04Å; M422-E425 HydrophobicContact SD-CB 4.44Å; M422-V426 HydrophobicContact CE-CG2 3.64Å; M422-V426 HydrophobicContact CG-CG2 4.24Å; M422-V426 WeakPolarHBondContact O-CG2 3.32Å; M422-V426 PolarHBondContact O-N 3.19Å; M422-F669 HydrophobicContact CG-CD1 4.49Å; M422-F669 HydrophobicContact CG-CE1 4.49Å
423	A	76.1	Confident	76	Confident	46 Å²	46	61.2 Å²	61.2	38%	0.38	32%	0.316	S	S	.	.	H	α-helix	trans	-59.1	-36.7	175.4	0	0	0	0	0	112.1	V419 S427	V419-A423 WeakPolarHBondContact O-CB 3.12Å; V419-A423 PolarHBondContact O-N 3.26Å; A423-S427 VanDerWaalsContact O-CB 3.26Å; A423-S427 WeakPolarHBondContact O-CB 3.22Å; A423-S427 PolarHBondContact O-N 2.67Å; A423-S427 PolarHBondContact O-OG 3.15Å
424	R	76.8	Confident	73.8	Confident	145 Å²	145	65.4 Å²	65.4	55%	0.547	34%	0.341	S	S	.	.	H	α-helix	trans	-65.9	-45.7	171.4	-78.3	179	-89	169.2	-10.8	111.5	K420 R421 M422 S427 L428	K420-R424 WeakPolarHBondContact O-CG 3.29Å; K420-R424 PolarHBondContact O-N 3.27Å; K420-R424 PolarHBondContact O-NE 3.39Å; R421-R424 WeakPolarHBondContact O-CB 3.15Å; R421-R424 PolarHBondContact O-N 3.09Å; M422-R424 PolarHBondContact O-N 3.36Å; R424-S427 PolarHBondContact O-N 3.48Å; R424-L428 WeakPolarHBondContact O-CB 3.19Å; R424-L428 WeakPolarHBondContact O-CD1 3.41Å; R424-L428 WeakPolarHBondContact O-CG 3.28Å; R424-L428 PolarHBondContact O-N 3.48Å
425	E	73.7	Confident	71.8	Confident	74 Å²	74	68.3 Å²	68.3	35%	0.346	37%	0.372	S	S	.	.	H	α-helix	trans	-64.2	-43	179.4	-167.8	-178.6	164.7	0	0	112.7	R421 M422 L428 K429	R421-E425 PolarHBondContact O-N 2.94Å; M422-E425 PolarHBondContact O-N 3.04Å; M422-E425 HydrophobicContact SD-CB 4.44Å; E425-L428 PolarHBondContact O-N 2.82Å; E425-K429 HydrophobicContact CG-CD 4.22Å; E425-K429 WeakPolarHBondContact O-CB 3.44Å; E425-K429 VanDerWaalsContact O-CG 3.31Å; E425-K429 WeakPolarHBondContact O-CG 3.38Å; E425-K429 PolarHBondContact O-N 2.9Å; E425-K429 WeakPolarHBondContact OE1-CE 3.47Å; E425-K429 IonicContact OE1-NZ 3.64Å; E425-K429 PolarHBondContact OE1-NZ 3.27Å
426	V	67.9	Low	69.4	Low	27 Å²	27	76.4 Å²	76.4	16%	0.164	42%	0.415	C	S	.	.	H	α-helix	trans	-64.4	-46.8	175.8	175.3	0	0	0	0	110.4	M422 L428 K429 M430	M422-V426 HydrophobicContact CE-CG2 3.64Å; M422-V426 HydrophobicContact CG-CG2 4.24Å; M422-V426 WeakPolarHBondContact O-CG2 3.32Å; M422-V426 PolarHBondContact O-N 3.19Å; V426-L428 PolarHBondContact O-N 3.47Å; V426-K429 PolarHBondContact O-N 3.33Å; V426-M430 HydrophobicContact CG1-CE 4.11Å; V426-M430 HydrophobicContact CG1-CG 4.29Å; V426-M430 HydrophobicContact CG1-SD 4.11Å; V426-M430 WeakPolarHBondContact O-CB 3.49Å; V426-M430 WeakPolarHBondContact O-CG 3.46Å; V426-M430 PolarHBondContact O-N 3.14Å
427	S	69.3	Low	67.4	Low	58 Å²	58	84 Å²	84	41%	0.406	44%	0.439	S	S	.	.	H	α-helix	trans	-60.1	-44	177.5	-60.7	0	0	0	0	112.1	A423 R424 K429 M430 N431	A423-S427 VanDerWaalsContact O-CB 3.26Å; A423-S427 WeakPolarHBondContact O-CB 3.22Å; A423-S427 PolarHBondContact O-N 2.67Å; A423-S427 PolarHBondContact O-OG 3.15Å; R424-S427 PolarHBondContact O-N 3.48Å; S427-K429 VanDerWaalsContact C-N 3.34Å; S427-K429 PolarHBondContact O-N 2.95Å; S427-M430 PolarHBondContact O-N 3.13Å; S427-N431 PolarHBondContact O-N 3.13Å; S427-N431 VanDerWaalsContact O-N 3.12Å
428	L	68.1	Low	65.5	Low	113 Å²	113	89.3 Å²	89.3	59%	0.592	47%	0.467	S	S	*	.	H	α-helix	trans	-62	-41.2	176.7	-75	166.8	0	0	0	112	R424 E425 V426 I432	R424-L428 WeakPolarHBondContact O-CB 3.19Å; R424-L428 WeakPolarHBondContact O-CD1 3.41Å; R424-L428 WeakPolarHBondContact O-CG 3.28Å; R424-L428 PolarHBondContact O-N 3.48Å; E425-L428 PolarHBondContact O-N 2.82Å; V426-L428 PolarHBondContact O-N 3.47Å; L428-I432 WeakPolarHBondContact O-CD1 3.5Å; L428-I432 WeakPolarHBondContact O-CG1 3.41Å
429	K	64.3	Low	63.5	Low	73 Å²	73	95.5 Å²	95.5	32%	0.317	50%	0.501	S	S	.	.	H	α-helix	trans	-74.2	-32.2	179.6	-72.4	175.1	177.9	173.7	0	112.7	E425 V426 S427 I432 A433 L441	E425-K429 HydrophobicContact CG-CD 4.22Å; E425-K429 WeakPolarHBondContact O-CB 3.44Å; E425-K429 VanDerWaalsContact O-CG 3.31Å; E425-K429 WeakPolarHBondContact O-CG 3.38Å; E425-K429 PolarHBondContact O-N 2.9Å; E425-K429 WeakPolarHBondContact OE1-CE 3.47Å; E425-K429 IonicContact OE1-NZ 3.64Å; E425-K429 PolarHBondContact OE1-NZ 3.27Å; V426-K429 PolarHBondContact O-N 3.33Å; S427-K429 VanDerWaalsContact C-N 3.34Å; S427-K429 PolarHBondContact O-N 2.95Å; K429-I432 PolarHBondContact O-N 2.75Å; K429-A433 VanDerWaalsContact O-CB 3.28Å; K429-A433 WeakPolarHBondContact O-CB 3.22Å; K429-A433 PolarHBondContact O-N 3.33Å; K429-L441 HydrophobicContact CB-CD1 3.69Å; K429-L441 HydrophobicContact CD-CD1 3.83Å; K429-L441 HydrophobicContact CG-CD1 4.37Å
430	M	58.9	Low	61.6	Low	51 Å²	51	101.2 Å²	101.2	25%	0.251	52%	0.524	S	S	.	.	H	α-helix	trans	-66.6	-39.2	174.4	-78	-171	164.7	0	0	111.8	V426 S427 I432 A433 R666	V426-M430 HydrophobicContact CG1-CE 4.11Å; V426-M430 HydrophobicContact CG1-CG 4.29Å; V426-M430 HydrophobicContact CG1-SD 4.11Å; V426-M430 WeakPolarHBondContact O-CB 3.49Å; V426-M430 WeakPolarHBondContact O-CG 3.46Å; V426-M430 PolarHBondContact O-N 3.14Å; S427-M430 PolarHBondContact O-N 3.13Å; M430-I432 PolarHBondContact O-N 2.97Å; M430-A433 PolarHBondContact O-N 3.38Å; M430-R666 PolarHBondContact SD-NH2 3.41Å
431	N	56	Low	60	Low	141 Å²	141	98.1 Å²	98.1	75%	0.754	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-12.7	178.3	-69	-11.6	0	0	0	114.2	S427	S427-N431 PolarHBondContact O-N 3.13Å; S427-N431 VanDerWaalsContact O-N 3.12Å
432	I	56.7	Low	58.6	Low	146 Å²	146	98.2 Å²	98.2	75%	0.749	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-11.8	-178.5	-61.7	168.5	0	0	0	111.5	L428 K429 M430	L428-I432 WeakPolarHBondContact O-CD1 3.5Å; L428-I432 WeakPolarHBondContact O-CG1 3.41Å; K429-I432 PolarHBondContact O-N 2.75Å; M430-I432 PolarHBondContact O-N 2.97Å
433	A	48.3	Very low	57.4	Low	56 Å²	56	103.4 Å²	103.4	46%	0.463	55%	0.55	S	S	.	.			trans	-109.9	62.3	-162.8	0	0	0	0	0	114.1	K429 M430 G435	K429-A433 VanDerWaalsContact O-CB 3.28Å; K429-A433 WeakPolarHBondContact O-CB 3.22Å; K429-A433 PolarHBondContact O-N 3.33Å; M430-A433 PolarHBondContact O-N 3.38Å; A433-G435 VanDerWaalsContact C-N 3.27Å; A433-G435 PolarHBondContact O-N 3.49Å
434	D	45.6	Very low	56.6	Low	176 Å²	176	102.7 Å²	102.7	94%	0.941	54%	0.542	S	S	*	.	S	Bend	trans	-89.1	34.7	169.4	-133.6	8.8	0	0	0	112.5
435	G	48.5	Very low	56.3	Low	64 Å²	64	97 Å²	97	66%	0.66	52%	0.524	S	S	*	.	S	Bend	trans	173.9	-31.8	170.6	0	0	0	0	0	122.8	A433	A433-G435 VanDerWaalsContact C-N 3.27Å; A433-G435 PolarHBondContact O-N 3.49Å
436	L	42.4	Very low	56.2	Low	170 Å²	170	98.2 Å²	98.2	89%	0.89	53%	0.533	S	S	*	.	S	Bend	trans	-145.6	16.7	-155.2	-94.9	137.6	0	0	0	120.4
437	R	47.4	Very low	56.7	Low	186 Å²	186	98.9 Å²	98.9	70%	0.702	54%	0.541	S	S	*	.			trans	-146.5	46.6	178.7	-72.1	-169.8	170.2	172.9	-0	117.3	D439	R437-D439 VanDerWaalsContact C-N 3.3Å; R437-D439 PolarHBondContact O-N 3.43Å
438	N	49.7	Very low	57.4	Low	134 Å²	134	96.6 Å²	96.6	72%	0.717	53%	0.525	S	S	*	.	H	α-helix	trans	-60	-30.6	179.5	-78.8	-11.7	0	0	0	115	K440 L441 S442	N438-K440 PolarHBondContact O-N 3.47Å; N438-L441 PolarHBondContact O-N 3.33Å; N438-S442 PolarHBondContact O-N 2.98Å
439	D	47.7	Very low	58.2	Low	135 Å²	135	91.9 Å²	91.9	72%	0.722	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-35.7	-175.1	-76.9	-15.7	0	0	0	114.6	R437 L441 I443	R437-D439 VanDerWaalsContact C-N 3.3Å; R437-D439 PolarHBondContact O-N 3.43Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 2.68Å; D439-I443 PolarHBondContact O-N 3.44Å
440	K	48.7	Very low	59.3	Low	139 Å²	139	90.9 Å²	90.9	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-72.8	-28.2	-179.3	-70.7	-169.9	179.2	-174	0	112.4	N438 S444	N438-K440 PolarHBondContact O-N 3.47Å; K440-S444 PolarHBondContact O-N 3.1Å
441	L	51.9	Low	60.7	Low	56 Å²	56	89.1 Å²	89.1	29%	0.293	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-43.2	177.9	-150.7	82.3	0	0	0	110.5	K429 N438 D439 S445	K429-L441 HydrophobicContact CB-CD1 3.69Å; K429-L441 HydrophobicContact CD-CD1 3.83Å; K429-L441 HydrophobicContact CG-CD1 4.37Å; N438-L441 PolarHBondContact O-N 3.33Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 2.68Å; L441-S445 WeakPolarHBondContact O-CB 3.32Å; L441-S445 PolarHBondContact O-N 2.94Å; L441-S445 VanDerWaalsContact O-N 3.11Å; L441-S445 PolarHBondContact O-OG 2.62Å
442	S	53.3	Low	62.4	Low	62 Å²	62	82.4 Å²	82.4	43%	0.434	46%	0.456	S	S	.	.	H	α-helix	trans	-59.4	-49.5	178.1	-177.6	0	0	0	0	111.9	N438 S444 S445 L446	N438-S442 PolarHBondContact O-N 2.98Å; S442-S444 PolarHBondContact O-N 3.42Å; S442-S445 PolarHBondContact O-N 3.38Å; S442-S445 PolarHBondContact O-OG 3.14Å; S442-L446 WeakPolarHBondContact O-CG 3.43Å; S442-L446 PolarHBondContact O-N 3.21Å; S442-L446 VanDerWaalsContact O-N 3.08Å
443	I	54.1	Low	64.1	Low	120 Å²	120	75.8 Å²	75.8	62%	0.615	42%	0.422	S	S	*	.	H	α-helix	trans	-63.4	-44.3	-176.1	-61.6	167.7	0	0	0	112.2	D439 L446 A447	D439-I443 PolarHBondContact O-N 3.44Å; I443-L446 PolarHBondContact O-N 3.26Å; I443-A447 PolarHBondContact O-N 3.15Å
444	S	59.9	Low	66.2	Low	31 Å²	31	74.7 Å²	74.7	22%	0.217	41%	0.406	C	S	.	.	H	α-helix	trans	-67.4	-36.6	179.5	169.7	0	0	0	0	112.2	K440 S442 S448	K440-S444 PolarHBondContact O-N 3.1Å; S442-S444 PolarHBondContact O-N 3.42Å; S444-S448 PolarHBondContact O-N 3.11Å; S444-S448 VanDerWaalsContact O-N 3.17Å; S444-S448 PolarHBondContact O-OG 2.98Å
445	S	70.9	Confident	68.4	Low	25 Å²	25	66.3 Å²	66.3	18%	0.175	36%	0.362	C	S	.	.	H	α-helix	trans	-65.3	-40.9	175.5	73.7	0	0	0	0	112.3	L441 S442 A447 S448 I449	L441-S445 WeakPolarHBondContact O-CB 3.32Å; L441-S445 PolarHBondContact O-N 2.94Å; L441-S445 VanDerWaalsContact O-N 3.11Å; L441-S445 PolarHBondContact O-OG 2.62Å; S442-S445 PolarHBondContact O-N 3.38Å; S442-S445 PolarHBondContact O-OG 3.14Å; S445-A447 PolarHBondContact O-N 3.05Å; S445-S448 PolarHBondContact O-N 3.21Å; S445-I449 VanDerWaalsContact O-CG1 3.25Å; S445-I449 WeakPolarHBondContact O-CG1 3.48Å; S445-I449 PolarHBondContact O-N 3.41Å
446	L	71.6	Confident	70.6	Confident	99 Å²	99	63.3 Å²	63.3	52%	0.518	33%	0.33	S	S	.	.	H	α-helix	trans	-65.3	-40.1	179.3	-70.5	174	0	0	0	112.8	S442 I443 T450	S442-L446 WeakPolarHBondContact O-CG 3.43Å; S442-L446 PolarHBondContact O-N 3.21Å; S442-L446 VanDerWaalsContact O-N 3.08Å; I443-L446 PolarHBondContact O-N 3.26Å; L446-T450 PolarHBondContact O-N 2.95Å; L446-T450 PolarHBondContact O-OG1 3.23Å
447	A	78.8	Confident	73	Confident	42 Å²	42	55.2 Å²	55.2	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-45.1	174.6	0	0	0	0	0	111	I443 S445 T450 H451	I443-A447 PolarHBondContact O-N 3.15Å; S445-A447 PolarHBondContact O-N 3.05Å; A447-T450 WeakPolarHBondContact O-CB 3.36Å; A447-T450 PolarHBondContact O-N 3.33Å; A447-T450 VanDerWaalsContact O-N 3.12Å; A447-H451 PolarHBondContact O-CD2 3.48Å; A447-H451 VanDerWaalsContact O-CG 3.29Å; A447-H451 PolarHBondContact O-N 3.37Å; A447-H451 PolarHBondContact O-ND1 3.41Å
448	S	83.3	Confident	75.2	Confident	10 Å²	10	46.3 Å²	46.3	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-44.4	179.4	-56.4	0	0	0	0	112.5	S444 S445 T450 H451 L452	S444-S448 PolarHBondContact O-N 3.11Å; S444-S448 VanDerWaalsContact O-N 3.17Å; S444-S448 PolarHBondContact O-OG 2.98Å; S445-S448 PolarHBondContact O-N 3.21Å; S448-T450 VanDerWaalsContact C-N 3.27Å; S448-T450 PolarHBondContact O-N 2.98Å; S448-H451 PolarHBondContact O-N 3.45Å; S448-H451 VanDerWaalsContact O-N 3.16Å; S448-L452 WeakPolarHBondContact O-CG 3.41Å; S448-L452 PolarHBondContact O-N 3.38Å
449	I	84.8	Confident	77.3	Confident	13 Å²	13	40 Å²	40	7%	0.067	22%	0.22	C	C	.	.	H	α-helix	trans	-55.8	-45.3	172.1	-72.1	170.3	0	0	0	110.5	S445 H451 L452 K453 W599 I631 F669	S445-I449 VanDerWaalsContact O-CG1 3.25Å; S445-I449 WeakPolarHBondContact O-CG1 3.48Å; S445-I449 PolarHBondContact O-N 3.41Å; I449-H451 VanDerWaalsContact C-N 3.31Å; I449-H451 PolarHBondContact O-N 3.49Å; I449-L452 PolarHBondContact O-N 2.87Å; I449-K453 HydrophobicContact CG2-CD 4.39Å; I449-K453 WeakPolarHBondContact O-CG 3.32Å; I449-K453 PolarHBondContact O-N 3.27Å; I449-W599 HydrophobicContact CD1-CZ2 4.47Å; I449-W599 HydrophobicContact CG2-CZ2 3.86Å; I449-I631 HydrophobicContact CB-CD1 4Å; I449-I631 HydrophobicContact CG1-CD1 3.71Å; I449-I631 HydrophobicContact CG2-CD1 3.7Å; I449-F669 HydrophobicContact CD1-CZ 4.19Å; I449-F669 HydrophobicContact CG1-CE1 3.84Å; I449-F669 HydrophobicContact CG1-CZ 3.74Å
450	T	86.5	Confident	79.3	Confident	53 Å²	53	33.9 Å²	33.9	33%	0.325	19%	0.188	S	C	.	.	H	α-helix	trans	-62.5	-39.8	179.3	-58.1	0	0	0	0	111.5	L446 A447 S448 K454 Y526	L446-T450 PolarHBondContact O-N 2.95Å; L446-T450 PolarHBondContact O-OG1 3.23Å; A447-T450 WeakPolarHBondContact O-CB 3.36Å; A447-T450 PolarHBondContact O-N 3.33Å; A447-T450 VanDerWaalsContact O-N 3.12Å; S448-T450 VanDerWaalsContact C-N 3.27Å; S448-T450 PolarHBondContact O-N 2.98Å; T450-K454 WeakPolarHBondContact O-CG 3.28Å; T450-K454 PolarHBondContact O-N 3.3Å; T450-Y526 HydrophobicContact CG2-CE1 4.47Å
451	H	89.7	Confident	81.2	Confident	13 Å²	13	27.9 Å²	27.9	6%	0.06	16%	0.162	C	C	.	.	H	α-helix	trans	-66.5	-43.7	176.3	-60.6	157.5	0	0	0	112.4	F418 A447 S448 I449 K453 K454 L455 K465 D471 F473	F418-H451 HydrophobicContact CE2-CB 4.24Å; F418-H451 HydrophobicContact CZ-CB 4.04Å; A447-H451 PolarHBondContact O-CD2 3.48Å; A447-H451 VanDerWaalsContact O-CG 3.29Å; A447-H451 PolarHBondContact O-N 3.37Å; A447-H451 PolarHBondContact O-ND1 3.41Å; S448-H451 PolarHBondContact O-N 3.45Å; S448-H451 VanDerWaalsContact O-N 3.16Å; I449-H451 VanDerWaalsContact C-N 3.31Å; I449-H451 PolarHBondContact O-N 3.49Å; H451-K453 VanDerWaalsContact C-N 3.34Å; H451-K453 PolarHBondContact O-N 3.23Å; H451-K454 PolarHBondContact O-N 3.23Å; H451-L455 WeakPolarHBondContact O-CB 3.34Å; H451-L455 PolarHBondContact O-N 3.04Å; H451-K465 PolarHBondContact CE1-NZ 2.81Å; H451-K465 VanDerWaalsContact CE1-NZ 3.3Å; H451-K465 WeakPolarHBondContact NE2-CE 3.44Å; H451-K465 PolarHBondContact NE2-NZ 2.83Å; H451-D471 IonicContact CE1-OD2 2.74Å; H451-F473 HydrophobicContact CB-CE2 3.82Å; H451-F473 HydrophobicContact CB-CZ 3.91Å; H451-F473 AromaticContact CG-CE2 4Å
452	L	91.1	Very high	83	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-41.5	176.3	-71	178.8	0	0	0	112	Y415 F418 V419 S448 I449 L455 C456 I631 F669	Y415-L452 HydrophobicContact CD2-CD2 3.9Å; Y415-L452 HydrophobicContact CE1-CD2 4.34Å; Y415-L452 HydrophobicContact CE2-CB 4.1Å; Y415-L452 HydrophobicContact CE2-CD2 3.62Å; Y415-L452 HydrophobicContact CE2-CG 4.34Å; Y415-L452 HydrophobicContact CG-CD2 4.37Å; F418-L452 HydrophobicContact CB-CD2 4.41Å; F418-L452 HydrophobicContact CD1-CD1 4.33Å; F418-L452 HydrophobicContact CD1-CD2 3.34Å; F418-L452 HydrophobicContact CD1-CG 3.85Å; F418-L452 HydrophobicContact CE1-CD1 4.24Å; F418-L452 HydrophobicContact CE1-CD2 3.77Å; F418-L452 HydrophobicContact CE1-CG 3.74Å; F418-L452 HydrophobicContact CG-CD2 4.01Å; V419-L452 HydrophobicContact CG2-CD1 4.48Å; V419-L452 HydrophobicContact CG2-CD2 4.44Å; S448-L452 WeakPolarHBondContact O-CG 3.41Å; S448-L452 PolarHBondContact O-N 3.38Å; I449-L452 PolarHBondContact O-N 2.87Å; L452-L455 PolarHBondContact O-N 3.4Å; L452-C456 PolarHBondContact O-N 3.12Å; L452-C456 PolarHBondContact O-SG 3.37Å; L452-I631 HydrophobicContact CB-CG2 4.02Å; L452-F669 HydrophobicContact CD1-CD1 3.83Å; L452-F669 HydrophobicContact CD1-CE1 4.14Å
453	K	91.5	Very high	84.7	Confident	8 Å²	8	23.8 Å²	23.8	4%	0.035	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-46.1	174.1	-72.2	-172.4	73.4	-176.6	0	112	I449 H451 L455 C456 N457 Y526 P597 I631 M635	I449-K453 HydrophobicContact CG2-CD 4.39Å; I449-K453 WeakPolarHBondContact O-CG 3.32Å; I449-K453 PolarHBondContact O-N 3.27Å; H451-K453 VanDerWaalsContact C-N 3.34Å; H451-K453 PolarHBondContact O-N 3.23Å; K453-L455 VanDerWaalsContact C-N 3.33Å; K453-L455 PolarHBondContact O-N 3.44Å; K453-C456 PolarHBondContact O-N 2.72Å; K453-N457 PolarHBondContact O-N 3.26Å; K453-Y526 HydrophobicContact CB-CE2 4.47Å; K453-Y526 WeakPolarHBondContact CD-OH 3.17Å; K453-Y526 WeakPolarHBondContact CE-OH 3.14Å; K453-Y526 PolarHBondContact NZ-OH 2.86Å; K453-P597 PolarHBondContact NZ-O 2.73Å; K453-I631 HydrophobicContact CG-CG2 4.31Å; K453-M635 HydrophobicContact CD-CE 4.37Å; K453-M635 HydrophobicContact CD-SD 3.66Å; K453-M635 VanDerWaalsContact CE-SD 3.59Å; K453-M635 HydrophobicContact CG-SD 4.22Å
454	K	92.3	Very high	86.2	Confident	33 Å²	33	24.4 Å²	24.4	14%	0.143	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-43.4	175.6	-75	-173.8	-177.1	-157.5	0	111.6	T450 H451 N457 H458 L461 V462	T450-K454 WeakPolarHBondContact O-CG 3.28Å; T450-K454 PolarHBondContact O-N 3.3Å; H451-K454 PolarHBondContact O-N 3.23Å; K454-N457 WeakPolarHBondContact O-CB 3.4Å; K454-N457 PolarHBondContact O-N 3.34Å; K454-H458 PolarHBondContact O-N 2.82Å; K454-H458 VanDerWaalsContact O-O 3.06Å; K454-L461 HydrophobicContact CB-CB 3.86Å; K454-L461 HydrophobicContact CD-CB 4.34Å; K454-L461 HydrophobicContact CG-CB 4.27Å; K454-V462 HydrophobicContact CB-CG1 3.67Å; K454-V462 HydrophobicContact CD-CG1 4.41Å
455	L	93.1	Very high	87.5	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-43	176.5	179.1	62.4	0	0	0	111.5	Q411 V414 Y415 H451 L452 K453 N457 P459 V462 M466	Q411-L455 HydrophobicContact CG-CD1 4.23Å; Q411-L455 HydrophobicContact CG-CG 4.4Å; Q411-L455 PolarHBondContact NE2-O 3.42Å; V414-L455 HydrophobicContact CB-CD1 4.44Å; V414-L455 HydrophobicContact CB-CD2 4.26Å; V414-L455 HydrophobicContact CG1-CD1 3.96Å; V414-L455 HydrophobicContact CG1-CD2 3.68Å; Y415-L455 HydrophobicContact CD2-CD2 3.83Å; Y415-L455 HydrophobicContact CD2-CG 4.43Å; Y415-L455 HydrophobicContact CG-CD2 4.32Å; H451-L455 WeakPolarHBondContact O-CB 3.34Å; H451-L455 PolarHBondContact O-N 3.04Å; L452-L455 PolarHBondContact O-N 3.4Å; K453-L455 VanDerWaalsContact C-N 3.33Å; K453-L455 PolarHBondContact O-N 3.44Å; L455-N457 VanDerWaalsContact C-N 3.3Å; L455-N457 PolarHBondContact O-N 3.35Å; L455-P459 HydrophobicContact CD1-CG 4.44Å; L455-V462 HydrophobicContact CB-CG2 4.4Å; L455-V462 HydrophobicContact CD1-CG2 4.03Å; L455-M466 HydrophobicContact CD1-CE 4.1Å
456	C	94.1	Very high	88.2	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-40	175.1	-68.2	0	0	0	0	112	Q411 Y415 L452 K453 K501 E632	Q411-C456 PolarHBondContact NE2-O 2.68Å; Q411-C456 VanDerWaalsContact NE2-O 3.12Å; Y415-C456 VanDerWaalsContact CE2-SG 3.56Å; L452-C456 PolarHBondContact O-N 3.12Å; L452-C456 PolarHBondContact O-SG 3.37Å; K453-C456 PolarHBondContact O-N 2.72Å; C456-K501 WeakPolarHBondContact O-CE 3.4Å; C456-E632 HydrophobicContact CB-CG 4.1Å
457	N	93.6	Very high	88.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-64.4	174.5	-80.1	7.8	0	0	0	111	K453 K454 L455 L461 S499 K501 F502 T529 F595 D596 E632	K453-N457 PolarHBondContact O-N 3.26Å; K454-N457 WeakPolarHBondContact O-CB 3.4Å; K454-N457 PolarHBondContact O-N 3.34Å; L455-N457 VanDerWaalsContact C-N 3.3Å; L455-N457 PolarHBondContact O-N 3.35Å; N457-L461 HydrophobicContact CB-CD1 3.49Å; N457-L461 VanDerWaalsContact CB-CD1 3.49Å; N457-S499 WeakPolarHBondContact O-CB 3.43Å; N457-S499 PolarHBondContact O-OG 3.5Å; N457-K501 PolarHBondContact OD1-NZ 3.09Å; N457-F502 WeakPolarHBondContact O-CD2 3.07Å; N457-F502 WeakPolarHBondContact O-CE2 3.47Å; N457-T529 PolarHBondContact ND2-OG1 3.23Å; N457-T529 VanDerWaalsContact ND2-OG1 3.08Å; N457-F595 HydrophobicContact CB-CE1 3.84Å; N457-D596 PolarHBondContact ND2-OD1 3.15Å; N457-D596 WeakPolarHBondContact OD1-CB 3.3Å; N457-E632 PolarHBondContact OD1-OE1 2.99Å
458	H	93.5	Very high	89.3	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.127	C	C	.	.			trans	-163.1	139.6	177	-162.6	-85.1	0	0	0	111.3	K454 D460 L461 K495 F502 L532	K454-H458 PolarHBondContact O-N 2.82Å; K454-H458 VanDerWaalsContact O-O 3.06Å; H458-D460 IonicContact CE1-OD1 3.05Å; H458-D460 PolarHBondContact CE1-OD1 3.38Å; H458-D460 IonicContact CE1-OD2 2.6Å; H458-D460 VanDerWaalsContact ND1-CB 3.26Å; H458-D460 WeakPolarHBondContact ND1-CB 3.29Å; H458-D460 PolarHBondContact ND1-N 3.35Å; H458-D460 IonicContact ND1-OD1 3.6Å; H458-D460 PolarHBondContact ND1-OD1 2.99Å; H458-D460 IonicContact ND1-OD2 3.62Å; H458-D460 PolarHBondContact O-N 3.16Å; H458-L461 HydrophobicContact CB-CD1 4.31Å; H458-L461 HydrophobicContact CB-CG 4.43Å; H458-L461 WeakPolarHBondContact O-CB 3.49Å; H458-L461 PolarHBondContact O-N 3.22Å; H458-K495 PolarHBondContact NE2-O 2.97Å; H458-K495 VanDerWaalsContact NE2-O 3.16Å; H458-F502 HydrophobicContact CB-CD2 3.96Å; H458-F502 HydrophobicContact CB-CE2 3.78Å; H458-F502 AromaticContact CD2-CD2 3.6Å; H458-F502 AromaticContact CD2-CG 3.75Å; H458-L532 HydrophobicContact CB-CD1 3.67Å
459	P	92.1	Very high	89.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-53.5	-35.8	175.6	-29.9	37.3	0	0	0	114.9	Q411 L455 L461 V462 Y463 F480 L498	Q411-P459 HydrophobicContact CG-CG 4.44Å; L455-P459 HydrophobicContact CD1-CG 4.44Å; P459-L461 PolarHBondContact O-N 2.9Å; P459-V462 WeakPolarHBondContact O-CG2 3.47Å; P459-V462 PolarHBondContact O-N 3.23Å; P459-Y463 PolarHBondContact O-N 3.31Å; P459-Y463 VanDerWaalsContact O-N 3.13Å; P459-F480 HydrophobicContact CB-CE1 3.66Å; P459-F480 HydrophobicContact CB-CZ 3.54Å; P459-F480 HydrophobicContact CG-CE1 3.78Å; P459-F480 HydrophobicContact CG-CZ 3.84Å; P459-L498 WeakPolarHBondContact CD-O 3.42Å; P459-L498 HydrophobicContact CG-CB 4.31Å; P459-L498 WeakPolarHBondContact CG-O 3.31Å
460	D	89.8	Confident	89.3	Confident	8 Å²	8	28.1 Å²	28.1	4%	0.043	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-51.7	-29.7	175.3	-71.4	19.6	0	0	0	114.2	H458 V462 Y463 Y484 S487 L532	H458-D460 IonicContact CE1-OD1 3.05Å; H458-D460 PolarHBondContact CE1-OD1 3.38Å; H458-D460 IonicContact CE1-OD2 2.6Å; H458-D460 VanDerWaalsContact ND1-CB 3.26Å; H458-D460 WeakPolarHBondContact ND1-CB 3.29Å; H458-D460 PolarHBondContact ND1-N 3.35Å; H458-D460 IonicContact ND1-OD1 3.6Å; H458-D460 PolarHBondContact ND1-OD1 2.99Å; H458-D460 IonicContact ND1-OD2 3.62Å; H458-D460 PolarHBondContact O-N 3.16Å; D460-V462 PolarHBondContact O-N 2.9Å; D460-Y463 WeakPolarHBondContact O-CB 3.1Å; D460-Y463 PolarHBondContact O-N 2.82Å; D460-Y484 WeakPolarHBondContact CA-OH 3.19Å; D460-Y484 PolarHBondContact N-OH 2.9Å; D460-Y484 VanDerWaalsContact N-OH 3.14Å; D460-Y484 WeakPolarHBondContact OD1-CE2 3.42Å; D460-Y484 VanDerWaalsContact OD1-CZ 3.31Å; D460-Y484 PolarHBondContact OD1-OH 2.71Å; D460-S487 WeakPolarHBondContact OD2-CB 3.33Å; D460-S487 PolarHBondContact OD2-N 2.83Å; D460-S487 PolarHBondContact OD2-OG 3.09Å; D460-L532 HydrophobicContact CB-CD1 4.43Å; D460-L532 HydrophobicContact CB-CD2 4.19Å
461	L	90.4	Very high	88.8	Confident	12 Å²	12	29.9 Å²	29.9	6%	0.063	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-72.9	-15.1	-179	-63.5	168.3	0	0	0	113.4	K454 N457 H458 P459 L488 Q528 T529 L532	K454-L461 HydrophobicContact CB-CB 3.86Å; K454-L461 HydrophobicContact CD-CB 4.34Å; K454-L461 HydrophobicContact CG-CB 4.27Å; N457-L461 HydrophobicContact CB-CD1 3.49Å; N457-L461 VanDerWaalsContact CB-CD1 3.49Å; H458-L461 HydrophobicContact CB-CD1 4.31Å; H458-L461 HydrophobicContact CB-CG 4.43Å; H458-L461 WeakPolarHBondContact O-CB 3.49Å; H458-L461 PolarHBondContact O-N 3.22Å; P459-L461 PolarHBondContact O-N 2.9Å; L461-L488 HydrophobicContact CD2-CD1 3.71Å; L461-Q528 HydrophobicContact CD2-CB 3.45Å; L461-Q528 VanDerWaalsContact CD2-CB 3.45Å; L461-T529 WeakPolarHBondContact CD1-OG1 3.23Å; L461-L532 HydrophobicContact CD1-CD1 4.24Å; L461-L532 HydrophobicContact CD2-CD1 3.88Å; L461-L532 HydrophobicContact CD2-CG 4.5Å; L461-L532 HydrophobicContact CG-CD1 3.83Å
462	V	89.8	Confident	88.2	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	3.8	177.6	-65.7	0	0	0	0	112.2	K454 L455 P459 D460 E464 K465 M466 F473	K454-V462 HydrophobicContact CB-CG1 3.67Å; K454-V462 HydrophobicContact CD-CG1 4.41Å; L455-V462 HydrophobicContact CB-CG2 4.4Å; L455-V462 HydrophobicContact CD1-CG2 4.03Å; P459-V462 WeakPolarHBondContact O-CG2 3.47Å; P459-V462 PolarHBondContact O-N 3.23Å; D460-V462 PolarHBondContact O-N 2.9Å; V462-E464 VanDerWaalsContact C-N 3.31Å; V462-E464 PolarHBondContact O-N 3.23Å; V462-K465 WeakPolarHBondContact O-CB 3.22Å; V462-K465 PolarHBondContact O-N 2.87Å; V462-M466 HydrophobicContact CG2-CE 3.48Å; V462-M466 VanDerWaalsContact CG2-CE 3.48Å; V462-M466 HydrophobicContact CG2-SD 4.14Å; V462-M466 WeakPolarHBondContact O-CG 3.28Å; V462-M466 PolarHBondContact O-N 2.99Å; V462-F473 HydrophobicContact CB-CE1 4.31Å; V462-F473 HydrophobicContact CB-CE2 4.25Å; V462-F473 HydrophobicContact CB-CZ 3.91Å; V462-F473 HydrophobicContact CG1-CE2 4.29Å; V462-F473 HydrophobicContact CG1-CZ 3.9Å; V462-F473 HydrophobicContact CG2-CE1 4.17Å; V462-F473 HydrophobicContact CG2-CZ 4.2Å
463	Y	87.9	Confident	87.7	Confident	32 Å²	32	30.3 Å²	30.3	13%	0.125	17%	0.169	C	C	.	.	H	α-helix	trans	-56	-41.3	-177.8	-177.6	-93.6	0	0	0	113.2	P459 D460 K465 M466 T467 L477 Y484	P459-Y463 PolarHBondContact O-N 3.31Å; P459-Y463 VanDerWaalsContact O-N 3.13Å; D460-Y463 WeakPolarHBondContact O-CB 3.1Å; D460-Y463 PolarHBondContact O-N 2.82Å; Y463-K465 PolarHBondContact O-N 3.33Å; Y463-M466 WeakPolarHBondContact O-CB 3.39Å; Y463-M466 PolarHBondContact O-N 3.39Å; Y463-M466 VanDerWaalsContact O-N 3.17Å; Y463-T467 WeakPolarHBondContact CE1-OG1 3.42Å; Y463-T467 PolarHBondContact O-N 3.12Å; Y463-T467 PolarHBondContact O-OG1 3.07Å; Y463-L477 HydrophobicContact CD2-CD2 3.97Å; Y463-L477 HydrophobicContact CE2-CD2 3.63Å; Y463-Y484 HydrophobicContact CD2-CD1 4Å; Y463-Y484 AromaticContact CD2-CE1 3.44Å; Y463-Y484 HydrophobicContact CD2-CE1 3.44Å; Y463-Y484 VanDerWaalsContact CD2-CE1 3.44Å; Y463-Y484 AromaticContact CD2-CZ 3.87Å; Y463-Y484 AromaticContact CE2-CD1 3.81Å; Y463-Y484 HydrophobicContact CE2-CD1 3.81Å; Y463-Y484 AromaticContact CE2-CE1 3.76Å; Y463-Y484 HydrophobicContact CE2-CE1 3.76Å; Y463-Y484 PolarHBondContact OH-O 2.97Å
464	E	86.7	Confident	87.2	Confident	132 Å²	132	34.1 Å²	34.1	62%	0.617	19%	0.187	S	C	*	.	H	α-helix	trans	-53.4	-44.2	175.1	-168.2	-178.6	174.9	0	0	111.4	V462 T467 A468 E489	V462-E464 VanDerWaalsContact C-N 3.31Å; V462-E464 PolarHBondContact O-N 3.23Å; E464-T467 PolarHBondContact O-N 3.34Å; E464-A468 WeakPolarHBondContact O-CB 3.49Å; E464-A468 PolarHBondContact O-N 3.41Å; E464-E489 WeakPolarHBondContact CA-OE1 3.49Å; E464-E489 WeakPolarHBondContact CB-OE1 3.49Å; E464-E489 WeakPolarHBondContact CG-OE1 3.43Å
465	K	86.6	Confident	86.6	Confident	46 Å²	46	38.2 Å²	38.2	20%	0.2	21%	0.21	C	C	.	.	H	α-helix	trans	-74.9	-35	-178.3	-58.1	-174.9	177.7	-121	0	112.2	H451 V462 Y463 T467 N469 T470 D471 F473	H451-K465 PolarHBondContact CE1-NZ 2.81Å; H451-K465 VanDerWaalsContact CE1-NZ 3.3Å; H451-K465 WeakPolarHBondContact NE2-CE 3.44Å; H451-K465 PolarHBondContact NE2-NZ 2.83Å; V462-K465 WeakPolarHBondContact O-CB 3.22Å; V462-K465 PolarHBondContact O-N 2.87Å; Y463-K465 PolarHBondContact O-N 3.33Å; K465-T467 VanDerWaalsContact C-N 3.34Å; K465-N469 WeakPolarHBondContact O-CA 3.42Å; K465-N469 PolarHBondContact O-N 3.41Å; K465-T470 PolarHBondContact O-N 2.9Å; K465-T470 VanDerWaalsContact O-N 3.15Å; K465-D471 HydrophobicContact CD-CB 4.35Å; K465-D471 IonicContact NZ-OD2 3.57Å; K465-D471 PolarHBondContact NZ-OD2 3.14Å; K465-F473 HydrophobicContact CB-CD2 3.73Å; K465-F473 HydrophobicContact CB-CE2 4.28Å; K465-F473 HydrophobicContact CB-CG 4.44Å; K465-F473 HydrophobicContact CD-CD2 4.39Å; K465-F473 HydrophobicContact CD-CE2 4.25Å
466	M	85.6	Confident	86.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-40.6	173.2	-63.1	172.9	162.8	0	0	111.2	V414 L455 V462 Y463 N469 F473 A476 L477 F480	V414-M466 HydrophobicContact CB-CE 4.47Å; V414-M466 HydrophobicContact CG1-CE 3.6Å; V414-M466 HydrophobicContact CG2-CE 4.17Å; L455-M466 HydrophobicContact CD1-CE 4.1Å; V462-M466 HydrophobicContact CG2-CE 3.48Å; V462-M466 VanDerWaalsContact CG2-CE 3.48Å; V462-M466 HydrophobicContact CG2-SD 4.14Å; V462-M466 WeakPolarHBondContact O-CG 3.28Å; V462-M466 PolarHBondContact O-N 2.99Å; Y463-M466 WeakPolarHBondContact O-CB 3.39Å; Y463-M466 PolarHBondContact O-N 3.39Å; Y463-M466 VanDerWaalsContact O-N 3.17Å; M466-N469 PolarHBondContact O-N 3.03Å; M466-F473 HydrophobicContact CE-CD1 4.16Å; M466-F473 HydrophobicContact CE-CE1 4.23Å; M466-F473 HydrophobicContact CG-CB 4.16Å; M466-F473 HydrophobicContact CG-CD1 3.99Å; M466-F473 HydrophobicContact CG-CG 4.2Å; M466-A476 HydrophobicContact CB-CB 4.27Å; M466-A476 HydrophobicContact CE-CB 4.33Å; M466-A476 HydrophobicContact CG-CB 3.85Å; M466-A476 HydrophobicContact SD-CB 4.47Å; M466-L477 HydrophobicContact CB-CD2 3.9Å; M466-L477 HydrophobicContact CB-CG 3.92Å; M466-F480 HydrophobicContact CE-CE2 3.81Å; M466-F480 HydrophobicContact CE-CZ 4.13Å; M466-F480 HydrophobicContact SD-CE2 3.92Å
467	T	85.6	Confident	85.6	Confident	67 Å²	67	41 Å²	41	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-70.1	-42	177.7	-53.8	0	0	0	0	111.4	Y463 E464 K465 N469	Y463-T467 WeakPolarHBondContact CE1-OG1 3.42Å; Y463-T467 PolarHBondContact O-N 3.12Å; Y463-T467 PolarHBondContact O-OG1 3.07Å; E464-T467 PolarHBondContact O-N 3.34Å; K465-T467 VanDerWaalsContact C-N 3.34Å; T467-N469 PolarHBondContact O-N 3.32Å
468	A	87	Confident	85.2	Confident	60 Å²	60	45.2 Å²	45.2	50%	0.496	26%	0.255	S	S	.	.	H	α-helix	trans	-73.9	-11	176.6	0	0	0	0	0	113.8	E464 T470	E464-A468 WeakPolarHBondContact O-CB 3.49Å; E464-A468 PolarHBondContact O-N 3.41Å; A468-T470 HydrophobicContact CB-CG2 3.91Å; A468-T470 WeakPolarHBondContact O-CG2 3.4Å; A468-T470 PolarHBondContact O-N 3.35Å
469	N	84.7	Confident	84.8	Confident	64 Å²	64	49.6 Å²	49.6	34%	0.342	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	40.5	-171.2	-70.5	-73	0	0	0	112.9	K465 M466 T467 F473 H474 N475	K465-N469 WeakPolarHBondContact O-CA 3.42Å; K465-N469 PolarHBondContact O-N 3.41Å; M466-N469 PolarHBondContact O-N 3.03Å; T467-N469 PolarHBondContact O-N 3.32Å; N469-F473 PolarHBondContact OD1-O 3.03Å; N469-H474 PolarHBondContact O-CE1 3.22Å; N469-H474 PolarHBondContact O-ND1 3.21Å; N469-H474 VanDerWaalsContact O-ND1 3.1Å; N469-N475 PolarHBondContact OD1-N 3.09Å
470	T	84.5	Confident	84.5	Confident	61 Å²	61	50.2 Å²	50.2	37%	0.374	28%	0.275	S	S	.	.			trans	-109.7	167.3	-178.5	55.7	0	0	0	0	112.1	K465 A468 G472 F473	K465-T470 PolarHBondContact O-N 2.9Å; K465-T470 VanDerWaalsContact O-N 3.15Å; A468-T470 HydrophobicContact CB-CG2 3.91Å; A468-T470 WeakPolarHBondContact O-CG2 3.4Å; A468-T470 PolarHBondContact O-N 3.35Å; T470-G472 PolarHBondContact O-N 3.13Å; T470-G472 VanDerWaalsContact O-N 3.07Å; T470-F473 PolarHBondContact O-N 3.17Å; T470-F473 VanDerWaalsContact O-N 3.09Å
471	D	76.5	Confident	84.1	Confident	91 Å²	91	53.6 Å²	53.6	49%	0.487	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	31.3	172	-60.9	-30.4	0	0	0	115.6	F418 H451 K465	F418-D471 VanDerWaalsContact CE2-O 3.25Å; F418-D471 WeakPolarHBondContact CE2-O 3.5Å; H451-D471 IonicContact CE1-OD2 2.74Å; K465-D471 HydrophobicContact CD-CB 4.35Å; K465-D471 IonicContact NZ-OD2 3.57Å; K465-D471 PolarHBondContact NZ-OD2 3.14Å
472	G	76.4	Confident	83.4	Confident	20 Å²	20	58 Å²	58	21%	0.206	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	-6.7	177.4	0	0	0	0	0	115.5	R421 T470 H474	R421-G472 PolarHBondContact NH1-O 2.9Å; T470-G472 PolarHBondContact O-N 3.13Å; T470-G472 VanDerWaalsContact O-N 3.07Å; G472-H474 VanDerWaalsContact C-N 3.3Å; G472-H474 PolarHBondContact O-N 2.96Å; G472-H474 VanDerWaalsContact O-N 3.16Å
473	F	81.1	Confident	82.8	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	37%	0.371	C	S	.	.			trans	-88.1	51.5	180	-67.1	-78.6	0	0	0	113.5	V414 F418 H451 V462 K465 M466 N469 T470 A476	V414-F473 HydrophobicContact CG1-CD1 4.02Å; V414-F473 HydrophobicContact CG1-CE1 3.92Å; F418-F473 HydrophobicContact CD2-CD1 4.14Å; F418-F473 HydrophobicContact CD2-CD2 4.35Å; F418-F473 AromaticContact CD2-CE1 3.82Å; F418-F473 HydrophobicContact CD2-CE1 3.82Å; F418-F473 HydrophobicContact CD2-CE2 4.05Å; F418-F473 HydrophobicContact CD2-CG 4.39Å; F418-F473 AromaticContact CD2-CZ 3.78Å; F418-F473 HydrophobicContact CD2-CZ 3.78Å; F418-F473 HydrophobicContact CE2-CD2 4.12Å; F418-F473 HydrophobicContact CE2-CE1 4.27Å; F418-F473 AromaticContact CE2-CE2 3.67Å; F418-F473 HydrophobicContact CE2-CE2 3.67Å; F418-F473 AromaticContact CE2-CZ 3.75Å; F418-F473 HydrophobicContact CE2-CZ 3.75Å; H451-F473 HydrophobicContact CB-CE2 3.82Å; H451-F473 HydrophobicContact CB-CZ 3.91Å; H451-F473 AromaticContact CG-CE2 4Å; V462-F473 HydrophobicContact CB-CE1 4.31Å; V462-F473 HydrophobicContact CB-CE2 4.25Å; V462-F473 HydrophobicContact CB-CZ 3.91Å; V462-F473 HydrophobicContact CG1-CE2 4.29Å; V462-F473 HydrophobicContact CG1-CZ 3.9Å; V462-F473 HydrophobicContact CG2-CE1 4.17Å; V462-F473 HydrophobicContact CG2-CZ 4.2Å; K465-F473 HydrophobicContact CB-CD2 3.73Å; K465-F473 HydrophobicContact CB-CE2 4.28Å; K465-F473 HydrophobicContact CB-CG 4.44Å; K465-F473 HydrophobicContact CD-CD2 4.39Å; K465-F473 HydrophobicContact CD-CE2 4.25Å; M466-F473 HydrophobicContact CE-CD1 4.16Å; M466-F473 HydrophobicContact CE-CE1 4.23Å; M466-F473 HydrophobicContact CG-CB 4.16Å; M466-F473 HydrophobicContact CG-CD1 3.99Å; M466-F473 HydrophobicContact CG-CG 4.2Å; N469-F473 PolarHBondContact OD1-O 3.03Å; T470-F473 PolarHBondContact O-N 3.17Å; T470-F473 VanDerWaalsContact O-N 3.09Å; F473-A476 HydrophobicContact CB-CB 4.21Å; F473-A476 HydrophobicContact CD1-CB 4.25Å
474	H	79.3	Confident	82.5	Confident	88 Å²	88	63.9 Å²	63.9	41%	0.407	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	127.9	177.6	-57.6	-68.2	0	0	0	111.4	R421 N469 G472 A476	R421-H474 PolarHBondContact NH1-O 2.89Å; R421-H474 PolarHBondContact NH2-O 2.77Å; N469-H474 PolarHBondContact O-CE1 3.22Å; N469-H474 PolarHBondContact O-ND1 3.21Å; N469-H474 VanDerWaalsContact O-ND1 3.1Å; G472-H474 VanDerWaalsContact C-N 3.3Å; G472-H474 PolarHBondContact O-N 2.96Å; G472-H474 VanDerWaalsContact O-N 3.16Å; H474-A476 PolarHBondContact O-N 3.3Å; H474-A476 VanDerWaalsContact O-N 3.07Å
475	N	80.3	Confident	82.2	Confident	118 Å²	118	63.5 Å²	63.5	63%	0.631	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	19.9	179.8	-64.2	-16.3	0	0	0	114.5	N469 L477 S478	N469-N475 PolarHBondContact OD1-N 3.09Å; N475-L477 VanDerWaalsContact C-N 3.25Å; N475-L477 PolarHBondContact O-N 2.75Å; N475-S478 WeakPolarHBondContact O-CB 3.32Å; N475-S478 PolarHBondContact O-N 2.98Å; N475-S478 VanDerWaalsContact O-N 3.15Å; N475-S478 PolarHBondContact O-OG 2.89Å
476	A	82	Confident	81.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-65.2	-27.7	-176.8	0	0	0	0	0	113.1	V414 M466 F473 H474 S478 Y479 F480	V414-A476 HydrophobicContact CG1-CB 4.28Å; V414-A476 HydrophobicContact CG2-CB 4.29Å; M466-A476 HydrophobicContact CB-CB 4.27Å; M466-A476 HydrophobicContact CE-CB 4.33Å; M466-A476 HydrophobicContact CG-CB 3.85Å; M466-A476 HydrophobicContact SD-CB 4.47Å; F473-A476 HydrophobicContact CB-CB 4.21Å; F473-A476 HydrophobicContact CD1-CB 4.25Å; H474-A476 PolarHBondContact O-N 3.3Å; H474-A476 VanDerWaalsContact O-N 3.07Å; A476-S478 PolarHBondContact O-N 3.5Å; A476-Y479 WeakPolarHBondContact O-CD2 3.46Å; A476-Y479 PolarHBondContact O-N 3.37Å; A476-F480 WeakPolarHBondContact O-CD2 3.48Å
477	L	83.7	Confident	81.4	Confident	59 Å²	59	61.4 Å²	61.4	31%	0.309	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-63.8	-22.4	176.3	-71.6	176.9	0	0	0	113.4	Y463 M466 N475 Y479 F480 Y484	Y463-L477 HydrophobicContact CD2-CD2 3.97Å; Y463-L477 HydrophobicContact CE2-CD2 3.63Å; M466-L477 HydrophobicContact CB-CD2 3.9Å; M466-L477 HydrophobicContact CB-CG 3.92Å; N475-L477 VanDerWaalsContact C-N 3.25Å; N475-L477 PolarHBondContact O-N 2.75Å; L477-Y479 PolarHBondContact O-N 2.9Å; L477-F480 PolarHBondContact O-N 3.42Å; L477-F480 VanDerWaalsContact O-N 3.11Å; L477-Y484 HydrophobicContact CD2-CD1 4.39Å
478	S	85.5	Confident	81	Confident	88 Å²	88	60.3 Å²	60.3	62%	0.615	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-64.5	-22.9	-179.7	65.8	0	0	0	0	113.7	N475 A476 F480	N475-S478 WeakPolarHBondContact O-CB 3.32Å; N475-S478 PolarHBondContact O-N 2.98Å; N475-S478 VanDerWaalsContact O-N 3.15Å; N475-S478 PolarHBondContact O-OG 2.89Å; A476-S478 PolarHBondContact O-N 3.5Å; S478-F480 VanDerWaalsContact C-N 3.31Å
479	Y	84.8	Confident	80.2	Confident	91 Å²	91	62.9 Å²	62.9	36%	0.357	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-83	-7.2	177.7	-58.4	-67.9	0	0	0	113.5	S410 E413 V414 A476 L477	S410-Y479 VanDerWaalsContact CB-O 3.3Å; S410-Y479 WeakPolarHBondContact CB-O 3.46Å; E413-Y479 HydrophobicContact CB-CD1 3.57Å; E413-Y479 HydrophobicContact CB-CD2 4.24Å; E413-Y479 HydrophobicContact CB-CE1 3.79Å; E413-Y479 HydrophobicContact CB-CE2 4.42Å; E413-Y479 HydrophobicContact CB-CG 3.81Å; E413-Y479 HydrophobicContact CG-CD1 4Å; E413-Y479 HydrophobicContact CG-CE1 4.22Å; V414-Y479 HydrophobicContact CG2-CD2 3.91Å; V414-Y479 HydrophobicContact CG2-CG 4.5Å; A476-Y479 WeakPolarHBondContact O-CD2 3.46Å; A476-Y479 PolarHBondContact O-N 3.37Å; L477-Y479 PolarHBondContact O-N 2.9Å
480	F	85.8	Confident	79.6	Confident	14 Å²	14	61.1 Å²	61.1	6%	0.061	34%	0.343	C	S	.	.	S	Bend	trans	-102	158.1	179.3	-67.3	-85	0	0	0	111.1	V414 P459 M466 A476 L477 S478 A482 Y484 L498	V414-F480 HydrophobicContact CG2-CE2 3.68Å; V414-F480 HydrophobicContact CG2-CZ 4.09Å; P459-F480 HydrophobicContact CB-CE1 3.66Å; P459-F480 HydrophobicContact CB-CZ 3.54Å; P459-F480 HydrophobicContact CG-CE1 3.78Å; P459-F480 HydrophobicContact CG-CZ 3.84Å; M466-F480 HydrophobicContact CE-CE2 3.81Å; M466-F480 HydrophobicContact CE-CZ 4.13Å; M466-F480 HydrophobicContact SD-CE2 3.92Å; A476-F480 WeakPolarHBondContact O-CD2 3.48Å; L477-F480 PolarHBondContact O-N 3.42Å; L477-F480 VanDerWaalsContact O-N 3.11Å; S478-F480 VanDerWaalsContact C-N 3.31Å; F480-A482 PolarHBondContact O-N 3.08Å; F480-Y484 HydrophobicContact CB-CD1 3.51Å; F480-Y484 HydrophobicContact CB-CE1 4.27Å; F480-Y484 HydrophobicContact CB-CG 3.97Å; F480-Y484 AromaticContact CD1-CD1 3.83Å; F480-Y484 HydrophobicContact CD1-CD1 3.83Å; F480-Y484 AromaticContact CD1-CE1 3.79Å; F480-Y484 HydrophobicContact CD1-CE1 3.79Å; F480-Y484 HydrophobicContact CD1-CG 4.35Å; F480-Y484 HydrophobicContact CD2-CD1 4.18Å; F480-Y484 HydrophobicContact CD2-CE1 4.18Å; F480-Y484 HydrophobicContact CE1-CE1 4.19Å; F480-Y484 AromaticContact CG-CD1 3.56Å; F480-Y484 HydrophobicContact CG-CD1 3.56Å; F480-Y484 AromaticContact CG-CE1 3.8Å; F480-Y484 HydrophobicContact CG-CE1 3.8Å; F480-Y484 HydrophobicContact CG-CG 4.31Å; F480-L498 HydrophobicContact CD1-CD2 4.24Å
481	P	81.1	Confident	79.1	Confident	78 Å²	78	66.4 Å²	66.4	51%	0.506	37%	0.369	S	S	.	.			trans	-55	141.6	173.2	-23.2	32.9	0	0	0	111.1	N483 Y484	P481-N483 PolarHBondContact O-N 2.87Å; P481-Y484 WeakPolarHBondContact O-CB 3.49Å; P481-Y484 PolarHBondContact O-N 2.78Å
482	A	75.6	Confident	79.1	Confident	106 Å²	106	63.6 Å²	63.6	88%	0.876	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-25.8	-175.4	0	0	0	0	0	114.4	F480 Y484	F480-A482 PolarHBondContact O-N 3.08Å; A482-Y484 VanDerWaalsContact C-N 3.34Å
483	N	79	Confident	79.4	Confident	142 Å²	142	66 Å²	66	76%	0.759	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	16	179.2	-58.9	-6.1	0	0	0	112.9	P481 Q485	P481-N483 PolarHBondContact O-N 2.87Å; N483-Q485 PolarHBondContact O-N 3.18Å
484	Y	81.2	Confident	79.6	Confident	14 Å²	14	66 Å²	66	6%	0.055	37%	0.372	C	S	.	.			trans	-74.6	116.8	179.1	176.6	-127.2	0	0	0	110.1	D460 Y463 L477 F480 P481 A482 L498	D460-Y484 WeakPolarHBondContact CA-OH 3.19Å; D460-Y484 PolarHBondContact N-OH 2.9Å; D460-Y484 VanDerWaalsContact N-OH 3.14Å; D460-Y484 WeakPolarHBondContact OD1-CE2 3.42Å; D460-Y484 VanDerWaalsContact OD1-CZ 3.31Å; D460-Y484 PolarHBondContact OD1-OH 2.71Å; Y463-Y484 HydrophobicContact CD2-CD1 4Å; Y463-Y484 AromaticContact CD2-CE1 3.44Å; Y463-Y484 HydrophobicContact CD2-CE1 3.44Å; Y463-Y484 VanDerWaalsContact CD2-CE1 3.44Å; Y463-Y484 AromaticContact CD2-CZ 3.87Å; Y463-Y484 AromaticContact CE2-CD1 3.81Å; Y463-Y484 HydrophobicContact CE2-CD1 3.81Å; Y463-Y484 AromaticContact CE2-CE1 3.76Å; Y463-Y484 HydrophobicContact CE2-CE1 3.76Å; Y463-Y484 PolarHBondContact OH-O 2.97Å; L477-Y484 HydrophobicContact CD2-CD1 4.39Å; F480-Y484 HydrophobicContact CB-CD1 3.51Å; F480-Y484 HydrophobicContact CB-CE1 4.27Å; F480-Y484 HydrophobicContact CB-CG 3.97Å; F480-Y484 AromaticContact CD1-CD1 3.83Å; F480-Y484 HydrophobicContact CD1-CD1 3.83Å; F480-Y484 AromaticContact CD1-CE1 3.79Å; F480-Y484 HydrophobicContact CD1-CE1 3.79Å; F480-Y484 HydrophobicContact CD1-CG 4.35Å; F480-Y484 HydrophobicContact CD2-CD1 4.18Å; F480-Y484 HydrophobicContact CD2-CE1 4.18Å; F480-Y484 HydrophobicContact CE1-CE1 4.19Å; F480-Y484 AromaticContact CG-CD1 3.56Å; F480-Y484 HydrophobicContact CG-CD1 3.56Å; F480-Y484 AromaticContact CG-CE1 3.8Å; F480-Y484 HydrophobicContact CG-CE1 3.8Å; F480-Y484 HydrophobicContact CG-CG 4.31Å; P481-Y484 WeakPolarHBondContact O-CB 3.49Å; P481-Y484 PolarHBondContact O-N 2.78Å; A482-Y484 VanDerWaalsContact C-N 3.34Å; Y484-L498 HydrophobicContact CD2-CD1 3.58Å; Y484-L498 HydrophobicContact CE2-CD1 3.24Å
485	Q	79.1	Confident	80.1	Confident	124 Å²	124	65.8 Å²	65.8	58%	0.579	37%	0.37	S	S	*	.			trans	-117.8	133.1	169.8	-65.8	-180	-7.3	0	0	107.4	N483 S487	N483-Q485 PolarHBondContact O-N 3.18Å; Q485-S487 PolarHBondContact O-N 2.8Å
486	G	77.1	Confident	80.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.01	34%	0.343	C	S	.	.			trans	-61.1	127.2	176.7	0	0	0	0	0	110	L488 E489 S490	G486-L488 VanDerWaalsContact C-N 3.29Å; G486-L488 PolarHBondContact O-N 3Å; G486-E489 PolarHBondContact O-N 2.65Å; G486-S490 PolarHBondContact O-N 3.31Å; G486-S490 PolarHBondContact O-OG 2.8Å
487	S	78.9	Confident	80.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-41.1	179.9	68	0	0	0	0	109.9	D460 Q485 E489 S490 A492 L532 R535	D460-S487 WeakPolarHBondContact OD2-CB 3.33Å; D460-S487 PolarHBondContact OD2-N 2.83Å; D460-S487 PolarHBondContact OD2-OG 3.09Å; Q485-S487 PolarHBondContact O-N 2.8Å; S487-E489 VanDerWaalsContact C-N 3.26Å; S487-E489 PolarHBondContact O-N 2.96Å; S487-E489 VanDerWaalsContact O-N 3.09Å; S487-S490 CarbonylContact O-C 3.58Å; S487-S490 PolarHBondContact O-N 3.2Å; S487-S490 VanDerWaalsContact O-N 3.11Å; S487-A492 WeakPolarHBondContact CB-O 2.99Å; S487-L532 WeakPolarHBondContact OG-CD2 3.28Å; S487-R535 PolarHBondContact O-NH1 3.25Å; S487-R535 PolarHBondContact O-NH2 3.29Å
488	L	77.6	Confident	81.2	Confident	45 Å²	45	65.4 Å²	65.4	24%	0.236	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.1	-176.3	-67.1	172.1	0	0	0	115	L461 G486 D531 L532 R535	L461-L488 HydrophobicContact CD2-CD1 3.71Å; G486-L488 VanDerWaalsContact C-N 3.29Å; G486-L488 PolarHBondContact O-N 3Å; L488-D531 HydrophobicContact CD2-CB 3.9Å; L488-L532 HydrophobicContact CD1-CD2 4.23Å; L488-L532 HydrophobicContact CD1-CG 4.37Å; L488-L532 HydrophobicContact CD2-CD2 3.82Å; L488-L532 HydrophobicContact CD2-CG 4.2Å; L488-L532 HydrophobicContact CG-CD2 3.78Å; L488-L532 HydrophobicContact CG-CG 4.36Å; L488-R535 PolarHBondContact O-NH2 3.46Å
489	E	70.2	Confident	81.5	Confident	114 Å²	114	61.2 Å²	61.2	53%	0.533	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-19.9	-179.9	-64.3	-176.8	-179.1	0	0	113.6	E464 G486 S487	E464-E489 WeakPolarHBondContact CA-OE1 3.49Å; E464-E489 WeakPolarHBondContact CB-OE1 3.49Å; E464-E489 WeakPolarHBondContact CG-OE1 3.43Å; G486-E489 PolarHBondContact O-N 2.65Å; S487-E489 VanDerWaalsContact C-N 3.26Å; S487-E489 PolarHBondContact O-N 2.96Å; S487-E489 VanDerWaalsContact O-N 3.09Å
490	S	71.3	Confident	81.9	Confident	26 Å²	26	57 Å²	57	18%	0.182	32%	0.318	C	S	.	.	S	Bend	trans	-115.7	167.9	-179	64.7	0	0	0	0	111.1	G486 S487 A492 R535	G486-S490 PolarHBondContact O-N 3.31Å; G486-S490 PolarHBondContact O-OG 2.8Å; S487-S490 CarbonylContact O-C 3.58Å; S487-S490 PolarHBondContact O-N 3.2Å; S487-S490 VanDerWaalsContact O-N 3.11Å; S490-A492 PolarHBondContact O-N 3.44Å; S490-A492 WeakPolarHBondContact OG-CB 3.47Å; S490-A492 PolarHBondContact OG-N 3.09Å; S490-R535 PolarHBondContact O-NH1 3.02Å
491	N	73.8	Confident	82.3	Confident	172 Å²	172	56.3 Å²	56.3	92%	0.92	32%	0.316	S	S	*	.	S	Bend	trans	-82.2	20.2	166.3	-76.7	-24	0	0	0	111.7
492	A	76.6	Confident	82.9	Confident	32 Å²	32	52.6 Å²	52.6	26%	0.264	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-69.8	150.4	178.9	0	0	0	0	0	111.8	S487 S490 R535	S487-A492 WeakPolarHBondContact CB-O 2.99Å; S490-A492 PolarHBondContact O-N 3.44Å; S490-A492 WeakPolarHBondContact OG-CB 3.47Å; S490-A492 PolarHBondContact OG-N 3.09Å; A492-R535 PolarHBondContact O-NH1 3.39Å
493	S	82.3	Confident	83.8	Confident	72 Å²	72	50.3 Å²	50.3	50%	0.503	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-63.7	141.3	172	56.3	0	0	0	0	110.8
494	V	87.3	Confident	84.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-64.5	142.6	171.3	63.5	0	0	0	0	109.3	P496 L532 R535 L536 Q539	V494-P496 WeakPolarHBondContact O-CD 3.35Å; V494-L532 HydrophobicContact CG2-CD2 4.27Å; V494-R535 HydrophobicContact CB-CB 4.43Å; V494-R535 HydrophobicContact CG1-CB 4.29Å; V494-L536 HydrophobicContact CG1-CB 3.91Å; V494-L536 HydrophobicContact CG1-CD1 4.06Å; V494-Q539 PolarHBondContact O-OE1 2.95Å; V494-Q539 VanDerWaalsContact O-OE1 3.08Å
495	K	88.4	Confident	85.2	Confident	83 Å²	83	42.9 Å²	42.9	36%	0.361	22%	0.224	S	C	.	.			trans	-111.9	91.5	178.5	-67.7	-175.1	-179.2	180	0	109.8	H458 E497 L498	H458-K495 PolarHBondContact NE2-O 2.97Å; H458-K495 VanDerWaalsContact NE2-O 3.16Å; K495-E497 PolarHBondContact O-N 3.43Å; K495-E497 VanDerWaalsContact O-N 3.07Å; K495-L498 HydrophobicContact CB-CD1 3.9Å; K495-L498 HydrophobicContact CB-CG 3.97Å; K495-L498 HydrophobicContact CD-CD1 4.27Å; K495-L498 PolarHBondContact O-N 3.39Å
496	P	88.9	Confident	86	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.058	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.4	-28.5	-176.8	-27.1	36.8	0	0	0	113.8	V494 L498 S499 F502 Q503 D506 L536	V494-P496 WeakPolarHBondContact O-CD 3.35Å; P496-L498 PolarHBondContact O-N 3.13Å; P496-L498 VanDerWaalsContact O-N 3.13Å; P496-S499 PolarHBondContact O-N 3.3Å; P496-F502 HydrophobicContact CB-CB 4.21Å; P496-Q503 PolarHBondContact O-N 3.06Å; P496-D506 HydrophobicContact CB-CB 4.06Å; P496-D506 HydrophobicContact CG-CB 4.3Å; P496-L536 HydrophobicContact CG-CD1 3.64Å
497	E	90.2	Very high	86.8	Confident	145 Å²	145	39.2 Å²	39.2	68%	0.678	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-60.6	-17.4	178.4	-60.8	168.6	-161.1	0	0	114	V408 K495 S499	V408-E497 WeakPolarHBondContact CG1-O 3.41Å; V408-E497 WeakPolarHBondContact CG2-O 3.08Å; K495-E497 PolarHBondContact O-N 3.43Å; K495-E497 VanDerWaalsContact O-N 3.07Å; E497-S499 VanDerWaalsContact C-N 3.34Å
498	L	90.4	Very high	87.5	Confident	17 Å²	17	39.2 Å²	39.2	9%	0.089	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-84.4	-7.2	179.8	-62.4	-179.4	0	0	0	113.5	P459 F480 Y484 K495 P496	P459-L498 WeakPolarHBondContact CD-O 3.42Å; P459-L498 HydrophobicContact CG-CB 4.31Å; P459-L498 WeakPolarHBondContact CG-O 3.31Å; F480-L498 HydrophobicContact CD1-CD2 4.24Å; Y484-L498 HydrophobicContact CD2-CD1 3.58Å; Y484-L498 HydrophobicContact CE2-CD1 3.24Å; K495-L498 HydrophobicContact CB-CD1 3.9Å; K495-L498 HydrophobicContact CB-CG 3.97Å; K495-L498 HydrophobicContact CD-CD1 4.27Å; K495-L498 PolarHBondContact O-N 3.39Å; P496-L498 PolarHBondContact O-N 3.13Å; P496-L498 VanDerWaalsContact O-N 3.13Å
499	S	92.5	Very high	88.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.			trans	-138.9	127.3	177.3	167	0	0	0	0	111.1	N457 P496 E497 K501 F502 Q503	N457-S499 WeakPolarHBondContact O-CB 3.43Å; N457-S499 PolarHBondContact O-OG 3.5Å; P496-S499 PolarHBondContact O-N 3.3Å; E497-S499 VanDerWaalsContact C-N 3.34Å; S499-K501 PolarHBondContact O-N 3.14Å; S499-K501 PolarHBondContact OG-N 3.4Å; S499-F502 PolarHBondContact O-N 2.97Å; S499-F502 VanDerWaalsContact O-N 3.09Å; S499-Q503 PolarHBondContact O-N 2.75Å
500	G	92.2	Very high	89.6	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-37.5	-179.5	0	0	0	0	0	112.5	N406 V504	N406-G500 WeakPolarHBondContact O-CA 3.47Å; G500-V504 WeakPolarHBondContact O-CG2 3.14Å; G500-V504 PolarHBondContact O-N 2.9Å; G500-V504 VanDerWaalsContact O-N 3.09Å
501	K	94.4	Very high	90.6	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-69.4	-40.3	176.9	-66.4	-163.1	-62.2	176	0	112.7	C405 C456 N457 S499 V504 L505 F595 L625 E632	C405-K501 HydrophobicContact CB-CG 3.94Å; C456-K501 WeakPolarHBondContact O-CE 3.4Å; N457-K501 PolarHBondContact OD1-NZ 3.09Å; S499-K501 PolarHBondContact O-N 3.14Å; S499-K501 PolarHBondContact OG-N 3.4Å; K501-V504 PolarHBondContact O-N 3.49Å; K501-L505 VanDerWaalsContact O-CB 3.31Å; K501-L505 WeakPolarHBondContact O-CB 2.96Å; K501-L505 PolarHBondContact O-N 3.1Å; K501-F595 HydrophobicContact CB-CE2 3.78Å; K501-F595 HydrophobicContact CB-CZ 3.63Å; K501-F595 PolarHBondContact NZ-O 3.11Å; K501-L625 HydrophobicContact CD-CB 4.08Å; K501-L625 HydrophobicContact CG-CB 4.45Å; K501-E632 WeakPolarHBondContact CE-OE2 3.36Å; K501-E632 IonicContact NZ-OE1 2.94Å; K501-E632 PolarHBondContact NZ-OE1 3.49Å; K501-E632 IonicContact NZ-OE2 2.65Å; K501-E632 PolarHBondContact NZ-OE2 3.08Å
502	F	94.4	Very high	91.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.8	-37.8	176.1	-94.6	-100	0	0	0	111.9	N457 H458 P496 S499 L505 D506 T529 L532 F533 L536 F595	N457-F502 WeakPolarHBondContact O-CD2 3.07Å; N457-F502 WeakPolarHBondContact O-CE2 3.47Å; H458-F502 HydrophobicContact CB-CD2 3.96Å; H458-F502 HydrophobicContact CB-CE2 3.78Å; H458-F502 AromaticContact CD2-CD2 3.6Å; H458-F502 AromaticContact CD2-CG 3.75Å; P496-F502 HydrophobicContact CB-CB 4.21Å; S499-F502 PolarHBondContact O-N 2.97Å; S499-F502 VanDerWaalsContact O-N 3.09Å; F502-L505 PolarHBondContact O-N 3.23Å; F502-D506 VanDerWaalsContact O-CB 3.23Å; F502-D506 WeakPolarHBondContact O-CB 3.12Å; F502-D506 PolarHBondContact O-N 3.29Å; F502-T529 HydrophobicContact CE2-CG2 4.44Å; F502-T529 HydrophobicContact CZ-CG2 4.38Å; F502-L532 HydrophobicContact CE1-CB 3.93Å; F502-L532 HydrophobicContact CE2-CD1 4.29Å; F502-L532 HydrophobicContact CZ-CB 3.61Å; F502-L532 HydrophobicContact CZ-CD1 3.93Å; F502-L532 HydrophobicContact CZ-CG 4.45Å; F502-F533 AromaticContact CE1-CD1 3.78Å; F502-F533 HydrophobicContact CE1-CD1 3.78Å; F502-F533 AromaticContact CE1-CE1 3.94Å; F502-F533 HydrophobicContact CE1-CE1 3.94Å; F502-F533 HydrophobicContact CE2-CE1 4.17Å; F502-F533 AromaticContact CZ-CD1 3.72Å; F502-F533 HydrophobicContact CZ-CD1 3.72Å; F502-F533 AromaticContact CZ-CE1 3.55Å; F502-F533 HydrophobicContact CZ-CE1 3.55Å; F502-L536 HydrophobicContact CD1-CD2 4.25Å; F502-L536 HydrophobicContact CE1-CD2 4.49Å; F502-F595 HydrophobicContact CD2-CE1 4.16Å; F502-F595 HydrophobicContact CD2-CE2 4.11Å; F502-F595 AromaticContact CD2-CZ 3.36Å; F502-F595 HydrophobicContact CD2-CZ 3.36Å; F502-F595 AromaticContact CE2-CE1 3.72Å; F502-F595 HydrophobicContact CE2-CE1 3.72Å; F502-F595 HydrophobicContact CE2-CE2 4.21Å; F502-F595 AromaticContact CE2-CZ 3.34Å; F502-F595 HydrophobicContact CE2-CZ 3.34Å; F502-F595 HydrophobicContact CG-CZ 4.27Å; F502-F595 HydrophobicContact CZ-CZ 4.27Å
503	Q	93.6	Very high	92.4	Very high	57 Å²	57	29 Å²	29	27%	0.266	15%	0.154	S	C	.	.	H	α-helix	trans	-62.9	-43.8	175.9	-171.8	170.3	-2.6	0	0	111.8	P496 S499 C507 C732	P496-Q503 PolarHBondContact O-N 3.06Å; S499-Q503 PolarHBondContact O-N 2.75Å; Q503-C507 WeakPolarHBondContact O-CB 3.39Å; Q503-C507 PolarHBondContact O-N 2.81Å; Q503-C507 VanDerWaalsContact O-N 3.08Å; Q503-C732 PolarHBondContact OE1-SG 3.07Å
504	V	94.8	Very high	92.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-44.7	173.7	172.4	0	0	0	0	111	V403 G500 K501 L508 L625 C732 I733	V403-V504 HydrophobicContact CG1-CG1 4.49Å; G500-V504 WeakPolarHBondContact O-CG2 3.14Å; G500-V504 PolarHBondContact O-N 2.9Å; G500-V504 VanDerWaalsContact O-N 3.09Å; K501-V504 PolarHBondContact O-N 3.49Å; V504-L508 VanDerWaalsContact O-CB 3.22Å; V504-L508 WeakPolarHBondContact O-CB 3.25Å; V504-L508 PolarHBondContact O-N 3.48Å; V504-L625 HydrophobicContact CG1-CD2 4.18Å; V504-C732 HydrophobicContact CG2-CB 3.71Å; V504-I733 HydrophobicContact CG1-CD1 4.22Å; V504-I733 HydrophobicContact CG1-CG1 4.37Å; V504-I733 HydrophobicContact CG2-CD1 4.45Å; V504-I733 HydrophobicContact CG2-CG1 3.78Å
505	L	95.7	Very high	93.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-47.4	177.9	175	65.7	0	0	0	112.4	K501 F502 L508 L509 L522 F533 L536 V593 F595 L625	K501-L505 VanDerWaalsContact O-CB 3.31Å; K501-L505 WeakPolarHBondContact O-CB 2.96Å; K501-L505 PolarHBondContact O-N 3.1Å; F502-L505 PolarHBondContact O-N 3.23Å; L505-L508 WeakPolarHBondContact O-CB 3.45Å; L505-L508 PolarHBondContact O-N 2.8Å; L505-L509 HydrophobicContact CD1-CD1 4.09Å; L505-L509 HydrophobicContact CD1-CG 4.12Å; L505-L509 HydrophobicContact CG-CD1 4.16Å; L505-L509 WeakPolarHBondContact O-CG 3.37Å; L505-L509 PolarHBondContact O-N 2.94Å; L505-L522 HydrophobicContact CD1-CD2 3.69Å; L505-F533 HydrophobicContact CD2-CD1 3.74Å; L505-F533 HydrophobicContact CD2-CE1 3.38Å; L505-F533 HydrophobicContact CD2-CZ 4.1Å; L505-L536 HydrophobicContact CD2-CD2 4.41Å; L505-V593 HydrophobicContact CD1-CG1 4.13Å; L505-V593 HydrophobicContact CD1-CG2 4.41Å; L505-F595 HydrophobicContact CB-CE2 4.24Å; L505-F595 HydrophobicContact CD2-CD2 3.97Å; L505-F595 HydrophobicContact CD2-CE2 3.89Å; L505-L625 HydrophobicContact CB-CD1 4.34Å
506	D	95.1	Very high	93.4	Very high	16 Å²	16	32.3 Å²	32.3	9%	0.086	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-44.7	-178.8	-174	33	0	0	0	110.8	P496 F502 L509 A510 L536 R540	P496-D506 HydrophobicContact CB-CB 4.06Å; P496-D506 HydrophobicContact CG-CB 4.3Å; F502-D506 VanDerWaalsContact O-CB 3.23Å; F502-D506 WeakPolarHBondContact O-CB 3.12Å; F502-D506 PolarHBondContact O-N 3.29Å; D506-L509 PolarHBondContact O-N 3.11Å; D506-A510 WeakPolarHBondContact O-CB 3.42Å; D506-A510 PolarHBondContact O-N 3.44Å; D506-L536 HydrophobicContact CB-CD1 4.5Å; D506-L536 HydrophobicContact CB-CD2 4.37Å; D506-R540 IonicContact OD1-CZ 2.67Å; D506-R540 IonicContact OD1-NE 2.83Å; D506-R540 PolarHBondContact OD1-NE 2.98Å; D506-R540 IonicContact OD1-NH2 3.28Å; D506-R540 IonicContact OD2-CZ 3.53Å; D506-R540 IonicContact OD2-NE 3.66Å; D506-R540 PolarHBondContact OD2-NE 2.91Å; D506-R540 IonicContact OD2-NH2 3.06Å; D506-R540 PolarHBondContact OD2-NH2 3.4Å
507	C	93.9	Very high	93.5	Very high	31 Å²	31	36.9 Å²	36.9	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-43.5	173.5	-170.4	0	0	0	0	111.9	Q503 L509 A510 V511 T727 T730	Q503-C507 WeakPolarHBondContact O-CB 3.39Å; Q503-C507 PolarHBondContact O-N 2.81Å; Q503-C507 VanDerWaalsContact O-N 3.08Å; C507-L509 PolarHBondContact O-N 3.45Å; C507-A510 PolarHBondContact O-N 2.88Å; C507-V511 VanDerWaalsContact O-CG2 3.31Å; C507-V511 WeakPolarHBondContact O-CG2 3.45Å; C507-V511 PolarHBondContact O-N 3.25Å; C507-T727 HydrophobicContact CB-CG2 4.2Å; C507-T730 HydrophobicContact CB-CG2 3.48Å; C507-T730 VanDerWaalsContact CB-CG2 3.48Å; C507-T730 WeakPolarHBondContact SG-CG2 3.22Å
508	L	94.7	Very high	93.7	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-48.9	178.2	-172.6	75.1	0	0	0	111.6	V504 L505 A510 V511 I512 V593 Y623 V723 T727	V504-L508 VanDerWaalsContact O-CB 3.22Å; V504-L508 WeakPolarHBondContact O-CB 3.25Å; V504-L508 PolarHBondContact O-N 3.48Å; L505-L508 WeakPolarHBondContact O-CB 3.45Å; L505-L508 PolarHBondContact O-N 2.8Å; L508-A510 VanDerWaalsContact C-N 3.34Å; L508-A510 PolarHBondContact O-N 2.86Å; L508-V511 PolarHBondContact O-N 3.13Å; L508-I512 HydrophobicContact CD1-CD1 4.35Å; L508-I512 HydrophobicContact CD2-CD1 4.46Å; L508-I512 HydrophobicContact CG-CD1 3.85Å; L508-I512 WeakPolarHBondContact O-CB 3.19Å; L508-I512 WeakPolarHBondContact O-CD1 3.42Å; L508-I512 WeakPolarHBondContact O-CG1 3.3Å; L508-I512 PolarHBondContact O-N 2.84Å; L508-V593 HydrophobicContact CD2-CG2 3.66Å; L508-Y623 HydrophobicContact CD1-CE1 4.11Å; L508-Y623 HydrophobicContact CD1-CE2 4.47Å; L508-Y623 HydrophobicContact CD2-CD1 4.45Å; L508-Y623 HydrophobicContact CD2-CD2 3.93Å; L508-Y623 HydrophobicContact CD2-CE2 4.15Å; L508-Y623 HydrophobicContact CD2-CG 4.09Å; L508-V723 HydrophobicContact CD1-CG1 3.61Å; L508-T727 HydrophobicContact CB-CG2 3.9Å; L508-T727 HydrophobicContact CD1-CG2 3.87Å
509	L	95.7	Very high	93.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-41.1	177.5	-67.7	176.3	0	0	0	111.9	L505 D506 C507 I512 K513 V520 L522 Y542 F571 V572	L505-L509 HydrophobicContact CD1-CD1 4.09Å; L505-L509 HydrophobicContact CD1-CG 4.12Å; L505-L509 HydrophobicContact CG-CD1 4.16Å; L505-L509 WeakPolarHBondContact O-CG 3.37Å; L505-L509 PolarHBondContact O-N 2.94Å; D506-L509 PolarHBondContact O-N 3.11Å; C507-L509 PolarHBondContact O-N 3.45Å; L509-I512 PolarHBondContact O-N 3.24Å; L509-K513 VanDerWaalsContact O-CB 3.25Å; L509-K513 WeakPolarHBondContact O-CB 3.46Å; L509-K513 PolarHBondContact O-N 3.45Å; L509-V520 HydrophobicContact CD2-CB 4.13Å; L509-V520 HydrophobicContact CD2-CG1 3.93Å; L509-V520 HydrophobicContact CD2-CG2 4.09Å; L509-L522 HydrophobicContact CD1-CD1 4.34Å; L509-L522 HydrophobicContact CD2-CD2 4.45Å; L509-Y542 HydrophobicContact CB-CE2 3.91Å; L509-Y542 HydrophobicContact CD1-CE2 4.47Å; L509-F571 HydrophobicContact CB-CE1 4.47Å; L509-F571 HydrophobicContact CD2-CE1 4.27Å; L509-F571 HydrophobicContact CD2-CZ 4.46Å; L509-V572 HydrophobicContact CD2-CG2 4.32Å
510	A	94.6	Very high	94.1	Very high	41 Å²	41	30.9 Å²	30.9	34%	0.339	19%	0.186	S	C	.	.	H	α-helix	trans	-64.4	-43.8	177.8	0	0	0	0	0	112.7	D506 C507 L508 K513 S514 Y542	D506-A510 WeakPolarHBondContact O-CB 3.42Å; D506-A510 PolarHBondContact O-N 3.44Å; C507-A510 PolarHBondContact O-N 2.88Å; L508-A510 VanDerWaalsContact C-N 3.34Å; L508-A510 PolarHBondContact O-N 2.86Å; A510-K513 PolarHBondContact O-N 2.82Å; A510-S514 WeakPolarHBondContact O-CB 3.34Å; A510-S514 PolarHBondContact O-N 3.03Å; A510-S514 VanDerWaalsContact O-N 3.09Å; A510-S514 PolarHBondContact O-OG 2.78Å; A510-Y542 WeakPolarHBondContact CA-OH 3.48Å
511	V	94.1	Very high	94.2	Very high	21 Å²	21	30.9 Å²	30.9	13%	0.127	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-46.3	176.5	176.3	0	0	0	0	110.3	C507 L508 K513 S514 T515 V723 A726 T727	C507-V511 VanDerWaalsContact O-CG2 3.31Å; C507-V511 WeakPolarHBondContact O-CG2 3.45Å; C507-V511 PolarHBondContact O-N 3.25Å; L508-V511 PolarHBondContact O-N 3.13Å; V511-K513 VanDerWaalsContact C-N 3.3Å; V511-K513 PolarHBondContact O-N 3.48Å; V511-S514 WeakPolarHBondContact CA-OG 3.31Å; V511-S514 PolarHBondContact O-N 2.91Å; V511-S514 PolarHBondContact O-OG 3.17Å; V511-T515 HydrophobicContact CG1-CG2 4Å; V511-T515 WeakPolarHBondContact O-CB 3.45Å; V511-T515 WeakPolarHBondContact O-CG2 3.22Å; V511-T515 PolarHBondContact O-N 2.81Å; V511-T515 PolarHBondContact O-OG1 2.87Å; V511-V723 HydrophobicContact CB-CG1 4.03Å; V511-V723 HydrophobicContact CG1-CB 4.23Å; V511-V723 HydrophobicContact CG1-CG1 3.71Å; V511-V723 HydrophobicContact CG1-CG2 4.4Å; V511-A726 HydrophobicContact CG1-CB 3.97Å; V511-A726 HydrophobicContact CG2-CB 4.06Å; V511-T727 HydrophobicContact CB-CG2 4.5Å; V511-T727 HydrophobicContact CG2-CG2 4.19Å
512	I	94.8	Very high	94.3	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-47.7	177.8	-67.8	166.4	0	0	0	110	L508 L509 S514 T516 D518 V520 F571 V723	L508-I512 HydrophobicContact CD1-CD1 4.35Å; L508-I512 HydrophobicContact CD2-CD1 4.46Å; L508-I512 HydrophobicContact CG-CD1 3.85Å; L508-I512 WeakPolarHBondContact O-CB 3.19Å; L508-I512 WeakPolarHBondContact O-CD1 3.42Å; L508-I512 WeakPolarHBondContact O-CG1 3.3Å; L508-I512 PolarHBondContact O-N 2.84Å; L509-I512 PolarHBondContact O-N 3.24Å; I512-S514 VanDerWaalsContact C-N 3.3Å; I512-S514 PolarHBondContact O-N 3.48Å; I512-T516 WeakPolarHBondContact CG2-OG1 3.4Å; I512-T516 CarbonylContact O-C 3.54Å; I512-T516 WeakPolarHBondContact O-CA 3.48Å; I512-T516 PolarHBondContact O-N 3.47Å; I512-T516 PolarHBondContact O-OG1 2.81Å; I512-D518 HydrophobicContact CG2-CB 4.04Å; I512-V520 HydrophobicContact CD1-CG2 3.76Å; I512-V520 HydrophobicContact CG2-CG2 3.87Å; I512-F571 HydrophobicContact CB-CZ 4.23Å; I512-F571 HydrophobicContact CG2-CE2 3.81Å; I512-F571 HydrophobicContact CG2-CZ 3.92Å; I512-V723 HydrophobicContact CD1-CG1 4.29Å; I512-V723 HydrophobicContact CG1-CG1 3.48Å; I512-V723 VanDerWaalsContact CG1-CG1 3.48Å; I512-V723 HydrophobicContact CG1-CG2 4.39Å
513	K	92.9	Very high	94.3	Very high	113 Å²	113	31 Å²	31	49%	0.491	19%	0.186	S	C	.	.	H	α-helix	trans	-65	-32.4	-176.9	-174.4	58.8	176.7	175.7	0	113.4	L509 A510 V511 Y542 F571	L509-K513 VanDerWaalsContact O-CB 3.25Å; L509-K513 WeakPolarHBondContact O-CB 3.46Å; L509-K513 PolarHBondContact O-N 3.45Å; A510-K513 PolarHBondContact O-N 2.82Å; V511-K513 VanDerWaalsContact C-N 3.3Å; V511-K513 PolarHBondContact O-N 3.48Å; K513-Y542 HydrophobicContact CB-CE1 4.31Å; K513-Y542 HydrophobicContact CG-CD1 4.49Å; K513-Y542 HydrophobicContact CG-CE1 3.98Å; K513-F571 HydrophobicContact CB-CE1 4.05Å; K513-F571 HydrophobicContact CB-CE2 4.37Å; K513-F571 HydrophobicContact CB-CZ 3.8Å; K513-F571 HydrophobicContact CD-CD1 4.25Å; K513-F571 HydrophobicContact CD-CD2 4.17Å; K513-F571 HydrophobicContact CD-CE1 4.26Å; K513-F571 HydrophobicContact CD-CE2 4.15Å; K513-F571 HydrophobicContact CD-CG 4.24Å; K513-F571 HydrophobicContact CD-CZ 4.21Å; K513-F571 HydrophobicContact CG-CE1 4.49Å
514	S	93.5	Very high	94.3	Very high	95 Å²	95	28.2 Å²	28.2	66%	0.664	17%	0.174	S	C	*	.	H	α-helix	trans	-87.2	-32.5	-178.8	54.2	0	0	0	0	113.4	A510 V511 I512	A510-S514 WeakPolarHBondContact O-CB 3.34Å; A510-S514 PolarHBondContact O-N 3.03Å; A510-S514 VanDerWaalsContact O-N 3.09Å; A510-S514 PolarHBondContact O-OG 2.78Å; V511-S514 WeakPolarHBondContact CA-OG 3.31Å; V511-S514 PolarHBondContact O-N 2.91Å; V511-S514 PolarHBondContact O-OG 3.17Å; I512-S514 VanDerWaalsContact C-N 3.3Å; I512-S514 PolarHBondContact O-N 3.48Å
515	T	92.1	Very high	94	Very high	87 Å²	87	29.5 Å²	29.5	53%	0.534	18%	0.18	S	C	.	.	H	α-helix	trans	-99.3	-23.4	-173.6	59.7	0	0	0	0	113.8	V511	V511-T515 HydrophobicContact CG1-CG2 4Å; V511-T515 WeakPolarHBondContact O-CB 3.45Å; V511-T515 WeakPolarHBondContact O-CG2 3.22Å; V511-T515 PolarHBondContact O-N 2.81Å; V511-T515 PolarHBondContact O-OG1 2.87Å
516	T	92.1	Very high	93.7	Very high	43 Å²	43	31.7 Å²	31.7	26%	0.264	19%	0.189	S	C	.	.			trans	-138.7	163.2	-172.7	67	0	0	0	0	112.5	I512 D518	I512-T516 WeakPolarHBondContact CG2-OG1 3.4Å; I512-T516 CarbonylContact O-C 3.54Å; I512-T516 WeakPolarHBondContact O-CA 3.48Å; I512-T516 PolarHBondContact O-N 3.47Å; I512-T516 PolarHBondContact O-OG1 2.81Å; T516-D518 VanDerWaalsContact C-N 3.29Å; T516-D518 WeakPolarHBondContact OG1-CB 3.49Å
517	S	91.7	Very high	93.5	Very high	104 Å²	104	34.4 Å²	34.4	73%	0.727	21%	0.206	S	C	*	.			trans	-98	27.1	171.1	80.4	0	0	0	0	111.8
518	D	94.3	Very high	93.4	Very high	16 Å²	16	36.3 Å²	36.3	9%	0.086	21%	0.212	C	C	.	.			trans	-80.4	145.3	-172.7	-74.3	-9	0	0	0	110.8	I512 T516 F571 N590 R591 K618	I512-D518 HydrophobicContact CG2-CB 4.04Å; T516-D518 VanDerWaalsContact C-N 3.29Å; T516-D518 WeakPolarHBondContact OG1-CB 3.49Å; D518-F571 WeakPolarHBondContact O-CD2 3.26Å; D518-F571 WeakPolarHBondContact O-CE2 3.03Å; D518-N590 WeakPolarHBondContact CA-OD1 3.3Å; D518-N590 WeakPolarHBondContact CB-OD1 3.5Å; D518-N590 VanDerWaalsContact CG-CG 3.44Å; D518-N590 PolarHBondContact OD1-ND2 3.2Å; D518-N590 PolarHBondContact OD1-OD1 3.47Å; D518-N590 PolarHBondContact OD2-ND2 3.37Å; D518-R591 HydrophobicContact CB-CG 4.43Å; D518-R591 IonicContact OD2-CZ 2.78Å; D518-R591 IonicContact OD2-NE 3.4Å; D518-R591 PolarHBondContact OD2-NE 3.28Å; D518-R591 IonicContact OD2-NH2 2.85Å; D518-R591 PolarHBondContact OD2-NH2 3.09Å; D518-K618 IonicContact OD1-NZ 3.45Å; D518-K618 PolarHBondContact OD1-NZ 3.49Å
519	K	95.4	Very high	93.4	Very high	21 Å²	21	36.3 Å²	36.3	9%	0.091	21%	0.212	C	C	.	.			trans	-98.6	144.9	171.6	-60.2	-177	-176.2	-175.1	0	109.4	F563 D565 D570 F571 A589 N590 R591	K519-F563 HydrophobicContact CB-CE2 4.04Å; K519-F563 HydrophobicContact CB-CZ 3.7Å; K519-F563 HydrophobicContact CD-CD2 4.28Å; K519-F563 HydrophobicContact CD-CE2 3.82Å; K519-F563 HydrophobicContact CD-CZ 4.02Å; K519-F563 HydrophobicContact CG-CE2 4.43Å; K519-F563 HydrophobicContact CG-CZ 4.47Å; K519-F563 PolarHBondContact NZ-O 2.91Å; K519-D565 PolarHBondContact NZ-O 3.31Å; K519-D570 WeakPolarHBondContact CD-O 3.46Å; K519-D570 WeakPolarHBondContact CE-O 3.47Å; K519-F571 WeakPolarHBondContact CA-O 3.48Å; K519-A589 HydrophobicContact CB-CB 4.22Å; K519-A589 WeakPolarHBondContact O-CA 3.07Å; K519-A589 WeakPolarHBondContact O-CB 3.5Å; K519-N590 PolarHBondContact O-N 3.31Å; K519-R591 PolarHBondContact O-N 3.48Å
520	V	96.2	Very high	93.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.9	-172.3	-172.3	0	0	0	0	110.9	L509 I512 L522 F571 V572 F573 R591 V593	L509-V520 HydrophobicContact CD2-CB 4.13Å; L509-V520 HydrophobicContact CD2-CG1 3.93Å; L509-V520 HydrophobicContact CD2-CG2 4.09Å; I512-V520 HydrophobicContact CD1-CG2 3.76Å; I512-V520 HydrophobicContact CG2-CG2 3.87Å; V520-L522 HydrophobicContact CG1-CD2 3.89Å; V520-F571 HydrophobicContact CG2-CE2 3.98Å; V520-F571 HydrophobicContact CG2-CZ 3.99Å; V520-F571 PolarHBondContact N-O 3.39Å; V520-V572 CarbonylContact O-C 3.6Å; V520-V572 WeakPolarHBondContact O-CA 3.39Å; V520-F573 PolarHBondContact O-N 3.17Å; V520-R591 CarbonylContact C-O 3.58Å; V520-R591 WeakPolarHBondContact CA-O 3.08Å; V520-R591 HydrophobicContact CG2-CB 4.31Å; V520-V593 HydrophobicContact CG1-CG2 4.07Å
521	V	95.4	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.9	172.3	173.8	0	0	0	0	109.1	I523 F563 F573 L575 L586 A589 R591 L592 V593 V611	V521-I523 HydrophobicContact CG1-CD1 4.12Å; V521-I523 HydrophobicContact CG1-CG1 3.91Å; V521-F563 HydrophobicContact CG2-CE1 4.22Å; V521-F563 HydrophobicContact CG2-CZ 4.43Å; V521-F573 CarbonylContact C-O 3.59Å; V521-F573 VanDerWaalsContact CA-O 3.29Å; V521-F573 WeakPolarHBondContact CA-O 3.46Å; V521-F573 HydrophobicContact CG2-CB 4.24Å; V521-L575 HydrophobicContact CG1-CD2 3.15Å; V521-L586 HydrophobicContact CG1-CD1 4.15Å; V521-L586 HydrophobicContact CG2-CB 4.34Å; V521-L586 HydrophobicContact CG2-CD1 4.12Å; V521-A589 HydrophobicContact CG2-CB 3.43Å; V521-A589 VanDerWaalsContact CG2-CB 3.43Å; V521-R591 PolarHBondContact N-O 3.13Å; V521-L592 HydrophobicContact CB-CB 4.43Å; V521-L592 HydrophobicContact CB-CD1 4.49Å; V521-L592 HydrophobicContact CB-CG 4.3Å; V521-L592 HydrophobicContact CG1-CD1 4.18Å; V521-L592 HydrophobicContact CG1-CG 4.23Å; V521-L592 CarbonylContact O-C 3.58Å; V521-L592 WeakPolarHBondContact O-CA 3.15Å; V521-V593 PolarHBondContact O-N 3.03Å; V521-V611 HydrophobicContact CB-CG2 4.16Å; V521-V611 HydrophobicContact CG2-CG2 3.82Å
522	L	95.6	Very high	93.2	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.3	176	-60.7	-175.8	0	0	0	110.2	L505 L509 V520 F533 V572 F573 M574 L575 V593	L505-L522 HydrophobicContact CD1-CD2 3.69Å; L509-L522 HydrophobicContact CD1-CD1 4.34Å; L509-L522 HydrophobicContact CD2-CD2 4.45Å; V520-L522 HydrophobicContact CG1-CD2 3.89Å; L522-F533 HydrophobicContact CB-CD2 4.18Å; L522-F533 HydrophobicContact CB-CE2 4.23Å; L522-F533 HydrophobicContact CD1-CB 4.37Å; L522-F533 HydrophobicContact CD1-CD2 4.1Å; L522-F533 HydrophobicContact CD1-CG 4.18Å; L522-V572 HydrophobicContact CB-CG1 4.47Å; L522-V572 HydrophobicContact CD1-CG1 3.57Å; L522-V572 HydrophobicContact CG-CG1 3.72Å; L522-F573 PolarHBondContact N-O 3.05Å; L522-M574 HydrophobicContact CB-CG 4.4Å; L522-M574 CarbonylContact O-C 3.58Å; L522-M574 WeakPolarHBondContact O-CA 3.31Å; L522-L575 PolarHBondContact O-N 3.46Å; L522-V593 HydrophobicContact CD2-CB 3.66Å; L522-V593 HydrophobicContact CD2-CG1 4.45Å; L522-V593 HydrophobicContact CD2-CG2 3.82Å
523	I	94.2	Very high	93.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.7	-178.6	-47.7	-163.7	0	0	0	109.7	V521 L575 S577 L592 V593 M594 F595 A607	V521-I523 HydrophobicContact CG1-CD1 4.12Å; V521-I523 HydrophobicContact CG1-CG1 3.91Å; I523-L575 WeakPolarHBondContact CA-O 3.25Å; I523-L575 HydrophobicContact CD1-CD1 3.96Å; I523-L575 HydrophobicContact CD1-CD2 3.99Å; I523-L575 HydrophobicContact CD1-CG 4.1Å; I523-L575 HydrophobicContact CG1-CD1 4.28Å; I523-L575 HydrophobicContact CG1-CD2 3.72Å; I523-L575 HydrophobicContact CG1-CG 3.86Å; I523-L575 HydrophobicContact CG2-CG 4.41Å; I523-S577 VanDerWaalsContact CG2-OG 3.26Å; I523-S577 WeakPolarHBondContact CG2-OG 3.35Å; I523-L592 HydrophobicContact CD1-CD1 3.63Å; I523-L592 HydrophobicContact CD1-CD2 4.01Å; I523-L592 HydrophobicContact CD1-CG 3.94Å; I523-L592 HydrophobicContact CG1-CD1 4.45Å; I523-L592 HydrophobicContact CG1-CD2 4.34Å; I523-L592 HydrophobicContact CG1-CG 4.27Å; I523-V593 PolarHBondContact N-O 2.93Å; I523-M594 HydrophobicContact CB-CE 4.07Å; I523-M594 HydrophobicContact CB-SD 3.88Å; I523-M594 HydrophobicContact CD1-CE 4.17Å; I523-M594 HydrophobicContact CG2-CE 3.85Å; I523-M594 HydrophobicContact CG2-SD 3.71Å; I523-F595 WeakPolarHBondContact O-CB 3.37Å; I523-F595 PolarHBondContact O-N 3.13Å; I523-A607 HydrophobicContact CD1-CB 3.84Å; I523-A607 HydrophobicContact CG2-CB 4.27Å
524	S	93.7	Very high	93.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.3	171	175.2	0	0	0	0	110.3	Y526 T529 L575 S576 S577 D596	S524-Y526 VanDerWaalsContact C-N 3.28Å; S524-Y526 PolarHBondContact OG-N 2.94Å; S524-Y526 VanDerWaalsContact OG-N 3.14Å; S524-Y526 PolarHBondContact OG-O 2.8Å; S524-T529 WeakPolarHBondContact OG-CB 3.42Å; S524-L575 PolarHBondContact N-O 3.02Å; S524-S576 CarbonylContact O-C 3.51Å; S524-S576 VanDerWaalsContact O-CA 3.23Å; S524-S576 WeakPolarHBondContact O-CA 3.13Å; S524-S577 PolarHBondContact O-N 3.3Å; S524-S577 PolarHBondContact O-OG 2.96Å; S524-D596 WeakPolarHBondContact CA-OD1 3.38Å; S524-D596 VanDerWaalsContact CB-OD1 3.28Å; S524-D596 WeakPolarHBondContact CB-OD1 3.44Å; S524-D596 PolarHBondContact OG-OD1 2.83Å
525	N	89.1	Confident	93.2	Very high	27 Å²	27	31.1 Å²	31.1	14%	0.144	17%	0.17	C	C	.	.	S	Bend	trans	-75.6	-19.3	172.3	-62.5	-60.3	0	0	0	112.5	S577 D596 P597 D598	N525-S577 WeakPolarHBondContact OD1-CB 3.15Å; N525-S577 PolarHBondContact OD1-OG 2.96Å; N525-D596 WeakPolarHBondContact CB-OD2 3.35Å; N525-D596 VanDerWaalsContact CG-OD2 3.25Å; N525-D596 PolarHBondContact N-OD2 3.41Å; N525-D596 PolarHBondContact ND2-O 3.26Å; N525-D596 PolarHBondContact ND2-OD2 2.86Å; N525-P597 PolarHBondContact ND2-O 3.08Å; N525-D598 PolarHBondContact ND2-N 3.14Å
526	Y	89.7	Confident	93.3	Very high	46 Å²	46	27 Å²	27	18%	0.18	15%	0.145	C	C	.	.			trans	-108.9	123.8	-173.9	-61.7	-83.3	0	0	0	111.7	T450 K453 S524 Q528 T529 L530	T450-Y526 HydrophobicContact CG2-CE1 4.47Å; K453-Y526 HydrophobicContact CB-CE2 4.47Å; K453-Y526 WeakPolarHBondContact CD-OH 3.17Å; K453-Y526 WeakPolarHBondContact CE-OH 3.14Å; K453-Y526 PolarHBondContact NZ-OH 2.86Å; S524-Y526 VanDerWaalsContact C-N 3.28Å; S524-Y526 PolarHBondContact OG-N 2.94Å; S524-Y526 VanDerWaalsContact OG-N 3.14Å; S524-Y526 PolarHBondContact OG-O 2.8Å; Y526-Q528 VanDerWaalsContact C-N 3.27Å; Y526-Q528 PolarHBondContact O-N 2.84Å; Y526-T529 WeakPolarHBondContact O-CB 3.4Å; Y526-T529 PolarHBondContact O-N 3Å; Y526-T529 VanDerWaalsContact O-N 3.09Å; Y526-L530 PolarHBondContact O-N 3.25Å
527	T	90.5	Very high	93.4	Very high	73 Å²	73	25 Å²	25	45%	0.448	13%	0.132	S	C	.	.	H	α-helix	trans	-62.1	-35.2	176.3	53.6	0	0	0	0	112.5	T529 L530 D531	T527-T529 PolarHBondContact O-N 3.25Å; T527-L530 WeakPolarHBondContact O-CA 3.5Å; T527-L530 VanDerWaalsContact O-CB 3.32Å; T527-L530 WeakPolarHBondContact O-CB 3.47Å; T527-L530 PolarHBondContact O-N 3.49Å; T527-D531 PolarHBondContact O-N 2.96Å
528	Q	91.1	Very high	93.5	Very high	72 Å²	72	25.9 Å²	25.9	34%	0.336	13%	0.128	S	C	.	.	H	α-helix	trans	-61.9	-31.2	175.5	-63.6	-178	-51	0	0	112.5	L461 Y526 D531 L532	L461-Q528 HydrophobicContact CD2-CB 3.45Å; L461-Q528 VanDerWaalsContact CD2-CB 3.45Å; Y526-Q528 VanDerWaalsContact C-N 3.27Å; Y526-Q528 PolarHBondContact O-N 2.84Å; Q528-D531 WeakPolarHBondContact CA-OD2 3.48Å; Q528-D531 PolarHBondContact O-N 3.16Å; Q528-L532 PolarHBondContact O-N 3.27Å
529	T	93.8	Very high	93.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-73.3	-35	173.8	-57.4	0	0	0	0	111.1	N457 L461 F502 S524 Y526 T527 D531 L532 F533 F595	N457-T529 PolarHBondContact ND2-OG1 3.23Å; N457-T529 VanDerWaalsContact ND2-OG1 3.08Å; L461-T529 WeakPolarHBondContact CD1-OG1 3.23Å; F502-T529 HydrophobicContact CE2-CG2 4.44Å; F502-T529 HydrophobicContact CZ-CG2 4.38Å; S524-T529 WeakPolarHBondContact OG-CB 3.42Å; Y526-T529 WeakPolarHBondContact O-CB 3.4Å; Y526-T529 PolarHBondContact O-N 3Å; Y526-T529 VanDerWaalsContact O-N 3.09Å; T527-T529 PolarHBondContact O-N 3.25Å; T529-D531 VanDerWaalsContact C-N 3.31Å; T529-D531 PolarHBondContact O-N 2.89Å; T529-L532 WeakPolarHBondContact O-CB 3.46Å; T529-L532 PolarHBondContact O-N 3.42Å; T529-F533 HydrophobicContact CG2-CE1 3.84Å; T529-F533 HydrophobicContact CG2-CE2 4.11Å; T529-F533 HydrophobicContact CG2-CZ 3.57Å; T529-F533 WeakPolarHBondContact O-CG 3.41Å; T529-F533 PolarHBondContact O-N 3.46Å; T529-F595 HydrophobicContact CG2-CD1 3.71Å; T529-F595 HydrophobicContact CG2-CE1 3.8Å
530	L	93.3	Very high	93.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-39.1	170.5	-56.8	179.5	0	0	0	111.6	Y526 T527 L532 F533 E534 M574	Y526-L530 PolarHBondContact O-N 3.25Å; T527-L530 WeakPolarHBondContact O-CA 3.5Å; T527-L530 VanDerWaalsContact O-CB 3.32Å; T527-L530 WeakPolarHBondContact O-CB 3.47Å; T527-L530 PolarHBondContact O-N 3.49Å; L530-L532 VanDerWaalsContact C-N 3.25Å; L530-L532 PolarHBondContact O-N 3.46Å; L530-F533 HydrophobicContact CD2-CD2 3.75Å; L530-F533 HydrophobicContact CD2-CE2 3.95Å; L530-F533 WeakPolarHBondContact O-CB 3.4Å; L530-F533 PolarHBondContact O-N 2.92Å; L530-E534 WeakPolarHBondContact O-CG 3.35Å; L530-E534 PolarHBondContact O-N 2.93Å; L530-M574 HydrophobicContact CD2-CB 4.31Å
531	D	93.3	Very high	93.1	Very high	52 Å²	52	37 Å²	37	28%	0.278	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-36.5	175.5	-57.3	-32.1	0	0	0	111.9	L488 T527 Q528 T529 E534 R535 R546	L488-D531 HydrophobicContact CD2-CB 3.9Å; T527-D531 PolarHBondContact O-N 2.96Å; Q528-D531 WeakPolarHBondContact CA-OD2 3.48Å; Q528-D531 PolarHBondContact O-N 3.16Å; T529-D531 VanDerWaalsContact C-N 3.31Å; T529-D531 PolarHBondContact O-N 2.89Å; D531-E534 PolarHBondContact O-N 2.95Å; D531-R535 WeakPolarHBondContact O-CG 3.28Å; D531-R535 PolarHBondContact O-N 3.07Å; D531-R546 IonicContact OD1-CZ 3.8Å; D531-R546 IonicContact OD1-NH1 2.65Å; D531-R546 PolarHBondContact OD1-NH1 3.19Å; D531-R546 IonicContact OD1-NH2 2.9Å; D531-R546 PolarHBondContact OD1-NH2 2.88Å
532	L	93.6	Very high	93.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.3	-38.3	172.5	-66.8	178.2	0	0	0	112.4	H458 D460 L461 S487 L488 V494 F502 Q528 T529 L530 E534 R535 L536	H458-L532 HydrophobicContact CB-CD1 3.67Å; D460-L532 HydrophobicContact CB-CD1 4.43Å; D460-L532 HydrophobicContact CB-CD2 4.19Å; L461-L532 HydrophobicContact CD1-CD1 4.24Å; L461-L532 HydrophobicContact CD2-CD1 3.88Å; L461-L532 HydrophobicContact CD2-CG 4.5Å; L461-L532 HydrophobicContact CG-CD1 3.83Å; S487-L532 WeakPolarHBondContact OG-CD2 3.28Å; L488-L532 HydrophobicContact CD1-CD2 4.23Å; L488-L532 HydrophobicContact CD1-CG 4.37Å; L488-L532 HydrophobicContact CD2-CD2 3.82Å; L488-L532 HydrophobicContact CD2-CG 4.2Å; L488-L532 HydrophobicContact CG-CD2 3.78Å; L488-L532 HydrophobicContact CG-CG 4.36Å; V494-L532 HydrophobicContact CG2-CD2 4.27Å; F502-L532 HydrophobicContact CE1-CB 3.93Å; F502-L532 HydrophobicContact CE2-CD1 4.29Å; F502-L532 HydrophobicContact CZ-CB 3.61Å; F502-L532 HydrophobicContact CZ-CD1 3.93Å; F502-L532 HydrophobicContact CZ-CG 4.45Å; Q528-L532 PolarHBondContact O-N 3.27Å; T529-L532 WeakPolarHBondContact O-CB 3.46Å; T529-L532 PolarHBondContact O-N 3.42Å; L530-L532 VanDerWaalsContact C-N 3.25Å; L530-L532 PolarHBondContact O-N 3.46Å; L532-E534 VanDerWaalsContact C-N 3.33Å; L532-R535 PolarHBondContact O-N 2.94Å; L532-L536 WeakPolarHBondContact O-CB 3.3Å; L532-L536 PolarHBondContact O-N 3.49Å
533	F	95.1	Very high	93.1	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-38.3	174.8	-61.8	-23.3	0	0	0	112.3	F502 L505 L522 T529 L530 L536 C537 M574 F595	F502-F533 AromaticContact CE1-CD1 3.78Å; F502-F533 HydrophobicContact CE1-CD1 3.78Å; F502-F533 AromaticContact CE1-CE1 3.94Å; F502-F533 HydrophobicContact CE1-CE1 3.94Å; F502-F533 HydrophobicContact CE2-CE1 4.17Å; F502-F533 AromaticContact CZ-CD1 3.72Å; F502-F533 HydrophobicContact CZ-CD1 3.72Å; F502-F533 AromaticContact CZ-CE1 3.55Å; F502-F533 HydrophobicContact CZ-CE1 3.55Å; L505-F533 HydrophobicContact CD2-CD1 3.74Å; L505-F533 HydrophobicContact CD2-CE1 3.38Å; L505-F533 HydrophobicContact CD2-CZ 4.1Å; L522-F533 HydrophobicContact CB-CD2 4.18Å; L522-F533 HydrophobicContact CB-CE2 4.23Å; L522-F533 HydrophobicContact CD1-CB 4.37Å; L522-F533 HydrophobicContact CD1-CD2 4.1Å; L522-F533 HydrophobicContact CD1-CG 4.18Å; T529-F533 HydrophobicContact CG2-CE1 3.84Å; T529-F533 HydrophobicContact CG2-CE2 4.11Å; T529-F533 HydrophobicContact CG2-CZ 3.57Å; T529-F533 WeakPolarHBondContact O-CG 3.41Å; T529-F533 PolarHBondContact O-N 3.46Å; L530-F533 HydrophobicContact CD2-CD2 3.75Å; L530-F533 HydrophobicContact CD2-CE2 3.95Å; L530-F533 WeakPolarHBondContact O-CB 3.4Å; L530-F533 PolarHBondContact O-N 2.92Å; F533-L536 PolarHBondContact O-N 3.39Å; F533-C537 WeakPolarHBondContact O-CB 3.27Å; F533-C537 PolarHBondContact O-N 2.94Å; F533-C537 PolarHBondContact O-SG 2.96Å; F533-M574 HydrophobicContact CB-CE 3.82Å; F533-M574 HydrophobicContact CB-SD 3.73Å; F533-M574 WeakPolarHBondContact O-CE 3.34Å; F533-F595 HydrophobicContact CE1-CD1 4.28Å; F533-F595 AromaticContact CE1-CD2 3.94Å; F533-F595 HydrophobicContact CE1-CD2 3.94Å; F533-F595 HydrophobicContact CE1-CE1 4.37Å; F533-F595 HydrophobicContact CE1-CE2 4.06Å; F533-F595 HydrophobicContact CE1-CG 4.08Å; F533-F595 HydrophobicContact CE1-CZ 4.3Å; F533-F595 HydrophobicContact CE2-CB 4.41Å; F533-F595 HydrophobicContact CZ-CB 3.75Å; F533-F595 AromaticContact CZ-CD1 3.79Å; F533-F595 HydrophobicContact CZ-CD1 3.79Å; F533-F595 AromaticContact CZ-CD2 3.71Å; F533-F595 HydrophobicContact CZ-CD2 3.71Å; F533-F595 HydrophobicContact CZ-CE1 4.32Å; F533-F595 HydrophobicContact CZ-CE2 4.27Å; F533-F595 AromaticContact CZ-CG 3.46Å; F533-F595 HydrophobicContact CZ-CG 3.46Å; F533-F595 VanDerWaalsContact CZ-CG 3.46Å
534	E	93.9	Very high	93.1	Very high	48 Å²	48	44.6 Å²	44.6	22%	0.224	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-48.3	174.6	-67.7	-168.7	-179.4	0	0	111	L530 D531 L532 L536 C537 L538 F544 R546 M574	L530-E534 WeakPolarHBondContact O-CG 3.35Å; L530-E534 PolarHBondContact O-N 2.93Å; D531-E534 PolarHBondContact O-N 2.95Å; L532-E534 VanDerWaalsContact C-N 3.33Å; E534-L536 VanDerWaalsContact C-N 3.31Å; E534-L536 PolarHBondContact O-N 3.01Å; E534-C537 PolarHBondContact O-N 3.29Å; E534-L538 WeakPolarHBondContact O-CB 3.25Å; E534-L538 VanDerWaalsContact O-CG 3.3Å; E534-L538 WeakPolarHBondContact O-CG 3.46Å; E534-L538 PolarHBondContact O-N 3.36Å; E534-F544 HydrophobicContact CB-CE2 4.04Å; E534-F544 HydrophobicContact CB-CZ 3.93Å; E534-F544 HydrophobicContact CG-CD2 4.21Å; E534-F544 HydrophobicContact CG-CE2 3.5Å; E534-F544 HydrophobicContact CG-CZ 3.93Å; E534-R546 WeakPolarHBondContact OE1-CB 3.29Å; E534-R546 WeakPolarHBondContact OE1-CD 3.25Å; E534-R546 WeakPolarHBondContact OE1-CG 3.34Å; E534-R546 IonicContact OE1-CZ 3.82Å; E534-R546 IonicContact OE1-NE 3.5Å; E534-R546 IonicContact OE1-NH1 2.84Å; E534-R546 PolarHBondContact OE1-NH1 3.47Å; E534-R546 IonicContact OE2-NH1 3.56Å; E534-M574 HydrophobicContact CG-CE 4.39Å; E534-M574 HydrophobicContact CG-SD 3.79Å
535	R	92.7	Very high	93.1	Very high	61 Å²	61	45.4 Å²	45.4	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-42.4	176.6	-69.7	170.1	179.3	-120.7	13.7	111.7	S487 L488 S490 A492 V494 D531 L532 L538 Q539	S487-R535 PolarHBondContact O-NH1 3.25Å; S487-R535 PolarHBondContact O-NH2 3.29Å; L488-R535 PolarHBondContact O-NH2 3.46Å; S490-R535 PolarHBondContact O-NH1 3.02Å; A492-R535 PolarHBondContact O-NH1 3.39Å; V494-R535 HydrophobicContact CB-CB 4.43Å; V494-R535 HydrophobicContact CG1-CB 4.29Å; D531-R535 WeakPolarHBondContact O-CG 3.28Å; D531-R535 PolarHBondContact O-N 3.07Å; L532-R535 PolarHBondContact O-N 2.94Å; R535-L538 PolarHBondContact O-N 3.44Å; R535-Q539 WeakPolarHBondContact O-CB 3.06Å; R535-Q539 PolarHBondContact O-N 3.4Å
536	L	93.9	Very high	93.3	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-46.9	175.6	-177.5	61.3	0	0	0	111.5	V494 P496 F502 L505 D506 L532 F533 E534 Q539 R540	V494-L536 HydrophobicContact CG1-CB 3.91Å; V494-L536 HydrophobicContact CG1-CD1 4.06Å; P496-L536 HydrophobicContact CG-CD1 3.64Å; F502-L536 HydrophobicContact CD1-CD2 4.25Å; F502-L536 HydrophobicContact CE1-CD2 4.49Å; L505-L536 HydrophobicContact CD2-CD2 4.41Å; D506-L536 HydrophobicContact CB-CD1 4.5Å; D506-L536 HydrophobicContact CB-CD2 4.37Å; L532-L536 WeakPolarHBondContact O-CB 3.3Å; L532-L536 PolarHBondContact O-N 3.49Å; F533-L536 PolarHBondContact O-N 3.39Å; E534-L536 VanDerWaalsContact C-N 3.31Å; E534-L536 PolarHBondContact O-N 3.01Å; L536-Q539 PolarHBondContact O-N 2.81Å; L536-R540 HydrophobicContact CD1-CG 4.19Å; L536-R540 WeakPolarHBondContact O-CG 3.19Å; L536-R540 PolarHBondContact O-N 2.87Å
537	C	94.6	Very high	93.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-40.5	179.8	-70.5	0	0	0	0	112	F533 E534 R540 G541 Y542 F544 M574	F533-C537 WeakPolarHBondContact O-CB 3.27Å; F533-C537 PolarHBondContact O-N 2.94Å; F533-C537 PolarHBondContact O-SG 2.96Å; E534-C537 PolarHBondContact O-N 3.29Å; C537-R540 PolarHBondContact O-N 3.32Å; C537-G541 PolarHBondContact O-N 3.26Å; C537-Y542 PolarHBondContact O-N 3.5Å; C537-F544 HydrophobicContact CB-CB 4.4Å; C537-F544 HydrophobicContact CB-CD1 3.53Å; C537-F544 HydrophobicContact CB-CE1 4.08Å; C537-F544 HydrophobicContact CB-CG 4.14Å; C537-M574 HydrophobicContact CB-CE 3.96Å; C537-M574 WeakPolarHBondContact SG-CE 3.28Å
538	L	93.1	Very high	92.7	Very high	122 Å²	122	41.5 Å²	41.5	64%	0.639	21%	0.209	S	C	*	.	H	α-helix	trans	-61.7	-45.1	174.1	-70.9	172.3	0	0	0	111.4	E534 R535 R540 G541 F544	E534-L538 WeakPolarHBondContact O-CB 3.25Å; E534-L538 VanDerWaalsContact O-CG 3.3Å; E534-L538 WeakPolarHBondContact O-CG 3.46Å; E534-L538 PolarHBondContact O-N 3.36Å; R535-L538 PolarHBondContact O-N 3.44Å; L538-R540 VanDerWaalsContact C-N 3.33Å; L538-R540 PolarHBondContact O-N 2.89Å; L538-G541 PolarHBondContact O-N 2.92Å; L538-F544 HydrophobicContact CD2-CE1 3.89Å; L538-F544 HydrophobicContact CD2-CZ 4.44Å; L538-F544 HydrophobicContact CG-CE1 3.92Å; L538-F544 HydrophobicContact CG-CZ 4.36Å
539	Q	92.2	Very high	92	Very high	87 Å²	87	40.8 Å²	40.8	41%	0.407	22%	0.221	S	C	.	.	H	α-helix	trans	-63.9	-35.5	178.5	179.6	176.8	-21.2	0	0	113	V494 R535 L536	V494-Q539 PolarHBondContact O-OE1 2.95Å; V494-Q539 VanDerWaalsContact O-OE1 3.08Å; R535-Q539 WeakPolarHBondContact O-CB 3.06Å; R535-Q539 PolarHBondContact O-N 3.4Å; L536-Q539 PolarHBondContact O-N 2.81Å
540	R	93.2	Very high	91.3	Very high	121 Å²	121	46.6 Å²	46.6	46%	0.457	26%	0.256	S	S	.	.	H	α-helix	trans	-90.1	-4.4	179	-62.9	-63.7	-171.2	-169.3	-4.9	113.9	D506 L536 C537 L538 Y542	D506-R540 IonicContact OD1-CZ 2.67Å; D506-R540 IonicContact OD1-NE 2.83Å; D506-R540 PolarHBondContact OD1-NE 2.98Å; D506-R540 IonicContact OD1-NH2 3.28Å; D506-R540 IonicContact OD2-CZ 3.53Å; D506-R540 IonicContact OD2-NE 3.66Å; D506-R540 PolarHBondContact OD2-NE 2.91Å; D506-R540 IonicContact OD2-NH2 3.06Å; D506-R540 PolarHBondContact OD2-NH2 3.4Å; L536-R540 HydrophobicContact CD1-CG 4.19Å; L536-R540 WeakPolarHBondContact O-CG 3.19Å; L536-R540 PolarHBondContact O-N 2.87Å; C537-R540 PolarHBondContact O-N 3.32Å; L538-R540 VanDerWaalsContact C-N 3.33Å; L538-R540 PolarHBondContact O-N 2.89Å; R540-Y542 HydrophobicContact CB-CD1 4.37Å; R540-Y542 HydrophobicContact CB-CD2 3.78Å; R540-Y542 HydrophobicContact CB-CE1 4.1Å; R540-Y542 HydrophobicContact CB-CE2 3.47Å; R540-Y542 VanDerWaalsContact CB-CE2 3.47Å; R540-Y542 HydrophobicContact CB-CG 4.21Å; R540-Y542 HydrophobicContact CG-CE2 4.01Å
541	G	92.9	Very high	90.6	Very high	64 Å²	64	47.6 Å²	47.6	66%	0.66	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	29.7	-179.1	0	0	0	0	0	114.4	C537 L538	C537-G541 PolarHBondContact O-N 3.26Å; L538-G541 PolarHBondContact O-N 2.92Å
542	Y	95.3	Very high	89.9	Confident	28 Å²	28	49.6 Å²	49.6	11%	0.11	28%	0.276	C	S	.	.			trans	-89.4	131.8	177.2	-59.3	-29.1	0	0	0	111.5	L509 A510 K513 C537 R540 F544 F571	L509-Y542 HydrophobicContact CB-CE2 3.91Å; L509-Y542 HydrophobicContact CD1-CE2 4.47Å; A510-Y542 WeakPolarHBondContact CA-OH 3.48Å; K513-Y542 HydrophobicContact CB-CE1 4.31Å; K513-Y542 HydrophobicContact CG-CD1 4.49Å; K513-Y542 HydrophobicContact CG-CE1 3.98Å; C537-Y542 PolarHBondContact O-N 3.5Å; R540-Y542 HydrophobicContact CB-CD1 4.37Å; R540-Y542 HydrophobicContact CB-CD2 3.78Å; R540-Y542 HydrophobicContact CB-CE1 4.1Å; R540-Y542 HydrophobicContact CB-CE2 3.47Å; R540-Y542 VanDerWaalsContact CB-CE2 3.47Å; R540-Y542 HydrophobicContact CB-CG 4.21Å; R540-Y542 HydrophobicContact CG-CE2 4.01Å; Y542-F544 WeakPolarHBondContact O-CD1 3.2Å; Y542-F571 HydrophobicContact CD1-CD1 4.09Å; Y542-F571 HydrophobicContact CD1-CE1 4.32Å; Y542-F571 HydrophobicContact CD2-CD1 4.34Å; Y542-F571 HydrophobicContact CD2-CE1 4.29Å; Y542-F571 HydrophobicContact CE1-CE1 4.5Å; Y542-F571 HydrophobicContact CE2-CE1 4.46Å; Y542-F571 AromaticContact CG-CD1 3.91Å; Y542-F571 HydrophobicContact CG-CD1 3.91Å; Y542-F571 HydrophobicContact CG-CE1 4.22Å
543	N	95.4	Very high	88.9	Confident	83 Å²	83	52.6 Å²	52.6	44%	0.444	29%	0.291	S	S	.	.			trans	-72.5	131.1	168.7	-64.9	-29.8	0	0	0	109.7	R569 F571 V572	N543-R569 WeakPolarHBondContact CB-O 3.21Å; N543-R569 PolarHBondContact ND2-O 2.99Å; N543-R569 VanDerWaalsContact ND2-O 3.11Å; N543-F571 PolarHBondContact O-N 2.95Å; N543-V572 PolarHBondContact O-N 2.74Å; N543-V572 VanDerWaalsContact O-N 3.13Å
544	F	95.2	Very high	88	Confident	51 Å²	51	60.7 Å²	60.7	22%	0.224	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	159.5	-178.1	69.3	-88.1	0	0	0	112.9	E534 C537 L538 Y542 V572 M574	E534-F544 HydrophobicContact CB-CE2 4.04Å; E534-F544 HydrophobicContact CB-CZ 3.93Å; E534-F544 HydrophobicContact CG-CD2 4.21Å; E534-F544 HydrophobicContact CG-CE2 3.5Å; E534-F544 HydrophobicContact CG-CZ 3.93Å; C537-F544 HydrophobicContact CB-CB 4.4Å; C537-F544 HydrophobicContact CB-CD1 3.53Å; C537-F544 HydrophobicContact CB-CE1 4.08Å; C537-F544 HydrophobicContact CB-CG 4.14Å; L538-F544 HydrophobicContact CD2-CE1 3.89Å; L538-F544 HydrophobicContact CD2-CZ 4.44Å; L538-F544 HydrophobicContact CG-CE1 3.92Å; L538-F544 HydrophobicContact CG-CZ 4.36Å; Y542-F544 WeakPolarHBondContact O-CD1 3.2Å; F544-V572 CarbonylContact C-O 3.59Å; F544-V572 WeakPolarHBondContact CA-O 3.5Å; F544-V572 HydrophobicContact CB-CB 3.95Å; F544-V572 HydrophobicContact CB-CG1 4.45Å; F544-M574 HydrophobicContact CB-CE 3.72Å; F544-M574 HydrophobicContact CD1-CE 4.38Å; F544-M574 HydrophobicContact CD2-CE 3.72Å; F544-M574 HydrophobicContact CD2-SD 4.03Å; F544-M574 HydrophobicContact CE2-CE 4.47Å; F544-M574 HydrophobicContact CG-CE 3.68Å
545	V	93.9	Very high	87.6	Confident	17 Å²	17	64.5 Å²	64.5	10%	0.103	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.1	172	175	0	0	0	0	108	V559 D570 V572 F573 M574	V545-V559 HydrophobicContact CG1-CB 3.76Å; V545-V559 HydrophobicContact CG1-CG1 4.26Å; V545-V559 HydrophobicContact CG1-CG2 4.05Å; V545-D570 HydrophobicContact CG2-CB 4.21Å; V545-V572 PolarHBondContact N-O 3.33Å; V545-F573 HydrophobicContact CB-CD2 4.02Å; V545-F573 HydrophobicContact CB-CE2 4.35Å; V545-F573 HydrophobicContact CG1-CD2 4.02Å; V545-F573 HydrophobicContact CG1-CE2 3.83Å; V545-F573 CarbonylContact O-C 3.52Å; V545-F573 WeakPolarHBondContact O-CA 3.41Å; V545-M574 PolarHBondContact O-N 2.78Å
546	R	92.2	Very high	87	Confident	49 Å²	49	63.7 Å²	63.7	19%	0.185	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.7	175.7	-174.2	-130.4	-171.8	94.1	-9.4	110.3	D531 E534 D548	D531-R546 IonicContact OD1-CZ 3.8Å; D531-R546 IonicContact OD1-NH1 2.65Å; D531-R546 PolarHBondContact OD1-NH1 3.19Å; D531-R546 IonicContact OD1-NH2 2.9Å; D531-R546 PolarHBondContact OD1-NH2 2.88Å; E534-R546 WeakPolarHBondContact OE1-CB 3.29Å; E534-R546 WeakPolarHBondContact OE1-CD 3.25Å; E534-R546 WeakPolarHBondContact OE1-CG 3.34Å; E534-R546 IonicContact OE1-CZ 3.82Å; E534-R546 IonicContact OE1-NE 3.5Å; E534-R546 IonicContact OE1-NH1 2.84Å; E534-R546 PolarHBondContact OE1-NH1 3.47Å; E534-R546 IonicContact OE2-NH1 3.56Å; R546-D548 IonicContact CZ-OD2 3.89Å; R546-D548 IonicContact NE-OD2 3.63Å; R546-D548 PolarHBondContact NE-OD2 2.95Å; R546-D548 IonicContact NH2-OD2 2.71Å; R546-D548 PolarHBondContact NH2-OD2 3.34Å
547	L	88.3	Confident	86.4	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.3	173.1	-166.8	160.7	0	0	0	110.7	M551 R556 V560 F573 M574 L575 S576 A579 L584	L547-M551 HydrophobicContact CB-SD 4.26Å; L547-M551 HydrophobicContact CG-SD 4.17Å; L547-R556 HydrophobicContact CD1-CB 4.33Å; L547-R556 HydrophobicContact CD1-CG 4.26Å; L547-R556 HydrophobicContact CG-CG 4.29Å; L547-V560 HydrophobicContact CD1-CG2 4.1Å; L547-F573 HydrophobicContact CB-CE1 3.81Å; L547-F573 HydrophobicContact CB-CZ 3.82Å; L547-F573 HydrophobicContact CD1-CE1 4.2Å; L547-F573 HydrophobicContact CD1-CZ 3.71Å; L547-F573 HydrophobicContact CG-CZ 4.43Å; L547-M574 PolarHBondContact N-O 3.4Å; L547-L575 WeakPolarHBondContact O-CA 3.45Å; L547-S576 PolarHBondContact O-N 2.71Å; L547-A579 HydrophobicContact CD2-CB 3.69Å; L547-L584 HydrophobicContact CD1-CD1 3.69Å; L547-L584 HydrophobicContact CD2-CD1 4.26Å
548	D	80.6	Confident	86	Confident	14 Å²	14	73 Å²	73	8%	0.075	39%	0.389	C	S	.	.			trans	-127.8	-177.7	173.6	70.1	17.4	0	0	0	112.4	R546 T550 M551 R556	R546-D548 IonicContact CZ-OD2 3.89Å; R546-D548 IonicContact NE-OD2 3.63Å; R546-D548 PolarHBondContact NE-OD2 2.95Å; R546-D548 IonicContact NH2-OD2 2.71Å; R546-D548 PolarHBondContact NH2-OD2 3.34Å; D548-T550 PolarHBondContact O-N 3.2Å; D548-T550 WeakPolarHBondContact OD1-CB 3.33Å; D548-T550 PolarHBondContact OD1-N 2.97Å; D548-T550 PolarHBondContact OD1-OG1 3.47Å; D548-M551 PolarHBondContact O-N 2.8Å; D548-R556 PolarHBondContact O-NH2 2.88Å
549	G	75.7	Confident	85.9	Confident	58 Å²	58	68 Å²	68	60%	0.598	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.4	-178.9	0	0	0	0	0	114.5	R556	G549-R556 PolarHBondContact O-NH2 3.05Å
550	T	78.3	Confident	85.7	Confident	121 Å²	121	64.6 Å²	64.6	74%	0.742	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.3	-175.6	73.4	0	0	0	0	112.8	D548	D548-T550 PolarHBondContact O-N 3.2Å; D548-T550 WeakPolarHBondContact OD1-CB 3.33Å; D548-T550 PolarHBondContact OD1-N 2.97Å; D548-T550 PolarHBondContact OD1-OG1 3.47Å
551	M	79.7	Confident	85.5	Confident	21 Å²	21	65.9 Å²	65.9	10%	0.103	36%	0.36	C	S	.	.	S	Bend	trans	-67.7	136	179.1	-71	-171.3	75.8	0	0	112.3	L547 D548 K555 R556 V559	L547-M551 HydrophobicContact CB-SD 4.26Å; L547-M551 HydrophobicContact CG-SD 4.17Å; D548-M551 PolarHBondContact O-N 2.8Å; M551-K555 HydrophobicContact CE-CB 3.96Å; M551-K555 HydrophobicContact CE-CD 3.66Å; M551-K555 HydrophobicContact CE-CG 3.49Å; M551-K555 VanDerWaalsContact CE-CG 3.49Å; M551-R556 HydrophobicContact CB-CG 3.71Å; M551-R556 VanDerWaalsContact O-CZ 3.32Å; M551-R556 PolarHBondContact O-NE 3.27Å; M551-R556 PolarHBondContact O-NH2 3.43Å; M551-V559 HydrophobicContact CE-CB 4.48Å; M551-V559 HydrophobicContact CE-CG1 3.84Å; M551-V559 HydrophobicContact CE-CG2 3.79Å
552	T	78.1	Confident	85.5	Confident	94 Å²	94	67.2 Å²	67.2	58%	0.577	35%	0.349	S	S	*	.			trans	-67.3	148.6	172.3	67.1	0	0	0	0	111.4	K554 K555 R556	T552-K554 VanDerWaalsContact C-N 3.27Å; T552-K554 PolarHBondContact O-N 2.82Å; T552-K555 PolarHBondContact O-N 2.67Å; T552-K555 WeakPolarHBondContact OG1-CB 3.04Å; T552-R556 WeakPolarHBondContact O-CG 3.3Å; T552-R556 PolarHBondContact O-N 3.49Å
553	I	72.4	Confident	85.3	Confident	63 Å²	63	65.9 Å²	65.9	32%	0.323	34%	0.344	S	S	.	.	H	α-helix	trans	-55.1	-40.9	-177.3	-61	170.9	0	0	0	111.9	D235 R556 A557	D235-I553 VanDerWaalsContact OD2-CD1 3.28Å; D235-I553 WeakPolarHBondContact OD2-CD1 3.14Å; I553-R556 WeakPolarHBondContact O-CB 3.49Å; I553-R556 PolarHBondContact O-N 3.01Å; I553-A557 PolarHBondContact O-N 3.35Å; I553-A557 VanDerWaalsContact O-N 3.14Å
554	K	77.1	Confident	85.2	Confident	172 Å²	172	63.7 Å²	63.7	75%	0.748	33%	0.332	S	S	*	.	H	α-helix	trans	-62.3	-44.2	177.7	-64	-173.8	-179.6	179.6	0	111.9	T552 K558	T552-K554 VanDerWaalsContact C-N 3.27Å; T552-K554 PolarHBondContact O-N 2.82Å; K554-K558 PolarHBondContact O-N 2.6Å
555	K	84.8	Confident	85	Confident	127 Å²	127	64.7 Å²	64.7	55%	0.552	34%	0.34	S	S	*	.	H	α-helix	trans	-67.2	-39.2	178	-163.5	-178.2	176.8	-178	0	110.9	M551 T552 A557 K558 V559	M551-K555 HydrophobicContact CE-CB 3.96Å; M551-K555 HydrophobicContact CE-CD 3.66Å; M551-K555 HydrophobicContact CE-CG 3.49Å; M551-K555 VanDerWaalsContact CE-CG 3.49Å; T552-K555 PolarHBondContact O-N 2.67Å; T552-K555 WeakPolarHBondContact OG1-CB 3.04Å; K555-A557 PolarHBondContact O-N 2.89Å; K555-K558 PolarHBondContact O-N 3.07Å; K555-V559 HydrophobicContact CG-CG1 4.49Å; K555-V559 WeakPolarHBondContact O-CG1 3.38Å; K555-V559 PolarHBondContact O-N 3.11Å
556	R	81.3	Confident	84.8	Confident	44 Å²	44	69.7 Å²	69.7	17%	0.166	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-48.2	175.9	-68.7	-177.8	-164.3	-170.4	4.8	112.2	L547 D548 G549 M551 T552 I553 K558 V559 V560	L547-R556 HydrophobicContact CD1-CB 4.33Å; L547-R556 HydrophobicContact CD1-CG 4.26Å; L547-R556 HydrophobicContact CG-CG 4.29Å; D548-R556 PolarHBondContact O-NH2 2.88Å; G549-R556 PolarHBondContact O-NH2 3.05Å; M551-R556 HydrophobicContact CB-CG 3.71Å; M551-R556 VanDerWaalsContact O-CZ 3.32Å; M551-R556 PolarHBondContact O-NE 3.27Å; M551-R556 PolarHBondContact O-NH2 3.43Å; T552-R556 WeakPolarHBondContact O-CG 3.3Å; T552-R556 PolarHBondContact O-N 3.49Å; I553-R556 WeakPolarHBondContact O-CB 3.49Å; I553-R556 PolarHBondContact O-N 3.01Å; R556-K558 PolarHBondContact O-N 3.14Å; R556-V559 VanDerWaalsContact O-CG2 3.22Å; R556-V559 WeakPolarHBondContact O-CG2 3.38Å; R556-V559 PolarHBondContact O-N 3.46Å; R556-V560 VanDerWaalsContact O-CG2 3.25Å; R556-V560 WeakPolarHBondContact O-CG2 3.39Å; R556-V560 PolarHBondContact O-N 3.36Å; R556-V560 VanDerWaalsContact O-N 3.16Å
557	A	80.5	Confident	84.7	Confident	52 Å²	52	72.9 Å²	72.9	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-46	178.9	0	0	0	0	0	112	I553 K555 V559 V560 E561	I553-A557 PolarHBondContact O-N 3.35Å; I553-A557 VanDerWaalsContact O-N 3.14Å; K555-A557 PolarHBondContact O-N 2.89Å; A557-V559 PolarHBondContact O-N 3.05Å; A557-V560 PolarHBondContact O-N 3.17Å; A557-E561 WeakPolarHBondContact O-CB 3.37Å; A557-E561 PolarHBondContact O-N 3.12Å
558	K	87.1	Confident	84.9	Confident	145 Å²	145	73.8 Å²	73.8	63%	0.63	40%	0.404	S	S	*	.	H	α-helix	trans	-60.9	-44.4	179.7	-174.4	177.2	179.1	178.6	0	112.6	K554 K555 R556 V560 E561 Q562	K554-K558 PolarHBondContact O-N 2.6Å; K555-K558 PolarHBondContact O-N 3.07Å; R556-K558 PolarHBondContact O-N 3.14Å; K558-V560 VanDerWaalsContact C-N 3.34Å; K558-E561 PolarHBondContact O-N 3.49Å; K558-Q562 WeakPolarHBondContact O-CB 3.26Å; K558-Q562 PolarHBondContact O-N 3.04Å
559	V	90.2	Very high	85.4	Confident	18 Å²	18	83.2 Å²	83.2	11%	0.109	44%	0.439	C	S	.	.	H	α-helix	trans	-69.8	-32.3	-179.5	-60.8	0	0	0	0	112.7	V545 M551 K555 R556 A557 F563	V545-V559 HydrophobicContact CG1-CB 3.76Å; V545-V559 HydrophobicContact CG1-CG1 4.26Å; V545-V559 HydrophobicContact CG1-CG2 4.05Å; M551-V559 HydrophobicContact CE-CB 4.48Å; M551-V559 HydrophobicContact CE-CG1 3.84Å; M551-V559 HydrophobicContact CE-CG2 3.79Å; K555-V559 HydrophobicContact CG-CG1 4.49Å; K555-V559 WeakPolarHBondContact O-CG1 3.38Å; K555-V559 PolarHBondContact O-N 3.11Å; R556-V559 VanDerWaalsContact O-CG2 3.22Å; R556-V559 WeakPolarHBondContact O-CG2 3.38Å; R556-V559 PolarHBondContact O-N 3.46Å; A557-V559 PolarHBondContact O-N 3.05Å; V559-F563 WeakPolarHBondContact O-CB 3.37Å; V559-F563 PolarHBondContact O-N 2.74Å
560	V	88.2	Confident	86.3	Confident	15 Å²	15	81.3 Å²	81.3	9%	0.091	42%	0.415	C	S	.	.	H	α-helix	trans	-69.9	-42.7	176	170	0	0	0	0	110.8	L547 R556 A557 K558 F563 N564 F573 L584 N585 L586	L547-V560 HydrophobicContact CD1-CG2 4.1Å; R556-V560 VanDerWaalsContact O-CG2 3.25Å; R556-V560 WeakPolarHBondContact O-CG2 3.39Å; R556-V560 PolarHBondContact O-N 3.36Å; R556-V560 VanDerWaalsContact O-N 3.16Å; A557-V560 PolarHBondContact O-N 3.17Å; K558-V560 VanDerWaalsContact C-N 3.34Å; V560-F563 PolarHBondContact O-N 3.45Å; V560-N564 WeakPolarHBondContact O-CB 3.44Å; V560-N564 PolarHBondContact O-N 2.74Å; V560-N564 PolarHBondContact O-ND2 2.82Å; V560-F573 HydrophobicContact CG2-CE2 4.29Å; V560-F573 HydrophobicContact CG2-CZ 4Å; V560-L584 HydrophobicContact CG2-CD2 4.22Å; V560-N585 WeakPolarHBondContact CG1-O 3.47Å; V560-L586 HydrophobicContact CG1-CD2 4.2Å; V560-L586 HydrophobicContact CG2-CD2 4.3Å
561	E	88.4	Confident	87.1	Confident	148 Å²	148	76.1 Å²	76.1	69%	0.692	38%	0.382	S	S	*	.	H	α-helix	trans	-61.5	-47.5	174.6	-174.2	174.3	-163.9	0	0	111.4	A557 K558 F563 N564 D565	A557-E561 WeakPolarHBondContact O-CB 3.37Å; A557-E561 PolarHBondContact O-N 3.12Å; K558-E561 PolarHBondContact O-N 3.49Å; E561-F563 VanDerWaalsContact C-N 3.33Å; E561-F563 PolarHBondContact O-N 2.69Å; E561-N564 PolarHBondContact O-N 2.92Å; E561-D565 PolarHBondContact O-N 2.88Å; E561-D565 VanDerWaalsContact O-N 3.09Å
562	Q	92.3	Very high	87.9	Confident	92 Å²	92	75.1 Å²	75.1	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-41.6	175.3	-178.1	-179.4	-21.8	0	0	112.1	K558 D565 S568 D570	K558-Q562 WeakPolarHBondContact O-CB 3.26Å; K558-Q562 PolarHBondContact O-N 3.04Å; Q562-D565 WeakPolarHBondContact O-CB 3.44Å; Q562-D565 PolarHBondContact O-N 3.32Å; Q562-S568 WeakPolarHBondContact O-CB 3.26Å; Q562-S568 PolarHBondContact O-OG 2.86Å; Q562-D570 PolarHBondContact NE2-OD2 2.91Å; Q562-D570 VanDerWaalsContact NE2-OD2 3.14Å
563	F	92.8	Very high	88.7	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-36.4	178.9	-176.6	-104.2	0	0	0	112.9	K519 V521 V559 V560 E561 D565 D570 F573 L586 A589	K519-F563 HydrophobicContact CB-CE2 4.04Å; K519-F563 HydrophobicContact CB-CZ 3.7Å; K519-F563 HydrophobicContact CD-CD2 4.28Å; K519-F563 HydrophobicContact CD-CE2 3.82Å; K519-F563 HydrophobicContact CD-CZ 4.02Å; K519-F563 HydrophobicContact CG-CE2 4.43Å; K519-F563 HydrophobicContact CG-CZ 4.47Å; K519-F563 PolarHBondContact NZ-O 2.91Å; V521-F563 HydrophobicContact CG2-CE1 4.22Å; V521-F563 HydrophobicContact CG2-CZ 4.43Å; V559-F563 WeakPolarHBondContact O-CB 3.37Å; V559-F563 PolarHBondContact O-N 2.74Å; V560-F563 PolarHBondContact O-N 3.45Å; E561-F563 VanDerWaalsContact C-N 3.33Å; E561-F563 PolarHBondContact O-N 2.69Å; F563-D565 VanDerWaalsContact C-N 3.27Å; F563-D565 PolarHBondContact O-N 2.92Å; F563-D570 HydrophobicContact CD2-CB 3.93Å; F563-D570 HydrophobicContact CE2-CB 4.46Å; F563-F573 HydrophobicContact CB-CD2 3.79Å; F563-F573 HydrophobicContact CB-CE2 4.14Å; F563-F573 HydrophobicContact CD1-CB 4.13Å; F563-F573 AromaticContact CD1-CD2 3.79Å; F563-F573 HydrophobicContact CD1-CD2 3.79Å; F563-F573 HydrophobicContact CD1-CG 4.21Å; F563-F573 HydrophobicContact CD2-CB 3.96Å; F563-F573 AromaticContact CD2-CD2 3.86Å; F563-F573 HydrophobicContact CD2-CD2 3.86Å; F563-F573 HydrophobicContact CD2-CG 4.41Å; F563-F573 HydrophobicContact CE1-CB 3.78Å; F563-F573 HydrophobicContact CE1-CD2 4.31Å; F563-F573 HydrophobicContact CE1-CG 4.29Å; F563-F573 HydrophobicContact CE2-CB 3.62Å; F563-F573 HydrophobicContact CE2-CD2 4.39Å; F563-F573 HydrophobicContact CG-CB 4.2Å; F563-F573 AromaticContact CG-CD2 3.52Å; F563-F573 HydrophobicContact CG-CD2 3.52Å; F563-F573 HydrophobicContact CG-CE2 4.31Å; F563-F573 HydrophobicContact CG-CG 4.26Å; F563-F573 HydrophobicContact CZ-CB 3.5Å; F563-F573 VanDerWaalsContact CZ-CB 3.5Å; F563-F573 HydrophobicContact CZ-CG 4.43Å; F563-L586 HydrophobicContact CD1-CD2 4.23Å; F563-A589 HydrophobicContact CE1-CB 3.72Å; F563-A589 HydrophobicContact CZ-CB 3.89Å
564	N	91.3	Very high	89.8	Confident	37 Å²	37	67.6 Å²	67.6	20%	0.198	33%	0.334	C	S	.	.	H	α-helix	trans	-72	-20.4	177.4	-74.8	-28.9	0	0	0	113.4	V560 E561 P566 N585 L586 I587 G588	V560-N564 WeakPolarHBondContact O-CB 3.44Å; V560-N564 PolarHBondContact O-N 2.74Å; V560-N564 PolarHBondContact O-ND2 2.82Å; E561-N564 PolarHBondContact O-N 2.92Å; N564-P566 WeakPolarHBondContact O-CD 3.3Å; N564-N585 PolarHBondContact ND2-O 3.25Å; N564-L586 WeakPolarHBondContact OD1-CA 3.43Å; N564-I587 PolarHBondContact OD1-N 3.26Å; N564-G588 PolarHBondContact OD1-N 3.4Å
565	D	92.1	Very high	90.5	Very high	71 Å²	71	59.4 Å²	59.4	38%	0.38	30%	0.298	S	S	.	.	S	Bend	trans	-64.7	120.2	172.4	-170.3	-19.9	0	0	0	110.5	K519 E561 Q562 F563 T567 S568	K519-D565 PolarHBondContact NZ-O 3.31Å; E561-D565 PolarHBondContact O-N 2.88Å; E561-D565 VanDerWaalsContact O-N 3.09Å; Q562-D565 WeakPolarHBondContact O-CB 3.44Å; Q562-D565 PolarHBondContact O-N 3.32Å; F563-D565 VanDerWaalsContact C-N 3.27Å; F563-D565 PolarHBondContact O-N 2.92Å; D565-T567 PolarHBondContact O-N 3.44Å; D565-T567 VanDerWaalsContact O-N 3.14Å; D565-T567 WeakPolarHBondContact OD1-CB 3.33Å; D565-T567 WeakPolarHBondContact OD1-CG2 3.49Å; D565-T567 PolarHBondContact OD1-N 2.87Å; D565-T567 PolarHBondContact OD1-OG1 2.97Å; D565-T567 PolarHBondContact OD2-OG1 3.31Å; D565-S568 WeakPolarHBondContact O-CB 3.41Å; D565-S568 PolarHBondContact O-N 3.04Å; D565-S568 VanDerWaalsContact O-N 3.09Å
566	P	89.7	Confident	90.6	Very high	122 Å²	122	54 Å²	54	79%	0.792	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.8	175.9	-24	35	0	0	0	113.8	N564 S568	N564-P566 WeakPolarHBondContact O-CD 3.3Å; P566-S568 VanDerWaalsContact C-N 3.33Å
567	T	91	Very high	90.6	Very high	116 Å²	116	52.1 Å²	52.1	71%	0.712	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-13.4	179.6	70.8	0	0	0	0	113.5	D565	D565-T567 PolarHBondContact O-N 3.44Å; D565-T567 VanDerWaalsContact O-N 3.14Å; D565-T567 WeakPolarHBondContact OD1-CB 3.33Å; D565-T567 WeakPolarHBondContact OD1-CG2 3.49Å; D565-T567 PolarHBondContact OD1-N 2.87Å; D565-T567 PolarHBondContact OD1-OG1 2.97Å; D565-T567 PolarHBondContact OD2-OG1 3.31Å
568	S	91.5	Very high	90.2	Very high	20 Å²	20	57.5 Å²	57.5	14%	0.14	28%	0.284	C	S	.	.			trans	-65.8	138.6	178.6	163.8	0	0	0	0	111.8	Q562 D565 P566 D570	Q562-S568 WeakPolarHBondContact O-CB 3.26Å; Q562-S568 PolarHBondContact O-OG 2.86Å; D565-S568 WeakPolarHBondContact O-CB 3.41Å; D565-S568 PolarHBondContact O-N 3.04Å; D565-S568 VanDerWaalsContact O-N 3.09Å; P566-S568 VanDerWaalsContact C-N 3.33Å; S568-D570 PolarHBondContact O-N 3.24Å; S568-D570 VanDerWaalsContact OG-CB 3.31Å; S568-D570 WeakPolarHBondContact OG-CB 3.37Å; S568-D570 PolarHBondContact OG-N 3.21Å; S568-D570 PolarHBondContact OG-OD2 3.5Å
569	R	91.8	Very high	89.5	Confident	211 Å²	211	50.9 Å²	50.9	80%	0.796	26%	0.256	S	S	*	.			trans	-79	-2.9	176.6	-59	-177.8	-179.4	179.2	-0.5	113.3	N543 F571	N543-R569 WeakPolarHBondContact CB-O 3.21Å; N543-R569 PolarHBondContact ND2-O 2.99Å; N543-R569 VanDerWaalsContact ND2-O 3.11Å; R569-F571 PolarHBondContact O-N 3.33Å
570	D	93.6	Very high	88	Confident	19 Å²	19	50 Å²	50	10%	0.102	25%	0.251	C	S	.	.			trans	-70	119.9	-178.7	-58.6	-41.8	0	0	0	109.6	K519 V545 Q562 F563 S568	K519-D570 WeakPolarHBondContact CD-O 3.46Å; K519-D570 WeakPolarHBondContact CE-O 3.47Å; V545-D570 HydrophobicContact CG2-CB 4.21Å; Q562-D570 PolarHBondContact NE2-OD2 2.91Å; Q562-D570 VanDerWaalsContact NE2-OD2 3.14Å; F563-D570 HydrophobicContact CD2-CB 3.93Å; F563-D570 HydrophobicContact CE2-CB 4.46Å; S568-D570 PolarHBondContact O-N 3.24Å; S568-D570 VanDerWaalsContact OG-CB 3.31Å; S568-D570 WeakPolarHBondContact OG-CB 3.37Å; S568-D570 PolarHBondContact OG-N 3.21Å; S568-D570 PolarHBondContact OG-OD2 3.5Å
571	F	95.9	Very high	86.6	Confident	11 Å²	11	49.9 Å²	49.9	5%	0.048	25%	0.252	C	S	.	.			trans	-94.7	-41.2	-178	173.8	-126.9	0	0	0	111.4	L509 I512 K513 D518 K519 V520 Y542 N543 R569	L509-F571 HydrophobicContact CB-CE1 4.47Å; L509-F571 HydrophobicContact CD2-CE1 4.27Å; L509-F571 HydrophobicContact CD2-CZ 4.46Å; I512-F571 HydrophobicContact CB-CZ 4.23Å; I512-F571 HydrophobicContact CG2-CE2 3.81Å; I512-F571 HydrophobicContact CG2-CZ 3.92Å; K513-F571 HydrophobicContact CB-CE1 4.05Å; K513-F571 HydrophobicContact CB-CE2 4.37Å; K513-F571 HydrophobicContact CB-CZ 3.8Å; K513-F571 HydrophobicContact CD-CD1 4.25Å; K513-F571 HydrophobicContact CD-CD2 4.17Å; K513-F571 HydrophobicContact CD-CE1 4.26Å; K513-F571 HydrophobicContact CD-CE2 4.15Å; K513-F571 HydrophobicContact CD-CG 4.24Å; K513-F571 HydrophobicContact CD-CZ 4.21Å; K513-F571 HydrophobicContact CG-CE1 4.49Å; D518-F571 WeakPolarHBondContact O-CD2 3.26Å; D518-F571 WeakPolarHBondContact O-CE2 3.03Å; K519-F571 WeakPolarHBondContact CA-O 3.48Å; V520-F571 HydrophobicContact CG2-CE2 3.98Å; V520-F571 HydrophobicContact CG2-CZ 3.99Å; V520-F571 PolarHBondContact N-O 3.39Å; Y542-F571 HydrophobicContact CD1-CD1 4.09Å; Y542-F571 HydrophobicContact CD1-CE1 4.32Å; Y542-F571 HydrophobicContact CD2-CD1 4.34Å; Y542-F571 HydrophobicContact CD2-CE1 4.29Å; Y542-F571 HydrophobicContact CE1-CE1 4.5Å; Y542-F571 HydrophobicContact CE2-CE1 4.46Å; Y542-F571 AromaticContact CG-CD1 3.91Å; Y542-F571 HydrophobicContact CG-CD1 3.91Å; Y542-F571 HydrophobicContact CG-CE1 4.22Å; N543-F571 PolarHBondContact O-N 2.95Å; R569-F571 PolarHBondContact O-N 3.33Å
572	V	96.5	Very high	85.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.5	-174.8	179.9	0	0	0	0	111.4	L509 V520 L522 N543 F544 V545 M574	L509-V572 HydrophobicContact CD2-CG2 4.32Å; V520-V572 CarbonylContact O-C 3.6Å; V520-V572 WeakPolarHBondContact O-CA 3.39Å; L522-V572 HydrophobicContact CB-CG1 4.47Å; L522-V572 HydrophobicContact CD1-CG1 3.57Å; L522-V572 HydrophobicContact CG-CG1 3.72Å; N543-V572 PolarHBondContact O-N 2.74Å; N543-V572 VanDerWaalsContact O-N 3.13Å; F544-V572 CarbonylContact C-O 3.59Å; F544-V572 WeakPolarHBondContact CA-O 3.5Å; F544-V572 HydrophobicContact CB-CB 3.95Å; F544-V572 HydrophobicContact CB-CG1 4.45Å; V545-V572 PolarHBondContact N-O 3.33Å; V572-M574 HydrophobicContact CG1-CE 3.96Å; V572-M574 HydrophobicContact CG1-CG 3.85Å
573	F	95	Very high	84	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.8	169.2	-166.4	-77.1	0	0	0	110	V520 V521 L522 V545 L547 V560 F563 L575 L586	V520-F573 PolarHBondContact O-N 3.17Å; V521-F573 CarbonylContact C-O 3.59Å; V521-F573 VanDerWaalsContact CA-O 3.29Å; V521-F573 WeakPolarHBondContact CA-O 3.46Å; V521-F573 HydrophobicContact CG2-CB 4.24Å; L522-F573 PolarHBondContact N-O 3.05Å; V545-F573 HydrophobicContact CB-CD2 4.02Å; V545-F573 HydrophobicContact CB-CE2 4.35Å; V545-F573 HydrophobicContact CG1-CD2 4.02Å; V545-F573 HydrophobicContact CG1-CE2 3.83Å; V545-F573 CarbonylContact O-C 3.52Å; V545-F573 WeakPolarHBondContact O-CA 3.41Å; L547-F573 HydrophobicContact CB-CE1 3.81Å; L547-F573 HydrophobicContact CB-CZ 3.82Å; L547-F573 HydrophobicContact CD1-CE1 4.2Å; L547-F573 HydrophobicContact CD1-CZ 3.71Å; L547-F573 HydrophobicContact CG-CZ 4.43Å; V560-F573 HydrophobicContact CG2-CE2 4.29Å; V560-F573 HydrophobicContact CG2-CZ 4Å; F563-F573 HydrophobicContact CB-CD2 3.79Å; F563-F573 HydrophobicContact CB-CE2 4.14Å; F563-F573 HydrophobicContact CD1-CB 4.13Å; F563-F573 AromaticContact CD1-CD2 3.79Å; F563-F573 HydrophobicContact CD1-CD2 3.79Å; F563-F573 HydrophobicContact CD1-CG 4.21Å; F563-F573 HydrophobicContact CD2-CB 3.96Å; F563-F573 AromaticContact CD2-CD2 3.86Å; F563-F573 HydrophobicContact CD2-CD2 3.86Å; F563-F573 HydrophobicContact CD2-CG 4.41Å; F563-F573 HydrophobicContact CE1-CB 3.78Å; F563-F573 HydrophobicContact CE1-CD2 4.31Å; F563-F573 HydrophobicContact CE1-CG 4.29Å; F563-F573 HydrophobicContact CE2-CB 3.62Å; F563-F573 HydrophobicContact CE2-CD2 4.39Å; F563-F573 HydrophobicContact CG-CB 4.2Å; F563-F573 AromaticContact CG-CD2 3.52Å; F563-F573 HydrophobicContact CG-CD2 3.52Å; F563-F573 HydrophobicContact CG-CE2 4.31Å; F563-F573 HydrophobicContact CG-CG 4.26Å; F563-F573 HydrophobicContact CZ-CB 3.5Å; F563-F573 VanDerWaalsContact CZ-CB 3.5Å; F563-F573 HydrophobicContact CZ-CG 4.43Å; F573-L575 HydrophobicContact CD1-CD2 3.9Å; F573-L575 HydrophobicContact CE1-CB 4.27Å; F573-L575 HydrophobicContact CE1-CD2 4.25Å; F573-L586 HydrophobicContact CD1-CD1 3.94Å; F573-L586 HydrophobicContact CD1-CD2 4.23Å; F573-L586 HydrophobicContact CD2-CD2 4.29Å; F573-L586 HydrophobicContact CE1-CD1 3.98Å; F573-L586 HydrophobicContact CE1-CD2 3.99Å; F573-L586 HydrophobicContact CE2-CD2 4.03Å; F573-L586 HydrophobicContact CG-CD2 4.37Å; F573-L586 HydrophobicContact CZ-CD2 3.87Å
574	M	94.4	Very high	83.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130	-179.4	-53.9	175.3	-171.5	0	0	109.6	L522 L530 F533 E534 C537 F544 V545 L547 V572	L522-M574 HydrophobicContact CB-CG 4.4Å; L522-M574 CarbonylContact O-C 3.58Å; L522-M574 WeakPolarHBondContact O-CA 3.31Å; L530-M574 HydrophobicContact CD2-CB 4.31Å; F533-M574 HydrophobicContact CB-CE 3.82Å; F533-M574 HydrophobicContact CB-SD 3.73Å; F533-M574 WeakPolarHBondContact O-CE 3.34Å; E534-M574 HydrophobicContact CG-CE 4.39Å; E534-M574 HydrophobicContact CG-SD 3.79Å; C537-M574 HydrophobicContact CB-CE 3.96Å; C537-M574 WeakPolarHBondContact SG-CE 3.28Å; F544-M574 HydrophobicContact CB-CE 3.72Å; F544-M574 HydrophobicContact CD1-CE 4.38Å; F544-M574 HydrophobicContact CD2-CE 3.72Å; F544-M574 HydrophobicContact CD2-SD 4.03Å; F544-M574 HydrophobicContact CE2-CE 4.47Å; F544-M574 HydrophobicContact CG-CE 3.68Å; V545-M574 PolarHBondContact O-N 2.78Å; L547-M574 PolarHBondContact N-O 3.4Å; V572-M574 HydrophobicContact CG1-CE 3.96Å; V572-M574 HydrophobicContact CG1-CG 3.85Å
575	L	91.5	Very high	82.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.7	171.7	63.6	146	0	0	0	112.3	V521 L522 I523 S524 L547 F573 L586	V521-L575 HydrophobicContact CG1-CD2 3.15Å; L522-L575 PolarHBondContact O-N 3.46Å; I523-L575 WeakPolarHBondContact CA-O 3.25Å; I523-L575 HydrophobicContact CD1-CD1 3.96Å; I523-L575 HydrophobicContact CD1-CD2 3.99Å; I523-L575 HydrophobicContact CD1-CG 4.1Å; I523-L575 HydrophobicContact CG1-CD1 4.28Å; I523-L575 HydrophobicContact CG1-CD2 3.72Å; I523-L575 HydrophobicContact CG1-CG 3.86Å; I523-L575 HydrophobicContact CG2-CG 4.41Å; S524-L575 PolarHBondContact N-O 3.02Å; L547-L575 WeakPolarHBondContact O-CA 3.45Å; F573-L575 HydrophobicContact CD1-CD2 3.9Å; F573-L575 HydrophobicContact CE1-CB 4.27Å; F573-L575 HydrophobicContact CE1-CD2 4.25Å; L575-L586 HydrophobicContact CD2-CD1 4.04Å
576	S	88.1	Confident	82.6	Confident	13 Å²	13	39.5 Å²	39.5	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	140.3	163.4	66.2	0	0	0	0	109.8	S524 L547 K578 A579 G580	S524-S576 CarbonylContact O-C 3.51Å; S524-S576 VanDerWaalsContact O-CA 3.23Å; S524-S576 WeakPolarHBondContact O-CA 3.13Å; L547-S576 PolarHBondContact O-N 2.71Å; S576-K578 PolarHBondContact O-N 2.79Å; S576-K578 VanDerWaalsContact O-N 3.13Å; S576-A579 CarbonylContact O-C 3.55Å; S576-A579 WeakPolarHBondContact O-CA 3.23Å; S576-A579 PolarHBondContact O-N 2.92Å; S576-A579 WeakPolarHBondContact OG-CB 3.43Å; S576-A579 PolarHBondContact OG-N 3.43Å; S576-G580 PolarHBondContact O-N 2.6Å
577	S	80.2	Confident	82.6	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.028	18%	0.183	C	C	.	.	H	α-helix	trans	-53.3	-39.1	179.9	-46	0	0	0	0	112.2	I523 S524 N525 G580 G581	I523-S577 VanDerWaalsContact CG2-OG 3.26Å; I523-S577 WeakPolarHBondContact CG2-OG 3.35Å; S524-S577 PolarHBondContact O-N 3.3Å; S524-S577 PolarHBondContact O-OG 2.96Å; N525-S577 WeakPolarHBondContact OD1-CB 3.15Å; N525-S577 PolarHBondContact OD1-OG 2.96Å; S577-G580 WeakPolarHBondContact O-CA 3.41Å; S577-G580 PolarHBondContact O-N 3.39Å; S577-G580 VanDerWaalsContact O-N 3.17Å; S577-G581 PolarHBondContact O-N 2.96Å; S577-G581 VanDerWaalsContact O-N 3.11Å
578	K	73.7	Confident	82.6	Confident	165 Å²	165	31.5 Å²	31.5	72%	0.717	16%	0.162	S	C	*	.	H	α-helix	trans	-65.9	-37.8	176.5	-65.4	-176.7	-179.6	178	0	113.3	S576 G580	S576-K578 PolarHBondContact O-N 2.79Å; S576-K578 VanDerWaalsContact O-N 3.13Å; K578-G580 VanDerWaalsContact C-N 3.34Å
579	A	70.4	Confident	82.7	Confident	7 Å²	7	30.6 Å²	30.6	6%	0.058	16%	0.155	C	C	.	.	H	α-helix	trans	-74.6	-27.6	172.9	0	0	0	0	0	112	L547 S576 G581 C582	L547-A579 HydrophobicContact CD2-CB 3.69Å; S576-A579 CarbonylContact O-C 3.55Å; S576-A579 WeakPolarHBondContact O-CA 3.23Å; S576-A579 PolarHBondContact O-N 2.92Å; S576-A579 WeakPolarHBondContact OG-CB 3.43Å; S576-A579 PolarHBondContact OG-N 3.43Å; A579-G581 VanDerWaalsContact C-N 3.26Å; A579-G581 PolarHBondContact O-N 2.88Å; A579-C582 VanDerWaalsContact O-CB 3.27Å; A579-C582 WeakPolarHBondContact O-CB 3.45Å; A579-C582 PolarHBondContact O-N 3.44Å; A579-C582 PolarHBondContact O-SG 3.2Å
580	G	59.9	Low	82.8	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-28.4	172.1	0	0	0	0	0	113.8	S576 S577 K578 C582 R610	S576-G580 PolarHBondContact O-N 2.6Å; S577-G580 WeakPolarHBondContact O-CA 3.41Å; S577-G580 PolarHBondContact O-N 3.39Å; S577-G580 VanDerWaalsContact O-N 3.17Å; K578-G580 VanDerWaalsContact C-N 3.34Å; G580-C582 PolarHBondContact O-N 2.69Å; G580-R610 PolarHBondContact O-NE 3.12Å; G580-R610 PolarHBondContact O-NH2 3.49Å
581	G	59.1	Low	82.9	Confident	11 Å²	11	20.2 Å²	20.2	11%	0.113	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-21	176.1	0	0	0	0	0	114.6	S577 A579 G583 Q606 R610	S577-G581 PolarHBondContact O-N 2.96Å; S577-G581 VanDerWaalsContact O-N 3.11Å; A579-G581 VanDerWaalsContact C-N 3.26Å; A579-G581 PolarHBondContact O-N 2.88Å; G581-G583 VanDerWaalsContact C-N 3.28Å; G581-G583 PolarHBondContact O-N 2.99Å; G581-Q606 VanDerWaalsContact CA-CD 3.45Å; G581-Q606 VanDerWaalsContact CA-OE1 3.23Å; G581-Q606 PolarHBondContact O-NE2 3.4Å; G581-R610 PolarHBondContact O-NH2 3.22Å; G581-R610 VanDerWaalsContact O-NH2 3.11Å
582	C	60.8	Low	82.9	Confident	27 Å²	27	19.7 Å²	19.7	18%	0.182	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	16.4	-167.8	-70	0	0	0	0	117.9	S212 L213 A579 G580	S212-C582 WeakPolarHBondContact CB-SG 3.39Å; S212-C582 VanDerWaalsContact OG-CB 3.28Å; S212-C582 WeakPolarHBondContact OG-CB 3.32Å; S212-C582 PolarHBondContact OG-SG 3.02Å; L213-C582 VanDerWaalsContact CD2-O 3.25Å; L213-C582 WeakPolarHBondContact CD2-O 3.24Å; A579-C582 VanDerWaalsContact O-CB 3.27Å; A579-C582 WeakPolarHBondContact O-CB 3.45Å; A579-C582 PolarHBondContact O-N 3.44Å; A579-C582 PolarHBondContact O-SG 3.2Å; G580-C582 PolarHBondContact O-N 2.69Å
583	G	64.3	Low	82.8	Confident	16 Å²	16	19.7 Å²	19.7	17%	0.165	11%	0.113	C	C	.	.			trans	95.9	-1.1	176.8	0	0	0	0	0	117.1	L213 G581 R613	L213-G583 VanDerWaalsContact CD2-CA 3.45Å; G581-G583 VanDerWaalsContact C-N 3.28Å; G581-G583 PolarHBondContact O-N 2.99Å; G583-R613 PolarHBondContact O-NH1 2.7Å
584	L	76	Confident	82.8	Confident	27 Å²	27	19.8 Å²	19.8	14%	0.141	11%	0.114	C	C	.	.			trans	-60.6	146.5	-169.2	-56.8	177.8	0	0	0	113.5	L547 V560 R610 R613	L547-L584 HydrophobicContact CD1-CD1 3.69Å; L547-L584 HydrophobicContact CD2-CD1 4.26Å; V560-L584 HydrophobicContact CG2-CD2 4.22Å; L584-R610 WeakPolarHBondContact O-CD 3.25Å; L584-R613 PolarHBondContact O-NH1 3.37Å; L584-R613 VanDerWaalsContact O-NH1 3.13Å
585	N	82.8	Confident	82.9	Confident	60 Å²	60	19.9 Å²	19.9	32%	0.321	11%	0.114	S	C	.	.			trans	-111.8	111.2	172.8	-165.6	20.4	0	0	0	108.9	V560 N564 I587	V560-N585 WeakPolarHBondContact CG1-O 3.47Å; N564-N585 PolarHBondContact ND2-O 3.25Å; N585-I587 WeakPolarHBondContact OD1-CG2 2.97Å
586	L	87.8	Confident	83	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.114	C	C	.	.			trans	-117.4	45.1	-175.6	-62.5	175.6	0	0	0	111	V521 V560 F563 N564 F573 L575 G588 A589 R610 V611	V521-L586 HydrophobicContact CG1-CD1 4.15Å; V521-L586 HydrophobicContact CG2-CB 4.34Å; V521-L586 HydrophobicContact CG2-CD1 4.12Å; V560-L586 HydrophobicContact CG1-CD2 4.2Å; V560-L586 HydrophobicContact CG2-CD2 4.3Å; F563-L586 HydrophobicContact CD1-CD2 4.23Å; N564-L586 WeakPolarHBondContact OD1-CA 3.43Å; F573-L586 HydrophobicContact CD1-CD1 3.94Å; F573-L586 HydrophobicContact CD1-CD2 4.23Å; F573-L586 HydrophobicContact CD2-CD2 4.29Å; F573-L586 HydrophobicContact CE1-CD1 3.98Å; F573-L586 HydrophobicContact CE1-CD2 3.99Å; F573-L586 HydrophobicContact CE2-CD2 4.03Å; F573-L586 HydrophobicContact CG-CD2 4.37Å; F573-L586 HydrophobicContact CZ-CD2 3.87Å; L575-L586 HydrophobicContact CD2-CD1 4.04Å; L586-G588 PolarHBondContact O-N 3.14Å; L586-A589 PolarHBondContact O-N 3.3Å; L586-R610 HydrophobicContact CD1-CB 4.38Å; L586-R610 PolarHBondContact N-O 3.34Å; L586-V611 HydrophobicContact CB-CG2 4.38Å
587	I	90.3	Very high	83.1	Confident	45 Å²	45	19.3 Å²	19.3	23%	0.231	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-14	-178.3	53	164.7	0	0	0	114	N564 N585 A589 R613 Q616	N564-I587 PolarHBondContact OD1-N 3.26Å; N585-I587 WeakPolarHBondContact OD1-CG2 2.97Å; I587-A589 PolarHBondContact O-N 3.14Å; I587-R613 HydrophobicContact CG2-CB 4.22Å; I587-Q616 HydrophobicContact CG2-CB 4.42Å; I587-Q616 PolarHBondContact O-NE2 3.49Å
588	G	90.7	Very high	83.5	Confident	26 Å²	26	20.3 Å²	20.3	27%	0.268	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-22.9	172.4	0	0	0	0	0	113.4	N564 L586	N564-G588 PolarHBondContact OD1-N 3.4Å; L586-G588 PolarHBondContact O-N 3.14Å
589	A	94.1	Very high	83.9	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.093	C	C	.	.			trans	-92.1	156.4	169.7	0	0	0	0	0	111.5	K519 V521 F563 L586 I587 V611 Q616	K519-A589 HydrophobicContact CB-CB 4.22Å; K519-A589 WeakPolarHBondContact O-CA 3.07Å; K519-A589 WeakPolarHBondContact O-CB 3.5Å; V521-A589 HydrophobicContact CG2-CB 3.43Å; V521-A589 VanDerWaalsContact CG2-CB 3.43Å; F563-A589 HydrophobicContact CE1-CB 3.72Å; F563-A589 HydrophobicContact CZ-CB 3.89Å; L586-A589 PolarHBondContact O-N 3.3Å; I587-A589 PolarHBondContact O-N 3.14Å; A589-V611 HydrophobicContact CB-CG2 4.39Å; A589-V611 WeakPolarHBondContact O-CG1 3.37Å; A589-Q616 PolarHBondContact O-NE2 3.01Å
590	N	93.8	Very high	84.4	Confident	5 Å²	5	17.1 Å²	17.1	3%	0.027	10%	0.1	C	C	.	.			trans	-128.3	-7.1	171.4	70.3	-61.2	0	0	0	112.2	D518 K519 K618 Q619 C620 Y621	D518-N590 WeakPolarHBondContact CA-OD1 3.3Å; D518-N590 WeakPolarHBondContact CB-OD1 3.5Å; D518-N590 VanDerWaalsContact CG-CG 3.44Å; D518-N590 PolarHBondContact OD1-ND2 3.2Å; D518-N590 PolarHBondContact OD1-OD1 3.47Å; D518-N590 PolarHBondContact OD2-ND2 3.37Å; K519-N590 PolarHBondContact O-N 3.31Å; N590-K618 HydrophobicContact CB-CB 3.84Å; N590-K618 HydrophobicContact CB-CD 4.17Å; N590-Q619 PolarHBondContact ND2-O 3.09Å; N590-C620 CarbonylContact O-C 3.59Å; N590-C620 VanDerWaalsContact O-CA 3.22Å; N590-C620 WeakPolarHBondContact O-CA 3.34Å; N590-Y621 PolarHBondContact O-N 3.4Å
591	R	95.5	Very high	85.4	Confident	7 Å²	7	17.6 Å²	17.6	3%	0.026	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.5	175.8	-59.4	-169.1	-178.2	-105.4	-0.9	110	D518 K519 V520 V521 Y621 Y623 D721	D518-R591 HydrophobicContact CB-CG 4.43Å; D518-R591 IonicContact OD2-CZ 2.78Å; D518-R591 IonicContact OD2-NE 3.4Å; D518-R591 PolarHBondContact OD2-NE 3.28Å; D518-R591 IonicContact OD2-NH2 2.85Å; D518-R591 PolarHBondContact OD2-NH2 3.09Å; K519-R591 PolarHBondContact O-N 3.48Å; V520-R591 CarbonylContact C-O 3.58Å; V520-R591 WeakPolarHBondContact CA-O 3.08Å; V520-R591 HydrophobicContact CG2-CB 4.31Å; V521-R591 PolarHBondContact N-O 3.13Å; R591-Y621 CarbonylContact C-O 3.54Å; R591-Y621 WeakPolarHBondContact CA-O 3.4Å; R591-Y621 HydrophobicContact CG-CD2 4.12Å; R591-Y621 HydrophobicContact CG-CG 4.5Å; R591-Y623 HydrophobicContact CB-CE2 4.23Å; R591-Y623 PolarHBondContact NH1-OH 3.08Å; R591-D721 IonicContact CZ-OD1 3.57Å; R591-D721 IonicContact NH1-OD1 2.79Å; R591-D721 PolarHBondContact NH1-OD1 3.39Å; R591-D721 IonicContact NH1-OD2 2.71Å
592	L	95.3	Very high	86.4	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.3	178.5	-175.8	151.7	0	0	0	109.6	V521 I523 M594 M608 V611 Y621 I622 Y623	V521-L592 HydrophobicContact CB-CB 4.43Å; V521-L592 HydrophobicContact CB-CD1 4.49Å; V521-L592 HydrophobicContact CB-CG 4.3Å; V521-L592 HydrophobicContact CG1-CD1 4.18Å; V521-L592 HydrophobicContact CG1-CG 4.23Å; V521-L592 CarbonylContact O-C 3.58Å; V521-L592 WeakPolarHBondContact O-CA 3.15Å; I523-L592 HydrophobicContact CD1-CD1 3.63Å; I523-L592 HydrophobicContact CD1-CD2 4.01Å; I523-L592 HydrophobicContact CD1-CG 3.94Å; I523-L592 HydrophobicContact CG1-CD1 4.45Å; I523-L592 HydrophobicContact CG1-CD2 4.34Å; I523-L592 HydrophobicContact CG1-CG 4.27Å; L592-M594 HydrophobicContact CD2-CB 4.38Å; L592-M608 HydrophobicContact CD2-CG 4.16Å; L592-V611 HydrophobicContact CB-CG2 4.19Å; L592-V611 HydrophobicContact CD1-CB 4.34Å; L592-V611 HydrophobicContact CD1-CG2 3.73Å; L592-Y621 PolarHBondContact N-O 2.82Å; L592-I622 HydrophobicContact CD2-CG2 4.12Å; L592-I622 CarbonylContact O-C 3.58Å; L592-I622 WeakPolarHBondContact O-CA 3.18Å; L592-Y623 WeakPolarHBondContact O-CD2 3.35Å; L592-Y623 PolarHBondContact O-N 2.54Å
593	V	96.2	Very high	87.3	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	111.4	174.3	-172.7	0	0	0	0	108.9	L505 L508 V520 V521 L522 I523 Y623 L625	L505-V593 HydrophobicContact CD1-CG1 4.13Å; L505-V593 HydrophobicContact CD1-CG2 4.41Å; L508-V593 HydrophobicContact CD2-CG2 3.66Å; V520-V593 HydrophobicContact CG1-CG2 4.07Å; V521-V593 PolarHBondContact O-N 3.03Å; L522-V593 HydrophobicContact CD2-CB 3.66Å; L522-V593 HydrophobicContact CD2-CG1 4.45Å; L522-V593 HydrophobicContact CD2-CG2 3.82Å; I523-V593 PolarHBondContact N-O 2.93Å; V593-Y623 CarbonylContact C-O 3.48Å; V593-Y623 WeakPolarHBondContact CA-O 3.3Å; V593-Y623 HydrophobicContact CG2-CD2 3.87Å; V593-Y623 HydrophobicContact CG2-CG 4.48Å; V593-L625 HydrophobicContact CG1-CD1 3.91Å; V593-L625 HydrophobicContact CG1-CG 3.95Å
594	M	94.5	Very high	88.3	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.01	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	105.3	165.7	-172.9	63.2	68.8	0	0	108.2	I523 L592 D604 A607 M608 Y623 R624 L625	I523-M594 HydrophobicContact CB-CE 4.07Å; I523-M594 HydrophobicContact CB-SD 3.88Å; I523-M594 HydrophobicContact CD1-CE 4.17Å; I523-M594 HydrophobicContact CG2-CE 3.85Å; I523-M594 HydrophobicContact CG2-SD 3.71Å; L592-M594 HydrophobicContact CD2-CB 4.38Å; M594-D604 HydrophobicContact CE-CB 4.41Å; M594-A607 HydrophobicContact CE-CB 3.76Å; M594-M608 HydrophobicContact CE-CG 4.09Å; M594-Y623 PolarHBondContact N-O 3.18Å; M594-R624 HydrophobicContact CB-CG 4.23Å; M594-L625 PolarHBondContact O-N 3.14Å
595	F	95.7	Very high	88.6	Confident	1 Å²	1	19 Å²	19	0%	0.004	10%	0.104	C	C	.	.			trans	-81.3	-28.6	-170.7	-170.2	-98.9	0	0	0	114	N457 K501 F502 L505 I523 T529 F533 L625	N457-F595 HydrophobicContact CB-CE1 3.84Å; K501-F595 HydrophobicContact CB-CE2 3.78Å; K501-F595 HydrophobicContact CB-CZ 3.63Å; K501-F595 PolarHBondContact NZ-O 3.11Å; F502-F595 HydrophobicContact CD2-CE1 4.16Å; F502-F595 HydrophobicContact CD2-CE2 4.11Å; F502-F595 AromaticContact CD2-CZ 3.36Å; F502-F595 HydrophobicContact CD2-CZ 3.36Å; F502-F595 AromaticContact CE2-CE1 3.72Å; F502-F595 HydrophobicContact CE2-CE1 3.72Å; F502-F595 HydrophobicContact CE2-CE2 4.21Å; F502-F595 AromaticContact CE2-CZ 3.34Å; F502-F595 HydrophobicContact CE2-CZ 3.34Å; F502-F595 HydrophobicContact CG-CZ 4.27Å; F502-F595 HydrophobicContact CZ-CZ 4.27Å; L505-F595 HydrophobicContact CB-CE2 4.24Å; L505-F595 HydrophobicContact CD2-CD2 3.97Å; L505-F595 HydrophobicContact CD2-CE2 3.89Å; I523-F595 WeakPolarHBondContact O-CB 3.37Å; I523-F595 PolarHBondContact O-N 3.13Å; T529-F595 HydrophobicContact CG2-CD1 3.71Å; T529-F595 HydrophobicContact CG2-CE1 3.8Å; F533-F595 HydrophobicContact CE1-CD1 4.28Å; F533-F595 AromaticContact CE1-CD2 3.94Å; F533-F595 HydrophobicContact CE1-CD2 3.94Å; F533-F595 HydrophobicContact CE1-CE1 4.37Å; F533-F595 HydrophobicContact CE1-CE2 4.06Å; F533-F595 HydrophobicContact CE1-CG 4.08Å; F533-F595 HydrophobicContact CE1-CZ 4.3Å; F533-F595 HydrophobicContact CE2-CB 4.41Å; F533-F595 HydrophobicContact CZ-CB 3.75Å; F533-F595 AromaticContact CZ-CD1 3.79Å; F533-F595 HydrophobicContact CZ-CD1 3.79Å; F533-F595 AromaticContact CZ-CD2 3.71Å; F533-F595 HydrophobicContact CZ-CD2 3.71Å; F533-F595 HydrophobicContact CZ-CE1 4.32Å; F533-F595 HydrophobicContact CZ-CE2 4.27Å; F533-F595 AromaticContact CZ-CG 3.46Å; F533-F595 HydrophobicContact CZ-CG 3.46Å; F533-F595 VanDerWaalsContact CZ-CG 3.46Å; F595-L625 HydrophobicContact CD2-CD1 3.82Å; F595-L625 HydrophobicContact CE2-CD1 4.07Å
596	D	93	Very high	88.5	Confident	1 Å²	1	17 Å²	17	1%	0.005	9%	0.093	C	C	.	.	S	Bend	trans	-145.9	141.3	179	53.8	-101.9	0	0	0	111.7	N457 S524 N525	N457-D596 PolarHBondContact ND2-OD1 3.15Å; N457-D596 WeakPolarHBondContact OD1-CB 3.3Å; S524-D596 WeakPolarHBondContact CA-OD1 3.38Å; S524-D596 VanDerWaalsContact CB-OD1 3.28Å; S524-D596 WeakPolarHBondContact CB-OD1 3.44Å; S524-D596 PolarHBondContact OG-OD1 2.83Å; N525-D596 WeakPolarHBondContact CB-OD2 3.35Å; N525-D596 VanDerWaalsContact CG-OD2 3.25Å; N525-D596 PolarHBondContact N-OD2 3.41Å; N525-D596 PolarHBondContact ND2-O 3.26Å; N525-D596 PolarHBondContact ND2-OD2 2.86Å
597	P	91.4	Very high	88.3	Confident	1 Å²	1	17 Å²	17	1%	0.006	9%	0.093	C	C	.	.			trans	-81.1	146.5	-178.2	31.9	-35	0	0	0	112.7	K453 N525 I626 E632 M635	K453-P597 PolarHBondContact NZ-O 2.73Å; N525-P597 PolarHBondContact ND2-O 3.08Å; P597-I626 HydrophobicContact CB-CD1 4.06Å; P597-I626 HydrophobicContact CG-CD1 3.72Å; P597-E632 HydrophobicContact CG-CB 4.11Å; P597-E632 HydrophobicContact CG-CG 4.39Å; P597-M635 HydrophobicContact CB-CE 4.49Å; P597-M635 HydrophobicContact CG-CB 4.34Å; P597-M635 HydrophobicContact CG-CE 4.32Å; P597-M635 HydrophobicContact CG-SD 4.45Å; P597-M635 WeakPolarHBondContact O-CE 3.45Å
598	D	87.8	Confident	88	Confident	24 Å²	24	15.2 Å²	15.2	13%	0.128	8%	0.083	C	C	.	.			trans	-87	159.2	165.9	-160.8	-48	0	0	0	110.9	N525 N600 N603 D604 M635 Q639	N525-D598 PolarHBondContact ND2-N 3.14Å; D598-N600 PolarHBondContact O-N 3.05Å; D598-N600 PolarHBondContact OD1-N 2.57Å; D598-N603 HydrophobicContact CB-CB 4.2Å; D598-N603 PolarHBondContact OD2-ND2 3.23Å; D598-D604 WeakPolarHBondContact CB-OD1 3.3Å; D598-D604 PolarHBondContact N-OD1 3.25Å; D598-D604 VanDerWaalsContact N-OD1 3.14Å; D598-M635 VanDerWaalsContact C-CE 3.42Å; D598-Q639 PolarHBondContact O-NE2 3.02Å
599	W	83.1	Confident	87.5	Confident	68 Å²	68	14.3 Å²	14.3	26%	0.258	7%	0.073	S	C	.	.	S	Bend	trans	-70.5	-22.6	170.1	-73.3	103.3	0	0	0	113.2	I449 M635 K642 L668	I449-W599 HydrophobicContact CD1-CZ2 4.47Å; I449-W599 HydrophobicContact CG2-CZ2 3.86Å; W599-M635 HydrophobicContact CB-CE 4.42Å; W599-M635 HydrophobicContact CD2-CE 3.75Å; W599-M635 HydrophobicContact CD2-CG 4.06Å; W599-M635 HydrophobicContact CD2-SD 4.29Å; W599-M635 HydrophobicContact CE3-CE 4.39Å; W599-M635 HydrophobicContact CE3-CG 3.96Å; W599-M635 HydrophobicContact CG-CE 3.74Å; W599-M635 HydrophobicContact CH2-CG 3.64Å; W599-M635 HydrophobicContact CZ2-CG 3.72Å; W599-M635 HydrophobicContact CZ2-SD 3.98Å; W599-M635 HydrophobicContact CZ3-CG 3.75Å; W599-K642 PolarHBondContact O-NZ 3.45Å; W599-L668 HydrophobicContact CH2-CD1 4.28Å; W599-L668 HydrophobicContact CH2-CD2 3.86Å; W599-L668 HydrophobicContact CZ3-CD2 4.36Å
600	N	79.3	Confident	87	Confident	38 Å²	38	14.3 Å²	14.3	20%	0.203	7%	0.073	C	C	.	.	S	Bend	trans	-100.7	110.3	176.4	-175.7	18.8	0	0	0	110.3	Q320 D598 A602 N603	Q320-N600 PolarHBondContact NE2-OD1 3.11Å; D598-N600 PolarHBondContact O-N 3.05Å; D598-N600 PolarHBondContact OD1-N 2.57Å; N600-A602 PolarHBondContact O-N 2.77Å; N600-A602 VanDerWaalsContact O-N 3.09Å; N600-A602 PolarHBondContact OD1-N 3Å; N600-N603 PolarHBondContact ND2-OD1 2.69Å; N600-N603 PolarHBondContact O-N 3.46Å; N600-N603 VanDerWaalsContact O-N 3.09Å
601	P	82.2	Confident	86.7	Confident	10 Å²	10	14.2 Å²	14.2	7%	0.065	7%	0.073	C	C	.	.	H	α-helix	trans	-57.3	-30.3	-179.3	20.4	-30.6	0	0	0	113	N603 D604 D605 Q639 K642 K643	P601-N603 VanDerWaalsContact C-N 3.26Å; P601-N603 PolarHBondContact O-N 3.05Å; P601-D604 PolarHBondContact O-N 2.99Å; P601-D605 VanDerWaalsContact O-CG 3.28Å; P601-D605 PolarHBondContact O-N 3.44Å; P601-Q639 HydrophobicContact CB-CB 4.02Å; P601-Q639 HydrophobicContact CB-CG 4.07Å; P601-Q639 HydrophobicContact CG-CB 4.46Å; P601-K642 HydrophobicContact CG-CB 4.24Å; P601-K643 HydrophobicContact CB-CD 4.19Å; P601-K643 VanDerWaalsContact CB-CE 3.47Å; P601-K643 HydrophobicContact CB-CG 3.81Å; P601-K643 HydrophobicContact CG-CG 3.99Å
602	A	78.8	Confident	86.2	Confident	12 Å²	12	14.3 Å²	14.3	10%	0.099	7%	0.073	C	C	.	.	H	α-helix	trans	-64.1	-29.3	-178.6	0	0	0	0	0	113.3	T317 N600 Q606	T317-A602 HydrophobicContact CG2-CB 3.61Å; N600-A602 PolarHBondContact O-N 2.77Å; N600-A602 VanDerWaalsContact O-N 3.09Å; N600-A602 PolarHBondContact OD1-N 3Å; A602-Q606 WeakPolarHBondContact O-CB 3.42Å; A602-Q606 PolarHBondContact O-N 3.48Å
603	N	81.2	Confident	85.6	Confident	46 Å²	46	16.1 Å²	16.1	25%	0.246	8%	0.08	C	C	.	.	H	α-helix	trans	-69.9	-43.3	176.1	-67.3	-8	0	0	0	110.7	D598 N600 P601 Q606 A607	D598-N603 HydrophobicContact CB-CB 4.2Å; D598-N603 PolarHBondContact OD2-ND2 3.23Å; N600-N603 PolarHBondContact ND2-OD1 2.69Å; N600-N603 PolarHBondContact O-N 3.46Å; N600-N603 VanDerWaalsContact O-N 3.09Å; P601-N603 VanDerWaalsContact C-N 3.26Å; P601-N603 PolarHBondContact O-N 3.05Å; N603-Q606 PolarHBondContact O-N 2.88Å; N603-A607 WeakPolarHBondContact O-CB 3.28Å; N603-A607 PolarHBondContact O-N 2.94Å; N603-A607 VanDerWaalsContact O-N 3.08Å
604	D	85.4	Confident	84.7	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-49.9	176.6	-70.9	15.1	0	0	0	110.1	M594 D598 P601 Q606 A607 M608 R624 Q639	M594-D604 HydrophobicContact CE-CB 4.41Å; D598-D604 WeakPolarHBondContact CB-OD1 3.3Å; D598-D604 PolarHBondContact N-OD1 3.25Å; D598-D604 VanDerWaalsContact N-OD1 3.14Å; P601-D604 PolarHBondContact O-N 2.99Å; D604-Q606 VanDerWaalsContact C-N 3.29Å; D604-Q606 PolarHBondContact O-N 3.33Å; D604-A607 PolarHBondContact O-N 2.78Å; D604-M608 HydrophobicContact CB-CE 4.48Å; D604-M608 WeakPolarHBondContact O-CB 3.17Å; D604-M608 VanDerWaalsContact O-CG 3.3Å; D604-M608 WeakPolarHBondContact O-CG 3.37Å; D604-M608 PolarHBondContact O-N 3.28Å; D604-R624 IonicContact OD2-NH2 2.68Å; D604-R624 PolarHBondContact OD2-NH2 3.36Å; D604-Q639 PolarHBondContact OD2-NE2 3.16Å
605	D	81.7	Confident	84.2	Confident	51 Å²	51	23.8 Å²	23.8	27%	0.273	13%	0.13	S	C	.	.	H	α-helix	trans	-59.7	-41.8	179.3	-65.8	-22.2	0	0	0	111.7	P601 A607 M608 A609 K643	P601-D605 VanDerWaalsContact O-CG 3.28Å; P601-D605 PolarHBondContact O-N 3.44Å; D605-A607 VanDerWaalsContact C-N 3.28Å; D605-A607 PolarHBondContact O-N 3.3Å; D605-M608 HydrophobicContact CB-CE 4.49Å; D605-M608 PolarHBondContact O-N 3.29Å; D605-M608 WeakPolarHBondContact OD1-CE 2.96Å; D605-A609 VanDerWaalsContact O-CB 3.24Å; D605-A609 WeakPolarHBondContact O-CB 3.46Å; D605-A609 PolarHBondContact O-N 2.78Å; D605-K643 IonicContact OD1-NZ 2.94Å; D605-K643 PolarHBondContact OD1-NZ 2.97Å; D605-K643 WeakPolarHBondContact OD2-CE 3.3Å; D605-K643 IonicContact OD2-NZ 3.02Å; D605-K643 PolarHBondContact OD2-NZ 2.86Å
606	Q	80.7	Confident	83.8	Confident	20 Å²	20	24.5 Å²	24.5	9%	0.093	13%	0.134	C	C	.	.	H	α-helix	trans	-62.3	-36.2	176.7	176.7	170	66	0	0	112.2	M176 E288 G581 A602 N603 D604 R610	M176-Q606 HydrophobicContact CE-CB 4.45Å; M176-Q606 HydrophobicContact CE-CG 3.68Å; M176-Q606 HydrophobicContact SD-CB 3.58Å; M176-Q606 VanDerWaalsContact SD-CB 3.58Å; M176-Q606 HydrophobicContact SD-CG 3.45Å; M176-Q606 WeakPolarHBondContact SD-CG 3.48Å; E288-Q606 PolarHBondContact OE1-NE2 3.03Å; G581-Q606 VanDerWaalsContact CA-CD 3.45Å; G581-Q606 VanDerWaalsContact CA-OE1 3.23Å; G581-Q606 PolarHBondContact O-NE2 3.4Å; A602-Q606 WeakPolarHBondContact O-CB 3.42Å; A602-Q606 PolarHBondContact O-N 3.48Å; N603-Q606 PolarHBondContact O-N 2.88Å; D604-Q606 VanDerWaalsContact C-N 3.29Å; D604-Q606 PolarHBondContact O-N 3.33Å; Q606-R610 PolarHBondContact O-NE 3.36Å; Q606-R610 PolarHBondContact O-NH2 3.27Å
607	A	83.7	Confident	83.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-78.1	-38.1	178	0	0	0	0	0	112.3	I523 M594 N603 D604 D605 R610	I523-A607 HydrophobicContact CD1-CB 3.84Å; I523-A607 HydrophobicContact CG2-CB 4.27Å; M594-A607 HydrophobicContact CE-CB 3.76Å; N603-A607 WeakPolarHBondContact O-CB 3.28Å; N603-A607 PolarHBondContact O-N 2.94Å; N603-A607 VanDerWaalsContact O-N 3.08Å; D604-A607 PolarHBondContact O-N 2.78Å; D605-A607 VanDerWaalsContact C-N 3.28Å; D605-A607 PolarHBondContact O-N 3.3Å; A607-R610 WeakPolarHBondContact O-CB 3.38Å; A607-R610 WeakPolarHBondContact O-CG 3.29Å; A607-R610 PolarHBondContact O-N 3.5Å
608	M	84.3	Confident	83.7	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.034	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-38.6	175	-71.7	-172.2	-56.6	0	0	112.1	L592 M594 D604 D605 R610 I622 R624	L592-M608 HydrophobicContact CD2-CG 4.16Å; M594-M608 HydrophobicContact CE-CG 4.09Å; D604-M608 HydrophobicContact CB-CE 4.48Å; D604-M608 WeakPolarHBondContact O-CB 3.17Å; D604-M608 VanDerWaalsContact O-CG 3.3Å; D604-M608 WeakPolarHBondContact O-CG 3.37Å; D604-M608 PolarHBondContact O-N 3.28Å; D605-M608 HydrophobicContact CB-CE 4.49Å; D605-M608 PolarHBondContact O-N 3.29Å; D605-M608 WeakPolarHBondContact OD1-CE 2.96Å; M608-R610 PolarHBondContact O-N 3.32Å; M608-I622 HydrophobicContact CB-CD1 4.11Å; M608-I622 HydrophobicContact CG-CG2 3.98Å; M608-I622 HydrophobicContact SD-CG2 3.62Å; M608-R624 HydrophobicContact SD-CG 4.23Å
609	A	80.7	Confident	83.9	Confident	6 Å²	6	39.2 Å²	39.2	5%	0.05	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	15.9	179.1	0	0	0	0	0	114.4	M176 D605 R613	M176-A609 HydrophobicContact CB-CB 4.22Å; D605-A609 VanDerWaalsContact O-CB 3.24Å; D605-A609 WeakPolarHBondContact O-CB 3.46Å; D605-A609 PolarHBondContact O-N 2.78Å; A609-R613 WeakPolarHBondContact O-CD 3.36Å; A609-R613 WeakPolarHBondContact O-CG 3.39Å; A609-R613 PolarHBondContact O-NE 2.75Å; A609-R613 PolarHBondContact O-NH2 2.98Å
610	R	82.7	Confident	84.4	Confident	1 Å²	1	36 Å²	36	0%	0.004	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-24.7	178.7	-57.7	-63.3	150.9	173.2	12.4	114.2	G580 G581 L584 L586 Q606 A607 M608	G580-R610 PolarHBondContact O-NE 3.12Å; G580-R610 PolarHBondContact O-NH2 3.49Å; G581-R610 PolarHBondContact O-NH2 3.22Å; G581-R610 VanDerWaalsContact O-NH2 3.11Å; L584-R610 WeakPolarHBondContact O-CD 3.25Å; L586-R610 HydrophobicContact CD1-CB 4.38Å; L586-R610 PolarHBondContact N-O 3.34Å; Q606-R610 PolarHBondContact O-NE 3.36Å; Q606-R610 PolarHBondContact O-NH2 3.27Å; A607-R610 WeakPolarHBondContact O-CB 3.38Å; A607-R610 WeakPolarHBondContact O-CG 3.29Å; A607-R610 PolarHBondContact O-N 3.5Å; M608-R610 PolarHBondContact O-N 3.32Å
611	V	87.2	Confident	85.1	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.012	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-44.8	-177.9	173.4	0	0	0	0	111	V521 L586 A589 L592 R613 Q616	V521-V611 HydrophobicContact CB-CG2 4.16Å; V521-V611 HydrophobicContact CG2-CG2 3.82Å; L586-V611 HydrophobicContact CB-CG2 4.38Å; A589-V611 HydrophobicContact CB-CG2 4.39Å; A589-V611 WeakPolarHBondContact O-CG1 3.37Å; L592-V611 HydrophobicContact CB-CG2 4.19Å; L592-V611 HydrophobicContact CD1-CB 4.34Å; L592-V611 HydrophobicContact CD1-CG2 3.73Å; V611-R613 PolarHBondContact O-N 3.48Å; V611-R613 VanDerWaalsContact O-N 3.14Å; V611-Q616 PolarHBondContact O-NE2 2.86Å
612	W	86.3	Confident	85.7	Confident	10 Å²	10	35 Å²	35	4%	0.038	18%	0.177	C	C	.	.	S	Bend	trans	-86.1	81.5	175.6	-165.9	66	0	0	0	110.5	Q388 L391 T392 L395 P396 K398 C620	Q388-W612 HydrophobicContact CB-CZ3 4.12Å; L391-W612 HydrophobicContact CB-CH2 4.34Å; T392-W612 HydrophobicContact CG2-CH2 4.25Å; L395-W612 HydrophobicContact CB-CZ2 3.73Å; L395-W612 HydrophobicContact CD1-CD2 3.88Å; L395-W612 HydrophobicContact CD1-CE3 4.19Å; L395-W612 HydrophobicContact CD1-CG 4.43Å; L395-W612 HydrophobicContact CD1-CH2 4.18Å; L395-W612 HydrophobicContact CD1-CZ2 3.85Å; L395-W612 HydrophobicContact CD1-CZ3 4.33Å; L395-W612 HydrophobicContact CG-CZ2 4.41Å; P396-W612 PolarHBondContact O-NE1 2.92Å; K398-W612 HydrophobicContact CB-CD2 3.98Å; K398-W612 HydrophobicContact CB-CG 4.01Å; K398-W612 HydrophobicContact CB-CZ2 4.4Å; K398-W612 HydrophobicContact CD-CB 4.23Å; K398-W612 HydrophobicContact CD-CD2 3.88Å; K398-W612 HydrophobicContact CD-CE3 3.91Å; K398-W612 HydrophobicContact CD-CG 4.04Å; K398-W612 HydrophobicContact CG-CD2 4.4Å; K398-W612 HydrophobicContact CG-CG 4.28Å; W612-C620 HydrophobicContact CB-CB 4.41Å
613	R	81.3	Confident	86.6	Confident	38 Å²	38	34.4 Å²	34.4	14%	0.143	17%	0.172	C	C	.	.	S	Bend	trans	-136.1	169.1	179.6	-75.5	-166.2	172	-170.4	-3.9	111.4	L395 G583 L584 I587 A609 V611 G615 Q616	L395-R613 WeakPolarHBondContact CD2-O 3.48Å; G583-R613 PolarHBondContact O-NH1 2.7Å; L584-R613 PolarHBondContact O-NH1 3.37Å; L584-R613 VanDerWaalsContact O-NH1 3.13Å; I587-R613 HydrophobicContact CG2-CB 4.22Å; A609-R613 WeakPolarHBondContact O-CD 3.36Å; A609-R613 WeakPolarHBondContact O-CG 3.39Å; A609-R613 PolarHBondContact O-NE 2.75Å; A609-R613 PolarHBondContact O-NH2 2.98Å; V611-R613 PolarHBondContact O-N 3.48Å; V611-R613 VanDerWaalsContact O-N 3.14Å; R613-G615 PolarHBondContact O-N 2.84Å; R613-Q616 WeakPolarHBondContact O-CB 3.41Å; R613-Q616 PolarHBondContact O-N 3.48Å
614	D	78	Confident	87.2	Confident	125 Å²	125	32.5 Å²	32.5	67%	0.668	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	133.4	170.9	-166.6	16.9	0	0	0	111.5
615	G	83.3	Confident	87.8	Confident	39 Å²	39	32.6 Å²	32.6	40%	0.402	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-10.1	-170.7	0	0	0	0	0	115.5	R613 K617	R613-G615 PolarHBondContact O-N 2.84Å; G615-K617 PolarHBondContact O-N 2.98Å
616	Q	88.4	Confident	88.4	Confident	16 Å²	16	30.3 Å²	30.3	8%	0.075	15%	0.15	C	C	.	.			trans	-66.8	131.4	171.1	-179.8	57.8	-96.3	0	0	110.7	P396 I587 A589 V611 R613 K618 C620	P396-Q616 WeakPolarHBondContact CD-O 3.46Å; P396-Q616 HydrophobicContact CG-CG 4.21Å; P396-Q616 WeakPolarHBondContact CG-O 3.15Å; I587-Q616 HydrophobicContact CG2-CB 4.42Å; I587-Q616 PolarHBondContact O-NE2 3.49Å; A589-Q616 PolarHBondContact O-NE2 3.01Å; V611-Q616 PolarHBondContact O-NE2 2.86Å; R613-Q616 WeakPolarHBondContact O-CB 3.41Å; R613-Q616 PolarHBondContact O-N 3.48Å; Q616-K618 VanDerWaalsContact CG-O 3.3Å; Q616-K618 WeakPolarHBondContact CG-O 3.34Å; Q616-K618 PolarHBondContact OE1-O 3.39Å; Q616-C620 VanDerWaalsContact CG-SG 3.57Å
617	K	89.2	Confident	89.1	Confident	191 Å²	191	29.4 Å²	29.4	83%	0.83	15%	0.146	S	C	*	.			trans	-111.7	-20.3	-177.7	-61.9	-177.2	-178.5	179.9	0	113.4	G615	G615-K617 PolarHBondContact O-N 2.98Å
618	K	91.8	Very high	89.6	Confident	86 Å²	86	29.6 Å²	29.6	37%	0.374	15%	0.147	S	C	.	.	S	Bend	trans	-104.3	155.7	-178.1	-68.4	-177.6	168.9	-169.2	0	110.7	P396 D518 N590 Q616 C620	P396-K618 VanDerWaalsContact CB-O 3.31Å; P396-K618 WeakPolarHBondContact CB-O 3.48Å; D518-K618 IonicContact OD1-NZ 3.45Å; D518-K618 PolarHBondContact OD1-NZ 3.49Å; N590-K618 HydrophobicContact CB-CB 3.84Å; N590-K618 HydrophobicContact CB-CD 4.17Å; Q616-K618 VanDerWaalsContact CG-O 3.3Å; Q616-K618 WeakPolarHBondContact CG-O 3.34Å; Q616-K618 PolarHBondContact OE1-O 3.39Å; K618-C620 PolarHBondContact O-N 3.08Å
619	Q	92.5	Very high	90	Very high	57 Å²	57	29.2 Å²	29.2	27%	0.266	15%	0.145	S	C	.	.			trans	-58	132.4	166.9	-175.8	172.8	12.6	0	0	110.4	V397 N590 Y621	V397-Q619 HydrophobicContact CB-CG 4.22Å; V397-Q619 WeakPolarHBondContact O-CA 3.45Å; V397-Q619 WeakPolarHBondContact O-CG 3.45Å; N590-Q619 PolarHBondContact ND2-O 3.09Å; Q619-Y621 HydrophobicContact CB-CE2 4.25Å; Q619-Y621 HydrophobicContact CG-CE2 4.03Å; Q619-Y621 PolarHBondContact OE1-OH 2.92Å
620	C	93.5	Very high	90.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	138.8	-177.9	-75.6	0	0	0	0	111.7	V397 K398 I399 N590 W612 Q616 K618	V397-C620 PolarHBondContact O-N 3.37Å; K398-C620 CarbonylContact C-O 3.56Å; K398-C620 WeakPolarHBondContact CA-O 3.18Å; K398-C620 HydrophobicContact CB-CB 4.45Å; K398-C620 HydrophobicContact CG-CB 4.47Å; I399-C620 PolarHBondContact N-O 3.38Å; N590-C620 CarbonylContact O-C 3.59Å; N590-C620 VanDerWaalsContact O-CA 3.22Å; N590-C620 WeakPolarHBondContact O-CA 3.34Å; W612-C620 HydrophobicContact CB-CB 4.41Å; Q616-C620 VanDerWaalsContact CG-SG 3.57Å; K618-C620 PolarHBondContact O-N 3.08Å
621	Y	95.2	Very high	90.9	Very high	23 Å²	23	28.9 Å²	28.9	9%	0.09	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125	174.2	-58.8	-97.9	0	0	0	109.6	I399 N590 R591 L592 Q619 D721	I399-Y621 HydrophobicContact CB-CD1 4.23Å; I399-Y621 HydrophobicContact CD1-CD1 4.35Å; I399-Y621 HydrophobicContact CD1-CE1 3.85Å; I399-Y621 WeakPolarHBondContact O-CA 3.42Å; N590-Y621 PolarHBondContact O-N 3.4Å; R591-Y621 CarbonylContact C-O 3.54Å; R591-Y621 WeakPolarHBondContact CA-O 3.4Å; R591-Y621 HydrophobicContact CG-CD2 4.12Å; R591-Y621 HydrophobicContact CG-CG 4.5Å; L592-Y621 PolarHBondContact N-O 2.82Å; Q619-Y621 HydrophobicContact CB-CE2 4.25Å; Q619-Y621 HydrophobicContact CG-CE2 4.03Å; Q619-Y621 PolarHBondContact OE1-OH 2.92Å; Y621-D721 HydrophobicContact CD1-CB 3.94Å; Y621-D721 HydrophobicContact CE1-CB 3.84Å
622	I	94.9	Very high	91.2	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.9	178.5	-57.2	-172.7	0	0	0	108.4	K398 I399 E400 Q401 L592 M608 R624	K398-I622 HydrophobicContact CD-CD1 3.74Å; K398-I622 HydrophobicContact CG-CD1 4.04Å; K398-I622 HydrophobicContact CG-CG1 4.4Å; I399-I622 PolarHBondContact O-N 3.06Å; E400-I622 HydrophobicContact CG-CB 4.13Å; E400-I622 HydrophobicContact CG-CD1 4.22Å; E400-I622 HydrophobicContact CG-CG1 4.5Å; Q401-I622 PolarHBondContact N-O 3.09Å; L592-I622 HydrophobicContact CD2-CG2 4.12Å; L592-I622 CarbonylContact O-C 3.58Å; L592-I622 WeakPolarHBondContact O-CA 3.18Å; M608-I622 HydrophobicContact CB-CD1 4.11Å; M608-I622 HydrophobicContact CG-CG2 3.98Å; M608-I622 HydrophobicContact SD-CG2 3.62Å; I622-R624 HydrophobicContact CG2-CG 4.46Å
623	Y	96	Very high	91.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.9	177.9	-51.1	-82.8	0	0	0	109.4	Q401 L508 R591 L592 V593 M594 D721 L724	Q401-Y623 HydrophobicContact CB-CD1 4.43Å; Q401-Y623 CarbonylContact O-C 3.46Å; Q401-Y623 WeakPolarHBondContact O-CA 3.47Å; L508-Y623 HydrophobicContact CD1-CE1 4.11Å; L508-Y623 HydrophobicContact CD1-CE2 4.47Å; L508-Y623 HydrophobicContact CD2-CD1 4.45Å; L508-Y623 HydrophobicContact CD2-CD2 3.93Å; L508-Y623 HydrophobicContact CD2-CE2 4.15Å; L508-Y623 HydrophobicContact CD2-CG 4.09Å; R591-Y623 HydrophobicContact CB-CE2 4.23Å; R591-Y623 PolarHBondContact NH1-OH 3.08Å; L592-Y623 WeakPolarHBondContact O-CD2 3.35Å; L592-Y623 PolarHBondContact O-N 2.54Å; V593-Y623 CarbonylContact C-O 3.48Å; V593-Y623 WeakPolarHBondContact CA-O 3.3Å; V593-Y623 HydrophobicContact CG2-CD2 3.87Å; V593-Y623 HydrophobicContact CG2-CG 4.48Å; M594-Y623 PolarHBondContact N-O 3.18Å; Y623-D721 VanDerWaalsContact CE1-OD2 3.27Å; Y623-D721 WeakPolarHBondContact CE1-OD2 3.2Å; Y623-D721 PolarHBondContact OH-OD2 3Å; Y623-L724 HydrophobicContact CD1-CD1 4.42Å; Y623-L724 HydrophobicContact CE1-CB 4.24Å; Y623-L724 HydrophobicContact CE1-CD1 4.45Å
624	R	95.6	Very high	91.8	Very high	7 Å²	7	26.8 Å²	26.8	3%	0.026	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	105	172.2	-56.7	-178.3	69.1	-163.2	1.3	108	Q401 V402 V403 M594 D604 M608 I622	Q401-R624 PolarHBondContact O-N 3.08Å; V402-R624 CarbonylContact C-O 3.58Å; V402-R624 WeakPolarHBondContact CA-O 3.16Å; V402-R624 HydrophobicContact CG2-CB 4.33Å; V403-R624 PolarHBondContact N-O 2.76Å; M594-R624 HydrophobicContact CB-CG 4.23Å; D604-R624 IonicContact OD2-NH2 2.68Å; D604-R624 PolarHBondContact OD2-NH2 3.36Å; M608-R624 HydrophobicContact SD-CG 4.23Å; I622-R624 HydrophobicContact CG2-CG 4.46Å
625	L	96.3	Very high	92.3	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.9	-179.3	-53.8	-171.8	0	0	0	109.6	V403 K501 V504 L505 V593 M594 F595	V403-L625 HydrophobicContact CB-CD2 3.83Å; V403-L625 HydrophobicContact CG1-CD2 4.3Å; V403-L625 HydrophobicContact CG2-CD2 4.22Å; K501-L625 HydrophobicContact CD-CB 4.08Å; K501-L625 HydrophobicContact CG-CB 4.45Å; V504-L625 HydrophobicContact CG1-CD2 4.18Å; L505-L625 HydrophobicContact CB-CD1 4.34Å; V593-L625 HydrophobicContact CG1-CD1 3.91Å; V593-L625 HydrophobicContact CG1-CG 3.95Å; M594-L625 PolarHBondContact O-N 3.14Å; F595-L625 HydrophobicContact CD2-CD1 3.82Å; F595-L625 HydrophobicContact CE2-CD1 4.07Å
626	I	95.5	Very high	92.6	Very high	2 Å²	2	19 Å²	19	1%	0.01	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133	-178.3	-58.6	-67	0	0	0	108.4	V402 V403 C404 C405 P597 T628 E632 E633 L636	V402-I626 HydrophobicContact CG1-CG1 3.9Å; V403-I626 PolarHBondContact O-N 3.35Å; C404-I626 CarbonylContact C-O 3.42Å; C404-I626 WeakPolarHBondContact CA-O 3.36Å; C405-I626 PolarHBondContact N-O 3.48Å; P597-I626 HydrophobicContact CB-CD1 4.06Å; P597-I626 HydrophobicContact CG-CD1 3.72Å; I626-T628 PolarHBondContact O-N 2.65Å; I626-E632 HydrophobicContact CG2-CB 3.94Å; I626-E633 HydrophobicContact CG2-CB 3.97Å; I626-E633 HydrophobicContact CG2-CG 4.45Å; I626-L636 HydrophobicContact CG1-CD2 4.37Å
627	S	95.2	Very high	92.6	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.014	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.8	173.5	-67.5	0	0	0	0	111.9	C405 T630 E632	C405-S627 CarbonylContact O-C 3.6Å; C405-S627 WeakPolarHBondContact O-CA 3.45Å; S627-T630 WeakPolarHBondContact CB-OG1 3.2Å; S627-T630 PolarHBondContact O-N 3.04Å; S627-T630 PolarHBondContact O-OG1 3.31Å; S627-E632 PolarHBondContact N-OE2 3.44Å; S627-E632 PolarHBondContact OG-OE2 2.92Å
628	T	94.3	Very high	92.3	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.018	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	132.6	-174.4	-51	0	0	0	0	112.8	C404 C405 I626 T630 T675 L676 S734	C404-T628 WeakPolarHBondContact CB-OG1 3.11Å; C405-T628 VanDerWaalsContact C-OG1 3.31Å; C405-T628 PolarHBondContact N-OG1 3.27Å; C405-T628 PolarHBondContact O-N 3.03Å; C405-T628 PolarHBondContact O-OG1 3.21Å; I626-T628 PolarHBondContact O-N 2.65Å; T628-T630 WeakPolarHBondContact O-CG2 3.12Å; T628-T630 PolarHBondContact O-N 3.31Å; T628-T675 WeakPolarHBondContact CG2-O 3.44Å; T628-L676 WeakPolarHBondContact CG2-O 3.47Å; T628-S734 WeakPolarHBondContact CG2-OG 3.49Å; T628-S734 PolarHBondContact OG1-OG 2.66Å
629	G	91.5	Very high	92	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	11.8	176	0	0	0	0	0	114.2	E633 Y671 H672	G629-E633 PolarHBondContact N-OE2 3.22Å; G629-Y671 WeakPolarHBondContact O-CA 3.41Å; G629-Y671 WeakPolarHBondContact O-CD2 3.23Å; G629-H672 PolarHBondContact O-N 3.48Å
630	T	92.8	Very high	91.5	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.032	C	C	.	.	S	Bend	trans	-104.9	177.5	-176.5	73.7	0	0	0	0	112.7	L407 Y415 S627 T628 E632 E633 K634 Y671	L407-T630 HydrophobicContact CD1-CG2 3.73Å; L407-T630 HydrophobicContact CD2-CG2 4.15Å; L407-T630 HydrophobicContact CG-CG2 4.01Å; Y415-T630 HydrophobicContact CE2-CG2 4.18Å; S627-T630 WeakPolarHBondContact CB-OG1 3.2Å; S627-T630 PolarHBondContact O-N 3.04Å; S627-T630 PolarHBondContact O-OG1 3.31Å; T628-T630 WeakPolarHBondContact O-CG2 3.12Å; T628-T630 PolarHBondContact O-N 3.31Å; T630-E632 PolarHBondContact O-N 3.09Å; T630-E632 VanDerWaalsContact O-N 3.13Å; T630-E632 PolarHBondContact OG1-N 3.43Å; T630-E633 WeakPolarHBondContact O-CB 3.33Å; T630-E633 PolarHBondContact O-N 3.4Å; T630-K634 PolarHBondContact O-N 2.75Å; T630-Y671 HydrophobicContact CG2-CD2 4.11Å; T630-Y671 HydrophobicContact CG2-CE2 3.92Å
631	I	90.4	Very high	90.6	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-50.8	-32.1	170.1	-166.5	165.2	0	0	0	114	Y415 I449 L452 K453 E633 K634 M635	Y415-I631 PolarHBondContact OH-N 3.34Å; I449-I631 HydrophobicContact CB-CD1 4Å; I449-I631 HydrophobicContact CG1-CD1 3.71Å; I449-I631 HydrophobicContact CG2-CD1 3.7Å; L452-I631 HydrophobicContact CB-CG2 4.02Å; K453-I631 HydrophobicContact CG-CG2 4.31Å; I631-E633 VanDerWaalsContact C-N 3.27Å; I631-E633 PolarHBondContact O-N 3.35Å; I631-K634 PolarHBondContact O-N 3.44Å; I631-M635 VanDerWaalsContact O-CG 3.3Å; I631-M635 WeakPolarHBondContact O-CG 3.45Å; I631-M635 PolarHBondContact O-N 3.49Å
632	E	92.6	Very high	89.6	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.4	-34.5	179.3	-63.8	-166	150.2	0	0	112	C456 N457 K501 P597 I626 S627 T630 M635 L636	C456-E632 HydrophobicContact CB-CG 4.1Å; N457-E632 PolarHBondContact OD1-OE1 2.99Å; K501-E632 WeakPolarHBondContact CE-OE2 3.36Å; K501-E632 IonicContact NZ-OE1 2.94Å; K501-E632 PolarHBondContact NZ-OE1 3.49Å; K501-E632 IonicContact NZ-OE2 2.65Å; K501-E632 PolarHBondContact NZ-OE2 3.08Å; P597-E632 HydrophobicContact CG-CB 4.11Å; P597-E632 HydrophobicContact CG-CG 4.39Å; I626-E632 HydrophobicContact CG2-CB 3.94Å; S627-E632 PolarHBondContact N-OE2 3.44Å; S627-E632 PolarHBondContact OG-OE2 2.92Å; T630-E632 PolarHBondContact O-N 3.09Å; T630-E632 VanDerWaalsContact O-N 3.13Å; T630-E632 PolarHBondContact OG1-N 3.43Å; E632-M635 WeakPolarHBondContact O-CB 3.34Å; E632-M635 PolarHBondContact O-N 3.45Å; E632-L636 PolarHBondContact O-N 3.28Å
633	E	91.8	Very high	88.6	Confident	1 Å²	1	16 Å²	16	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-72	-37.7	177.1	-164.8	162.9	-163.7	0	0	111.1	I626 G629 T630 I631 M635 L636 Q637 S677 D678 T679	I626-E633 HydrophobicContact CG2-CB 3.97Å; I626-E633 HydrophobicContact CG2-CG 4.45Å; G629-E633 PolarHBondContact N-OE2 3.22Å; T630-E633 WeakPolarHBondContact O-CB 3.33Å; T630-E633 PolarHBondContact O-N 3.4Å; I631-E633 VanDerWaalsContact C-N 3.27Å; I631-E633 PolarHBondContact O-N 3.35Å; E633-M635 VanDerWaalsContact C-N 3.32Å; E633-M635 PolarHBondContact O-N 2.67Å; E633-L636 WeakPolarHBondContact O-CB 3.48Å; E633-L636 PolarHBondContact O-N 2.83Å; E633-Q637 VanDerWaalsContact O-CG 3.3Å; E633-Q637 WeakPolarHBondContact O-CG 3.33Å; E633-Q637 PolarHBondContact O-N 2.65Å; E633-S677 VanDerWaalsContact OE1-C 3.28Å; E633-S677 VanDerWaalsContact OE1-CA 3.29Å; E633-S677 WeakPolarHBondContact OE1-CA 3.48Å; E633-S677 WeakPolarHBondContact OE1-CB 3.25Å; E633-S677 PolarHBondContact OE1-OG 3.04Å; E633-D678 HydrophobicContact CG-CB 4.22Å; E633-D678 PolarHBondContact OE1-N 3.29Å; E633-D678 WeakPolarHBondContact OE2-CB 3.44Å; E633-D678 PolarHBondContact OE2-N 2.98Å; E633-T679 WeakPolarHBondContact CG-OG1 3.44Å; E633-T679 WeakPolarHBondContact OE1-CB 3.44Å; E633-T679 PolarHBondContact OE1-N 3.16Å; E633-T679 PolarHBondContact OE1-OG1 3.37Å; E633-T679 VanDerWaalsContact OE1-OG1 3.05Å
634	K	88.4	Confident	87.2	Confident	5 Å²	5	16.6 Å²	16.6	2%	0.022	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-36.8	170.1	-53.8	-60.7	-176.5	-175.1	0	112.5	T630 I631 Q637 R638 E667 L668 D678 R682	T630-K634 PolarHBondContact O-N 2.75Å; I631-K634 PolarHBondContact O-N 3.44Å; K634-Q637 PolarHBondContact O-N 3.16Å; K634-R638 WeakPolarHBondContact O-CG 3.49Å; K634-R638 PolarHBondContact O-N 2.91Å; K634-E667 WeakPolarHBondContact CE-O 3.43Å; K634-L668 HydrophobicContact CB-CD2 3.8Å; K634-D678 VanDerWaalsContact CE-OD2 3.3Å; K634-D678 WeakPolarHBondContact CE-OD2 3.36Å; K634-D678 IonicContact NZ-OD1 3.63Å; K634-D678 PolarHBondContact NZ-OD1 3.35Å; K634-D678 IonicContact NZ-OD2 3.84Å; K634-D678 PolarHBondContact NZ-OD2 2.84Å; K634-R682 VanDerWaalsContact NZ-CZ 3.26Å
635	M	89.2	Confident	85.7	Confident	0 Å²	0	17 Å²	17	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-44.7	173.6	-72.9	-177.8	61.4	0	0	111.2	K453 P597 D598 W599 I631 E632 E633 Q637 R638 Q639	K453-M635 HydrophobicContact CD-CE 4.37Å; K453-M635 HydrophobicContact CD-SD 3.66Å; K453-M635 VanDerWaalsContact CE-SD 3.59Å; K453-M635 HydrophobicContact CG-SD 4.22Å; P597-M635 HydrophobicContact CB-CE 4.49Å; P597-M635 HydrophobicContact CG-CB 4.34Å; P597-M635 HydrophobicContact CG-CE 4.32Å; P597-M635 HydrophobicContact CG-SD 4.45Å; P597-M635 WeakPolarHBondContact O-CE 3.45Å; D598-M635 VanDerWaalsContact C-CE 3.42Å; W599-M635 HydrophobicContact CB-CE 4.42Å; W599-M635 HydrophobicContact CD2-CE 3.75Å; W599-M635 HydrophobicContact CD2-CG 4.06Å; W599-M635 HydrophobicContact CD2-SD 4.29Å; W599-M635 HydrophobicContact CE3-CE 4.39Å; W599-M635 HydrophobicContact CE3-CG 3.96Å; W599-M635 HydrophobicContact CG-CE 3.74Å; W599-M635 HydrophobicContact CH2-CG 3.64Å; W599-M635 HydrophobicContact CZ2-CG 3.72Å; W599-M635 HydrophobicContact CZ2-SD 3.98Å; W599-M635 HydrophobicContact CZ3-CG 3.75Å; I631-M635 VanDerWaalsContact O-CG 3.3Å; I631-M635 WeakPolarHBondContact O-CG 3.45Å; I631-M635 PolarHBondContact O-N 3.49Å; E632-M635 WeakPolarHBondContact O-CB 3.34Å; E632-M635 PolarHBondContact O-N 3.45Å; E633-M635 VanDerWaalsContact C-N 3.32Å; E633-M635 PolarHBondContact O-N 2.67Å; M635-Q637 VanDerWaalsContact C-N 3.35Å; M635-Q637 PolarHBondContact O-N 3.42Å; M635-R638 PolarHBondContact O-N 2.78Å; M635-Q639 WeakPolarHBondContact O-CG 3.17Å; M635-Q639 PolarHBondContact O-N 3.22Å
636	L	90	Very high	83.9	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.3	-43.6	176.7	-176.6	71.7	0	0	0	111.8	V402 I626 E632 E633 R638 Q639 A640 F707	V402-L636 HydrophobicContact CG1-CD2 3.73Å; I626-L636 HydrophobicContact CG1-CD2 4.37Å; E632-L636 PolarHBondContact O-N 3.28Å; E633-L636 WeakPolarHBondContact O-CB 3.48Å; E633-L636 PolarHBondContact O-N 2.83Å; L636-R638 VanDerWaalsContact C-N 3.33Å; L636-R638 PolarHBondContact O-N 2.69Å; L636-Q639 WeakPolarHBondContact O-CB 3.44Å; L636-Q639 PolarHBondContact O-N 2.84Å; L636-A640 PolarHBondContact O-N 3.12Å; L636-F707 HydrophobicContact CD1-CE2 3.66Å; L636-F707 HydrophobicContact CD1-CZ 3.77Å; L636-F707 HydrophobicContact CD2-CE2 4.06Å; L636-F707 HydrophobicContact CG-CD2 4.44Å; L636-F707 HydrophobicContact CG-CE2 3.69Å; L636-F707 HydrophobicContact CG-CZ 4.27Å
637	Q	87.4	Confident	82.2	Confident	23 Å²	23	18.6 Å²	18.6	11%	0.107	9%	0.092	C	C	.	.	H	α-helix	trans	-61.2	-42.4	176.2	-68.1	158.3	14.2	0	0	111.8	E633 K634 M635 Q639 A640 H641 D678 T679 R682	E633-Q637 VanDerWaalsContact O-CG 3.3Å; E633-Q637 WeakPolarHBondContact O-CG 3.33Å; E633-Q637 PolarHBondContact O-N 2.65Å; K634-Q637 PolarHBondContact O-N 3.16Å; M635-Q637 VanDerWaalsContact C-N 3.35Å; M635-Q637 PolarHBondContact O-N 3.42Å; Q637-Q639 VanDerWaalsContact C-N 3.34Å; Q637-Q639 PolarHBondContact O-N 3.21Å; Q637-A640 PolarHBondContact O-N 2.9Å; Q637-H641 PolarHBondContact O-N 3.28Å; Q637-D678 PolarHBondContact NE2-OD2 3.06Å; Q637-T679 HydrophobicContact CG-CG2 3.97Å; Q637-T679 VanDerWaalsContact NE2-CA 3.29Å; Q637-T679 PolarHBondContact NE2-OG1 3.13Å; Q637-T679 VanDerWaalsContact NE2-OG1 3.14Å; Q637-R682 VanDerWaalsContact CD-CD 3.47Å
638	R	82.6	Confident	80.3	Confident	52 Å²	52	19.5 Å²	19.5	20%	0.196	10%	0.098	C	C	.	.	H	α-helix	trans	-66.9	-34.3	175.2	-77.4	173.4	169.8	-152.3	3.1	112.8	K634 M635 L636 K642 F660	K634-R638 WeakPolarHBondContact O-CG 3.49Å; K634-R638 PolarHBondContact O-N 2.91Å; M635-R638 PolarHBondContact O-N 2.78Å; L636-R638 VanDerWaalsContact C-N 3.33Å; L636-R638 PolarHBondContact O-N 2.69Å; R638-K642 WeakPolarHBondContact O-CB 3.06Å; R638-K642 VanDerWaalsContact O-CG 3.3Å; R638-K642 WeakPolarHBondContact O-CG 3.35Å; R638-K642 PolarHBondContact O-N 2.73Å; R638-F660 HydrophobicContact CG-CE1 4.18Å; R638-F660 HydrophobicContact CG-CZ 4Å
639	Q	85.3	Confident	78.3	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-45.9	171.3	-76.3	-174.3	-18	0	0	111.1	D598 P601 D604 M635 L636 Q637 K642 K643	D598-Q639 PolarHBondContact O-NE2 3.02Å; P601-Q639 HydrophobicContact CB-CB 4.02Å; P601-Q639 HydrophobicContact CB-CG 4.07Å; P601-Q639 HydrophobicContact CG-CB 4.46Å; D604-Q639 PolarHBondContact OD2-NE2 3.16Å; M635-Q639 WeakPolarHBondContact O-CG 3.17Å; M635-Q639 PolarHBondContact O-N 3.22Å; L636-Q639 WeakPolarHBondContact O-CB 3.44Å; L636-Q639 PolarHBondContact O-N 2.84Å; Q637-Q639 VanDerWaalsContact C-N 3.34Å; Q637-Q639 PolarHBondContact O-N 3.21Å; Q639-K642 PolarHBondContact O-N 3.25Å; Q639-K643 WeakPolarHBondContact O-CG 3.35Å; Q639-K643 PolarHBondContact O-N 3.46Å
640	A	82.6	Confident	76.4	Confident	17 Å²	17	23 Å²	23	14%	0.14	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-48.4	177.3	0	0	0	0	0	111.1	L636 Q637 K642 K643 A644 F707	L636-A640 PolarHBondContact O-N 3.12Å; Q637-A640 PolarHBondContact O-N 2.9Å; A640-K642 PolarHBondContact O-N 3.02Å; A640-K643 PolarHBondContact O-N 3.04Å; A640-K643 VanDerWaalsContact O-N 3.13Å; A640-A644 PolarHBondContact O-N 3.19Å; A640-F707 HydrophobicContact CB-CD2 4Å; A640-F707 HydrophobicContact CB-CE2 3.97Å
641	H	75.1	Confident	74.4	Confident	53 Å²	53	26.6 Å²	26.6	25%	0.245	14%	0.139	C	C	.	.	H	α-helix	trans	-56.6	-48.4	174.7	-175.1	-99.4	0	0	0	111.6	Q637 K643 A644 L645 E657	Q637-H641 PolarHBondContact O-N 3.28Å; H641-K643 VanDerWaalsContact C-N 3.33Å; H641-K643 PolarHBondContact O-N 3.46Å; H641-A644 PolarHBondContact O-N 2.68Å; H641-L645 WeakPolarHBondContact O-CB 3.39Å; H641-L645 VanDerWaalsContact O-CG 3.25Å; H641-L645 WeakPolarHBondContact O-CG 3.44Å; H641-L645 PolarHBondContact O-N 2.94Å; H641-E657 PolarHBondContact NE2-O 3.48Å; H641-E657 VanDerWaalsContact NE2-O 3.14Å
642	K	74.1	Confident	72.4	Confident	91 Å²	91	32.8 Å²	32.8	40%	0.396	17%	0.168	S	C	.	.	H	α-helix	trans	-61.2	-37.1	176.6	-77.7	-179.2	-179	-178.8	0	113.6	W599 P601 R638 Q639 A640 S646	W599-K642 PolarHBondContact O-NZ 3.45Å; P601-K642 HydrophobicContact CG-CB 4.24Å; R638-K642 WeakPolarHBondContact O-CB 3.06Å; R638-K642 VanDerWaalsContact O-CG 3.3Å; R638-K642 WeakPolarHBondContact O-CG 3.35Å; R638-K642 PolarHBondContact O-N 2.73Å; Q639-K642 PolarHBondContact O-N 3.25Å; A640-K642 PolarHBondContact O-N 3.02Å; K642-S646 WeakPolarHBondContact O-CB 3.4Å; K642-S646 PolarHBondContact O-N 3.16Å
643	K	72.8	Confident	69.8	Low	75 Å²	75	38.5 Å²	38.5	33%	0.326	19%	0.194	S	C	.	.	H	α-helix	trans	-67.1	-49.3	176.3	-77.6	-170.9	178.1	-163.3	0	110.8	P601 D605 Q639 A640 H641 L645 S646 S647	P601-K643 HydrophobicContact CB-CD 4.19Å; P601-K643 VanDerWaalsContact CB-CE 3.47Å; P601-K643 HydrophobicContact CB-CG 3.81Å; P601-K643 HydrophobicContact CG-CG 3.99Å; D605-K643 IonicContact OD1-NZ 2.94Å; D605-K643 PolarHBondContact OD1-NZ 2.97Å; D605-K643 WeakPolarHBondContact OD2-CE 3.3Å; D605-K643 IonicContact OD2-NZ 3.02Å; D605-K643 PolarHBondContact OD2-NZ 2.86Å; Q639-K643 WeakPolarHBondContact O-CG 3.35Å; Q639-K643 PolarHBondContact O-N 3.46Å; A640-K643 PolarHBondContact O-N 3.04Å; A640-K643 VanDerWaalsContact O-N 3.13Å; H641-K643 VanDerWaalsContact C-N 3.33Å; H641-K643 PolarHBondContact O-N 3.46Å; K643-L645 VanDerWaalsContact C-N 3.31Å; K643-L645 PolarHBondContact O-N 3.44Å; K643-S646 WeakPolarHBondContact O-CA 3.48Å; K643-S646 WeakPolarHBondContact O-CB 3.21Å; K643-S646 PolarHBondContact O-N 3.06Å; K643-S647 PolarHBondContact O-N 3.06Å
644	A	68.3	Low	67.2	Low	14 Å²	14	46.5 Å²	46.5	12%	0.116	23%	0.232	C	C	.	.	H	α-helix	trans	-57.2	-44.2	176.3	0	0	0	0	0	111.5	A640 H641 S646 S647 C648 V656	A640-A644 PolarHBondContact O-N 3.19Å; H641-A644 PolarHBondContact O-N 2.68Å; A644-S646 PolarHBondContact O-N 3.2Å; A644-S647 PolarHBondContact O-N 3.05Å; A644-S647 PolarHBondContact O-OG 3.38Å; A644-C648 PolarHBondContact O-N 3.41Å; A644-C648 PolarHBondContact O-SG 2.59Å; A644-V656 HydrophobicContact CB-CG2 4.34Å
645	L	62.9	Low	64.7	Low	15 Å²	15	55.2 Å²	55.2	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-36.3	174.9	-72.2	-172.7	0	0	0	112.9	N321 H641 K643 V649 V656 R658	N321-L645 WeakPolarHBondContact ND2-CB 3.37Å; N321-L645 PolarHBondContact ND2-O 3.22Å; N321-L645 PolarHBondContact OD1-O 3.07Å; H641-L645 WeakPolarHBondContact O-CB 3.39Å; H641-L645 VanDerWaalsContact O-CG 3.25Å; H641-L645 WeakPolarHBondContact O-CG 3.44Å; H641-L645 PolarHBondContact O-N 2.94Å; K643-L645 VanDerWaalsContact C-N 3.31Å; K643-L645 PolarHBondContact O-N 3.44Å; L645-V649 PolarHBondContact O-N 3.24Å; L645-V656 HydrophobicContact CD2-CB 3.53Å; L645-V656 HydrophobicContact CD2-CG1 3.35Å; L645-V656 HydrophobicContact CD2-CG2 4.33Å; L645-V656 HydrophobicContact CG-CG1 4.24Å; L645-R658 HydrophobicContact CD1-CG 3.89Å; L645-R658 HydrophobicContact CD2-CG 3.69Å; L645-R658 HydrophobicContact CG-CG 4.41Å; L645-R658 PolarHBondContact O-NH2 3.13Å
646	S	59.6	Low	62.3	Low	10 Å²	10	57.8 Å²	57.8	7%	0.07	29%	0.288	C	S	.	.	H	α-helix	trans	-80.4	-25.3	-175.2	-171.2	0	0	0	0	112.9	P318 N321 R385 K642 K643 A644	P318-S646 VanDerWaalsContact CB-OG 3.28Å; P318-S646 WeakPolarHBondContact CB-OG 3.42Å; N321-S646 VanDerWaalsContact ND2-CA 3.32Å; N321-S646 WeakPolarHBondContact ND2-CA 3.18Å; N321-S646 PolarHBondContact ND2-N 3.07Å; R385-S646 PolarHBondContact NH1-O 3.22Å; K642-S646 WeakPolarHBondContact O-CB 3.4Å; K642-S646 PolarHBondContact O-N 3.16Å; K643-S646 WeakPolarHBondContact O-CA 3.48Å; K643-S646 WeakPolarHBondContact O-CB 3.21Å; K643-S646 PolarHBondContact O-N 3.06Å; A644-S646 PolarHBondContact O-N 3.2Å
647	S	59.6	Low	59.7	Low	27 Å²	27	66.6 Å²	66.6	19%	0.189	33%	0.329	C	S	.	.	H	α-helix	trans	-73.5	-44.1	166.6	51.9	0	0	0	0	109.9	K643 A644 V649 V650 D651	K643-S647 PolarHBondContact O-N 3.06Å; A644-S647 PolarHBondContact O-N 3.05Å; A644-S647 PolarHBondContact O-OG 3.38Å; S647-V649 VanDerWaalsContact C-N 3.34Å; S647-V649 PolarHBondContact O-N 2.53Å; S647-V650 PolarHBondContact O-N 2.96Å; S647-D651 WeakPolarHBondContact O-CA 3.41Å; S647-D651 VanDerWaalsContact O-CB 3.29Å; S647-D651 WeakPolarHBondContact O-CB 3.36Å; S647-D651 PolarHBondContact O-N 3.11Å
648	C	54	Low	57.4	Low	22 Å²	22	68 Å²	68	15%	0.149	33%	0.333	C	S	.	.	H	α-helix	trans	-53.5	-45	-179.9	-67.3	0	0	0	0	114.2	A644 V650 Q652 Q653	A644-C648 PolarHBondContact O-N 3.41Å; A644-C648 PolarHBondContact O-SG 2.59Å; C648-V650 VanDerWaalsContact C-N 3.3Å; C648-V650 PolarHBondContact O-N 3.02Å; C648-Q652 PolarHBondContact O-N 3.02Å; C648-Q653 VanDerWaalsContact CB-O 3.26Å; C648-Q653 WeakPolarHBondContact CB-O 3.42Å; C648-Q653 PolarHBondContact SG-O 3.27Å
649	V	52.9	Low	55.3	Low	21 Å²	21	71 Å²	71	13%	0.127	35%	0.35	C	S	.	.	H	α-helix	trans	-69.7	-27.9	-178.7	174.5	0	0	0	0	112.7	N321 L376 L645 S647	N321-V649 WeakPolarHBondContact OD1-CG2 3.41Å; L376-V649 VanDerWaalsContact CD2-O 3.22Å; L376-V649 WeakPolarHBondContact CD2-O 3.34Å; L645-V649 PolarHBondContact O-N 3.24Å; S647-V649 VanDerWaalsContact C-N 3.34Å; S647-V649 PolarHBondContact O-N 2.53Å
650	V	52.4	Low	53.1	Low	54 Å²	54	76.3 Å²	76.3	33%	0.327	37%	0.373	S	S	.	.	H	α-helix	trans	-103.1	-29.2	-173.6	-175.9	0	0	0	0	112.5	R385 S647 C648	R385-V650 VanDerWaalsContact NH1-CB 3.3Å; S647-V650 PolarHBondContact O-N 2.96Å; C648-V650 VanDerWaalsContact C-N 3.3Å; C648-V650 PolarHBondContact O-N 3.02Å
651	D	51.1	Low	51.6	Low	76 Å²	76	78.4 Å²	78.4	41%	0.406	39%	0.386	S	S	.	.	H	α-helix	trans	-113.1	15.9	-170.9	-55	-40.5	0	0	0	112.7	S647 Q653	S647-D651 WeakPolarHBondContact O-CA 3.41Å; S647-D651 VanDerWaalsContact O-CB 3.29Å; S647-D651 WeakPolarHBondContact O-CB 3.36Å; S647-D651 PolarHBondContact O-N 3.11Å; D651-Q653 PolarHBondContact O-N 3.09Å; D651-Q653 VanDerWaalsContact O-N 3.14Å
652	Q	47.1	Very low	50.6	Low	131 Å²	131	81.5 Å²	81.5	61%	0.612	40%	0.404	S	S	*	.			trans	52	34.3	175.7	-64.8	-179.3	-27.1	0	0	114.5	C648	C648-Q652 PolarHBondContact O-N 3.02Å
653	Q	38.3	Very low	50	Low	119 Å²	119	81.6 Å²	81.6	56%	0.556	41%	0.409	S	S	*	.			trans	-89.9	118.8	175.4	-69.5	-178.6	-14.8	0	0	110.2	C648 D651	C648-Q653 VanDerWaalsContact CB-O 3.26Å; C648-Q653 WeakPolarHBondContact CB-O 3.42Å; C648-Q653 PolarHBondContact SG-O 3.27Å; D651-Q653 PolarHBondContact O-N 3.09Å; D651-Q653 VanDerWaalsContact O-N 3.14Å
654	E	37.9	Very low	49.7	Very low	169 Å²	169	79.7 Å²	79.7	79%	0.79	40%	0.403	S	S	*	.			trans	-70.3	151.6	176.5	-67.2	177.6	164	0	0	111.6
655	E	35.6	Very low	49.5	Very low	189 Å²	189	82.4 Å²	82.4	88%	0.883	42%	0.415	S	S	*	.			trans	74.4	84.9	172.3	-59	-172.2	165.4	0	0	118.6
656	V	38.4	Very low	49.9	Very low	54 Å²	54	87.8 Å²	87.8	33%	0.327	43%	0.434	S	S	.	.			trans	-141.4	112.2	147.7	-174.6	0	0	0	0	110.2	A644 L645 R658	A644-V656 HydrophobicContact CB-CG2 4.34Å; L645-V656 HydrophobicContact CD2-CB 3.53Å; L645-V656 HydrophobicContact CD2-CG1 3.35Å; L645-V656 HydrophobicContact CD2-CG2 4.33Å; L645-V656 HydrophobicContact CG-CG1 4.24Å; V656-R658 PolarHBondContact O-N 3.46Å
657	E	35.2	Very low	50.7	Low	184 Å²	184	90.8 Å²	90.8	86%	0.86	45%	0.447	S	S	*	.			trans	-59.3	132	172.5	-67.4	176.9	165.7	0	0	110.9	H641	H641-E657 PolarHBondContact NE2-O 3.48Å; H641-E657 VanDerWaalsContact NE2-O 3.14Å
658	R	39.2	Very low	51.5	Low	52 Å²	52	89.7 Å²	89.7	20%	0.196	44%	0.439	C	S	.	.			trans	-116.9	133.3	172.9	-62.4	-178.6	-172	-168.7	-3.1	107	N321 L645 V656	N321-R658 PolarHBondContact OD1-NH2 3.15Å; L645-R658 HydrophobicContact CD1-CG 3.89Å; L645-R658 HydrophobicContact CD2-CG 3.69Å; L645-R658 HydrophobicContact CG-CG 4.41Å; L645-R658 PolarHBondContact O-NH2 3.13Å; V656-R658 PolarHBondContact O-N 3.46Å
659	H	39.3	Very low	52.6	Low	116 Å²	116	89.5 Å²	89.5	54%	0.537	44%	0.436	S	S	.	.			trans	169	116.9	131	-82.7	-61.1	0	0	0	107	D357 S661	D357-H659 IonicContact OD1-CD2 2.87Å; D357-H659 IonicContact OD1-CE1 3.79Å; D357-H659 IonicContact OD1-NE2 3.85Å; D357-H659 PolarHBondContact OD1-NE2 3.29Å; H659-S661 PolarHBondContact O-N 3.21Å
660	F	39.8	Very low	54	Low	113 Å²	113	92.8 Å²	92.8	50%	0.496	45%	0.45	S	S	.	.			trans	-75.9	125.8	175	-72.6	-83	0	0	0	109.4	R638 D664	R638-F660 HydrophobicContact CG-CE1 4.18Å; R638-F660 HydrophobicContact CG-CZ 4Å; F660-D664 WeakPolarHBondContact CA-OD2 3.48Å; F660-D664 HydrophobicContact CB-CB 4.4Å; F660-D664 WeakPolarHBondContact CB-OD2 3.44Å; F660-D664 HydrophobicContact CD1-CB 3.7Å; F660-D664 WeakPolarHBondContact CD1-OD2 3.26Å
661	S	50.6	Low	55.6	Low	61 Å²	61	92.1 Å²	92.1	43%	0.427	44%	0.442	S	S	.	.			trans	-91.3	170.5	175	67.6	0	0	0	0	110.8	H659 D663 D664	H659-S661 PolarHBondContact O-N 3.21Å; S661-D663 PolarHBondContact O-N 3.2Å; S661-D663 PolarHBondContact OG-N 3.3Å; S661-D664 PolarHBondContact N-OD2 3.25Å; S661-D664 WeakPolarHBondContact O-CB 3.46Å; S661-D664 PolarHBondContact O-N 3.37Å; S661-D664 VanDerWaalsContact O-N 3.15Å; S661-D664 PolarHBondContact OG-OD2 3.19Å
662	L	54	Low	57.3	Low	118 Å²	118	91.2 Å²	91.2	62%	0.618	44%	0.436	S	S	*	.	H	α-helix	trans	-60.7	-21.9	170.3	-72.1	171.6	0	0	0	112.3	D664 L665	L662-D664 VanDerWaalsContact C-N 3.3Å; L662-D664 PolarHBondContact O-N 3.07Å; L662-L665 HydrophobicContact CD2-CD1 4.17Å; L662-L665 WeakPolarHBondContact O-CB 3.22Å; L662-L665 PolarHBondContact O-N 3.47Å
663	D	61.7	Low	59.1	Low	93 Å²	93	87.9 Å²	87.9	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-69.4	-29	176.8	-67.9	-44.3	0	0	0	112.1	S661 L665 R666 E667	S661-D663 PolarHBondContact O-N 3.2Å; S661-D663 PolarHBondContact OG-N 3.3Å; D663-L665 PolarHBondContact O-N 3.1Å; D663-R666 WeakPolarHBondContact O-CB 3.42Å; D663-R666 PolarHBondContact O-N 3Å; D663-R666 IonicContact OD1-NH1 2.87Å; D663-R666 PolarHBondContact OD1-NH1 2.92Å; D663-E667 PolarHBondContact O-N 3.08Å; D663-E667 VanDerWaalsContact O-N 3.1Å
664	D	64.8	Low	61.4	Low	36 Å²	36	90.9 Å²	90.9	19%	0.193	44%	0.441	C	S	.	.	H	α-helix	trans	-67.1	-24.3	174.9	-64.6	-57.7	0	0	0	113.2	F660 S661 L662 R666 L668	F660-D664 WeakPolarHBondContact CA-OD2 3.48Å; F660-D664 HydrophobicContact CB-CB 4.4Å; F660-D664 WeakPolarHBondContact CB-OD2 3.44Å; F660-D664 HydrophobicContact CD1-CB 3.7Å; F660-D664 WeakPolarHBondContact CD1-OD2 3.26Å; S661-D664 PolarHBondContact N-OD2 3.25Å; S661-D664 WeakPolarHBondContact O-CB 3.46Å; S661-D664 PolarHBondContact O-N 3.37Å; S661-D664 VanDerWaalsContact O-N 3.15Å; S661-D664 PolarHBondContact OG-OD2 3.19Å; L662-D664 VanDerWaalsContact C-N 3.3Å; L662-D664 PolarHBondContact O-N 3.07Å; D664-R666 VanDerWaalsContact C-N 3.35Å; D664-L668 WeakPolarHBondContact O-CG 3.4Å; D664-L668 PolarHBondContact O-N 3.49Å
665	L	64.9	Low	63.9	Low	71 Å²	71	84.2 Å²	84.2	37%	0.372	41%	0.412	S	S	.	.	H	α-helix	trans	-70.3	-34.4	171.6	-71.3	177.3	0	0	0	111.2	L662 D663 L668 F669	L662-L665 HydrophobicContact CD2-CD1 4.17Å; L662-L665 WeakPolarHBondContact O-CB 3.22Å; L662-L665 PolarHBondContact O-N 3.47Å; D663-L665 PolarHBondContact O-N 3.1Å; L665-L668 HydrophobicContact CD2-CD1 3.99Å; L665-L668 PolarHBondContact O-N 3.42Å; L665-F669 WeakPolarHBondContact O-CD2 3.46Å
666	R	70.8	Confident	66.5	Low	128 Å²	128	78.6 Å²	78.6	48%	0.483	39%	0.388	S	S	.	.	H	α-helix	trans	-67.1	-44.6	174.2	-67.8	177.6	174.5	157.8	-6.3	110.1	M430 D663 D664 L668 F669 M670	M430-R666 PolarHBondContact SD-NH2 3.41Å; D663-R666 WeakPolarHBondContact O-CB 3.42Å; D663-R666 PolarHBondContact O-N 3Å; D663-R666 IonicContact OD1-NH1 2.87Å; D663-R666 PolarHBondContact OD1-NH1 2.92Å; D664-R666 VanDerWaalsContact C-N 3.35Å; R666-L668 PolarHBondContact O-N 3.27Å; R666-F669 PolarHBondContact O-N 3.27Å; R666-F669 VanDerWaalsContact O-N 3.07Å; R666-M670 WeakPolarHBondContact O-CG 3.49Å; R666-M670 PolarHBondContact O-N 3.2Å
667	E	76.4	Confident	69	Low	72 Å²	72	76.1 Å²	76.1	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-58.1	-34.3	177.4	-66.2	-159	144.4	0	0	113.5	K634 D663 F669 M670 R682	K634-E667 WeakPolarHBondContact CE-O 3.43Å; D663-E667 PolarHBondContact O-N 3.08Å; D663-E667 VanDerWaalsContact O-N 3.1Å; E667-F669 PolarHBondContact O-N 3.39Å; E667-M670 PolarHBondContact O-N 2.72Å; E667-R682 IonicContact OE1-NH2 2.58Å; E667-R682 PolarHBondContact OE1-NH2 3.27Å; E667-R682 IonicContact OE2-CZ 3.58Å; E667-R682 IonicContact OE2-NH1 3.01Å; E667-R682 IonicContact OE2-NH2 3.29Å; E667-R682 PolarHBondContact OE2-NH2 2.95Å
668	L	76.2	Confident	71.7	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-32.1	176.9	-81.1	-179.6	0	0	0	113.7	W599 K634 D664 L665 R666	W599-L668 HydrophobicContact CH2-CD1 4.28Å; W599-L668 HydrophobicContact CH2-CD2 3.86Å; W599-L668 HydrophobicContact CZ3-CD2 4.36Å; K634-L668 HydrophobicContact CB-CD2 3.8Å; D664-L668 WeakPolarHBondContact O-CG 3.4Å; D664-L668 PolarHBondContact O-N 3.49Å; L665-L668 HydrophobicContact CD2-CD1 3.99Å; L665-L668 PolarHBondContact O-N 3.42Å; R666-L668 PolarHBondContact O-N 3.27Å
669	F	78.1	Confident	74.1	Confident	19 Å²	19	65.3 Å²	65.3	8%	0.083	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	1.7	-178.7	-65.2	-71.5	0	0	0	112.4	V419 M422 I449 L452 L665 R666 E667	V419-F669 WeakPolarHBondContact CG1-O 3.14Å; V419-F669 WeakPolarHBondContact CG2-O 3.39Å; M422-F669 HydrophobicContact CG-CD1 4.49Å; M422-F669 HydrophobicContact CG-CE1 4.49Å; I449-F669 HydrophobicContact CD1-CZ 4.19Å; I449-F669 HydrophobicContact CG1-CE1 3.84Å; I449-F669 HydrophobicContact CG1-CZ 3.74Å; L452-F669 HydrophobicContact CD1-CD1 3.83Å; L452-F669 HydrophobicContact CD1-CE1 4.14Å; L665-F669 WeakPolarHBondContact O-CD2 3.46Å; R666-F669 PolarHBondContact O-N 3.27Å; R666-F669 VanDerWaalsContact O-N 3.07Å; E667-F669 PolarHBondContact O-N 3.39Å
670	M	82.1	Confident	76.5	Confident	89 Å²	89	60.4 Å²	60.4	44%	0.438	30%	0.302	S	S	.	.			trans	-76.4	133.2	175.5	-69	179.2	69.6	0	0	110.9	R666 E667	R666-M670 WeakPolarHBondContact O-CG 3.49Å; R666-M670 PolarHBondContact O-N 3.2Å; E667-M670 PolarHBondContact O-N 2.72Å
671	Y	85.9	Confident	78.9	Confident	40 Å²	40	58.7 Å²	58.7	16%	0.157	30%	0.298	C	S	.	.			trans	-108.5	122.1	173.6	179.8	-122.9	0	0	0	110.1	L407 R412 Y415 G629 T630	L407-Y671 HydrophobicContact CD1-CE2 3.72Å; R412-Y671 HydrophobicContact CG-CE1 3.76Å; Y415-Y671 HydrophobicContact CD1-CD1 4.31Å; Y415-Y671 AromaticContact CD1-CD2 3.8Å; Y415-Y671 HydrophobicContact CD1-CD2 3.8Å; Y415-Y671 AromaticContact CD1-CG 3.72Å; Y415-Y671 HydrophobicContact CD1-CG 3.72Å; Y415-Y671 AromaticContact CE1-CD2 3.8Å; Y415-Y671 HydrophobicContact CE1-CD2 3.8Å; Y415-Y671 AromaticContact CE1-CG 3.94Å; Y415-Y671 HydrophobicContact CE1-CG 3.94Å; G629-Y671 WeakPolarHBondContact O-CA 3.41Å; G629-Y671 WeakPolarHBondContact O-CD2 3.23Å; T630-Y671 HydrophobicContact CG2-CD2 4.11Å; T630-Y671 HydrophobicContact CG2-CE2 3.92Å
672	H	87.6	Confident	80.5	Confident	57 Å²	57	60.6 Å²	60.6	26%	0.264	30%	0.296	S	S	.	.			trans	-105.9	101.5	176.3	-60.6	109.6	0	0	0	109.9	G629 T675 D678	G629-H672 PolarHBondContact O-N 3.48Å; H672-T675 HydrophobicContact CB-CG2 3.67Å; H672-T675 WeakPolarHBondContact CB-OG1 3.38Å; H672-T675 PolarHBondContact O-OG1 3.29Å; H672-D678 IonicContact CE1-OD1 3.46Å; H672-D678 PolarHBondContact CE1-OD1 2.95Å; H672-D678 VanDerWaalsContact CE1-OD1 3.28Å; H672-D678 IonicContact CG-OD1 2.65Å; H672-D678 IonicContact ND1-OD1 3.23Å; H672-D678 PolarHBondContact ND1-OD1 3.32Å
673	S	84.6	Confident	81.8	Confident	62 Å²	62	58.5 Å²	58.5	43%	0.434	28%	0.282	S	S	.	.	S	Bend	trans	-78.7	-23.4	-174.5	52.1	0	0	0	0	114.8
674	E	86.7	Confident	82.8	Confident	182 Å²	182	62.7 Å²	62.7	85%	0.85	30%	0.295	S	S	*	.	S	Bend	trans	-97.7	-14.1	-172.7	-62.7	-177.9	177.8	0	0	113.2
675	T	90	Very high	83.7	Confident	29 Å²	29	62 Å²	62	18%	0.178	29%	0.293	C	S	.	.			trans	-73.5	140.1	-177.7	54.8	0	0	0	0	110.7	T628 H672 D681	T628-T675 WeakPolarHBondContact CG2-O 3.44Å; H672-T675 HydrophobicContact CB-CG2 3.67Å; H672-T675 WeakPolarHBondContact CB-OG1 3.38Å; H672-T675 PolarHBondContact O-OG1 3.29Å; T675-D681 WeakPolarHBondContact CB-OD2 3.36Å; T675-D681 WeakPolarHBondContact CG2-OD2 3.48Å
676	L	90.6	Very high	84.8	Confident	71 Å²	71	69.9 Å²	69.9	37%	0.372	32%	0.318	S	S	.	.	S	Bend	trans	-75.5	-33	170.7	-62	176.9	0	0	0	111.6	T628 Y714 S734 F735	T628-L676 WeakPolarHBondContact CG2-O 3.47Å; L676-Y714 HydrophobicContact CD1-CD1 3.71Å; L676-Y714 HydrophobicContact CD1-CE1 4.22Å; L676-S734 WeakPolarHBondContact O-CB 3.17Å; L676-S734 PolarHBondContact O-OG 2.8Å; L676-F735 HydrophobicContact CB-CB 4.41Å; L676-F735 VanDerWaalsContact O-CB 3.28Å; L676-F735 WeakPolarHBondContact O-CB 3.43Å
677	S	91.4	Very high	85.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.007	30%	0.3	C	S	.	.			trans	-161.4	115.3	170.7	166.9	0	0	0	0	108.9	E633 T679 H680 D681 F737	E633-S677 VanDerWaalsContact OE1-C 3.28Å; E633-S677 VanDerWaalsContact OE1-CA 3.29Å; E633-S677 WeakPolarHBondContact OE1-CA 3.48Å; E633-S677 WeakPolarHBondContact OE1-CB 3.25Å; E633-S677 PolarHBondContact OE1-OG 3.04Å; S677-T679 PolarHBondContact O-N 3.45Å; S677-T679 PolarHBondContact OG-N 2.96Å; S677-H680 PolarHBondContact O-N 3.27Å; S677-H680 VanDerWaalsContact O-N 3.13Å; S677-H680 PolarHBondContact OG-N 3.12Å; S677-H680 VanDerWaalsContact OG-N 3.15Å; S677-D681 VanDerWaalsContact O-CG 3.26Å; S677-D681 PolarHBondContact O-N 2.51Å; S677-D681 VanDerWaalsContact O-N 3.09Å; S677-F737 WeakPolarHBondContact OG-CE2 3.44Å
678	D	91	Very high	86.1	Confident	9 Å²	9	62.5 Å²	62.5	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-28.8	174.7	174.3	94.8	0	0	0	111.9	E633 K634 Q637 H672 R682	E633-D678 HydrophobicContact CG-CB 4.22Å; E633-D678 PolarHBondContact OE1-N 3.29Å; E633-D678 WeakPolarHBondContact OE2-CB 3.44Å; E633-D678 PolarHBondContact OE2-N 2.98Å; K634-D678 VanDerWaalsContact CE-OD2 3.3Å; K634-D678 WeakPolarHBondContact CE-OD2 3.36Å; K634-D678 IonicContact NZ-OD1 3.63Å; K634-D678 PolarHBondContact NZ-OD1 3.35Å; K634-D678 IonicContact NZ-OD2 3.84Å; K634-D678 PolarHBondContact NZ-OD2 2.84Å; Q637-D678 PolarHBondContact NE2-OD2 3.06Å; H672-D678 IonicContact CE1-OD1 3.46Å; H672-D678 PolarHBondContact CE1-OD1 2.95Å; H672-D678 VanDerWaalsContact CE1-OD1 3.28Å; H672-D678 IonicContact CG-OD1 2.65Å; H672-D678 IonicContact ND1-OD1 3.23Å; H672-D678 PolarHBondContact ND1-OD1 3.32Å; D678-R682 WeakPolarHBondContact O-CG 3.31Å; D678-R682 PolarHBondContact O-N 3.14Å; D678-R682 VanDerWaalsContact O-N 3.13Å; D678-R682 IonicContact OD2-NE 3.22Å; D678-R682 PolarHBondContact OD2-NE 3.42Å
679	T	89.6	Confident	86.6	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-66.8	-44.6	173.7	-54.8	0	0	0	0	111.8	E633 Q637 S677 D681 R682 F683 F737	E633-T679 WeakPolarHBondContact CG-OG1 3.44Å; E633-T679 WeakPolarHBondContact OE1-CB 3.44Å; E633-T679 PolarHBondContact OE1-N 3.16Å; E633-T679 PolarHBondContact OE1-OG1 3.37Å; E633-T679 VanDerWaalsContact OE1-OG1 3.05Å; Q637-T679 HydrophobicContact CG-CG2 3.97Å; Q637-T679 VanDerWaalsContact NE2-CA 3.29Å; Q637-T679 PolarHBondContact NE2-OG1 3.13Å; Q637-T679 VanDerWaalsContact NE2-OG1 3.14Å; S677-T679 PolarHBondContact O-N 3.45Å; S677-T679 PolarHBondContact OG-N 2.96Å; T679-D681 VanDerWaalsContact C-N 3.33Å; T679-R682 PolarHBondContact O-N 3.13Å; T679-F683 HydrophobicContact CG2-CE2 3.65Å; T679-F683 HydrophobicContact CG2-CZ 3.6Å; T679-F683 VanDerWaalsContact O-CD2 3.27Å; T679-F683 WeakPolarHBondContact O-CD2 3.41Å; T679-F683 WeakPolarHBondContact O-CE2 3.36Å; T679-F683 PolarHBondContact O-N 3.03Å; T679-F737 HydrophobicContact CG2-CZ 4.17Å
680	H	90.5	Very high	86.8	Confident	13 Å²	13	72.2 Å²	72.2	6%	0.06	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-43.1	177.4	179.5	-82.7	0	0	0	110.8	S677 R682 F683 C685 H712 Y714 F735 F737	S677-H680 PolarHBondContact O-N 3.27Å; S677-H680 VanDerWaalsContact O-N 3.13Å; S677-H680 PolarHBondContact OG-N 3.12Å; S677-H680 VanDerWaalsContact OG-N 3.15Å; H680-R682 VanDerWaalsContact C-N 3.3Å; H680-R682 PolarHBondContact O-N 3.06Å; H680-F683 PolarHBondContact O-N 3.46Å; H680-F683 VanDerWaalsContact O-N 3.14Å; H680-C685 VanDerWaalsContact NE2-CB 3.3Å; H680-C685 WeakPolarHBondContact NE2-CB 3.35Å; H680-H712 AromaticContact CD2-CE1 3.86Å; H680-H712 AromaticContact CD2-ND1 3.44Å; H680-H712 PolarHBondContact CD2-ND1 2.95Å; H680-H712 AromaticContact NE2-ND1 3.49Å; H680-H712 PolarHBondContact NE2-ND1 3.25Å; H680-Y714 PolarHBondContact CE1-OH 3.39Å; H680-Y714 PolarHBondContact ND1-OH 3.49Å; H680-Y714 PolarHBondContact NE2-OH 2.78Å; H680-F735 HydrophobicContact CB-CE1 4.4Å; H680-F735 HydrophobicContact CB-CZ 4.27Å; H680-F735 AromaticContact CD2-CZ 3.79Å; H680-F737 HydrophobicContact CB-CE1 4.28Å; H680-F737 HydrophobicContact CB-CZ 3.77Å
681	D	88.8	Confident	86.9	Confident	77 Å²	77	70.6 Å²	70.6	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-37	-177	-63.6	-19.8	0	0	0	111.8	T675 S677 T679 F683 K684	T675-D681 WeakPolarHBondContact CB-OD2 3.36Å; T675-D681 WeakPolarHBondContact CG2-OD2 3.48Å; S677-D681 VanDerWaalsContact O-CG 3.26Å; S677-D681 PolarHBondContact O-N 2.51Å; S677-D681 VanDerWaalsContact O-N 3.09Å; T679-D681 VanDerWaalsContact C-N 3.33Å; D681-F683 VanDerWaalsContact C-N 3.3Å; D681-F683 PolarHBondContact O-N 3.4Å; D681-K684 PolarHBondContact O-N 3.31Å
682	R	85	Confident	87	Confident	101 Å²	101	72.9 Å²	72.9	38%	0.381	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-32.4	174.4	-79.3	177.7	176.8	-140.4	-21.4	113.9	K634 Q637 E667 D678 T679 H680 K684	K634-R682 VanDerWaalsContact NZ-CZ 3.26Å; Q637-R682 VanDerWaalsContact CD-CD 3.47Å; E667-R682 IonicContact OE1-NH2 2.58Å; E667-R682 PolarHBondContact OE1-NH2 3.27Å; E667-R682 IonicContact OE2-CZ 3.58Å; E667-R682 IonicContact OE2-NH1 3.01Å; E667-R682 IonicContact OE2-NH2 3.29Å; E667-R682 PolarHBondContact OE2-NH2 2.95Å; D678-R682 WeakPolarHBondContact O-CG 3.31Å; D678-R682 PolarHBondContact O-N 3.14Å; D678-R682 VanDerWaalsContact O-N 3.13Å; D678-R682 IonicContact OD2-NE 3.22Å; D678-R682 PolarHBondContact OD2-NE 3.42Å; T679-R682 PolarHBondContact O-N 3.13Å; H680-R682 VanDerWaalsContact C-N 3.3Å; H680-R682 PolarHBondContact O-N 3.06Å; R682-K684 PolarHBondContact O-N 2.71Å
683	F	82.1	Confident	87	Confident	73 Å²	73	72.1 Å²	72.1	32%	0.32	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-17.7	178.8	-62	-40.2	0	0	0	113.5	T679 H680 D681 C685 F707 F737	T679-F683 HydrophobicContact CG2-CE2 3.65Å; T679-F683 HydrophobicContact CG2-CZ 3.6Å; T679-F683 VanDerWaalsContact O-CD2 3.27Å; T679-F683 WeakPolarHBondContact O-CD2 3.41Å; T679-F683 WeakPolarHBondContact O-CE2 3.36Å; T679-F683 PolarHBondContact O-N 3.03Å; H680-F683 PolarHBondContact O-N 3.46Å; H680-F683 VanDerWaalsContact O-N 3.14Å; D681-F683 VanDerWaalsContact C-N 3.3Å; D681-F683 PolarHBondContact O-N 3.4Å; F683-C685 PolarHBondContact O-N 3.33Å; F683-F707 HydrophobicContact CE2-CB 3.85Å; F683-F707 HydrophobicContact CZ-CB 3.85Å; F683-F737 HydrophobicContact CE2-CE1 4.15Å; F683-F737 HydrophobicContact CE2-CZ 4.48Å
684	K	82.2	Confident	87.2	Confident	181 Å²	181	74.7 Å²	74.7	79%	0.787	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	50.2	-170.2	-61.6	179.6	-179.6	175.5	0	110.6	D681 R682 R686	D681-K684 PolarHBondContact O-N 3.31Å; R682-K684 PolarHBondContact O-N 2.71Å; K684-R686 PolarHBondContact O-N 3.41Å
685	C	84.1	Confident	87.2	Confident	21 Å²	21	72.3 Å²	72.3	14%	0.142	35%	0.351	C	S	.	.			trans	-59.6	119.5	-165.4	-174.4	0	0	0	0	112.4	H680 F683 R687 H712	H680-C685 VanDerWaalsContact NE2-CB 3.3Å; H680-C685 WeakPolarHBondContact NE2-CB 3.35Å; F683-C685 PolarHBondContact O-N 3.33Å; C685-R687 PolarHBondContact O-N 3.3Å; C685-R687 PolarHBondContact SG-N 3.23Å; C685-H712 VanDerWaalsContact SG-CE1 3.59Å; C685-H712 PolarHBondContact SG-ND1 3.21Å
686	R	86.6	Confident	87.1	Confident	237 Å²	237	75.7 Å²	75.7	89%	0.894	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.5	176.7	-58.2	-179.1	-175.5	177.7	1.5	113.8	K684	K684-R686 PolarHBondContact O-N 3.41Å
687	R	87.6	Confident	86.9	Confident	31 Å²	31	73.1 Å²	73.1	12%	0.117	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-16.1	-178.6	-57.3	-172.8	-63.7	115.3	5.2	112.8	C685 I694 K695 P696 S708 W710 H712	C685-R687 PolarHBondContact O-N 3.3Å; C685-R687 PolarHBondContact SG-N 3.23Å; R687-I694 PolarHBondContact O-N 2.92Å; R687-K695 HydrophobicContact CB-CB 4.12Å; R687-K695 HydrophobicContact CG-CB 4.19Å; R687-K695 PolarHBondContact O-N 3.49Å; R687-P696 PolarHBondContact NH1-O 3.11Å; R687-S708 PolarHBondContact NE-O 3.48Å; R687-S708 PolarHBondContact NH2-O 3.42Å; R687-W710 PolarHBondContact NH1-O 3.26Å; R687-W710 PolarHBondContact NH2-O 3.36Å; R687-H712 PolarHBondContact NH2-CE1 3.27Å; R687-H712 PolarHBondContact NH2-NE2 2.87Å
688	C	87.6	Confident	86.6	Confident	14 Å²	14	76 Å²	76	10%	0.095	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.4	-176.9	-60.7	0	0	0	0	109.9	V692 H712 Y714	C688-V692 WeakPolarHBondContact CA-O 3.13Å; C688-H712 VanDerWaalsContact SG-CB 3.54Å; C688-H712 PolarHBondContact SG-ND1 2.92Å; C688-H712 VanDerWaalsContact SG-ND1 3.39Å; C688-Y714 HydrophobicContact CB-CE2 3.9Å; C688-Y714 VanDerWaalsContact CB-OH 3.25Å; C688-Y714 WeakPolarHBondContact CB-OH 3.45Å
689	V	86.1	Confident	86.3	Confident	73 Å²	73	85.1 Å²	85.1	44%	0.442	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.1	175.6	-177.6	0	0	0	0	107.6	S691 V692 I694	V689-S691 VanDerWaalsContact C-N 3.27Å; V689-S691 PolarHBondContact O-N 3.46Å; V689-V692 PolarHBondContact N-O 2.92Å; V689-V692 PolarHBondContact O-N 3.38Å; V689-I694 HydrophobicContact CB-CD1 3.59Å; V689-I694 HydrophobicContact CB-CG1 4.35Å; V689-I694 HydrophobicContact CG1-CD1 4.44Å; V689-I694 HydrophobicContact CG2-CD1 3.75Å
690	N	83.4	Confident	85.8	Confident	154 Å²	154	89.2 Å²	89.2	82%	0.824	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	43.8	-179.9	-60.7	-20.9	0	0	0	113.6	V692	N690-V692 PolarHBondContact O-N 3.4Å
691	S	83.6	Confident	85.5	Confident	56 Å²	56	89.7 Å²	89.7	39%	0.392	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	32.2	-178.1	-57.8	0	0	0	0	114.3	V689 Y714	V689-S691 VanDerWaalsContact C-N 3.27Å; V689-S691 PolarHBondContact O-N 3.46Å; S691-Y714 WeakPolarHBondContact O-CB 3.3Å; S691-Y714 WeakPolarHBondContact O-CD2 3.38Å
692	V	87.1	Confident	85.2	Confident	87 Å²	87	87.6 Å²	87.6	53%	0.527	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.4	169.5	-177.7	0	0	0	0	108.7	C688 V689 N690 I694	C688-V692 WeakPolarHBondContact CA-O 3.13Å; V689-V692 PolarHBondContact N-O 2.92Å; V689-V692 PolarHBondContact O-N 3.38Å; N690-V692 PolarHBondContact O-N 3.4Å; V692-I694 PolarHBondContact O-N 3.27Å
693	Q	87.9	Confident	85.2	Confident	42 Å²	42	83.2 Å²	83.2	20%	0.196	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	109.8	171.3	-176.1	-176.6	-0.3	0	0	108.8	K695 N711 H712	Q693-K695 WeakPolarHBondContact CG-O 3.43Å; Q693-K695 PolarHBondContact NE2-O 2.86Å; Q693-N711 PolarHBondContact NE2-OD1 3Å; Q693-H712 WeakPolarHBondContact CB-O 3.25Å; Q693-H712 PolarHBondContact OE1-O 2.95Å
694	I	88.4	Confident	85	Confident	115 Å²	115	83.5 Å²	83.5	59%	0.59	45%	0.448	S	S	*	.			trans	-86.5	-38.7	-179.7	-60.9	-174.7	0	0	0	110.7	R687 V689 V692	R687-I694 PolarHBondContact O-N 2.92Å; V689-I694 HydrophobicContact CB-CD1 3.59Å; V689-I694 HydrophobicContact CB-CG1 4.35Å; V689-I694 HydrophobicContact CG1-CD1 4.44Å; V689-I694 HydrophobicContact CG2-CD1 3.75Å; V692-I694 PolarHBondContact O-N 3.27Å
695	K	87.8	Confident	84.9	Confident	133 Å²	133	76.1 Å²	76.1	58%	0.578	42%	0.419	S	S	*	.	S	Bend	trans	-104	130.9	179.3	-65.6	-175.9	179.4	-177.8	0	110.4	R687 Q693	R687-K695 HydrophobicContact CB-CB 4.12Å; R687-K695 HydrophobicContact CG-CB 4.19Å; R687-K695 PolarHBondContact O-N 3.49Å; Q693-K695 WeakPolarHBondContact CG-O 3.43Å; Q693-K695 PolarHBondContact NE2-O 2.86Å
696	P	86.8	Confident	85	Confident	100 Å²	100	78.5 Å²	78.5	65%	0.649	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-62.4	170.5	176.7	28	-34.5	0	0	0	111.5	R687	R687-P696 PolarHBondContact NH1-O 3.11Å
697	A	86.3	Confident	85	Confident	16 Å²	16	68 Å²	68	13%	0.132	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-57.1	146.5	165.8	0	0	0	0	0	110.1	Q709	A697-Q709 WeakPolarHBondContact CB-O 3.38Å
698	P	86.4	Confident	84.9	Confident	63 Å²	63	68.6 Å²	68.6	41%	0.409	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-57.6	144.6	174	-20.6	30.8	0	0	0	112.2	T701	P698-T701 HydrophobicContact CB-CG2 3.88Å; P698-T701 HydrophobicContact CG-CG2 4.2Å; P698-T701 WeakPolarHBondContact O-CB 3.33Å; P698-T701 VanDerWaalsContact O-CG2 3.31Å; P698-T701 WeakPolarHBondContact O-CG2 3.49Å; P698-T701 PolarHBondContact O-N 3.17Å; P698-T701 PolarHBondContact O-OG1 3.39Å
699	E	83.4	Confident	84.8	Confident	199 Å²	199	71.4 Å²	71.4	93%	0.93	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	141.6	175.2	-65.6	-176.9	-178.3	0	0	110.9	T701	E699-T701 VanDerWaalsContact C-N 3.33Å
700	G	80.4	Confident	85.1	Confident	87 Å²	87	68.1 Å²	68.1	90%	0.897	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-1.6	-178.3	0	0	0	0	0	115.6
701	T	83.4	Confident	85.5	Confident	24 Å²	24	61.9 Å²	61.9	15%	0.147	36%	0.358	C	S	.	.			trans	-76	149.9	173.5	56.8	0	0	0	0	112.1	P698 E699 Q709 H739	P698-T701 HydrophobicContact CB-CG2 3.88Å; P698-T701 HydrophobicContact CG-CG2 4.2Å; P698-T701 WeakPolarHBondContact O-CB 3.33Å; P698-T701 VanDerWaalsContact O-CG2 3.31Å; P698-T701 WeakPolarHBondContact O-CG2 3.49Å; P698-T701 PolarHBondContact O-N 3.17Å; P698-T701 PolarHBondContact O-OG1 3.39Å; E699-T701 VanDerWaalsContact C-N 3.33Å; T701-Q709 HydrophobicContact CG2-CB 4.1Å; T701-H739 PolarHBondContact O-NE2 3.36Å; T701-H739 PolarHBondContact OG1-CE1 3.44Å; T701-H739 VanDerWaalsContact OG1-CE1 3.28Å
702	D	83.7	Confident	85.9	Confident	33 Å²	33	59.3 Å²	59.3	18%	0.176	34%	0.34	C	S	.	.			trans	-138.1	-176.6	-178	75.9	-8.6	0	0	0	112	N704 S705 H739	D702-N704 PolarHBondContact O-N 3.45Å; D702-N704 VanDerWaalsContact O-N 3.09Å; D702-N704 WeakPolarHBondContact OD1-CA 2.95Å; D702-N704 WeakPolarHBondContact OD1-CB 3.45Å; D702-N704 PolarHBondContact OD1-N 3.46Å; D702-N704 PolarHBondContact OD2-ND2 3.3Å; D702-S705 PolarHBondContact N-OG 3.48Å; D702-S705 VanDerWaalsContact O-CB 3.24Å; D702-S705 WeakPolarHBondContact O-CB 3.12Å; D702-S705 PolarHBondContact O-N 3.11Å; D702-S705 VanDerWaalsContact O-N 3.09Å; D702-S705 PolarHBondContact O-OG 3.21Å; D702-S705 PolarHBondContact OD1-N 2.94Å; D702-S705 VanDerWaalsContact OD1-N 3.12Å; D702-S705 PolarHBondContact OD1-OG 3.42Å; D702-H739 WeakPolarHBondContact CA-CD2 3.47Å; D702-H739 WeakPolarHBondContact CA-NE2 3.2Å; D702-H739 PolarHBondContact N-NE2 3.4Å; D702-H739 PolarHBondContact O-CD2 3.5Å
703	C	83.4	Confident	86.1	Confident	8 Å²	8	55.3 Å²	55.3	5%	0.054	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.8	177.2	-59.4	0	0	0	0	114	E400 W710 S741	E400-C703 HydrophobicContact CB-CB 4.48Å; E400-C703 HydrophobicContact CG-CB 4.03Å; C703-W710 HydrophobicContact CB-CZ2 4.48Å; C703-W710 VanDerWaalsContact O-CZ2 3.29Å; C703-W710 WeakPolarHBondContact O-CZ2 3.34Å; C703-S741 PolarHBondContact SG-N 3.12Å; C703-S741 VanDerWaalsContact SG-N 3.42Å
704	N	78.5	Confident	86.2	Confident	80 Å²	80	54.9 Å²	54.9	43%	0.428	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.7	176.2	-56.7	-51.3	0	0	0	112.2	D702	D702-N704 PolarHBondContact O-N 3.45Å; D702-N704 VanDerWaalsContact O-N 3.09Å; D702-N704 WeakPolarHBondContact OD1-CA 2.95Å; D702-N704 WeakPolarHBondContact OD1-CB 3.45Å; D702-N704 PolarHBondContact OD1-N 3.46Å; D702-N704 PolarHBondContact OD2-ND2 3.3Å
705	S	81.3	Confident	86.2	Confident	25 Å²	25	53 Å²	53	18%	0.175	31%	0.306	C	S	.	.	S	Bend	trans	-68.4	159.5	176.4	-55.6	0	0	0	0	111.3	D702 W710	D702-S705 PolarHBondContact N-OG 3.48Å; D702-S705 VanDerWaalsContact O-CB 3.24Å; D702-S705 WeakPolarHBondContact O-CB 3.12Å; D702-S705 PolarHBondContact O-N 3.11Å; D702-S705 VanDerWaalsContact O-N 3.09Å; D702-S705 PolarHBondContact O-OG 3.21Å; D702-S705 PolarHBondContact OD1-N 2.94Å; D702-S705 VanDerWaalsContact OD1-N 3.12Å; D702-S705 PolarHBondContact OD1-OG 3.42Å; S705-W710 PolarHBondContact O-NE1 2.88Å
706	D	84.7	Confident	86.3	Confident	71 Å²	71	50.5 Å²	50.5	38%	0.38	30%	0.295	S	S	.	.			trans	-62.4	149.7	178.4	-76.8	-43.2	0	0	0	112.4	S708 Q709 W710	D706-S708 PolarHBondContact O-N 2.65Å; D706-Q709 WeakPolarHBondContact O-CA 3.35Å; D706-Q709 WeakPolarHBondContact O-CB 3.32Å; D706-Q709 PolarHBondContact O-N 3.11Å; D706-W710 PolarHBondContact O-N 3.02Å
707	F	86.5	Confident	86.1	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.079	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.3	177.5	-60.7	-48	0	0	0	113.3	V402 L636 A640 F683 Q709 W710 H712 F737	V402-F707 HydrophobicContact CG2-CE1 3.89Å; V402-F707 HydrophobicContact CG2-CZ 4.28Å; L636-F707 HydrophobicContact CD1-CE2 3.66Å; L636-F707 HydrophobicContact CD1-CZ 3.77Å; L636-F707 HydrophobicContact CD2-CE2 4.06Å; L636-F707 HydrophobicContact CG-CD2 4.44Å; L636-F707 HydrophobicContact CG-CE2 3.69Å; L636-F707 HydrophobicContact CG-CZ 4.27Å; A640-F707 HydrophobicContact CB-CD2 4Å; A640-F707 HydrophobicContact CB-CE2 3.97Å; F683-F707 HydrophobicContact CE2-CB 3.85Å; F683-F707 HydrophobicContact CZ-CB 3.85Å; F707-Q709 PolarHBondContact O-N 3.17Å; F707-W710 AromaticContact CD1-CD2 3.9Å; F707-W710 HydrophobicContact CD1-CD2 3.9Å; F707-W710 AromaticContact CD1-CE2 3.88Å; F707-W710 HydrophobicContact CD1-CE3 4.14Å; F707-W710 HydrophobicContact CD1-CG 4.37Å; F707-W710 HydrophobicContact CD1-CH2 4.37Å; F707-W710 HydrophobicContact CD1-CZ2 4.11Å; F707-W710 HydrophobicContact CD1-CZ3 4.39Å; F707-W710 HydrophobicContact CE1-CD2 4.43Å; F707-W710 HydrophobicContact CE1-CE3 4.45Å; F707-W710 AromaticContact CE1-CH2 3.95Å; F707-W710 HydrophobicContact CE1-CH2 3.95Å; F707-W710 AromaticContact CE1-CZ2 3.87Å; F707-W710 HydrophobicContact CE1-CZ2 3.87Å; F707-W710 HydrophobicContact CE1-CZ3 4.24Å; F707-W710 PolarHBondContact O-N 3.29Å; F707-H712 PolarHBondContact O-NE2 3.34Å; F707-F737 HydrophobicContact CB-CD1 4.33Å
708	S	85.8	Confident	85.8	Confident	42 Å²	42	56.5 Å²	56.5	29%	0.294	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22	172.9	65.8	0	0	0	0	112.9	R687 D706	R687-S708 PolarHBondContact NE-O 3.48Å; R687-S708 PolarHBondContact NH2-O 3.42Å; D706-S708 PolarHBondContact O-N 2.65Å
709	Q	86.4	Confident	85.8	Confident	73 Å²	73	53.7 Å²	53.7	34%	0.341	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-13.6	179.7	-60.8	-179	-5.6	0	0	113.1	A697 T701 D706 F707	A697-Q709 WeakPolarHBondContact CB-O 3.38Å; T701-Q709 HydrophobicContact CG2-CB 4.1Å; D706-Q709 WeakPolarHBondContact O-CA 3.35Å; D706-Q709 WeakPolarHBondContact O-CB 3.32Å; D706-Q709 PolarHBondContact O-N 3.11Å; F707-Q709 PolarHBondContact O-N 3.17Å
710	W	91.4	Very high	85.7	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.015	28%	0.279	C	S	.	.	S	Bend	trans	-68.9	169.6	177.6	-73.5	31.3	0	0	0	112.8	E400 V402 R687 C703 S705 D706 F707 H712 F737 H739	E400-W710 HydrophobicContact CB-CH2 3.58Å; E400-W710 HydrophobicContact CB-CZ3 3.94Å; V402-W710 HydrophobicContact CG2-CZ3 4.22Å; R687-W710 PolarHBondContact NH1-O 3.26Å; R687-W710 PolarHBondContact NH2-O 3.36Å; C703-W710 HydrophobicContact CB-CZ2 4.48Å; C703-W710 VanDerWaalsContact O-CZ2 3.29Å; C703-W710 WeakPolarHBondContact O-CZ2 3.34Å; S705-W710 PolarHBondContact O-NE1 2.88Å; D706-W710 PolarHBondContact O-N 3.02Å; F707-W710 AromaticContact CD1-CD2 3.9Å; F707-W710 HydrophobicContact CD1-CD2 3.9Å; F707-W710 AromaticContact CD1-CE2 3.88Å; F707-W710 HydrophobicContact CD1-CE3 4.14Å; F707-W710 HydrophobicContact CD1-CG 4.37Å; F707-W710 HydrophobicContact CD1-CH2 4.37Å; F707-W710 HydrophobicContact CD1-CZ2 4.11Å; F707-W710 HydrophobicContact CD1-CZ3 4.39Å; F707-W710 HydrophobicContact CE1-CD2 4.43Å; F707-W710 HydrophobicContact CE1-CE3 4.45Å; F707-W710 AromaticContact CE1-CH2 3.95Å; F707-W710 HydrophobicContact CE1-CH2 3.95Å; F707-W710 AromaticContact CE1-CZ2 3.87Å; F707-W710 HydrophobicContact CE1-CZ2 3.87Å; F707-W710 HydrophobicContact CE1-CZ3 4.24Å; F707-W710 PolarHBondContact O-N 3.29Å; W710-H712 PolarHBondContact O-CD2 3.43Å; W710-H712 PolarHBondContact O-NE2 3.38Å; W710-F737 HydrophobicContact CE3-CB 4.06Å; W710-H739 HydrophobicContact CB-CB 4.4Å; W710-H739 HydrophobicContact CD2-CB 3.66Å; W710-H739 HydrophobicContact CE3-CB 3.92Å; W710-H739 HydrophobicContact CG-CB 3.88Å; W710-H739 HydrophobicContact CZ3-CB 4.46Å
711	N	92.2	Very high	86.2	Confident	24 Å²	24	44.5 Å²	44.5	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	136.9	170.2	-63.6	-64.6	0	0	0	111.1	Q693 F737 W738	Q693-N711 PolarHBondContact NE2-OD1 3Å; N711-F737 WeakPolarHBondContact O-CA 3.3Å; N711-W738 HydrophobicContact CB-CD2 4.32Å; N711-W738 HydrophobicContact CB-CG 4.33Å; N711-W738 HydrophobicContact CB-CZ2 4.33Å; N711-W738 WeakPolarHBondContact CB-O 3.41Å; N711-W738 PolarHBondContact N-O 2.96Å; N711-W738 PolarHBondContact O-N 3.27Å
712	H	92.8	Very high	86.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	106.1	-170.2	-71.4	179.8	0	0	0	108.7	H680 C685 R687 C688 Q693 F707 W710 F735 F737	H680-H712 AromaticContact CD2-CE1 3.86Å; H680-H712 AromaticContact CD2-ND1 3.44Å; H680-H712 PolarHBondContact CD2-ND1 2.95Å; H680-H712 AromaticContact NE2-ND1 3.49Å; H680-H712 PolarHBondContact NE2-ND1 3.25Å; C685-H712 VanDerWaalsContact SG-CE1 3.59Å; C685-H712 PolarHBondContact SG-ND1 3.21Å; R687-H712 PolarHBondContact NH2-CE1 3.27Å; R687-H712 PolarHBondContact NH2-NE2 2.87Å; C688-H712 VanDerWaalsContact SG-CB 3.54Å; C688-H712 PolarHBondContact SG-ND1 2.92Å; C688-H712 VanDerWaalsContact SG-ND1 3.39Å; Q693-H712 WeakPolarHBondContact CB-O 3.25Å; Q693-H712 PolarHBondContact OE1-O 2.95Å; F707-H712 PolarHBondContact O-NE2 3.34Å; W710-H712 PolarHBondContact O-CD2 3.43Å; W710-H712 PolarHBondContact O-NE2 3.38Å; H712-F735 HydrophobicContact CB-CE2 4.49Å; H712-F735 HydrophobicContact CB-CZ 3.76Å; H712-F737 AromaticContact CD2-CD1 3.49Å; H712-F737 VanDerWaalsContact CD2-CD1 3.49Å; H712-F737 WeakPolarHBondContact CD2-CD1 3.29Å; H712-F737 AromaticContact CD2-CE1 3.78Å; H712-F737 AromaticContact NE2-CD1 3.67Å; H712-F737 AromaticContact NE2-CE1 3.7Å
713	C	91.5	Very high	86.9	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.1	-174.3	-69.1	0	0	0	0	111.6	L719 F735 V736 W738	C713-L719 HydrophobicContact CB-CD2 4.06Å; C713-F735 WeakPolarHBondContact O-CD2 3.39Å; C713-V736 HydrophobicContact CB-CB 4.3Å; C713-V736 WeakPolarHBondContact CB-O 3.25Å; C713-V736 PolarHBondContact N-O 2.84Å; C713-V736 PolarHBondContact O-N 3.07Å; C713-W738 PolarHBondContact SG-NE1 3.41Å
714	Y	90	Very high	87.4	Confident	33 Å²	33	45.5 Å²	45.5	13%	0.129	25%	0.245	C	C	.	.	S	Bend	trans	-92.1	-17	169.4	-57.4	-92	0	0	0	112.8	L676 H680 C688 S691 F735	L676-Y714 HydrophobicContact CD1-CD1 3.71Å; L676-Y714 HydrophobicContact CD1-CE1 4.22Å; H680-Y714 PolarHBondContact CE1-OH 3.39Å; H680-Y714 PolarHBondContact ND1-OH 3.49Å; H680-Y714 PolarHBondContact NE2-OH 2.78Å; C688-Y714 HydrophobicContact CB-CE2 3.9Å; C688-Y714 VanDerWaalsContact CB-OH 3.25Å; C688-Y714 WeakPolarHBondContact CB-OH 3.45Å; S691-Y714 WeakPolarHBondContact O-CB 3.3Å; S691-Y714 WeakPolarHBondContact O-CD2 3.38Å; Y714-F735 AromaticContact CD1-CD2 3.55Å; Y714-F735 HydrophobicContact CD1-CD2 3.55Å; Y714-F735 AromaticContact CD1-CE2 3.52Å; Y714-F735 HydrophobicContact CD1-CE2 3.52Å; Y714-F735 AromaticContact CD2-CE2 3.93Å; Y714-F735 HydrophobicContact CD2-CE2 3.93Å; Y714-F735 AromaticContact CE1-CD2 3.77Å; Y714-F735 HydrophobicContact CE1-CD2 3.77Å; Y714-F735 AromaticContact CE1-CE2 3.42Å; Y714-F735 HydrophobicContact CE1-CE2 3.42Å; Y714-F735 VanDerWaalsContact CE1-CE2 3.42Å; Y714-F735 AromaticContact CE2-CE2 3.84Å; Y714-F735 HydrophobicContact CE2-CE2 3.84Å; Y714-F735 HydrophobicContact CG-CD2 4.02Å; Y714-F735 AromaticContact CG-CE2 3.8Å; Y714-F735 HydrophobicContact CG-CE2 3.8Å; Y714-F735 AromaticContact CZ-CE2 3.6Å
715	T	88	Confident	88	Confident	75 Å²	75	45 Å²	45	46%	0.46	24%	0.24	S	C	.	.	S	Bend	trans	-135.6	154.5	-179.1	70.4	0	0	0	0	110.5	K717	T715-K717 PolarHBondContact O-N 2.72Å; T715-K717 VanDerWaalsContact O-N 3.08Å
716	K	88.5	Confident	88.5	Confident	82 Å²	82	45.9 Å²	45.9	36%	0.357	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-61.7	-16.2	-179.5	66.4	-177.8	-176.5	179.5	0	115.3	A718 L719 K725 W728 D729	K716-A718 PolarHBondContact O-N 3.37Å; K716-L719 PolarHBondContact O-N 2.85Å; K716-K725 VanDerWaalsContact O-CE 3.25Å; K716-K725 WeakPolarHBondContact O-CE 3.41Å; K716-K725 WeakPolarHBondContact O-CG 3.11Å; K716-W728 HydrophobicContact CB-CB 3.98Å; K716-W728 HydrophobicContact CB-CD2 4.16Å; K716-W728 HydrophobicContact CB-CE3 4.45Å; K716-W728 HydrophobicContact CB-CG 3.92Å; K716-D729 IonicContact NZ-OD1 3.45Å; K716-D729 PolarHBondContact NZ-OD1 2.58Å; K716-D729 IonicContact NZ-OD2 3.44Å; K716-D729 PolarHBondContact NZ-OD2 2.71Å
717	K	83	Confident	88.8	Confident	185 Å²	185	42.5 Å²	42.5	80%	0.804	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-63.2	-40.8	-173	-69.1	-176.1	179.8	179	0	113.1	T715	T715-K717 PolarHBondContact O-N 2.72Å; T715-K717 VanDerWaalsContact O-N 3.08Å
718	A	79.9	Confident	89	Confident	56 Å²	56	43 Å²	43	46%	0.463	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-85.7	-2.4	-172.7	0	0	0	0	0	114.5	K716 W738	K716-A718 PolarHBondContact O-N 3.37Å; A718-W738 WeakPolarHBondContact O-CZ2 3.39Å; A718-W738 PolarHBondContact O-NE1 3.09Å
719	L	86.1	Confident	88.9	Confident	5 Å²	5	46 Å²	46	3%	0.026	24%	0.244	C	C	.	.			trans	-70.8	150	176.2	-66.9	177.2	0	0	0	110.9	C713 K716 L724 K725 W728 V736 W738	C713-L719 HydrophobicContact CB-CD2 4.06Å; K716-L719 PolarHBondContact O-N 2.85Å; L719-L724 HydrophobicContact CD1-CB 4.35Å; L719-L724 HydrophobicContact CD1-CD2 3.96Å; L719-L724 HydrophobicContact CD1-CG 3.95Å; L719-L724 HydrophobicContact CD2-CD2 4.28Å; L719-K725 VanDerWaalsContact C-CE 3.49Å; L719-K725 HydrophobicContact CB-CG 3.86Å; L719-K725 HydrophobicContact CD1-CG 4.27Å; L719-K725 WeakPolarHBondContact O-CE 3.26Å; L719-K725 PolarHBondContact O-NZ 2.81Å; L719-W728 HydrophobicContact CD1-CE3 3.63Å; L719-W728 HydrophobicContact CD1-CZ3 3.85Å; L719-V736 HydrophobicContact CD2-CB 4.08Å; L719-V736 HydrophobicContact CD2-CG1 3.69Å; L719-W738 HydrophobicContact CD2-CG 4.38Å
720	N	82.2	Confident	88.6	Confident	92 Å²	92	44.2 Å²	44.2	49%	0.492	24%	0.238	S	C	.	.	S	Bend	trans	-93.6	-28.5	171.6	-161.1	7.5	0	0	0	112.3	I399 P722 W738	I399-N720 HydrophobicContact CD1-CB 4.36Å; N720-P722 VanDerWaalsContact O-CD 3.28Å; N720-P722 WeakPolarHBondContact O-CD 3.39Å; N720-W738 HydrophobicContact CB-CE3 4.47Å; N720-W738 HydrophobicContact CB-CH2 3.72Å; N720-W738 HydrophobicContact CB-CZ2 4.34Å; N720-W738 HydrophobicContact CB-CZ3 3.78Å
721	D	90.6	Very high	88.3	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.267	C	S	.	.			trans	-79.7	113.9	-178.6	179.1	26.4	0	0	0	112.1	R591 Y621 Y623 V723 L724 K725	R591-D721 IonicContact CZ-OD1 3.57Å; R591-D721 IonicContact NH1-OD1 2.79Å; R591-D721 PolarHBondContact NH1-OD1 3.39Å; R591-D721 IonicContact NH1-OD2 2.71Å; Y621-D721 HydrophobicContact CD1-CB 3.94Å; Y621-D721 HydrophobicContact CE1-CB 3.84Å; Y623-D721 VanDerWaalsContact CE1-OD2 3.27Å; Y623-D721 WeakPolarHBondContact CE1-OD2 3.2Å; Y623-D721 PolarHBondContact OH-OD2 3Å; D721-V723 PolarHBondContact O-N 2.8Å; D721-V723 WeakPolarHBondContact OD1-CB 3.48Å; D721-V723 PolarHBondContact OD1-N 3.05Å; D721-V723 VanDerWaalsContact OD1-N 3.12Å; D721-L724 HydrophobicContact CB-CB 4.12Å; D721-L724 PolarHBondContact O-N 3.38Å; D721-L724 WeakPolarHBondContact OD2-CB 3.46Å; D721-L724 PolarHBondContact OD2-N 3.33Å; D721-L724 VanDerWaalsContact OD2-N 3.08Å; D721-K725 WeakPolarHBondContact O-CG 3.36Å; D721-K725 PolarHBondContact O-N 3.42Å; D721-K725 VanDerWaalsContact O-N 3.12Å
722	P	90.3	Very high	88.1	Confident	84 Å²	84	46.4 Å²	46.4	55%	0.545	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-27.9	178.4	26.9	-34.8	0	0	0	112.6	N720 K725 A726	N720-P722 VanDerWaalsContact O-CD 3.28Å; N720-P722 WeakPolarHBondContact O-CD 3.39Å; P722-K725 PolarHBondContact O-N 3.01Å; P722-A726 PolarHBondContact O-N 3.41Å
723	V	92.7	Very high	88.1	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-51.9	178.8	-179.5	0	0	0	0	109.6	L508 V511 I512 D721 K725 A726 T727	L508-V723 HydrophobicContact CD1-CG1 3.61Å; V511-V723 HydrophobicContact CB-CG1 4.03Å; V511-V723 HydrophobicContact CG1-CB 4.23Å; V511-V723 HydrophobicContact CG1-CG1 3.71Å; V511-V723 HydrophobicContact CG1-CG2 4.4Å; I512-V723 HydrophobicContact CD1-CG1 4.29Å; I512-V723 HydrophobicContact CG1-CG1 3.48Å; I512-V723 VanDerWaalsContact CG1-CG1 3.48Å; I512-V723 HydrophobicContact CG1-CG2 4.39Å; D721-V723 PolarHBondContact O-N 2.8Å; D721-V723 WeakPolarHBondContact OD1-CB 3.48Å; D721-V723 PolarHBondContact OD1-N 3.05Å; D721-V723 VanDerWaalsContact OD1-N 3.12Å; V723-K725 PolarHBondContact O-N 3.31Å; V723-A726 PolarHBondContact O-N 3.23Å; V723-A726 VanDerWaalsContact O-N 3.11Å; V723-T727 WeakPolarHBondContact O-CG2 3.34Å; V723-T727 PolarHBondContact O-N 3.45Å; V723-T727 VanDerWaalsContact O-N 3.09Å
724	L	92.7	Very high	88.2	Confident	1 Å²	1	47 Å²	47	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-30.8	176.9	-169.5	64.6	0	0	0	112.9	Q401 V403 Y623 L719 D721 A726 T727 W728 I733 V736	Q401-L724 HydrophobicContact CB-CD2 4.2Å; Q401-L724 HydrophobicContact CG-CD2 4.41Å; Q401-L724 VanDerWaalsContact OE1-CD2 3.24Å; V403-L724 HydrophobicContact CG1-CD1 4.33Å; V403-L724 HydrophobicContact CG2-CD1 3.87Å; V403-L724 HydrophobicContact CG2-CD2 3.96Å; Y623-L724 HydrophobicContact CD1-CD1 4.42Å; Y623-L724 HydrophobicContact CE1-CB 4.24Å; Y623-L724 HydrophobicContact CE1-CD1 4.45Å; L719-L724 HydrophobicContact CD1-CB 4.35Å; L719-L724 HydrophobicContact CD1-CD2 3.96Å; L719-L724 HydrophobicContact CD1-CG 3.95Å; L719-L724 HydrophobicContact CD2-CD2 4.28Å; D721-L724 HydrophobicContact CB-CB 4.12Å; D721-L724 PolarHBondContact O-N 3.38Å; D721-L724 WeakPolarHBondContact OD2-CB 3.46Å; D721-L724 PolarHBondContact OD2-N 3.33Å; D721-L724 VanDerWaalsContact OD2-N 3.08Å; L724-A726 VanDerWaalsContact C-N 3.35Å; L724-T727 WeakPolarHBondContact CA-OG1 3.28Å; L724-T727 PolarHBondContact O-N 3.01Å; L724-T727 PolarHBondContact O-OG1 2.92Å; L724-W728 PolarHBondContact O-N 2.94Å; L724-I733 HydrophobicContact CD1-CD1 3.91Å; L724-V736 HydrophobicContact CD2-CG1 4.09Å; L724-V736 HydrophobicContact CD2-CG2 4.17Å
725	K	92.4	Very high	88.4	Confident	71 Å²	71	45.4 Å²	45.4	31%	0.309	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-43.5	172.7	-75.8	-175.8	-177.9	174.6	0	112.5	K716 L719 D721 P722 V723 W728	K716-K725 VanDerWaalsContact O-CE 3.25Å; K716-K725 WeakPolarHBondContact O-CE 3.41Å; K716-K725 WeakPolarHBondContact O-CG 3.11Å; L719-K725 VanDerWaalsContact C-CE 3.49Å; L719-K725 HydrophobicContact CB-CG 3.86Å; L719-K725 HydrophobicContact CD1-CG 4.27Å; L719-K725 WeakPolarHBondContact O-CE 3.26Å; L719-K725 PolarHBondContact O-NZ 2.81Å; D721-K725 WeakPolarHBondContact O-CG 3.36Å; D721-K725 PolarHBondContact O-N 3.42Å; D721-K725 VanDerWaalsContact O-N 3.12Å; P722-K725 PolarHBondContact O-N 3.01Å; V723-K725 PolarHBondContact O-N 3.31Å; K725-W728 WeakPolarHBondContact O-CB 3.09Å; K725-W728 PolarHBondContact O-N 3.21Å
726	A	91.1	Very high	88.7	Confident	42 Å²	42	41.8 Å²	41.8	35%	0.347	24%	0.241	S	C	.	.	H	α-helix	trans	-70.4	-34.8	179.1	0	0	0	0	0	111.7	V511 P722 V723 L724 W728 D729	V511-A726 HydrophobicContact CG1-CB 3.97Å; V511-A726 HydrophobicContact CG2-CB 4.06Å; P722-A726 PolarHBondContact O-N 3.41Å; V723-A726 PolarHBondContact O-N 3.23Å; V723-A726 VanDerWaalsContact O-N 3.11Å; L724-A726 VanDerWaalsContact C-N 3.35Å; A726-W728 VanDerWaalsContact C-N 3.32Å; A726-W728 PolarHBondContact O-N 3.22Å; A726-D729 WeakPolarHBondContact O-CB 3.49Å; A726-D729 PolarHBondContact O-N 3Å
727	T	90.3	Very high	89	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.1	-22.2	177.3	62.4	0	0	0	0	113.7	C507 L508 V511 V723 L724 D729 T730	C507-T727 HydrophobicContact CB-CG2 4.2Å; L508-T727 HydrophobicContact CB-CG2 3.9Å; L508-T727 HydrophobicContact CD1-CG2 3.87Å; V511-T727 HydrophobicContact CB-CG2 4.5Å; V511-T727 HydrophobicContact CG2-CG2 4.19Å; V723-T727 WeakPolarHBondContact O-CG2 3.34Å; V723-T727 PolarHBondContact O-N 3.45Å; V723-T727 VanDerWaalsContact O-N 3.09Å; L724-T727 WeakPolarHBondContact CA-OG1 3.28Å; L724-T727 PolarHBondContact O-N 3.01Å; L724-T727 PolarHBondContact O-OG1 2.92Å; T727-D729 PolarHBondContact O-N 3.36Å; T727-T730 WeakPolarHBondContact O-CB 3.38Å; T727-T730 VanDerWaalsContact O-CG2 3.26Å; T727-T730 WeakPolarHBondContact O-CG2 3.45Å; T727-T730 PolarHBondContact O-N 2.68Å; T727-T730 VanDerWaalsContact O-N 3.11Å; T727-T730 PolarHBondContact O-OG1 3.48Å
728	W	91.5	Very high	89.5	Confident	29 Å²	29	30.3 Å²	30.3	11%	0.11	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-57.1	-28.8	172.5	-158	-64.4	0	0	0	112.1	K716 L719 L724 K725 A726 T730 G731 I733 V736	K716-W728 HydrophobicContact CB-CB 3.98Å; K716-W728 HydrophobicContact CB-CD2 4.16Å; K716-W728 HydrophobicContact CB-CE3 4.45Å; K716-W728 HydrophobicContact CB-CG 3.92Å; L719-W728 HydrophobicContact CD1-CE3 3.63Å; L719-W728 HydrophobicContact CD1-CZ3 3.85Å; L724-W728 PolarHBondContact O-N 2.94Å; K725-W728 WeakPolarHBondContact O-CB 3.09Å; K725-W728 PolarHBondContact O-N 3.21Å; A726-W728 VanDerWaalsContact C-N 3.32Å; A726-W728 PolarHBondContact O-N 3.22Å; W728-T730 PolarHBondContact O-N 3.07Å; W728-T730 VanDerWaalsContact O-N 3.07Å; W728-G731 PolarHBondContact O-N 3.36Å; W728-G731 VanDerWaalsContact O-N 3.12Å; W728-I733 HydrophobicContact CB-CD1 4.38Å; W728-I733 HydrophobicContact CD2-CB 3.97Å; W728-I733 HydrophobicContact CD2-CG2 3.81Å; W728-I733 HydrophobicContact CE3-CB 4.24Å; W728-I733 HydrophobicContact CE3-CD1 4.41Å; W728-I733 HydrophobicContact CE3-CG2 3.64Å; W728-I733 HydrophobicContact CG-CB 4.29Å; W728-I733 HydrophobicContact CH2-CG2 3.78Å; W728-I733 HydrophobicContact CZ2-CG2 3.92Å; W728-I733 HydrophobicContact CZ3-CG2 3.67Å; W728-V736 HydrophobicContact CE3-CG2 4.05Å; W728-V736 HydrophobicContact CH2-CB 4.26Å; W728-V736 HydrophobicContact CH2-CG2 3.88Å; W728-V736 HydrophobicContact CZ3-CB 3.8Å; W728-V736 HydrophobicContact CZ3-CG2 3.24Å
729	D	82.8	Confident	90.1	Very high	104 Å²	104	27.8 Å²	27.8	56%	0.556	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-68.8	-5.6	-180	-66.2	-25	0	0	0	113.8	K716 A726 T727 G731	K716-D729 IonicContact NZ-OD1 3.45Å; K716-D729 PolarHBondContact NZ-OD1 2.58Å; K716-D729 IonicContact NZ-OD2 3.44Å; K716-D729 PolarHBondContact NZ-OD2 2.71Å; A726-D729 WeakPolarHBondContact O-CB 3.49Å; A726-D729 PolarHBondContact O-N 3Å; T727-D729 PolarHBondContact O-N 3.36Å; D729-G731 PolarHBondContact O-N 3.16Å
730	T	80.1	Confident	90.3	Very high	37 Å²	37	30.2 Å²	30.2	23%	0.227	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-64.4	-20	167.7	56.1	0	0	0	0	113.7	C507 T727 W728 C732	C507-T730 HydrophobicContact CB-CG2 3.48Å; C507-T730 VanDerWaalsContact CB-CG2 3.48Å; C507-T730 WeakPolarHBondContact SG-CG2 3.22Å; T727-T730 WeakPolarHBondContact O-CB 3.38Å; T727-T730 VanDerWaalsContact O-CG2 3.26Å; T727-T730 WeakPolarHBondContact O-CG2 3.45Å; T727-T730 PolarHBondContact O-N 2.68Å; T727-T730 VanDerWaalsContact O-N 3.11Å; T727-T730 PolarHBondContact O-OG1 3.48Å; W728-T730 PolarHBondContact O-N 3.07Å; W728-T730 VanDerWaalsContact O-N 3.07Å; T730-C732 PolarHBondContact O-N 3Å; T730-C732 PolarHBondContact OG1-N 3.2Å
731	G	85.3	Confident	90.4	Very high	61 Å²	61	26.4 Å²	26.4	63%	0.629	16%	0.158	S	C	*	.	S	Bend	trans	76.3	0.6	-175.1	0	0	0	0	0	114.4	W728 D729	W728-G731 PolarHBondContact O-N 3.36Å; W728-G731 VanDerWaalsContact O-N 3.12Å; D729-G731 PolarHBondContact O-N 3.16Å
732	C	89.4	Confident	90.1	Very high	13 Å²	13	28.7 Å²	28.7	9%	0.088	17%	0.169	C	C	.	.			trans	-88.4	-22.8	-178.8	-60.8	0	0	0	0	113.4	C405 N406 Q503 V504 T730	C405-C732 CarbonylContact C-O 3.6Å; C405-C732 WeakPolarHBondContact CA-O 3.36Å; N406-C732 PolarHBondContact N-O 3.11Å; Q503-C732 PolarHBondContact OE1-SG 3.07Å; V504-C732 HydrophobicContact CG2-CB 3.71Å; T730-C732 PolarHBondContact O-N 3Å; T730-C732 PolarHBondContact OG1-N 3.2Å
733	I	92.9	Very high	89.4	Confident	7 Å²	7	31 Å²	31	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.3	-178	-55.3	-176.8	0	0	0	109.3	V403 C404 V504 L724 W728 V736	V403-I733 HydrophobicContact CG1-CB 4.49Å; V403-I733 HydrophobicContact CG1-CD1 3.81Å; V403-I733 HydrophobicContact CG1-CG1 3.96Å; V403-I733 HydrophobicContact CG1-CG2 3.81Å; C404-I733 WeakPolarHBondContact O-CA 3.33Å; V504-I733 HydrophobicContact CG1-CD1 4.22Å; V504-I733 HydrophobicContact CG1-CG1 4.37Å; V504-I733 HydrophobicContact CG2-CD1 4.45Å; V504-I733 HydrophobicContact CG2-CG1 3.78Å; L724-I733 HydrophobicContact CD1-CD1 3.91Å; W728-I733 HydrophobicContact CB-CD1 4.38Å; W728-I733 HydrophobicContact CD2-CB 3.97Å; W728-I733 HydrophobicContact CD2-CG2 3.81Å; W728-I733 HydrophobicContact CE3-CB 4.24Å; W728-I733 HydrophobicContact CE3-CD1 4.41Å; W728-I733 HydrophobicContact CE3-CG2 3.64Å; W728-I733 HydrophobicContact CG-CB 4.29Å; W728-I733 HydrophobicContact CH2-CG2 3.78Å; W728-I733 HydrophobicContact CZ2-CG2 3.92Å; W728-I733 HydrophobicContact CZ3-CG2 3.67Å; I733-V736 HydrophobicContact CG2-CG2 3.78Å
734	S	92.7	Very high	88.2	Confident	8 Å²	8	38 Å²	38	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-38.8	178.3	61.1	0	0	0	0	112.9	C404 N406 T628 L676	C404-S734 WeakPolarHBondContact CB-OG 3.31Å; C404-S734 PolarHBondContact O-N 3.23Å; C404-S734 PolarHBondContact O-OG 3.39Å; N406-S734 WeakPolarHBondContact OD1-CB 3.4Å; T628-S734 WeakPolarHBondContact CG2-OG 3.49Å; T628-S734 PolarHBondContact OG1-OG 2.66Å; L676-S734 WeakPolarHBondContact O-CB 3.17Å; L676-S734 PolarHBondContact O-OG 2.8Å
735	F	93.7	Very high	86.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	150.7	-172.5	-169.7	-92.7	0	0	0	110.8	C404 L676 H680 H712 C713 Y714 F737	C404-F735 HydrophobicContact CB-CB 4.04Å; C404-F735 VanDerWaalsContact CB-O 3.3Å; C404-F735 WeakPolarHBondContact CB-O 3.42Å; C404-F735 PolarHBondContact N-O 3.26Å; L676-F735 HydrophobicContact CB-CB 4.41Å; L676-F735 VanDerWaalsContact O-CB 3.28Å; L676-F735 WeakPolarHBondContact O-CB 3.43Å; H680-F735 HydrophobicContact CB-CE1 4.4Å; H680-F735 HydrophobicContact CB-CZ 4.27Å; H680-F735 AromaticContact CD2-CZ 3.79Å; H712-F735 HydrophobicContact CB-CE2 4.49Å; H712-F735 HydrophobicContact CB-CZ 3.76Å; C713-F735 WeakPolarHBondContact O-CD2 3.39Å; Y714-F735 AromaticContact CD1-CD2 3.55Å; Y714-F735 HydrophobicContact CD1-CD2 3.55Å; Y714-F735 AromaticContact CD1-CE2 3.52Å; Y714-F735 HydrophobicContact CD1-CE2 3.52Å; Y714-F735 AromaticContact CD2-CE2 3.93Å; Y714-F735 HydrophobicContact CD2-CE2 3.93Å; Y714-F735 AromaticContact CE1-CD2 3.77Å; Y714-F735 HydrophobicContact CE1-CD2 3.77Å; Y714-F735 AromaticContact CE1-CE2 3.42Å; Y714-F735 HydrophobicContact CE1-CE2 3.42Å; Y714-F735 VanDerWaalsContact CE1-CE2 3.42Å; Y714-F735 AromaticContact CE2-CE2 3.84Å; Y714-F735 HydrophobicContact CE2-CE2 3.84Å; Y714-F735 HydrophobicContact CG-CD2 4.02Å; Y714-F735 AromaticContact CG-CE2 3.8Å; Y714-F735 HydrophobicContact CG-CE2 3.8Å; Y714-F735 AromaticContact CZ-CE2 3.6Å; F735-F737 AromaticContact CD1-CD2 3.78Å; F735-F737 HydrophobicContact CD1-CD2 3.78Å; F735-F737 HydrophobicContact CD1-CE1 4.43Å; F735-F737 AromaticContact CD1-CE2 3.54Å; F735-F737 HydrophobicContact CD1-CE2 3.54Å; F735-F737 HydrophobicContact CD1-CG 4.34Å; F735-F737 AromaticContact CD1-CZ 3.9Å; F735-F737 HydrophobicContact CD1-CZ 3.9Å; F735-F737 AromaticContact CE1-CD1 3.7Å; F735-F737 HydrophobicContact CE1-CD1 3.7Å; F735-F737 AromaticContact CE1-CD2 3.62Å; F735-F737 HydrophobicContact CE1-CD2 3.62Å; F735-F737 AromaticContact CE1-CE1 3.5Å; F735-F737 HydrophobicContact CE1-CE1 3.5Å; F735-F737 VanDerWaalsContact CE1-CE1 3.5Å; F735-F737 AromaticContact CE1-CE2 3.42Å; F735-F737 HydrophobicContact CE1-CE2 3.42Å; F735-F737 VanDerWaalsContact CE1-CE2 3.42Å; F735-F737 AromaticContact CE1-CG 3.75Å; F735-F737 HydrophobicContact CE1-CG 3.75Å; F735-F737 AromaticContact CE1-CZ 3.37Å; F735-F737 HydrophobicContact CE1-CZ 3.37Å; F735-F737 HydrophobicContact CZ-CD1 4.46Å; F735-F737 HydrophobicContact CZ-CE1 4.15Å; F735-F737 HydrophobicContact CZ-CZ 4.25Å
736	V	94.7	Very high	84.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.6	173.6	173.6	0	0	0	0	110.9	Q401 V402 V403 C713 L719 L724 W728 I733 W738	Q401-V736 HydrophobicContact CB-CG1 4.38Å; V402-V736 VanDerWaalsContact O-CA 3.26Å; V402-V736 WeakPolarHBondContact O-CA 3.49Å; V403-V736 HydrophobicContact CB-CG2 4.35Å; V403-V736 HydrophobicContact CG1-CG2 4.09Å; V403-V736 HydrophobicContact CG2-CG2 4.22Å; C713-V736 HydrophobicContact CB-CB 4.3Å; C713-V736 WeakPolarHBondContact CB-O 3.25Å; C713-V736 PolarHBondContact N-O 2.84Å; C713-V736 PolarHBondContact O-N 3.07Å; L719-V736 HydrophobicContact CD2-CB 4.08Å; L719-V736 HydrophobicContact CD2-CG1 3.69Å; L724-V736 HydrophobicContact CD2-CG1 4.09Å; L724-V736 HydrophobicContact CD2-CG2 4.17Å; W728-V736 HydrophobicContact CE3-CG2 4.05Å; W728-V736 HydrophobicContact CH2-CB 4.26Å; W728-V736 HydrophobicContact CH2-CG2 3.88Å; W728-V736 HydrophobicContact CZ3-CB 3.8Å; W728-V736 HydrophobicContact CZ3-CG2 3.24Å; I733-V736 HydrophobicContact CG2-CG2 3.78Å; V736-W738 HydrophobicContact CG1-CB 4.26Å
737	F	93.9	Very high	81.9	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.5	160.7	-56.8	-94	0	0	0	108.2	Q401 V402 S677 T679 H680 F683 F707 W710 N711 H712 F735	Q401-F737 CarbonylContact C-O 3.45Å; Q401-F737 WeakPolarHBondContact CA-O 3.38Å; V402-F737 HydrophobicContact CB-CB 4.14Å; V402-F737 HydrophobicContact CB-CD2 4.25Å; V402-F737 HydrophobicContact CG1-CD2 4.42Å; V402-F737 PolarHBondContact N-O 3.15Å; V402-F737 PolarHBondContact O-N 3.27Å; S677-F737 WeakPolarHBondContact OG-CE2 3.44Å; T679-F737 HydrophobicContact CG2-CZ 4.17Å; H680-F737 HydrophobicContact CB-CE1 4.28Å; H680-F737 HydrophobicContact CB-CZ 3.77Å; F683-F737 HydrophobicContact CE2-CE1 4.15Å; F683-F737 HydrophobicContact CE2-CZ 4.48Å; F707-F737 HydrophobicContact CB-CD1 4.33Å; W710-F737 HydrophobicContact CE3-CB 4.06Å; N711-F737 WeakPolarHBondContact O-CA 3.3Å; H712-F737 AromaticContact CD2-CD1 3.49Å; H712-F737 VanDerWaalsContact CD2-CD1 3.49Å; H712-F737 WeakPolarHBondContact CD2-CD1 3.29Å; H712-F737 AromaticContact CD2-CE1 3.78Å; H712-F737 AromaticContact NE2-CD1 3.67Å; H712-F737 AromaticContact NE2-CE1 3.7Å; F735-F737 AromaticContact CD1-CD2 3.78Å; F735-F737 HydrophobicContact CD1-CD2 3.78Å; F735-F737 HydrophobicContact CD1-CE1 4.43Å; F735-F737 AromaticContact CD1-CE2 3.54Å; F735-F737 HydrophobicContact CD1-CE2 3.54Å; F735-F737 HydrophobicContact CD1-CG 4.34Å; F735-F737 AromaticContact CD1-CZ 3.9Å; F735-F737 HydrophobicContact CD1-CZ 3.9Å; F735-F737 AromaticContact CE1-CD1 3.7Å; F735-F737 HydrophobicContact CE1-CD1 3.7Å; F735-F737 AromaticContact CE1-CD2 3.62Å; F735-F737 HydrophobicContact CE1-CD2 3.62Å; F735-F737 AromaticContact CE1-CE1 3.5Å; F735-F737 HydrophobicContact CE1-CE1 3.5Å; F735-F737 VanDerWaalsContact CE1-CE1 3.5Å; F735-F737 AromaticContact CE1-CE2 3.42Å; F735-F737 HydrophobicContact CE1-CE2 3.42Å; F735-F737 VanDerWaalsContact CE1-CE2 3.42Å; F735-F737 AromaticContact CE1-CG 3.75Å; F735-F737 HydrophobicContact CE1-CG 3.75Å; F735-F737 AromaticContact CE1-CZ 3.37Å; F735-F737 HydrophobicContact CE1-CZ 3.37Å; F735-F737 HydrophobicContact CZ-CD1 4.46Å; F735-F737 HydrophobicContact CZ-CE1 4.15Å; F735-F737 HydrophobicContact CZ-CZ 4.25Å
738	W	94.1	Very high	79	Confident	25 Å²	25	67.5 Å²	67.5	10%	0.095	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153	173.2	76.1	-79.2	0	0	0	113.6	I399 E400 Q401 N711 C713 A718 L719 N720 V736 Y740	I399-W738 HydrophobicContact CG2-CE3 4.16Å; E400-W738 CarbonylContact O-C 3.49Å; E400-W738 WeakPolarHBondContact O-CA 3.5Å; E400-W738 WeakPolarHBondContact O-CB 3.49Å; Q401-W738 HydrophobicContact CB-CB 4.38Å; Q401-W738 HydrophobicContact CG-CB 3.82Å; N711-W738 HydrophobicContact CB-CD2 4.32Å; N711-W738 HydrophobicContact CB-CG 4.33Å; N711-W738 HydrophobicContact CB-CZ2 4.33Å; N711-W738 WeakPolarHBondContact CB-O 3.41Å; N711-W738 PolarHBondContact N-O 2.96Å; N711-W738 PolarHBondContact O-N 3.27Å; C713-W738 PolarHBondContact SG-NE1 3.41Å; A718-W738 WeakPolarHBondContact O-CZ2 3.39Å; A718-W738 PolarHBondContact O-NE1 3.09Å; L719-W738 HydrophobicContact CD2-CG 4.38Å; N720-W738 HydrophobicContact CB-CE3 4.47Å; N720-W738 HydrophobicContact CB-CH2 3.72Å; N720-W738 HydrophobicContact CB-CZ2 4.34Å; N720-W738 HydrophobicContact CB-CZ3 3.78Å; V736-W738 HydrophobicContact CG1-CB 4.26Å; W738-Y740 HydrophobicContact CH2-CD1 4.34Å; W738-Y740 AromaticContact CZ3-CD1 3.84Å; W738-Y740 HydrophobicContact CZ3-CD1 3.84Å
739	H	92.4	Very high	76.3	Confident	3 Å²	3	75.5 Å²	75.5	1%	0.014	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	168.4	173.3	-151.1	70.9	0	0	0	111.2	I399 E400 T701 D702 W710	I399-H739 WeakPolarHBondContact CA-O 3.48Å; E400-H739 PolarHBondContact N-O 3.15Å; E400-H739 PolarHBondContact O-N 3.31Å; T701-H739 PolarHBondContact O-NE2 3.36Å; T701-H739 PolarHBondContact OG1-CE1 3.44Å; T701-H739 VanDerWaalsContact OG1-CE1 3.28Å; D702-H739 WeakPolarHBondContact CA-CD2 3.47Å; D702-H739 WeakPolarHBondContact CA-NE2 3.2Å; D702-H739 PolarHBondContact N-NE2 3.4Å; D702-H739 PolarHBondContact O-CD2 3.5Å; W710-H739 HydrophobicContact CB-CB 4.4Å; W710-H739 HydrophobicContact CD2-CB 3.66Å; W710-H739 HydrophobicContact CE3-CB 3.92Å; W710-H739 HydrophobicContact CG-CB 3.88Å; W710-H739 HydrophobicContact CZ3-CB 4.46Å
740	Y	90	Very high	76	Confident	56 Å²	56	74.1 Å²	74.1	22%	0.22	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155.8	178.2	56.1	-94.9	0	0	0	111.8	K398 W738 H742 E743	K398-Y740 CarbonylContact O-C 3.54Å; K398-Y740 VanDerWaalsContact O-CA 3.23Å; K398-Y740 WeakPolarHBondContact O-CA 3.37Å; W738-Y740 HydrophobicContact CH2-CD1 4.34Å; W738-Y740 AromaticContact CZ3-CD1 3.84Å; W738-Y740 HydrophobicContact CZ3-CD1 3.84Å; Y740-H742 VanDerWaalsContact CD2-O 3.29Å; Y740-H742 WeakPolarHBondContact CD2-O 3.35Å; Y740-E743 HydrophobicContact CD2-CG 4.42Å; Y740-E743 HydrophobicContact CE2-CB 4.29Å; Y740-E743 HydrophobicContact CE2-CG 3.36Å; Y740-E743 WeakPolarHBondContact OH-CG 3.34Å; Y740-E743 PolarHBondContact OH-OE1 3.32Å
741	S	85	Confident	75.8	Confident	12 Å²	12	76 Å²	76	8%	0.084	39%	0.385	C	S	.	.	S	Bend	trans	-73	-36.8	-175.4	58.6	0	0	0	0	113.8	K398 C703	K398-S741 PolarHBondContact N-OG 3.45Å; K398-S741 PolarHBondContact O-N 2.98Å; C703-S741 PolarHBondContact SG-N 3.12Å; C703-S741 VanDerWaalsContact SG-N 3.42Å
742	H	84.1	Confident	75.2	Confident	48 Å²	48	76.8 Å²	76.8	22%	0.222	37%	0.371	C	S	.	.	S	Bend	trans	-160	155.3	174.2	56.5	-72	0	0	0	108.5	T392 L395 Y740 E744	T392-H742 HydrophobicContact CG2-CB 4.35Å; T392-H742 PolarHBondContact O-CE1 3.12Å; T392-H742 VanDerWaalsContact O-CE1 3.29Å; T392-H742 PolarHBondContact O-NE2 3.31Å; L395-H742 PolarHBondContact O-CE1 3.42Å; L395-H742 PolarHBondContact O-NE2 2.72Å; Y740-H742 VanDerWaalsContact CD2-O 3.29Å; Y740-H742 WeakPolarHBondContact CD2-O 3.35Å; H742-E744 PolarHBondContact O-N 3.18Å
743	E	75.8	Confident	74.4	Confident	133 Å²	133	80.6 Å²	80.6	62%	0.621	39%	0.388	S	S	*	.			trans	-66.4	136.2	171	-67.6	-170.1	169.8	0	0	109.2	Y740 Q745	Y740-E743 HydrophobicContact CD2-CG 4.42Å; Y740-E743 HydrophobicContact CE2-CB 4.29Å; Y740-E743 HydrophobicContact CE2-CG 3.36Å; Y740-E743 WeakPolarHBondContact OH-CG 3.34Å; Y740-E743 PolarHBondContact OH-OE1 3.32Å; E743-Q745 VanDerWaalsContact C-N 3.31Å; E743-Q745 PolarHBondContact O-N 2.9Å
744	E	68.2	Low	73.2	Confident	147 Å²	147	85.2 Å²	85.2	69%	0.687	41%	0.41	S	S	*	.			trans	-65.4	100	168.1	-164	171.2	-165.2	0	0	106.6	V397 H742 R746	V397-E744 HydrophobicContact CG2-CB 3.84Å; V397-E744 HydrophobicContact CG2-CG 4.34Å; H742-E744 PolarHBondContact O-N 3.18Å; E744-R746 VanDerWaalsContact C-N 3.29Å; E744-R746 PolarHBondContact O-N 2.87Å
745	Q	58.3	Low	71.9	Confident	176 Å²	176	90.3 Å²	90.3	82%	0.822	43%	0.433	S	S	*	.			trans	-58.2	104	166.4	-70	-173.6	-5.9	0	0	105	E743 K747	E743-Q745 VanDerWaalsContact C-N 3.31Å; E743-Q745 PolarHBondContact O-N 2.9Å; Q745-K747 PolarHBondContact O-N 3.18Å
746	R	44.7	Very low	70.4	Confident	228 Å²	228	96.8 Å²	96.8	86%	0.86	46%	0.464	S	S	*	.			trans	-45.6	116.3	172.6	-80	-177.7	175.7	177.5	-0.4	105	E744 T748	E744-R746 VanDerWaalsContact C-N 3.29Å; E744-R746 PolarHBondContact O-N 2.87Å; R746-T748 PolarHBondContact O-N 3.1Å
747	K	39.6	Very low	68.5	Low	194 Å²	194	104.2 Å²	104.2	84%	0.843	50%	0.5	S	S	*	.			trans	-58.5	92	170.1	-71.9	-178.4	179.1	178.5	0	105.7	Q745 V749	Q745-K747 PolarHBondContact O-N 3.18Å; K747-V749 HydrophobicContact CB-CG2 4.31Å; K747-V749 PolarHBondContact O-N 3.08Å
748	T	29.8	Very low	66.4	Low	137 Å²	137	112.9 Å²	112.9	84%	0.84	54%	0.541	S	S	*	.			trans	-62.8	89.7	152.1	44.5	0	0	0	0	103.8	R746	R746-T748 PolarHBondContact O-N 3.1Å
749	V	34.8	Very low	63.9	Low	196 Å²	196	120.9 Å²	120.9	100%	1.188	58%	0.582	S	S	*	*			trans	-67.4	0	156.6	179.5	0	0	0	0	106.9	K747	K747-V749 HydrophobicContact CB-CG2 4.31Å; K747-V749 PolarHBondContact O-N 3.08Å

Retrieved 749 of 749 residues in 1142.7 ms (Link to these results)

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