A0A077Z0G8_TRITR Loading...

Phosphatidylinositol-3-phosphatase SAC1

AlphaFold DB , UniProt , Accession A0A077Z0G8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 533 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	26.8	Very low	22.8	Very low	240 Å²	240	159.9 Å²	159.9	100%	1.182	84%	0.84	S	S	*	*				0	106.8	0	-76	-179.2	-171	0	0	105.5
2	E	29.3	Very low	22.8	Very low	200 Å²	200	153.3 Å²	153.3	94%	0.935	84%	0.84	S	S	*	*			trans	31	80.7	-178.2	-70.3	179.9	169.8	0	0	116.7
3	E	21.9	Very low	23	Very low	192 Å²	192	156.4 Å²	156.4	90%	0.897	84%	0.844	S	S	*	*			trans	-75.2	127.8	155	-69.5	174.3	152.8	0	0	109.3
4	S	23	Very low	23.5	Very low	117 Å²	117	152.9 Å²	152.9	82%	0.818	83%	0.834	S	S	*	*			trans	-162.4	90.2	141.7	44.1	0	0	0	0	109.3
5	A	21.5	Very low	23.6	Very low	95 Å²	95	155.3 Å²	155.3	79%	0.785	83%	0.833	S	S	*	*			trans	-92.5	126.6	158.1	0	0	0	0	0	107.7
6	V	22.9	Very low	23.6	Very low	128 Å²	128	153.6 Å²	153.6	78%	0.776	83%	0.83	S	S	*	*			trans	-128.8	91.8	161.3	-177.3	0	0	0	0	106.9
7	V	19.2	Very low	23.8	Very low	130 Å²	130	150.7 Å²	150.7	79%	0.788	82%	0.824	S	S	*	*			trans	-108.8	100.4	167.2	176.2	0	0	0	0	105.9
8	T	21.7	Very low	24.1	Very low	112 Å²	112	151.8 Å²	151.8	69%	0.687	83%	0.827	S	S	*	*			trans	-97.1	99.1	177	-30.3	0	0	0	0	108.3
9	S	21	Very low	24.2	Very low	87 Å²	87	152.2 Å²	152.2	61%	0.608	83%	0.828	S	S	*	*			trans	-105.4	124.9	165.2	63.5	0	0	0	0	108.5	R11	S9-R11 PolarHBondContact O-N 3.41Å
10	Y	21.5	Very low	24.1	Very low	233 Å²	233	148.2 Å²	148.2	91%	0.914	82%	0.824	S	S	*	*			trans	-72.4	107.3	176.9	-80.5	-93.5	0	0	0	109.4
11	R	22.4	Very low	24.1	Very low	225 Å²	225	150.9 Å²	150.9	85%	0.849	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-99.8	118.3	168.7	-85.5	-173.5	175.1	-177.3	0.3	109.8	S9	S9-R11 PolarHBondContact O-N 3.41Å
12	G	22.3	Very low	24	Very low	81 Å²	81	148 Å²	148	84%	0.835	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.4	138.1	166.5	0	0	0	0	0	112
13	Q	25.2	Very low	23.7	Very low	193 Å²	193	144 Å²	144	90%	0.902	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-93.9	148.5	175.2	-80.1	-169	-19.4	0	0	112.1
14	P	30.4	Very low	23.7	Very low	107 Å²	107	142.5 Å²	142.5	70%	0.695	81%	0.807	S	S	*	*			trans	-110.4	165.8	-177.4	41.8	-33.2	0	0	0	114.4
15	K	24.6	Very low	23.7	Very low	190 Å²	190	144.7 Å²	144.7	83%	0.826	81%	0.808	S	S	*	*			trans	75.4	143.4	157	-70.3	173.9	-178.2	-174.3	0	115.8
16	T	24.3	Very low	23.7	Very low	128 Å²	128	149.5 Å²	149.5	79%	0.785	81%	0.811	S	S	*	*			cis	-169.6	157.4	30.8	-5	0	0	0	0	109.9
17	S	27.6	Very low	23.7	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	81%	0.81	S	S	*	*			trans	-62.5	151.6	167.9	60	0	0	0	0	113.1
18	I	28.9	Very low	23.9	Very low	171 Å²	171	151.3 Å²	151.3	88%	0.877	81%	0.81	S	S	*	*			trans	-168.4	140.2	140.6	-91.4	143.6	0	0	0	109.3
19	D	24.7	Very low	23.9	Very low	159 Å²	159	150.5 Å²	150.5	85%	0.85	81%	0.807	S	S	*	*			trans	-56.7	149.2	-179.7	-67.9	-58.5	0	0	0	116.3
20	G	23.2	Very low	24.2	Very low	72 Å²	72	154.4 Å²	154.4	74%	0.742	82%	0.82	S	S	*	*			trans	106.1	112.9	133.1	0	0	0	0	0	118.1
21	K	23.9	Very low	24.3	Very low	205 Å²	205	153.2 Å²	153.2	89%	0.891	82%	0.82	S	S	*	*			trans	88.1	123.8	158	-62.7	-176.1	175.8	179.3	0	117.7	C23	K21-C23 PolarHBondContact O-N 3.33Å
22	L	25.4	Very low	24.4	Very low	178 Å²	178	148.2 Å²	148.2	93%	0.932	81%	0.81	S	S	*	*			trans	-47.5	116	170.2	-77.6	90.7	0	0	0	111.4
23	C	22.5	Very low	24.6	Very low	116 Å²	116	147.7 Å²	147.7	78%	0.784	81%	0.805	S	S	*	*			trans	-143	132.1	150.6	-82	0	0	0	0	107.5	K21 L25	K21-C23 PolarHBondContact O-N 3.33Å; C23-L25 PolarHBondContact O-N 3.39Å; C23-L25 VanDerWaalsContact O-N 3.12Å
24	D	22.8	Very low	24.6	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	80%	0.804	S	S	*	*			trans	-44.8	111.9	-178.5	-62	-55.4	0	0	0	112.3	K26	D24-K26 PolarHBondContact O-N 3.29Å
25	L	22.8	Very low	24.4	Very low	162 Å²	162	149 Å²	149	85%	0.848	80%	0.804	S	S	*	*			trans	-68.8	96.1	172.3	-87.8	157.8	0	0	0	108.8	C23 L27	C23-L25 PolarHBondContact O-N 3.39Å; C23-L25 VanDerWaalsContact O-N 3.12Å; L25-L27 PolarHBondContact O-N 2.96Å; L25-L27 VanDerWaalsContact O-N 3.08Å
26	K	21.2	Very low	24.5	Very low	196 Å²	196	148 Å²	148	85%	0.852	80%	0.803	S	S	*	*			trans	-65.5	95.5	156.5	-80	-179.2	174.5	178	0	108.3	D24	D24-K26 PolarHBondContact O-N 3.29Å
27	L	22.9	Very low	24.7	Very low	143 Å²	143	148.4 Å²	148.4	75%	0.749	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72	124.2	165.2	-85.5	154.8	0	0	0	108.9	L25	L25-L27 PolarHBondContact O-N 2.96Å; L25-L27 VanDerWaalsContact O-N 3.08Å
28	I	22.2	Very low	24.7	Very low	153 Å²	153	148.7 Å²	148.7	79%	0.785	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.4	130.3	175.8	-65.2	168.3	0	0	0	106.6	L30	I28-L30 PolarHBondContact O-N 3.41Å
29	P	23	Very low	24.5	Very low	96 Å²	96	144.5 Å²	144.5	62%	0.623	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.1	116.7	-158	30	-34	0	0	0	111.6
30	L	26	Very low	24.7	Very low	168 Å²	168	146.9 Å²	146.9	88%	0.88	80%	0.802	S	S	*	*	S	Bend	trans	-106.2	77.8	156	-76.7	164	0	0	0	106.2	I28 D32	I28-L30 PolarHBondContact O-N 3.41Å; L30-D32 PolarHBondContact O-N 2.96Å
31	F	25.2	Very low	24.8	Very low	209 Å²	209	147.3 Å²	147.3	92%	0.917	79%	0.793	S	S	*	*			trans	39	75.1	178	-75.6	-86.3	0	0	0	114	G33	F31-G33 PolarHBondContact O-N 2.92Å
32	D	24.2	Very low	24.8	Very low	120 Å²	120	144.3 Å²	144.3	64%	0.642	79%	0.786	S	S	*	*			trans	-60.7	111.7	168.7	-84.3	-41.7	0	0	0	110.7	L30	L30-D32 PolarHBondContact O-N 2.96Å
33	G	26.3	Very low	24.8	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	78%	0.779	S	S	*	*			trans	-148.5	53.4	165.7	0	0	0	0	0	109.2	F31 S35	F31-G33 PolarHBondContact O-N 2.92Å; G33-S35 PolarHBondContact O-N 3.07Å
34	Y	25.1	Very low	24.9	Very low	225 Å²	225	147.1 Å²	147.1	88%	0.882	78%	0.78	S	S	*	*			trans	-68.6	107.5	161.7	-86.5	-88.2	0	0	0	108
35	S	26.7	Very low	25	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	76%	0.764	S	S	*	*			trans	-102	122.1	148.9	50.6	0	0	0	0	108.3	G33	G33-S35 PolarHBondContact O-N 3.07Å
36	E	25.6	Very low	25.1	Very low	169 Å²	169	144.2 Å²	144.2	79%	0.79	76%	0.763	S	S	*	*			trans	-48.9	158.4	162.3	-73.4	-176.8	157.1	0	0	110.7	V38	E36-V38 VanDerWaalsContact C-N 3.31Å; E36-V38 PolarHBondContact O-N 2.88Å
37	P	29.2	Very low	25.7	Very low	137 Å²	137	138 Å²	138	89%	0.89	74%	0.739	S	S	*	*			trans	-68.6	90.2	-170.2	28.6	-33.2	0	0	0	110.2	A39	P37-A39 PolarHBondContact O-N 3.49Å
38	V	26.9	Very low	26.2	Very low	110 Å²	110	137.5 Å²	137.5	67%	0.667	73%	0.734	S	S	*	*			trans	-70	113.1	170.1	-179.1	0	0	0	0	105.9	E36 E40	E36-V38 VanDerWaalsContact C-N 3.31Å; E36-V38 PolarHBondContact O-N 2.88Å; V38-E40 PolarHBondContact O-N 2.99Å
39	A	25.5	Very low	27.1	Very low	83 Å²	83	132.2 Å²	132.2	69%	0.686	71%	0.71	S	S	*	*			trans	-41.4	130.5	168.1	0	0	0	0	0	108.9	P37 S41	P37-A39 PolarHBondContact O-N 3.49Å; A39-S41 PolarHBondContact O-N 3.25Å
40	E	27.4	Very low	27.7	Very low	209 Å²	209	132.2 Å²	132.2	98%	0.977	70%	0.704	S	S	*	*			trans	-51.2	80.7	-178.1	-67.1	172.8	153.9	0	0	111.6	V38	V38-E40 PolarHBondContact O-N 2.99Å
41	S	25.5	Very low	28.5	Very low	81 Å²	81	127.4 Å²	127.4	57%	0.566	68%	0.679	S	S	*	*			trans	-103.3	112.4	166.9	60.5	0	0	0	0	105.8	A39 E43	A39-S41 PolarHBondContact O-N 3.25Å; S41-E43 PolarHBondContact O-N 3.4Å
42	L	25	Very low	29	Very low	142 Å²	142	122.8 Å²	122.8	74%	0.743	66%	0.66	S	S	*	*			trans	-48.1	98.8	169.7	-72.2	151.1	0	0	0	108.9	K44	L42-K44 PolarHBondContact O-N 3.15Å; L42-K44 VanDerWaalsContact O-N 3.16Å
43	E	24	Very low	29.6	Very low	168 Å²	168	121 Å²	121	79%	0.785	65%	0.654	S	S	*	*			trans	-69.4	111.8	173.6	-93.7	-172.4	160.3	0	0	108.1	S41 V45	S41-E43 PolarHBondContact O-N 3.4Å; E43-V45 PolarHBondContact O-N 3.43Å; E43-V45 VanDerWaalsContact O-N 3.13Å
44	K	24.7	Very low	30.3	Very low	184 Å²	184	121 Å²	121	80%	0.8	64%	0.643	S	S	*	*			trans	-76.9	95.5	172	-156.1	-176.7	-174.7	-167.2	0	107.6	L42 E46	L42-K44 PolarHBondContact O-N 3.15Å; L42-K44 VanDerWaalsContact O-N 3.16Å; K44-E46 PolarHBondContact O-N 2.81Å
45	V	26.1	Very low	31.3	Very low	88 Å²	88	118.3 Å²	118.3	53%	0.533	64%	0.644	S	S	.	*			trans	-81.5	113.5	175.1	-174.6	0	0	0	0	108.4	E43 I47	E43-V45 PolarHBondContact O-N 3.43Å; E43-V45 VanDerWaalsContact O-N 3.13Å; V45-I47 HydrophobicContact CB-CG1 4.38Å; V45-I47 HydrophobicContact CG1-CD1 4.35Å; V45-I47 HydrophobicContact CG1-CG1 3.73Å; V45-I47 PolarHBondContact O-N 3.49Å
46	E	24.9	Very low	32	Very low	176 Å²	176	119.8 Å²	119.8	82%	0.822	64%	0.643	S	S	*	*			trans	-81.2	111.1	170	-71.6	-175.9	167.3	0	0	108.8	K44	K44-E46 PolarHBondContact O-N 2.81Å
47	I	34.1	Very low	32.5	Very low	66 Å²	66	117.9 Å²	117.9	34%	0.338	63%	0.632	S	S	.	*			trans	-105.7	129.1	-175.2	-57.1	172.1	0	0	0	108.6	V45	V45-I47 HydrophobicContact CB-CG1 4.38Å; V45-I47 HydrophobicContact CG1-CD1 4.35Å; V45-I47 HydrophobicContact CG1-CG1 3.73Å; V45-I47 PolarHBondContact O-N 3.49Å
48	M	31.6	Very low	33.1	Very low	132 Å²	132	112.3 Å²	112.3	65%	0.65	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.8	105.1	172.5	-66.4	-147.1	-52.2	0	0	110.3	C63	M48-C63 WeakPolarHBondContact O-CB 3.4Å; M48-C63 PolarHBondContact O-N 3.32Å
49	C	42.8	Very low	33.7	Very low	41 Å²	41	110.3 Å²	110.3	28%	0.277	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.4	124.3	165.9	-62.5	0	0	0	0	108.5	L51 I60	C49-L51 PolarHBondContact O-N 3.25Å; C49-I60 HydrophobicContact CB-CG2 4.18Å
50	D	35.6	Very low	34.5	Very low	96 Å²	96	107.5 Å²	107.5	51%	0.513	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	119.8	169.4	-95.2	-29.6	0	0	0	108.8	Q61	D50-Q61 HydrophobicContact CB-CB 4.21Å; D50-Q61 PolarHBondContact N-O 3.44Å; D50-Q61 PolarHBondContact O-N 3.39Å
51	L	41.8	Very low	35.3	Very low	67 Å²	67	100.1 Å²	100.1	35%	0.351	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	101.7	-171.1	-153.5	82.8	0	0	0	109.5	C49 V53 I60 F119	C49-L51 PolarHBondContact O-N 3.25Å; L51-V53 HydrophobicContact CD2-CG2 4.23Å; L51-V53 HydrophobicContact CG-CG2 4.41Å; L51-I60 HydrophobicContact CD1-CG1 3.83Å; L51-F119 HydrophobicContact CD1-CD1 4.34Å; L51-F119 HydrophobicContact CD1-CE1 3.51Å; L51-F119 HydrophobicContact CD1-CZ 3.96Å; L51-F119 HydrophobicContact CD2-CD1 3.2Å; L51-F119 HydrophobicContact CD2-CE1 3.27Å; L51-F119 HydrophobicContact CD2-CG 3.99Å; L51-F119 HydrophobicContact CD2-CZ 4.07Å; L51-F119 HydrophobicContact CG-CD1 3.87Å; L51-F119 HydrophobicContact CG-CE1 3.51Å; L51-F119 HydrophobicContact CG-CZ 4.38Å
52	H	36.7	Very low	36.1	Very low	112 Å²	112	97.2 Å²	97.2	52%	0.519	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	111.9	174.8	-74.3	-84.2	0	0	0	109.5	F58 R59	H52-F58 CarbonylContact O-C 3.58Å; H52-F58 VanDerWaalsContact O-CA 3.3Å; H52-F58 WeakPolarHBondContact O-CA 3.37Å; H52-R59 HydrophobicContact CB-CB 4.27Å; H52-R59 PolarHBondContact N-O 2.84Å; H52-R59 PolarHBondContact O-N 3.21Å
53	V	36.2	Very low	36.7	Very low	83 Å²	83	92.2 Å²	92.2	50%	0.503	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.5	175.7	-171.6	0	0	0	0	108.7	L51 F119	L51-V53 HydrophobicContact CD2-CG2 4.23Å; L51-V53 HydrophobicContact CG-CG2 4.41Å; V53-F119 HydrophobicContact CG2-CD1 3.73Å
54	S	41.3	Very low	37.4	Very low	70 Å²	70	86.8 Å²	86.8	49%	0.49	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	164.2	164	80.1	0	0	0	0	109.7	D56 K57	S54-D56 PolarHBondContact O-N 3.45Å; S54-K57 PolarHBondContact N-O 2.9Å; S54-K57 PolarHBondContact O-N 2.79Å; S54-K57 VanDerWaalsContact O-O 3.1Å; S54-K57 PolarHBondContact OG-N 3.3Å; S54-K57 PolarHBondContact OG-O 2.95Å
55	D	46.5	Very low	38.4	Very low	169 Å²	169	82.3 Å²	82.3	90%	0.904	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-26.9	-170.4	-66	-31.9	0	0	0	114.2
56	D	39.8	Very low	39.1	Very low	132 Å²	132	85.2 Å²	85.2	71%	0.706	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-9.7	-179.3	-66.7	-40.9	0	0	0	115	S54 R79	S54-D56 PolarHBondContact O-N 3.45Å; D56-R79 PolarHBondContact O-NH2 3.48Å
57	K	35.9	Very low	39.6	Very low	129 Å²	129	79.7 Å²	79.7	56%	0.561	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	140.5	-171.2	-60.2	-174.1	-178.1	-177.1	0	112	S54	S54-K57 PolarHBondContact N-O 2.9Å; S54-K57 PolarHBondContact O-N 2.79Å; S54-K57 VanDerWaalsContact O-O 3.1Å; S54-K57 PolarHBondContact OG-N 3.3Å; S54-K57 PolarHBondContact OG-O 2.95Å
58	F	42.5	Very low	39.5	Very low	20 Å²	20	83.6 Å²	83.6	9%	0.088	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.9	170	63.5	-90.3	0	0	0	109	H52 V77 F119 D194	H52-F58 CarbonylContact O-C 3.58Å; H52-F58 VanDerWaalsContact O-CA 3.3Å; H52-F58 WeakPolarHBondContact O-CA 3.37Å; F58-V77 HydrophobicContact CD1-CG1 4.25Å; F58-V77 HydrophobicContact CD2-CG1 4.1Å; F58-V77 HydrophobicContact CD2-CG2 4.1Å; F58-V77 HydrophobicContact CE1-CG1 3.81Å; F58-V77 HydrophobicContact CE2-CB 3.77Å; F58-V77 HydrophobicContact CE2-CG1 3.67Å; F58-V77 HydrophobicContact CE2-CG2 3.55Å; F58-V77 HydrophobicContact CG-CG1 4.39Å; F58-V77 HydrophobicContact CZ-CB 3.79Å; F58-V77 HydrophobicContact CZ-CG1 3.5Å; F58-V77 VanDerWaalsContact CZ-CG1 3.5Å; F58-V77 HydrophobicContact CZ-CG2 4.12Å; F58-F119 HydrophobicContact CB-CE1 4.28Å; F58-D194 HydrophobicContact CE1-CB 4.46Å; F58-D194 HydrophobicContact CZ-CB 4.12Å
59	R	39.1	Very low	39.5	Very low	68 Å²	68	82.3 Å²	82.3	26%	0.257	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.6	174.3	178	-176.1	-179.1	157.3	9.4	108.3	H52	H52-R59 HydrophobicContact CB-CB 4.27Å; H52-R59 PolarHBondContact N-O 2.84Å; H52-R59 PolarHBondContact O-N 3.21Å
60	I	44	Very low	38.9	Very low	25 Å²	25	82.5 Å²	82.5	13%	0.128	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.5	170.4	-61.7	172.8	0	0	0	106.6	C49 L51 V77 L91 Y212	C49-I60 HydrophobicContact CB-CG2 4.18Å; L51-I60 HydrophobicContact CD1-CG1 3.83Å; I60-V77 HydrophobicContact CD1-CG2 3.61Å; I60-L91 HydrophobicContact CD1-CD1 4.2Å; I60-Y212 HydrophobicContact CB-CE1 4.42Å
61	Q	42.6	Very low	39.3	Very low	53 Å²	53	80.9 Å²	80.9	25%	0.248	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.1	171.7	-171.1	169.5	-23.2	0	0	109.2	D50 F208	D50-Q61 HydrophobicContact CB-CB 4.21Å; D50-Q61 PolarHBondContact N-O 3.44Å; D50-Q61 PolarHBondContact O-N 3.39Å; Q61-F208 HydrophobicContact CG-CE1 4.21Å; Q61-F208 HydrophobicContact CG-CZ 4.37Å
62	P	43	Very low	39.1	Very low	21 Å²	21	82.3 Å²	82.3	14%	0.136	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.1	-177.6	28.3	-32.3	0	0	0	112.7	I210 F215	P62-I210 HydrophobicContact CB-CD1 3.77Å; P62-I210 HydrophobicContact CG-CB 3.74Å; P62-I210 HydrophobicContact CG-CD1 3.57Å; P62-I210 HydrophobicContact CG-CG1 4.2Å; P62-I210 HydrophobicContact CG-CG2 4.08Å; P62-F215 HydrophobicContact CB-CE1 4.45Å; P62-F215 HydrophobicContact CB-CE2 3.94Å; P62-F215 HydrophobicContact CB-CZ 3.44Å; P62-F215 VanDerWaalsContact CB-CZ 3.44Å; P62-F215 HydrophobicContact CG-CE2 3.89Å; P62-F215 HydrophobicContact CG-CZ 3.9Å
63	C	36.8	Very low	39.3	Very low	36 Å²	36	77.5 Å²	77.5	24%	0.243	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	136.2	177.2	-57.4	0	0	0	0	110	M48	M48-C63 WeakPolarHBondContact O-CB 3.4Å; M48-C63 PolarHBondContact O-N 3.32Å
64	D	40.1	Very low	39.5	Very low	55 Å²	55	74.1 Å²	74.1	29%	0.294	44%	0.44	S	S	.	.			trans	-81.9	175	153	77.8	11.7	0	0	0	109.4	N66 G67 K68	D64-N66 PolarHBondContact O-N 2.79Å; D64-N66 VanDerWaalsContact OD1-CA 3.26Å; D64-N66 WeakPolarHBondContact OD1-CA 3.42Å; D64-N66 PolarHBondContact OD1-N 3.4Å; D64-G67 PolarHBondContact O-N 2.98Å; D64-G67 PolarHBondContact OD1-N 3.27Å; D64-K68 WeakPolarHBondContact CB-O 3.46Å; D64-K68 PolarHBondContact N-O 3.41Å; D64-K68 PolarHBondContact OD1-N 2.78Å; D64-K68 WeakPolarHBondContact OD2-CA 3.18Å; D64-K68 VanDerWaalsContact OD2-CB 3.31Å; D64-K68 WeakPolarHBondContact OD2-CB 3.28Å; D64-K68 PolarHBondContact OD2-N 3.33Å
65	A	44.1	Very low	39.6	Very low	90 Å²	90	71.3 Å²	71.3	74%	0.744	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-14	-180	0	0	0	0	0	114.6
66	N	41.4	Very low	39.8	Very low	148 Å²	148	63.3 Å²	63.3	79%	0.791	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	14.1	177.9	-66.1	-44.8	0	0	0	113.6	D64	D64-N66 PolarHBondContact O-N 2.79Å; D64-N66 VanDerWaalsContact OD1-CA 3.26Å; D64-N66 WeakPolarHBondContact OD1-CA 3.42Å; D64-N66 PolarHBondContact OD1-N 3.4Å
67	G	35.4	Very low	39.8	Very low	60 Å²	60	57 Å²	57	62%	0.619	34%	0.343	S	S	*	.	S	Bend	trans	72	23.8	180	0	0	0	0	0	117.1	D64	D64-G67 PolarHBondContact O-N 2.98Å; D64-G67 PolarHBondContact OD1-N 3.27Å
68	K	32.3	Very low	39.7	Very low	149 Å²	149	51 Å²	51	65%	0.648	32%	0.317	S	S	*	.			trans	-111.4	155.8	176.5	-75.5	-175.4	-178.9	-179.5	0	113.3	D64 G70	D64-K68 WeakPolarHBondContact CB-O 3.46Å; D64-K68 PolarHBondContact N-O 3.41Å; D64-K68 PolarHBondContact OD1-N 2.78Å; D64-K68 WeakPolarHBondContact OD2-CA 3.18Å; D64-K68 VanDerWaalsContact OD2-CB 3.31Å; D64-K68 WeakPolarHBondContact OD2-CB 3.28Å; D64-K68 PolarHBondContact OD2-N 3.33Å; K68-G70 PolarHBondContact O-N 2.88Å
69	P	32.4	Very low	39.2	Very low	104 Å²	104	54.7 Å²	54.7	68%	0.675	33%	0.33	S	S	*	.			trans	-80.1	108.3	-169.3	29.2	-33	0	0	0	111.5	I210	P69-I210 HydrophobicContact CB-CD1 3.97Å; P69-I210 HydrophobicContact CB-CG1 4.33Å
70	G	30.3	Very low	38.9	Very low	46 Å²	46	52.5 Å²	52.5	47%	0.474	32%	0.324	S	S	.	.			trans	-142.5	108.9	167.3	0	0	0	0	0	109.4	K68	K68-G70 PolarHBondContact O-N 2.88Å
71	V	42.6	Very low	38.1	Very low	62 Å²	62	54 Å²	54	38%	0.376	34%	0.335	S	S	.	.			trans	-140.9	129.3	178.7	-170.2	0	0	0	0	110.2	F215	V71-F215 HydrophobicContact CB-CE1 4.15Å; V71-F215 HydrophobicContact CG1-CD1 4.09Å; V71-F215 HydrophobicContact CG1-CE1 3.57Å; V71-F215 HydrophobicContact CG2-CE1 3.75Å; V71-F215 HydrophobicContact CG2-CZ 4.02Å
72	S	38.2	Very low	37.8	Very low	96 Å²	96	57.1 Å²	57.1	67%	0.671	36%	0.357	S	S	*	.			trans	-102.9	96.9	157	-68.4	0	0	0	0	107.9
73	A	41.3	Very low	37.4	Very low	11 Å²	11	63.3 Å²	63.3	9%	0.091	38%	0.384	C	S	.	.			trans	56.4	90.8	156.2	0	0	0	0	0	118.9	Y152 L217	A73-Y152 HydrophobicContact CB-CE2 3.74Å; A73-L217 HydrophobicContact CB-CD1 3.15Å
74	C	38.9	Very low	37.6	Very low	13 Å²	13	62.9 Å²	62.9	9%	0.088	38%	0.379	C	S	.	.			trans	-78.3	148.2	155.5	-64.6	0	0	0	0	109.8	F215	C74-F215 CarbonylContact C-O 3.51Å; C74-F215 HydrophobicContact CB-CB 4Å; C74-F215 HydrophobicContact CB-CD1 3.66Å; C74-F215 HydrophobicContact CB-CG 4.26Å; C74-F215 CarbonylContact O-C 3.55Å
75	L	44.5	Very low	38.2	Very low	11 Å²	11	67.4 Å²	67.4	6%	0.058	39%	0.392	C	S	.	.			trans	-107.7	140.3	150.7	-114	99.8	0	0	0	106.3	I92 I94 N188 L217 V219	L75-I92 CarbonylContact C-O 3.56Å; L75-I92 WeakPolarHBondContact CA-O 3.43Å; L75-I92 WeakPolarHBondContact CB-O 3.5Å; L75-I92 CarbonylContact O-C 3.35Å; L75-I94 HydrophobicContact CB-CG1 4.38Å; L75-I94 HydrophobicContact CD1-CD1 3.14Å; L75-I94 HydrophobicContact CD1-CG1 3.45Å; L75-I94 VanDerWaalsContact CD1-CG1 3.45Å; L75-I94 HydrophobicContact CG-CG1 4.48Å; L75-N188 HydrophobicContact CD2-CB 4.34Å; L75-N188 VanDerWaalsContact CD2-ND2 3.27Å; L75-N188 WeakPolarHBondContact CD2-ND2 3.4Å; L75-L217 HydrophobicContact CD1-CB 3.91Å; L75-V219 HydrophobicContact CD1-CG2 3.61Å; L75-V219 HydrophobicContact CD2-CG2 3.75Å; L75-V219 HydrophobicContact CG-CG2 4.26Å
76	L	49.8	Very low	39	Very low	1 Å²	1	64.1 Å²	64.1	1%	0.005	36%	0.362	C	S	.	.			trans	66.8	133.9	135.3	-129.3	117.5	0	0	0	123.8	D78 L91 I92 N188 L191 L192	L76-D78 HydrophobicContact CD2-CB 3.63Å; L76-L91 CarbonylContact O-C 3.57Å; L76-L91 VanDerWaalsContact O-CA 3.24Å; L76-L91 WeakPolarHBondContact O-CA 3.5Å; L76-L91 WeakPolarHBondContact O-CD1 3.41Å; L76-I92 HydrophobicContact CB-CB 4.01Å; L76-I92 HydrophobicContact CB-CG1 4.49Å; L76-I92 HydrophobicContact CD2-CD1 3.9Å; L76-I92 HydrophobicContact CD2-CG1 4.21Å; L76-I92 PolarHBondContact O-N 2.93Å; L76-N188 HydrophobicContact CD1-CB 3.98Å; L76-L191 HydrophobicContact CD1-CB 3.16Å; L76-L191 HydrophobicContact CD1-CD1 3.97Å; L76-L191 HydrophobicContact CD1-CG 4.19Å; L76-L191 HydrophobicContact CD2-CB 3.4Å; L76-L191 VanDerWaalsContact CD2-CB 3.4Å; L76-L191 HydrophobicContact CD2-CD1 4.18Å; L76-L191 HydrophobicContact CD2-CD2 4Å; L76-L191 HydrophobicContact CD2-CG 4.09Å; L76-L191 WeakPolarHBondContact CD2-O 3.28Å; L76-L191 HydrophobicContact CG-CB 3.61Å; L76-L191 VanDerWaalsContact CG-O 3.3Å; L76-L191 WeakPolarHBondContact CG-O 3.18Å; L76-L192 HydrophobicContact CD1-CD2 3.71Å; L76-L192 HydrophobicContact CD1-CG 4.04Å; L76-L192 HydrophobicContact CG-CD2 4.32Å
77	V	39.8	Very low	40.2	Very low	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	113	158.5	-179.2	0	0	0	0	107.3	F58 I60 P89 Y90 L91 F119 I195	F58-V77 HydrophobicContact CD1-CG1 4.25Å; F58-V77 HydrophobicContact CD2-CG1 4.1Å; F58-V77 HydrophobicContact CD2-CG2 4.1Å; F58-V77 HydrophobicContact CE1-CG1 3.81Å; F58-V77 HydrophobicContact CE2-CB 3.77Å; F58-V77 HydrophobicContact CE2-CG1 3.67Å; F58-V77 HydrophobicContact CE2-CG2 3.55Å; F58-V77 HydrophobicContact CG-CG1 4.39Å; F58-V77 HydrophobicContact CZ-CB 3.79Å; F58-V77 HydrophobicContact CZ-CG1 3.5Å; F58-V77 VanDerWaalsContact CZ-CG1 3.5Å; F58-V77 HydrophobicContact CZ-CG2 4.12Å; I60-V77 HydrophobicContact CD1-CG2 3.61Å; V77-P89 HydrophobicContact CG1-CB 4.18Å; V77-Y90 CarbonylContact C-O 3.43Å; V77-Y90 WeakPolarHBondContact CA-O 3.15Å; V77-L91 HydrophobicContact CG2-CD1 3.98Å; V77-F119 HydrophobicContact CB-CE2 4.42Å; V77-F119 HydrophobicContact CB-CZ 4.3Å; V77-F119 HydrophobicContact CG1-CE2 3.75Å; V77-F119 HydrophobicContact CG1-CZ 3.73Å; V77-F119 HydrophobicContact CG2-CE2 4.21Å; V77-F119 HydrophobicContact CG2-CZ 3.71Å; V77-I195 HydrophobicContact CB-CG1 4.37Å; V77-I195 HydrophobicContact CG2-CD1 4.44Å; V77-I195 HydrophobicContact CG2-CG1 4.37Å
78	D	34.2	Very low	41.9	Very low	3 Å²	3	55.3 Å²	55.3	2%	0.016	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.5	179.9	-159.9	-2	0	0	0	110	L76 V80 P89 Y90 I92 L191	L76-D78 HydrophobicContact CD2-CB 3.63Å; D78-V80 HydrophobicContact CB-CG2 3.78Å; D78-V80 PolarHBondContact O-N 3.27Å; D78-V80 WeakPolarHBondContact OD1-CA 3.39Å; D78-V80 PolarHBondContact OD1-N 3.4Å; D78-V80 WeakPolarHBondContact OD2-CG2 3.45Å; D78-P89 WeakPolarHBondContact O-CA 3.3Å; D78-P89 VanDerWaalsContact O-CB 3.31Å; D78-P89 WeakPolarHBondContact O-CB 3.25Å; D78-Y90 PolarHBondContact N-O 3.25Å; D78-Y90 PolarHBondContact O-N 2.86Å; D78-Y90 VanDerWaalsContact O-N 3.14Å; D78-I92 HydrophobicContact CB-CD1 4.23Å; D78-L191 HydrophobicContact CB-CD2 4.23Å; D78-L191 WeakPolarHBondContact OD1-CD2 3.34Å; D78-L191 WeakPolarHBondContact OD2-CD2 3.25Å
79	R	33.4	Very low	43.8	Very low	96 Å²	96	49.6 Å²	49.6	36%	0.362	28%	0.284	S	S	.	.			trans	-80.3	78.9	146.6	-69.6	179.4	169.6	-177.6	-1.7	106.7	D56 T81 P89 D194	D56-R79 PolarHBondContact O-NH2 3.48Å; R79-T81 PolarHBondContact O-N 3.47Å; R79-P89 HydrophobicContact CG-CB 4.42Å; R79-D194 WeakPolarHBondContact CB-OD2 3.45Å; R79-D194 VanDerWaalsContact CD-OD2 3.24Å; R79-D194 WeakPolarHBondContact CD-OD2 3.36Å; R79-D194 WeakPolarHBondContact CG-OD2 3.45Å
80	V	31.3	Very low	45.8	Very low	22 Å²	22	45.3 Å²	45.3	13%	0.133	25%	0.254	C	S	.	.			trans	-58.5	98.3	-175.8	-166.3	0	0	0	0	108.2	D78 I84 V141	D78-V80 HydrophobicContact CB-CG2 3.78Å; D78-V80 PolarHBondContact O-N 3.27Å; D78-V80 WeakPolarHBondContact OD1-CA 3.39Å; D78-V80 PolarHBondContact OD1-N 3.4Å; D78-V80 WeakPolarHBondContact OD2-CG2 3.45Å; V80-I84 HydrophobicContact CB-CB 4.01Å; V80-I84 HydrophobicContact CB-CD1 4.37Å; V80-I84 HydrophobicContact CB-CG2 4.35Å; V80-I84 HydrophobicContact CG1-CB 4.17Å; V80-I84 HydrophobicContact CG1-CD1 3.57Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 CarbonylContact O-C 3.5Å; V80-I84 WeakPolarHBondContact O-CA 3.16Å; V80-I84 WeakPolarHBondContact O-CB 3.39Å; V80-I84 PolarHBondContact O-N 2.94Å; V80-V141 HydrophobicContact CG1-CG2 4.31Å
81	T	28.3	Very low	47.9	Very low	58 Å²	58	44.4 Å²	44.4	36%	0.356	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	157.9	179	67.6	0	0	0	0	115.6	R79 E83 I84	R79-T81 PolarHBondContact O-N 3.47Å; T81-E83 PolarHBondContact O-N 3.3Å; T81-I84 WeakPolarHBondContact OG1-CG1 3.39Å; T81-I84 PolarHBondContact OG1-N 3.01Å; T81-I84 VanDerWaalsContact OG1-N 3.12Å
82	T	35.3	Very low	49.5	Very low	117 Å²	117	41.6 Å²	41.6	72%	0.718	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.3	171.3	39.7	0	0	0	0	113.4
83	E	35.5	Very low	51.4	Low	151 Å²	151	38 Å²	38	71%	0.706	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-30.2	-173.8	-66.8	-179.7	173.3	0	0	113.9	T81 R85	T81-E83 PolarHBondContact O-N 3.3Å; E83-R85 PolarHBondContact O-N 3.4Å
84	I	41.5	Very low	53.1	Low	27 Å²	27	38 Å²	38	14%	0.138	19%	0.193	C	C	.	.			trans	-89.8	33.9	172.1	-42.8	160.5	0	0	0	110.2	V80 T81 I86 Y137	V80-I84 HydrophobicContact CB-CB 4.01Å; V80-I84 HydrophobicContact CB-CD1 4.37Å; V80-I84 HydrophobicContact CB-CG2 4.35Å; V80-I84 HydrophobicContact CG1-CB 4.17Å; V80-I84 HydrophobicContact CG1-CD1 3.57Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 CarbonylContact O-C 3.5Å; V80-I84 WeakPolarHBondContact O-CA 3.16Å; V80-I84 WeakPolarHBondContact O-CB 3.39Å; V80-I84 PolarHBondContact O-N 2.94Å; T81-I84 WeakPolarHBondContact OG1-CG1 3.39Å; T81-I84 PolarHBondContact OG1-N 3.01Å; T81-I84 VanDerWaalsContact OG1-N 3.12Å; I84-I86 PolarHBondContact O-N 2.77Å; I84-I86 VanDerWaalsContact O-N 3.12Å; I84-Y137 HydrophobicContact CB-CD2 4.15Å; I84-Y137 HydrophobicContact CB-CG 4.38Å; I84-Y137 HydrophobicContact CD1-CD1 3.64Å; I84-Y137 HydrophobicContact CD1-CD2 4.08Å; I84-Y137 HydrophobicContact CD1-CE1 4.24Å; I84-Y137 HydrophobicContact CD1-CG 3.54Å; I84-Y137 HydrophobicContact CG1-CD1 3.94Å; I84-Y137 HydrophobicContact CG1-CD2 3.53Å; I84-Y137 HydrophobicContact CG1-CE1 4.26Å; I84-Y137 HydrophobicContact CG1-CE2 3.85Å; I84-Y137 HydrophobicContact CG1-CG 3.57Å; I84-Y137 HydrophobicContact CG2-CD2 3.67Å; I84-Y137 HydrophobicContact CG2-CG 3.89Å
85	R	51.7	Low	55	Low	151 Å²	151	39.3 Å²	39.3	57%	0.57	20%	0.203	S	C	*	.			trans	-70	7.3	162.2	-76.6	-173	173	-150.1	0.4	113.2	E83 G88	E83-R85 PolarHBondContact O-N 3.4Å; R85-G88 PolarHBondContact O-N 3.44Å
86	I	61.1	Low	56.7	Low	21 Å²	21	41.7 Å²	41.7	11%	0.108	21%	0.214	C	C	.	.	S	Bend	trans	-57.2	-62.9	-166.5	-58.3	-178.1	0	0	0	109.5	I84 H125 L126 Q130 D133 N134 Y137	I84-I86 PolarHBondContact O-N 2.77Å; I84-I86 VanDerWaalsContact O-N 3.12Å; I86-H125 PolarHBondContact O-NE2 3.37Å; I86-L126 HydrophobicContact CG2-CD1 3.88Å; I86-L126 HydrophobicContact CG2-CD2 3.56Å; I86-L126 HydrophobicContact CG2-CG 4.32Å; I86-L126 WeakPolarHBondContact O-CD2 3.45Å; I86-Q130 HydrophobicContact CG2-CB 3.44Å; I86-Q130 VanDerWaalsContact CG2-CB 3.44Å; I86-Q130 HydrophobicContact CG2-CG 3.85Å; I86-Q130 VanDerWaalsContact CG2-O 3.23Å; I86-Q130 WeakPolarHBondContact CG2-O 3.25Å; I86-D133 HydrophobicContact CD1-CB 3.65Å; I86-N134 HydrophobicContact CB-CB 4.19Å; I86-N134 HydrophobicContact CG2-CB 3.99Å; I86-Y137 HydrophobicContact CD1-CD2 3.99Å; I86-Y137 HydrophobicContact CD1-CE2 3.74Å
87	A	66.4	Low	58.4	Low	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-91.1	-5.8	178.4	0	0	0	0	0	115.2	Y90 S120 T123 L126 N134	A87-Y90 HydrophobicContact CB-CE2 4.48Å; A87-S120 VanDerWaalsContact O-CB 3.29Å; A87-S120 WeakPolarHBondContact O-CB 3.43Å; A87-S120 PolarHBondContact O-OG 2.89Å; A87-T123 HydrophobicContact CB-CG2 4.3Å; A87-L126 HydrophobicContact CB-CD1 4Å; A87-N134 VanDerWaalsContact CB-OD1 3.27Å; A87-N134 WeakPolarHBondContact CB-OD1 3.35Å
88	G	70.6	Confident	60.5	Low	22 Å²	22	47.8 Å²	47.8	23%	0.227	25%	0.246	C	C	.	.			trans	97.1	-175.4	-170.3	0	0	0	0	0	113.3	R85 Y90	R85-G88 PolarHBondContact O-N 3.44Å; G88-Y90 WeakPolarHBondContact O-CD2 3.24Å; G88-Y90 WeakPolarHBondContact O-CE2 3.02Å
89	P	72.9	Confident	63	Low	29 Å²	29	52.4 Å²	52.4	19%	0.188	27%	0.27	C	S	.	.			trans	-73.6	159.1	-172.2	27.3	-30.4	0	0	0	113	V77 D78 R79 F119	V77-P89 HydrophobicContact CG1-CB 4.18Å; D78-P89 WeakPolarHBondContact O-CA 3.3Å; D78-P89 VanDerWaalsContact O-CB 3.31Å; D78-P89 WeakPolarHBondContact O-CB 3.25Å; R79-P89 HydrophobicContact CG-CB 4.42Å; P89-F119 HydrophobicContact CB-CD2 4.1Å; P89-F119 HydrophobicContact CB-CG 4.48Å; P89-F119 HydrophobicContact CG-CB 3.91Å; P89-F119 HydrophobicContact CG-CD2 4.11Å; P89-F119 HydrophobicContact CG-CG 3.99Å; P89-F119 WeakPolarHBondContact O-CB 3.22Å; P89-F119 VanDerWaalsContact O-CD2 3.28Å; P89-F119 WeakPolarHBondContact O-CD2 3.08Å; P89-F119 PolarHBondContact O-N 3.32Å
90	Y	75	Confident	65.6	Low	15 Å²	15	49.6 Å²	49.6	6%	0.059	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	146.2	174.9	-70.1	-102	0	0	0	110.9	V77 D78 A87 G88 F117 Q118 N134 L138	V77-Y90 CarbonylContact C-O 3.43Å; V77-Y90 WeakPolarHBondContact CA-O 3.15Å; D78-Y90 PolarHBondContact N-O 3.25Å; D78-Y90 PolarHBondContact O-N 2.86Å; D78-Y90 VanDerWaalsContact O-N 3.14Å; A87-Y90 HydrophobicContact CB-CE2 4.48Å; G88-Y90 WeakPolarHBondContact O-CD2 3.24Å; G88-Y90 WeakPolarHBondContact O-CE2 3.02Å; Y90-F117 CarbonylContact C-O 3.47Å; Y90-F117 VanDerWaalsContact CA-O 3.28Å; Y90-F117 WeakPolarHBondContact CA-O 3.44Å; Y90-Q118 HydrophobicContact CD1-CB 3.87Å; Y90-Q118 HydrophobicContact CD1-CG 4.35Å; Y90-Q118 HydrophobicContact CE1-CB 3.55Å; Y90-Q118 HydrophobicContact CE1-CG 3.79Å; Y90-N134 PolarHBondContact OH-ND2 3.4Å; Y90-N134 PolarHBondContact OH-OD1 3.29Å; Y90-L138 HydrophobicContact CD1-CD1 4.28Å; Y90-L138 HydrophobicContact CE1-CD1 3.52Å
91	L	74	Confident	68.3	Low	26 Å²	26	49.3 Å²	49.3	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.8	171.2	-175.5	80	0	0	0	108.4	I60 L76 V77 V93 L116 F117 F119	I60-L91 HydrophobicContact CD1-CD1 4.2Å; L76-L91 CarbonylContact O-C 3.57Å; L76-L91 VanDerWaalsContact O-CA 3.24Å; L76-L91 WeakPolarHBondContact O-CA 3.5Å; L76-L91 WeakPolarHBondContact O-CD1 3.41Å; V77-L91 HydrophobicContact CG2-CD1 3.98Å; L91-V93 HydrophobicContact CD2-CG2 3.59Å; L91-V93 HydrophobicContact CG-CG2 3.8Å; L91-L116 CarbonylContact O-C 3.56Å; L91-L116 VanDerWaalsContact O-CA 3.32Å; L91-L116 WeakPolarHBondContact O-CA 3.45Å; L91-F117 HydrophobicContact CB-CB 4.24Å; L91-F117 HydrophobicContact CD2-CD2 4.32Å; L91-F117 PolarHBondContact N-O 3.26Å; L91-F117 PolarHBondContact O-N 3.32Å; L91-F119 HydrophobicContact CB-CD2 4.45Å; L91-F119 HydrophobicContact CB-CE2 3.65Å; L91-F119 HydrophobicContact CB-CZ 4.19Å; L91-F119 HydrophobicContact CD1-CZ 4.34Å
92	I	76.8	Confident	71.1	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	92.5	-176.8	-50.3	-178	0	0	0	110.2	L75 L76 D78 D115 L116 V141 L145	L75-I92 CarbonylContact C-O 3.56Å; L75-I92 WeakPolarHBondContact CA-O 3.43Å; L75-I92 WeakPolarHBondContact CB-O 3.5Å; L75-I92 CarbonylContact O-C 3.35Å; L76-I92 HydrophobicContact CB-CB 4.01Å; L76-I92 HydrophobicContact CB-CG1 4.49Å; L76-I92 HydrophobicContact CD2-CD1 3.9Å; L76-I92 HydrophobicContact CD2-CG1 4.21Å; L76-I92 PolarHBondContact O-N 2.93Å; D78-I92 HydrophobicContact CB-CD1 4.23Å; I92-D115 CarbonylContact C-O 3.09Å; I92-D115 WeakPolarHBondContact CA-O 3.33Å; I92-L116 HydrophobicContact CG1-CD2 4.41Å; I92-L116 HydrophobicContact CG1-CG 4.27Å; I92-L116 HydrophobicContact CG2-CG 4.47Å; I92-V141 HydrophobicContact CD1-CG1 4.23Å; I92-L145 HydrophobicContact CD1-CD1 4.25Å; I92-L145 HydrophobicContact CG2-CD1 3.6Å; I92-L145 HydrophobicContact CG2-CD2 4.02Å; I92-L145 HydrophobicContact CG2-CG 4.48Å
93	V	76.4	Confident	73.4	Confident	22 Å²	22	43.1 Å²	43.1	13%	0.133	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.4	-174.2	-176.4	0	0	0	0	110.9	L91 S95 T114 D115 F117	L91-V93 HydrophobicContact CD2-CG2 3.59Å; L91-V93 HydrophobicContact CG-CG2 3.8Å; V93-S95 PolarHBondContact O-N 3.25Å; V93-T114 CarbonylContact O-C 3.57Å; V93-T114 WeakPolarHBondContact O-CA 3.36Å; V93-D115 PolarHBondContact N-O 3.37Å; V93-D115 PolarHBondContact O-N 3.3Å; V93-F117 HydrophobicContact CB-CE2 4.1Å; V93-F117 HydrophobicContact CG2-CD2 3.97Å; V93-F117 HydrophobicContact CG2-CE2 3.84Å
94	I	78.5	Confident	75.5	Confident	9 Å²	9	41 Å²	41	5%	0.046	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	106.3	161.2	-63.1	174.2	0	0	0	106.8	L75 I111 Y152	L75-I94 HydrophobicContact CB-CG1 4.38Å; L75-I94 HydrophobicContact CD1-CD1 3.14Å; L75-I94 HydrophobicContact CD1-CG1 3.45Å; L75-I94 VanDerWaalsContact CD1-CG1 3.45Å; L75-I94 HydrophobicContact CG-CG1 4.48Å; I94-I111 HydrophobicContact CD1-CD1 3.53Å; I94-I111 HydrophobicContact CD1-CG1 3.81Å; I94-I111 HydrophobicContact CG1-CD1 3.9Å; I94-I111 HydrophobicContact CG1-CG1 4.24Å; I94-I111 HydrophobicContact CG1-CG2 4.34Å; I94-I111 HydrophobicContact CG2-CG2 4.24Å; I94-Y152 HydrophobicContact CD1-CD1 3.62Å; I94-Y152 HydrophobicContact CD1-CD2 4.37Å; I94-Y152 HydrophobicContact CD1-CE1 3.49Å; I94-Y152 VanDerWaalsContact CD1-CE1 3.49Å; I94-Y152 HydrophobicContact CD1-CE2 4.26Å; I94-Y152 HydrophobicContact CD1-CG 4.05Å; I94-Y152 HydrophobicContact CG2-CE1 4.29Å
95	S	77.7	Confident	77.4	Confident	41 Å²	41	48 Å²	48	29%	0.287	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-26.6	179.4	55.8	0	0	0	0	113.2	V93 R113 D115	V93-S95 PolarHBondContact O-N 3.25Å; S95-R113 PolarHBondContact N-O 2.96Å; S95-R113 PolarHBondContact OG-NE 3.06Å; S95-R113 VanDerWaalsContact OG-NE 3.09Å; S95-D115 WeakPolarHBondContact CB-OD2 3.19Å; S95-D115 VanDerWaalsContact OG-CG 3.27Å; S95-D115 PolarHBondContact OG-OD2 3.03Å
96	E	81.1	Confident	79	Confident	61 Å²	61	44.2 Å²	44.2	29%	0.285	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.7	174.3	-60	179.6	172.6	0	0	110.7	T112 R113	E96-T112 VanDerWaalsContact CB-OG1 3.31Å; E96-T112 WeakPolarHBondContact CB-OG1 3.16Å; E96-T112 PolarHBondContact O-N 2.84Å; E96-T112 PolarHBondContact O-OG1 3.42Å; E96-T112 VanDerWaalsContact O-OG1 3.13Å; E96-R113 HydrophobicContact CB-CB 3.77Å; E96-R113 HydrophobicContact CG-CB 4.09Å; E96-R113 PolarHBondContact N-O 3.19Å; E96-R113 VanDerWaalsContact N-O 3.17Å; E96-R113 PolarHBondContact O-N 3.12Å; E96-R113 VanDerWaalsContact O-N 3.12Å; E96-R113 IonicContact OE1-CZ 2.86Å; E96-R113 IonicContact OE1-NE 3.89Å; E96-R113 IonicContact OE1-NH1 2.86Å; E96-R113 PolarHBondContact OE1-NH1 3.33Å; E96-R113 IonicContact OE1-NH2 3.74Å; E96-R113 PolarHBondContact OE1-NH2 3.14Å; E96-R113 IonicContact OE2-CZ 3.3Å; E96-R113 IonicContact OE2-NH1 3.92Å; E96-R113 PolarHBondContact OE2-NH1 3.27Å
97	S	84.4	Confident	80.2	Confident	35 Å²	35	49 Å²	49	25%	0.245	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	155.2	173.8	68.1	0	0	0	0	110.8	R110 Y152	S97-R110 CarbonylContact C-O 3.54Å; S97-R110 WeakPolarHBondContact CA-O 3.39Å; S97-R110 WeakPolarHBondContact CB-O 3.24Å; S97-Y152 PolarHBondContact OG-OH 2.97Å; S97-Y152 VanDerWaalsContact OG-OH 3.06Å
98	E	85.3	Confident	81.2	Confident	95 Å²	95	49 Å²	49	44%	0.444	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.2	178.1	-72.2	173.6	-173	0	0	110.3	V100 F109 R110 T112	E98-V100 PolarHBondContact O-N 2.85Å; E98-F109 CarbonylContact O-C 3.58Å; E98-F109 VanDerWaalsContact O-CA 3.25Å; E98-F109 WeakPolarHBondContact O-CA 3.37Å; E98-R110 PolarHBondContact N-O 3.13Å; E98-R110 PolarHBondContact O-N 2.97Å; E98-R110 IonicContact OE1-NH2 3.19Å; E98-R110 IonicContact OE2-CZ 2.9Å; E98-R110 IonicContact OE2-NE 2.88Å; E98-R110 PolarHBondContact OE2-NE 3.23Å; E98-R110 IonicContact OE2-NH2 3.71Å; E98-R110 PolarHBondContact OE2-NH2 3.33Å; E98-T112 HydrophobicContact CB-CG2 4.31Å; E98-T112 HydrophobicContact CG-CG2 3.68Å
99	L	86.9	Confident	82	Confident	99 Å²	99	49.8 Å²	49.8	52%	0.518	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	118.9	173.6	-179.1	67.5	0	0	0	109.6	K107 F109	L99-K107 HydrophobicContact CD1-CB 3.82Å; L99-K107 HydrophobicContact CD1-CD 4.4Å; L99-K107 HydrophobicContact CD1-CG 4.09Å; L99-F109 HydrophobicContact CB-CD1 4.19Å; L99-F109 HydrophobicContact CB-CE1 4.05Å; L99-F109 HydrophobicContact CD1-CD1 4.15Å; L99-F109 HydrophobicContact CD1-CE1 3.74Å; L99-F109 HydrophobicContact CD1-CZ 3.98Å; L99-F109 HydrophobicContact CG-CE1 4.5Å
100	V	86.1	Confident	82.7	Confident	37 Å²	37	52.3 Å²	52.3	22%	0.224	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-32.6	174.8	-175.4	0	0	0	0	110.9	E98 V108 R110 Y151 M224 I226	E98-V100 PolarHBondContact O-N 2.85Å; V100-V108 PolarHBondContact N-O 3.1Å; V100-R110 HydrophobicContact CG2-CB 3.7Å; V100-Y151 HydrophobicContact CG2-CD1 3.95Å; V100-Y151 HydrophobicContact CG2-CE1 3.83Å; V100-M224 HydrophobicContact CB-CE 3.44Å; V100-M224 VanDerWaalsContact CB-CE 3.44Å; V100-M224 HydrophobicContact CG1-CE 3.44Å; V100-M224 VanDerWaalsContact CG1-CE 3.44Å; V100-M224 HydrophobicContact CG2-CE 3.78Å; V100-I226 HydrophobicContact CG1-CG1 4.42Å
101	G	87.9	Confident	83.1	Confident	17 Å²	17	52.4 Å²	52.4	18%	0.175	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-160.3	178.6	0	0	0	0	0	111.5	V108	G101-V108 PolarHBondContact O-N 2.89Å
102	T	88.1	Confident	83.5	Confident	41 Å²	41	54.1 Å²	54.1	25%	0.252	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.9	179.9	59.9	0	0	0	0	112.5	Q106 K107 K237	T102-Q106 CarbonylContact C-O 3.17Å; T102-Q106 WeakPolarHBondContact CA-O 3.33Å; T102-K107 HydrophobicContact CG2-CG 4.04Å; T102-K237 WeakPolarHBondContact O-CD 3.49Å; T102-K237 PolarHBondContact O-NZ 3.31Å
103	I	83.4	Confident	83.7	Confident	4 Å²	4	59 Å²	59	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.4	172.5	-54.4	-178.5	0	0	0	106.3	E105 Q106 V108 Y156 M224 I226 A239 I241 I273	I103-E105 VanDerWaalsContact C-N 3.26Å; I103-E105 PolarHBondContact O-N 2.81Å; I103-Q106 PolarHBondContact N-O 2.8Å; I103-Q106 VanDerWaalsContact O-CB 3.25Å; I103-Q106 WeakPolarHBondContact O-CB 3.36Å; I103-Q106 PolarHBondContact O-N 2.85Å; I103-V108 HydrophobicContact CD1-CG2 4.33Å; I103-V108 HydrophobicContact CG1-CG2 4.32Å; I103-Y156 HydrophobicContact CD1-CE1 4.43Å; I103-Y156 HydrophobicContact CG2-CE1 4.47Å; I103-M224 HydrophobicContact CD1-SD 4.32Å; I103-I226 HydrophobicContact CD1-CD1 4.1Å; I103-I226 HydrophobicContact CG1-CD1 3.64Å; I103-A239 HydrophobicContact CD1-CB 4.35Å; I103-I241 HydrophobicContact CD1-CD1 3.72Å; I103-I241 HydrophobicContact CD1-CG1 4.39Å; I103-I273 HydrophobicContact CG2-CD1 4.38Å
104	Y	80	Confident	84	Confident	107 Å²	107	59.3 Å²	59.3	42%	0.42	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	43	-167.4	-70.4	-84.6	0	0	0	113.9	Q106 L162 L280	Y104-Q106 PolarHBondContact O-N 2.74Å; Y104-L162 HydrophobicContact CD2-CD1 4.45Å; Y104-L162 HydrophobicContact CE2-CD1 3.23Å; Y104-L162 WeakPolarHBondContact OH-CD1 3.39Å; Y104-L280 HydrophobicContact CD1-CD1 3.76Å; Y104-L280 HydrophobicContact CD2-CD1 4.44Å; Y104-L280 HydrophobicContact CE1-CD1 3.07Å; Y104-L280 HydrophobicContact CE2-CD1 3.85Å; Y104-L280 HydrophobicContact CG-CD1 4.39Å; Y104-L280 WeakPolarHBondContact OH-CD1 3.49Å
105	E	82	Confident	84	Confident	172 Å²	172	61.5 Å²	61.5	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-0.8	-176.1	-49.4	179.1	164.6	0	0	114.1	I103	I103-E105 VanDerWaalsContact C-N 3.26Å; I103-E105 PolarHBondContact O-N 2.81Å
106	Q	85	Confident	84.2	Confident	72 Å²	72	61.5 Å²	61.5	34%	0.336	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127	174.6	-54.4	-58.1	-30.3	0	0	109.5	T102 I103 Y104 T155 Y156	T102-Q106 CarbonylContact C-O 3.17Å; T102-Q106 WeakPolarHBondContact CA-O 3.33Å; I103-Q106 PolarHBondContact N-O 2.8Å; I103-Q106 VanDerWaalsContact O-CB 3.25Å; I103-Q106 WeakPolarHBondContact O-CB 3.36Å; I103-Q106 PolarHBondContact O-N 2.85Å; Y104-Q106 PolarHBondContact O-N 2.74Å; Q106-T155 PolarHBondContact OE1-OG1 3.19Å; Q106-Y156 HydrophobicContact CB-CG 4.41Å
107	K	86.7	Confident	83.9	Confident	121 Å²	121	63.8 Å²	63.8	53%	0.526	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.5	-178.8	-64.9	179.8	-176.8	178.2	0	110.4	L99 T102 F109 S153	L99-K107 HydrophobicContact CD1-CB 3.82Å; L99-K107 HydrophobicContact CD1-CD 4.4Å; L99-K107 HydrophobicContact CD1-CG 4.09Å; T102-K107 HydrophobicContact CG2-CG 4.04Å; K107-F109 HydrophobicContact CB-CD2 4.43Å; K107-F109 HydrophobicContact CB-CE2 3.49Å; K107-F109 VanDerWaalsContact CB-CE2 3.49Å; K107-F109 HydrophobicContact CB-CZ 3.64Å; K107-F109 HydrophobicContact CD-CZ 3.95Å; K107-F109 HydrophobicContact CG-CZ 4.41Å; K107-S153 VanDerWaalsContact O-CB 3.29Å; K107-S153 WeakPolarHBondContact O-CB 3.31Å; K107-S153 PolarHBondContact O-OG 3.36Å
108	V	87	Confident	83.5	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.3	175.8	-167	0	0	0	0	109.7	V100 G101 I103 Y152 Y156 L158 M224	V100-V108 PolarHBondContact N-O 3.1Å; G101-V108 PolarHBondContact O-N 2.89Å; I103-V108 HydrophobicContact CD1-CG2 4.33Å; I103-V108 HydrophobicContact CG1-CG2 4.32Å; V108-Y152 WeakPolarHBondContact CG1-O 3.38Å; V108-Y156 HydrophobicContact CG2-CD1 4.42Å; V108-L158 HydrophobicContact CG1-CD1 3.62Å; V108-L158 HydrophobicContact CG1-CD2 3.57Å; V108-L158 HydrophobicContact CG1-CG 4.09Å; V108-L158 HydrophobicContact CG2-CD2 4.13Å; V108-M224 HydrophobicContact CB-CE 3.63Å; V108-M224 HydrophobicContact CB-SD 4.22Å; V108-M224 HydrophobicContact CG1-CE 3.28Å; V108-M224 HydrophobicContact CG1-SD 3.64Å
109	F	86.6	Confident	82.7	Confident	39 Å²	39	61.9 Å²	61.9	17%	0.171	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.2	-169.3	-59.8	-90.3	0	0	0	111.5	E98 L99 K107 Y151 Y152	E98-F109 CarbonylContact O-C 3.58Å; E98-F109 VanDerWaalsContact O-CA 3.25Å; E98-F109 WeakPolarHBondContact O-CA 3.37Å; L99-F109 HydrophobicContact CB-CD1 4.19Å; L99-F109 HydrophobicContact CB-CE1 4.05Å; L99-F109 HydrophobicContact CD1-CD1 4.15Å; L99-F109 HydrophobicContact CD1-CE1 3.74Å; L99-F109 HydrophobicContact CD1-CZ 3.98Å; L99-F109 HydrophobicContact CG-CE1 4.5Å; K107-F109 HydrophobicContact CB-CD2 4.43Å; K107-F109 HydrophobicContact CB-CE2 3.49Å; K107-F109 VanDerWaalsContact CB-CE2 3.49Å; K107-F109 HydrophobicContact CB-CZ 3.64Å; K107-F109 HydrophobicContact CD-CZ 3.95Å; K107-F109 HydrophobicContact CG-CZ 4.41Å; F109-Y151 WeakPolarHBondContact O-CA 3.49Å; F109-Y151 WeakPolarHBondContact O-CB 3.31Å; F109-Y152 HydrophobicContact CB-CD1 4Å; F109-Y152 HydrophobicContact CB-CE1 3.52Å; F109-Y152 HydrophobicContact CB-CE2 4.48Å; F109-Y152 HydrophobicContact CD2-CE2 4.31Å; F109-Y152 HydrophobicContact CG-CE1 4.38Å; F109-Y152 PolarHBondContact N-O 2.98Å; F109-Y152 PolarHBondContact O-N 3.35Å
110	R	87	Confident	81.8	Confident	82 Å²	82	58.7 Å²	58.7	31%	0.309	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.6	168.5	-177.4	175.2	69.9	154.1	9.2	108.4	S97 E98 V100 F150 Y151	S97-R110 CarbonylContact C-O 3.54Å; S97-R110 WeakPolarHBondContact CA-O 3.39Å; S97-R110 WeakPolarHBondContact CB-O 3.24Å; E98-R110 PolarHBondContact N-O 3.13Å; E98-R110 PolarHBondContact O-N 2.97Å; E98-R110 IonicContact OE1-NH2 3.19Å; E98-R110 IonicContact OE2-CZ 2.9Å; E98-R110 IonicContact OE2-NE 2.88Å; E98-R110 PolarHBondContact OE2-NE 3.23Å; E98-R110 IonicContact OE2-NH2 3.71Å; E98-R110 PolarHBondContact OE2-NH2 3.33Å; V100-R110 HydrophobicContact CG2-CB 3.7Å; R110-F150 WeakPolarHBondContact CA-O 3.43Å; R110-Y151 HydrophobicContact CB-CD1 3.83Å; R110-Y151 HydrophobicContact CB-CE1 3.68Å; R110-Y151 HydrophobicContact CG-CD1 4.2Å; R110-Y151 HydrophobicContact CG-CE1 3.77Å
111	I	84.3	Confident	80.8	Confident	18 Å²	18	69.3 Å²	69.3	9%	0.092	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.6	175.4	-55.1	-179.9	0	0	0	108.4	I94 T114 F150 Y152 V219	I94-I111 HydrophobicContact CD1-CD1 3.53Å; I94-I111 HydrophobicContact CD1-CG1 3.81Å; I94-I111 HydrophobicContact CG1-CD1 3.9Å; I94-I111 HydrophobicContact CG1-CG1 4.24Å; I94-I111 HydrophobicContact CG1-CG2 4.34Å; I94-I111 HydrophobicContact CG2-CG2 4.24Å; I111-T114 HydrophobicContact CG2-CG2 3.63Å; I111-F150 HydrophobicContact CB-CB 4.1Å; I111-F150 HydrophobicContact CD1-CB 3.81Å; I111-F150 HydrophobicContact CG1-CB 4.13Å; I111-F150 PolarHBondContact N-O 2.79Å; I111-Y152 HydrophobicContact CD1-CD1 4.09Å; I111-Y152 HydrophobicContact CG1-CD1 3.6Å; I111-Y152 HydrophobicContact CG1-CE1 3.92Å; I111-V219 HydrophobicContact CD1-CG1 4Å; I111-V219 HydrophobicContact CD1-CG2 3.96Å
112	T	82.2	Confident	79.9	Confident	62 Å²	62	71.5 Å²	71.5	38%	0.38	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-30.5	177.7	52.8	0	0	0	0	112.7	E96 E98	E96-T112 VanDerWaalsContact CB-OG1 3.31Å; E96-T112 WeakPolarHBondContact CB-OG1 3.16Å; E96-T112 PolarHBondContact O-N 2.84Å; E96-T112 PolarHBondContact O-OG1 3.42Å; E96-T112 VanDerWaalsContact O-OG1 3.13Å; E98-T112 HydrophobicContact CB-CG2 4.31Å; E98-T112 HydrophobicContact CG-CG2 3.68Å
113	R	80.8	Confident	79.1	Confident	104 Å²	104	72.3 Å²	72.3	39%	0.392	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.5	172.7	-162.1	173.8	74.7	-145.3	-8.1	112	S95 E96 D115	S95-R113 PolarHBondContact N-O 2.96Å; S95-R113 PolarHBondContact OG-NE 3.06Å; S95-R113 VanDerWaalsContact OG-NE 3.09Å; E96-R113 HydrophobicContact CB-CB 3.77Å; E96-R113 HydrophobicContact CG-CB 4.09Å; E96-R113 PolarHBondContact N-O 3.19Å; E96-R113 VanDerWaalsContact N-O 3.17Å; E96-R113 PolarHBondContact O-N 3.12Å; E96-R113 VanDerWaalsContact O-N 3.12Å; E96-R113 IonicContact OE1-CZ 2.86Å; E96-R113 IonicContact OE1-NE 3.89Å; E96-R113 IonicContact OE1-NH1 2.86Å; E96-R113 PolarHBondContact OE1-NH1 3.33Å; E96-R113 IonicContact OE1-NH2 3.74Å; E96-R113 PolarHBondContact OE1-NH2 3.14Å; E96-R113 IonicContact OE2-CZ 3.3Å; E96-R113 IonicContact OE2-NH1 3.92Å; E96-R113 PolarHBondContact OE2-NH1 3.27Å; R113-D115 IonicContact NE-OD1 2.89Å; R113-D115 IonicContact NE-OD2 3.64Å
114	T	82.7	Confident	78.6	Confident	29 Å²	29	76.3 Å²	76.3	18%	0.178	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138	171.1	59	0	0	0	0	109.9	V93 I111 L145	V93-T114 CarbonylContact O-C 3.57Å; V93-T114 WeakPolarHBondContact O-CA 3.36Å; I111-T114 HydrophobicContact CG2-CG2 3.63Å; T114-L145 HydrophobicContact CG2-CD2 4.48Å; T114-L145 WeakPolarHBondContact OG1-CB 3.33Å
115	D	79.4	Confident	78.5	Confident	55 Å²	55	77.2 Å²	77.2	29%	0.294	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.3	175.4	-68	-44.4	0	0	0	110.7	I92 V93 S95 R113 F117	I92-D115 CarbonylContact C-O 3.09Å; I92-D115 WeakPolarHBondContact CA-O 3.33Å; V93-D115 PolarHBondContact N-O 3.37Å; V93-D115 PolarHBondContact O-N 3.3Å; S95-D115 WeakPolarHBondContact CB-OD2 3.19Å; S95-D115 VanDerWaalsContact OG-CG 3.27Å; S95-D115 PolarHBondContact OG-OD2 3.03Å; R113-D115 IonicContact NE-OD1 2.89Å; R113-D115 IonicContact NE-OD2 3.64Å; D115-F117 HydrophobicContact CB-CE2 3.75Å; D115-F117 HydrophobicContact CB-CZ 3.88Å
116	L	80.6	Confident	78.4	Confident	41 Å²	41	70 Å²	70	22%	0.215	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.2	179.2	-67.2	84.6	0	0	0	109.9	L91 I92 V141 K142 L145	L91-L116 CarbonylContact O-C 3.56Å; L91-L116 VanDerWaalsContact O-CA 3.32Å; L91-L116 WeakPolarHBondContact O-CA 3.45Å; I92-L116 HydrophobicContact CG1-CD2 4.41Å; I92-L116 HydrophobicContact CG1-CG 4.27Å; I92-L116 HydrophobicContact CG2-CG 4.47Å; L116-V141 HydrophobicContact CD2-CG1 4.06Å; L116-K142 HydrophobicContact CD1-CG 3.91Å; L116-K142 HydrophobicContact CD2-CG 4.47Å; L116-L145 HydrophobicContact CD1-CD1 3.78Å; L116-L145 HydrophobicContact CD2-CD1 4.29Å; L116-L145 HydrophobicContact CG-CD1 4.25Å
117	F	76.5	Confident	78.4	Confident	110 Å²	110	69.5 Å²	69.5	48%	0.482	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.1	178.1	-55.1	-86.8	0	0	0	110.5	Y90 L91 V93 D115	Y90-F117 CarbonylContact C-O 3.47Å; Y90-F117 VanDerWaalsContact CA-O 3.28Å; Y90-F117 WeakPolarHBondContact CA-O 3.44Å; L91-F117 HydrophobicContact CB-CB 4.24Å; L91-F117 HydrophobicContact CD2-CD2 4.32Å; L91-F117 PolarHBondContact N-O 3.26Å; L91-F117 PolarHBondContact O-N 3.32Å; V93-F117 HydrophobicContact CB-CE2 4.1Å; V93-F117 HydrophobicContact CG2-CD2 3.97Å; V93-F117 HydrophobicContact CG2-CE2 3.84Å; D115-F117 HydrophobicContact CB-CE2 3.75Å; D115-F117 HydrophobicContact CB-CZ 3.88Å
118	Q	76	Confident	78.3	Confident	75 Å²	75	71.4 Å²	71.4	35%	0.35	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.5	178	-172.1	175.9	-10	0	0	110.6	Y90 S120	Y90-Q118 HydrophobicContact CD1-CB 3.87Å; Y90-Q118 HydrophobicContact CD1-CG 4.35Å; Y90-Q118 HydrophobicContact CE1-CB 3.55Å; Y90-Q118 HydrophobicContact CE1-CG 3.79Å; Q118-S120 PolarHBondContact NE2-OG 3.33Å
119	F	67.5	Low	78.2	Confident	15 Å²	15	77.1 Å²	77.1	7%	0.066	39%	0.385	C	S	.	.	S	Bend	trans	-77.3	-36.8	175.6	-80.9	-106.2	0	0	0	112.7	L51 V53 F58 V77 P89 L91	L51-F119 HydrophobicContact CD1-CD1 4.34Å; L51-F119 HydrophobicContact CD1-CE1 3.51Å; L51-F119 HydrophobicContact CD1-CZ 3.96Å; L51-F119 HydrophobicContact CD2-CD1 3.2Å; L51-F119 HydrophobicContact CD2-CE1 3.27Å; L51-F119 HydrophobicContact CD2-CG 3.99Å; L51-F119 HydrophobicContact CD2-CZ 4.07Å; L51-F119 HydrophobicContact CG-CD1 3.87Å; L51-F119 HydrophobicContact CG-CE1 3.51Å; L51-F119 HydrophobicContact CG-CZ 4.38Å; V53-F119 HydrophobicContact CG2-CD1 3.73Å; F58-F119 HydrophobicContact CB-CE1 4.28Å; V77-F119 HydrophobicContact CB-CE2 4.42Å; V77-F119 HydrophobicContact CB-CZ 4.3Å; V77-F119 HydrophobicContact CG1-CE2 3.75Å; V77-F119 HydrophobicContact CG1-CZ 3.73Å; V77-F119 HydrophobicContact CG2-CE2 4.21Å; V77-F119 HydrophobicContact CG2-CZ 3.71Å; P89-F119 HydrophobicContact CB-CD2 4.1Å; P89-F119 HydrophobicContact CB-CG 4.48Å; P89-F119 HydrophobicContact CG-CB 3.91Å; P89-F119 HydrophobicContact CG-CD2 4.11Å; P89-F119 HydrophobicContact CG-CG 3.99Å; P89-F119 WeakPolarHBondContact O-CB 3.22Å; P89-F119 VanDerWaalsContact O-CD2 3.28Å; P89-F119 WeakPolarHBondContact O-CD2 3.08Å; P89-F119 PolarHBondContact O-N 3.32Å; L91-F119 HydrophobicContact CB-CD2 4.45Å; L91-F119 HydrophobicContact CB-CE2 3.65Å; L91-F119 HydrophobicContact CB-CZ 4.19Å; L91-F119 HydrophobicContact CD1-CZ 4.34Å
120	S	68.3	Low	78.1	Confident	31 Å²	31	78.8 Å²	78.8	22%	0.217	39%	0.394	C	S	.	.			trans	-75.3	133.3	-177.6	75.3	0	0	0	0	111.3	A87 Q118 S122	A87-S120 VanDerWaalsContact O-CB 3.29Å; A87-S120 WeakPolarHBondContact O-CB 3.43Å; A87-S120 PolarHBondContact O-OG 2.89Å; Q118-S120 PolarHBondContact NE2-OG 3.33Å; S120-S122 PolarHBondContact O-N 3.29Å
121	R	64.8	Low	77.8	Confident	260 Å²	260	77.2 Å²	77.2	98%	0.981	39%	0.393	S	S	*	.	S	Bend	trans	-73.4	-12.8	-179.2	-65.3	-175.2	179.3	-177	-0.4	113.4
122	S	69.3	Low	77.8	Confident	63 Å²	63	81 Å²	81	44%	0.441	41%	0.41	S	S	.	.			trans	-157.6	137.2	-174.5	178.6	0	0	0	0	112.2	S120 A124 H125	S120-S122 PolarHBondContact O-N 3.29Å; S122-A124 WeakPolarHBondContact OG-CB 3.35Å; S122-A124 PolarHBondContact OG-N 2.89Å; S122-H125 PolarHBondContact O-CE1 3.29Å; S122-H125 VanDerWaalsContact O-CE1 3.27Å; S122-H125 PolarHBondContact O-ND1 3.36Å; S122-H125 VanDerWaalsContact O-ND1 3.16Å
123	T	70.4	Confident	77.9	Confident	59 Å²	59	80.1 Å²	80.1	36%	0.362	40%	0.403	S	S	.	.			trans	-92	7.2	170.1	50.5	0	0	0	0	112.7	A87 H125 L126	A87-T123 HydrophobicContact CB-CG2 4.3Å; T123-H125 PolarHBondContact O-N 3.4Å; T123-H125 VanDerWaalsContact O-N 3.1Å; T123-L126 HydrophobicContact CG2-CD1 4.13Å; T123-L126 VanDerWaalsContact O-CB 3.24Å; T123-L126 WeakPolarHBondContact O-CB 3.37Å; T123-L126 WeakPolarHBondContact O-CG 3.4Å; T123-L126 PolarHBondContact O-N 2.84Å
124	A	74	Confident	78	Confident	88 Å²	88	75.6 Å²	75.6	73%	0.727	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.7	-174.9	0	0	0	0	0	114.7	S122 L126	S122-A124 WeakPolarHBondContact OG-CB 3.35Å; S122-A124 PolarHBondContact OG-N 2.89Å; A124-L126 PolarHBondContact O-N 3.46Å
125	H	77.9	Confident	78	Confident	125 Å²	125	78.5 Å²	78.5	58%	0.579	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-6.3	174.6	64.3	-80.5	0	0	0	112.8	I86 S122 T123	I86-H125 PolarHBondContact O-NE2 3.37Å; S122-H125 PolarHBondContact O-CE1 3.29Å; S122-H125 VanDerWaalsContact O-CE1 3.27Å; S122-H125 PolarHBondContact O-ND1 3.36Å; S122-H125 VanDerWaalsContact O-ND1 3.16Å; T123-H125 PolarHBondContact O-N 3.4Å; T123-H125 VanDerWaalsContact O-N 3.1Å
126	L	79	Confident	78.3	Confident	22 Å²	22	79.6 Å²	79.6	12%	0.115	41%	0.406	C	S	.	.	S	Bend	trans	-92.4	139.4	-178.3	-61.5	178.2	0	0	0	112.3	I86 A87 T123 A124 Q130 V131	I86-L126 HydrophobicContact CG2-CD1 3.88Å; I86-L126 HydrophobicContact CG2-CD2 3.56Å; I86-L126 HydrophobicContact CG2-CG 4.32Å; I86-L126 WeakPolarHBondContact O-CD2 3.45Å; A87-L126 HydrophobicContact CB-CD1 4Å; T123-L126 HydrophobicContact CG2-CD1 4.13Å; T123-L126 VanDerWaalsContact O-CB 3.24Å; T123-L126 WeakPolarHBondContact O-CB 3.37Å; T123-L126 WeakPolarHBondContact O-CG 3.4Å; T123-L126 PolarHBondContact O-N 2.84Å; A124-L126 PolarHBondContact O-N 3.46Å; L126-Q130 HydrophobicContact CB-CB 4Å; L126-Q130 HydrophobicContact CD2-CB 3.94Å; L126-Q130 HydrophobicContact CD2-CG 4.43Å; L126-Q130 HydrophobicContact CG-CB 4.45Å; L126-V131 HydrophobicContact CB-CG2 3.76Å; L126-V131 HydrophobicContact CD1-CG2 4.22Å
127	S	85	Confident	78.4	Confident	60 Å²	60	81.1 Å²	81.1	42%	0.42	41%	0.409	S	S	.	.			trans	-65.5	160	162.5	62.7	0	0	0	0	111.5	Q129 Q130 V131	S127-Q129 VanDerWaalsContact C-N 3.28Å; S127-Q129 PolarHBondContact O-N 3.28Å; S127-Q130 WeakPolarHBondContact O-CB 3.44Å; S127-Q130 PolarHBondContact O-N 2.78Å; S127-Q130 VanDerWaalsContact O-N 3.12Å; S127-Q130 WeakPolarHBondContact OG-CB 3.28Å; S127-Q130 VanDerWaalsContact OG-CG 3.29Å; S127-Q130 WeakPolarHBondContact OG-CG 3.37Å; S127-Q130 PolarHBondContact OG-N 2.94Å; S127-Q130 PolarHBondContact OG-OE1 2.96Å; S127-V131 WeakPolarHBondContact O-CG2 3.36Å; S127-V131 PolarHBondContact O-N 2.86Å
128	E	85.6	Confident	78.8	Confident	161 Å²	161	77.5 Å²	77.5	75%	0.752	40%	0.395	S	S	*	.	H	α-helix	trans	-57	-40.9	177.7	-172.3	172.7	-168.1	0	0	112.5	V131 Q132	E128-V131 PolarHBondContact O-N 2.76Å; E128-Q132 WeakPolarHBondContact O-CG 3.35Å; E128-Q132 PolarHBondContact O-N 3.09Å; E128-Q132 VanDerWaalsContact O-N 3.1Å
129	Q	84.7	Confident	79.3	Confident	120 Å²	120	80 Å²	80	56%	0.561	41%	0.407	S	S	*	.	H	α-helix	trans	-62.3	-44.7	175.7	-175.7	60.7	40.6	0	0	111.8	S127 V131 Q132 D133	S127-Q129 VanDerWaalsContact C-N 3.28Å; S127-Q129 PolarHBondContact O-N 3.28Å; Q129-V131 VanDerWaalsContact C-N 3.3Å; Q129-V131 PolarHBondContact O-N 2.8Å; Q129-Q132 WeakPolarHBondContact O-CB 2.97Å; Q129-Q132 PolarHBondContact O-N 2.78Å; Q129-Q132 VanDerWaalsContact O-N 3.14Å; Q129-D133 PolarHBondContact NE2-OD1 3.42Å; Q129-D133 VanDerWaalsContact O-CG 3.28Å; Q129-D133 PolarHBondContact O-N 3.17Å
130	Q	83.7	Confident	80.2	Confident	75 Å²	75	84.7 Å²	84.7	35%	0.35	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-39.5	176.8	-83.5	170.8	-40.1	0	0	112	I86 L126 S127 Q132 D133 N134	I86-Q130 HydrophobicContact CG2-CB 3.44Å; I86-Q130 VanDerWaalsContact CG2-CB 3.44Å; I86-Q130 HydrophobicContact CG2-CG 3.85Å; I86-Q130 VanDerWaalsContact CG2-O 3.23Å; I86-Q130 WeakPolarHBondContact CG2-O 3.25Å; L126-Q130 HydrophobicContact CB-CB 4Å; L126-Q130 HydrophobicContact CD2-CB 3.94Å; L126-Q130 HydrophobicContact CD2-CG 4.43Å; L126-Q130 HydrophobicContact CG-CB 4.45Å; S127-Q130 WeakPolarHBondContact O-CB 3.44Å; S127-Q130 PolarHBondContact O-N 2.78Å; S127-Q130 VanDerWaalsContact O-N 3.12Å; S127-Q130 WeakPolarHBondContact OG-CB 3.28Å; S127-Q130 VanDerWaalsContact OG-CG 3.29Å; S127-Q130 WeakPolarHBondContact OG-CG 3.37Å; S127-Q130 PolarHBondContact OG-N 2.94Å; S127-Q130 PolarHBondContact OG-OE1 2.96Å; Q130-Q132 VanDerWaalsContact C-N 3.32Å; Q130-Q132 PolarHBondContact O-N 3.47Å; Q130-D133 PolarHBondContact O-N 3.02Å; Q130-N134 VanDerWaalsContact O-CB 3.23Å; Q130-N134 WeakPolarHBondContact O-CB 3.49Å; Q130-N134 PolarHBondContact O-N 3.27Å
131	V	82.1	Confident	80.9	Confident	49 Å²	49	84.6 Å²	84.6	30%	0.297	43%	0.428	S	S	.	.	H	α-helix	trans	-60.8	-44.3	174.6	175.2	0	0	0	0	110.7	L126 S127 E128 Q129 N134 L135	L126-V131 HydrophobicContact CB-CG2 3.76Å; L126-V131 HydrophobicContact CD1-CG2 4.22Å; S127-V131 WeakPolarHBondContact O-CG2 3.36Å; S127-V131 PolarHBondContact O-N 2.86Å; E128-V131 PolarHBondContact O-N 2.76Å; Q129-V131 VanDerWaalsContact C-N 3.3Å; Q129-V131 PolarHBondContact O-N 2.8Å; V131-N134 PolarHBondContact O-N 3.5Å; V131-L135 HydrophobicContact CG1-CD1 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 3.26Å; V131-L135 VanDerWaalsContact O-N 3.09Å
132	Q	84.3	Confident	81.9	Confident	98 Å²	98	77.1 Å²	77.1	46%	0.458	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-47.3	177.4	-67.6	-62.2	-27.2	0	0	112.4	E128 Q129 Q130 N134 L135 I136	E128-Q132 WeakPolarHBondContact O-CG 3.35Å; E128-Q132 PolarHBondContact O-N 3.09Å; E128-Q132 VanDerWaalsContact O-N 3.1Å; Q129-Q132 WeakPolarHBondContact O-CB 2.97Å; Q129-Q132 PolarHBondContact O-N 2.78Å; Q129-Q132 VanDerWaalsContact O-N 3.14Å; Q130-Q132 VanDerWaalsContact C-N 3.32Å; Q130-Q132 PolarHBondContact O-N 3.47Å; Q132-N134 VanDerWaalsContact C-N 3.32Å; Q132-N134 PolarHBondContact O-N 2.88Å; Q132-L135 WeakPolarHBondContact O-CB 3.11Å; Q132-L135 PolarHBondContact O-N 3.33Å; Q132-L135 VanDerWaalsContact O-N 3.16Å; Q132-I136 WeakPolarHBondContact O-CG1 3.39Å; Q132-I136 PolarHBondContact O-N 3.4Å; Q132-I136 VanDerWaalsContact O-N 3.09Å
133	D	83.1	Confident	82.7	Confident	42 Å²	42	77.8 Å²	77.8	23%	0.225	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-43.8	178	-66.7	-17.7	0	0	0	110.7	I86 Q129 Q130 L135 I136 Y137	I86-D133 HydrophobicContact CD1-CB 3.65Å; Q129-D133 PolarHBondContact NE2-OD1 3.42Å; Q129-D133 VanDerWaalsContact O-CG 3.28Å; Q129-D133 PolarHBondContact O-N 3.17Å; Q130-D133 PolarHBondContact O-N 3.02Å; D133-L135 VanDerWaalsContact C-N 3.31Å; D133-L135 PolarHBondContact O-N 2.8Å; D133-I136 PolarHBondContact O-N 3.03Å; D133-Y137 HydrophobicContact CB-CD2 4.32Å; D133-Y137 HydrophobicContact CB-CE2 3.91Å; D133-Y137 WeakPolarHBondContact O-CD2 3.31Å; D133-Y137 PolarHBondContact O-N 2.91Å
134	N	82.1	Confident	83.4	Confident	10 Å²	10	78 Å²	78	5%	0.053	41%	0.405	C	S	.	.	H	α-helix	trans	-59.6	-39.6	176.2	-179.6	79.5	0	0	0	112.3	I86 A87 Y90 Q130 V131 Q132 L138	I86-N134 HydrophobicContact CB-CB 4.19Å; I86-N134 HydrophobicContact CG2-CB 3.99Å; A87-N134 VanDerWaalsContact CB-OD1 3.27Å; A87-N134 WeakPolarHBondContact CB-OD1 3.35Å; Y90-N134 PolarHBondContact OH-ND2 3.4Å; Y90-N134 PolarHBondContact OH-OD1 3.29Å; Q130-N134 VanDerWaalsContact O-CB 3.23Å; Q130-N134 WeakPolarHBondContact O-CB 3.49Å; Q130-N134 PolarHBondContact O-N 3.27Å; V131-N134 PolarHBondContact O-N 3.5Å; Q132-N134 VanDerWaalsContact C-N 3.32Å; Q132-N134 PolarHBondContact O-N 2.88Å; N134-L138 WeakPolarHBondContact O-CB 3.11Å; N134-L138 PolarHBondContact O-N 2.59Å
135	L	84.4	Confident	83.8	Confident	90 Å²	90	75.2 Å²	75.2	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-44.4	175.8	-71.3	170.7	0	0	0	111.7	V131 Q132 D133 L138 E139	V131-L135 HydrophobicContact CG1-CD1 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 3.26Å; V131-L135 VanDerWaalsContact O-N 3.09Å; Q132-L135 WeakPolarHBondContact O-CB 3.11Å; Q132-L135 PolarHBondContact O-N 3.33Å; Q132-L135 VanDerWaalsContact O-N 3.16Å; D133-L135 VanDerWaalsContact C-N 3.31Å; D133-L135 PolarHBondContact O-N 2.8Å; L135-L138 PolarHBondContact O-N 3.39Å; L135-E139 WeakPolarHBondContact O-CB 3.22Å; L135-E139 PolarHBondContact O-N 3.27Å
136	I	85.5	Confident	84.1	Confident	78 Å²	78	73 Å²	73	40%	0.4	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-48.2	177.9	-67.4	168	0	0	0	110.4	Q132 D133 L138 E139 M140	Q132-I136 WeakPolarHBondContact O-CG1 3.39Å; Q132-I136 PolarHBondContact O-N 3.4Å; Q132-I136 VanDerWaalsContact O-N 3.09Å; D133-I136 PolarHBondContact O-N 3.03Å; I136-L138 PolarHBondContact O-N 2.71Å; I136-E139 WeakPolarHBondContact O-CB 3.38Å; I136-E139 PolarHBondContact O-N 2.98Å; I136-M140 HydrophobicContact CG2-CE 3.68Å; I136-M140 HydrophobicContact CG2-SD 4.47Å; I136-M140 WeakPolarHBondContact O-CG 3.48Å; I136-M140 PolarHBondContact O-N 2.73Å
137	Y	83.2	Confident	84.3	Confident	72 Å²	72	76.4 Å²	76.4	28%	0.282	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-40.5	-179.8	-65.6	-47.2	0	0	0	112.6	I84 I86 D133 E139 M140 V141	I84-Y137 HydrophobicContact CB-CD2 4.15Å; I84-Y137 HydrophobicContact CB-CG 4.38Å; I84-Y137 HydrophobicContact CD1-CD1 3.64Å; I84-Y137 HydrophobicContact CD1-CD2 4.08Å; I84-Y137 HydrophobicContact CD1-CE1 4.24Å; I84-Y137 HydrophobicContact CD1-CG 3.54Å; I84-Y137 HydrophobicContact CG1-CD1 3.94Å; I84-Y137 HydrophobicContact CG1-CD2 3.53Å; I84-Y137 HydrophobicContact CG1-CE1 4.26Å; I84-Y137 HydrophobicContact CG1-CE2 3.85Å; I84-Y137 HydrophobicContact CG1-CG 3.57Å; I84-Y137 HydrophobicContact CG2-CD2 3.67Å; I84-Y137 HydrophobicContact CG2-CG 3.89Å; I86-Y137 HydrophobicContact CD1-CD2 3.99Å; I86-Y137 HydrophobicContact CD1-CE2 3.74Å; D133-Y137 HydrophobicContact CB-CD2 4.32Å; D133-Y137 HydrophobicContact CB-CE2 3.91Å; D133-Y137 WeakPolarHBondContact O-CD2 3.31Å; D133-Y137 PolarHBondContact O-N 2.91Å; Y137-E139 VanDerWaalsContact C-N 3.29Å; Y137-E139 PolarHBondContact O-N 3.38Å; Y137-M140 HydrophobicContact CD1-SD 4.14Å; Y137-M140 WeakPolarHBondContact O-CB 3.09Å; Y137-M140 PolarHBondContact O-N 3.26Å; Y137-M140 VanDerWaalsContact O-N 3.16Å; Y137-V141 WeakPolarHBondContact O-CG2 3.38Å; Y137-V141 PolarHBondContact O-N 3.43Å
138	L	83.9	Confident	83.9	Confident	34 Å²	34	81.3 Å²	81.3	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-63.9	-36.8	175.9	-175.9	144.5	0	0	0	111.5	Y90 N134 L135 I136 V141 K142	Y90-L138 HydrophobicContact CD1-CD1 4.28Å; Y90-L138 HydrophobicContact CE1-CD1 3.52Å; N134-L138 WeakPolarHBondContact O-CB 3.11Å; N134-L138 PolarHBondContact O-N 2.59Å; L135-L138 PolarHBondContact O-N 3.39Å; I136-L138 PolarHBondContact O-N 2.71Å; L138-V141 PolarHBondContact O-N 3.42Å; L138-K142 HydrophobicContact CD2-CD 3.73Å; L138-K142 HydrophobicContact CD2-CG 4.4Å; L138-K142 WeakPolarHBondContact O-CB 3.23Å; L138-K142 WeakPolarHBondContact O-CG 3.33Å; L138-K142 PolarHBondContact O-N 3.45Å
139	E	86.6	Confident	83.9	Confident	129 Å²	129	74.9 Å²	74.9	60%	0.603	38%	0.384	S	S	*	.	H	α-helix	trans	-64.5	-40.7	171.9	-170.4	-177.4	-176.4	0	0	112.1	L135 I136 Y137 K142 T143	L135-E139 WeakPolarHBondContact O-CB 3.22Å; L135-E139 PolarHBondContact O-N 3.27Å; I136-E139 WeakPolarHBondContact O-CB 3.38Å; I136-E139 PolarHBondContact O-N 2.98Å; Y137-E139 VanDerWaalsContact C-N 3.29Å; Y137-E139 PolarHBondContact O-N 3.38Å; E139-K142 PolarHBondContact O-N 3.39Å; E139-T143 WeakPolarHBondContact O-CB 3.37Å; E139-T143 PolarHBondContact O-N 2.92Å; E139-T143 PolarHBondContact O-OG1 2.96Å
140	M	85.4	Confident	84.1	Confident	112 Å²	112	69.9 Å²	69.9	55%	0.552	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-45.6	175.5	-69.2	177.6	178.8	0	0	111.9	I136 Y137 T143 V144	I136-M140 HydrophobicContact CG2-CE 3.68Å; I136-M140 HydrophobicContact CG2-SD 4.47Å; I136-M140 WeakPolarHBondContact O-CG 3.48Å; I136-M140 PolarHBondContact O-N 2.73Å; Y137-M140 HydrophobicContact CD1-SD 4.14Å; Y137-M140 WeakPolarHBondContact O-CB 3.09Å; Y137-M140 PolarHBondContact O-N 3.26Å; Y137-M140 VanDerWaalsContact O-N 3.16Å; M140-T143 WeakPolarHBondContact O-CB 3.44Å; M140-T143 PolarHBondContact O-N 3.11Å; M140-V144 PolarHBondContact O-N 2.6Å; M140-V144 VanDerWaalsContact O-N 3.12Å
141	V	84.2	Confident	84.3	Confident	29 Å²	29	66.6 Å²	66.6	18%	0.176	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-47.9	177	175	0	0	0	0	110.3	V80 I92 L116 Y137 L138 T143 V144 L145	V80-V141 HydrophobicContact CG1-CG2 4.31Å; I92-V141 HydrophobicContact CD1-CG1 4.23Å; L116-V141 HydrophobicContact CD2-CG1 4.06Å; Y137-V141 WeakPolarHBondContact O-CG2 3.38Å; Y137-V141 PolarHBondContact O-N 3.43Å; L138-V141 PolarHBondContact O-N 3.42Å; V141-T143 VanDerWaalsContact C-N 3.25Å; V141-T143 PolarHBondContact O-N 3.08Å; V141-V144 PolarHBondContact O-N 2.83Å; V141-V144 VanDerWaalsContact O-N 3.15Å; V141-L145 HydrophobicContact CG1-CD1 3.83Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CG 3.37Å; V141-L145 PolarHBondContact O-N 3.02Å
142	K	85.8	Confident	84.6	Confident	104 Å²	104	64.7 Å²	64.7	45%	0.452	33%	0.333	S	S	.	.	H	α-helix	trans	-57.7	-38.4	175.3	-78	-179.9	176.9	176.3	0	112.5	L116 L138 E139 L145 A146	L116-K142 HydrophobicContact CD1-CG 3.91Å; L116-K142 HydrophobicContact CD2-CG 4.47Å; L138-K142 HydrophobicContact CD2-CD 3.73Å; L138-K142 HydrophobicContact CD2-CG 4.4Å; L138-K142 WeakPolarHBondContact O-CB 3.23Å; L138-K142 WeakPolarHBondContact O-CG 3.33Å; L138-K142 PolarHBondContact O-N 3.45Å; E139-K142 PolarHBondContact O-N 3.39Å; K142-L145 PolarHBondContact O-N 3.15Å; K142-A146 WeakPolarHBondContact O-CB 3.37Å; K142-A146 PolarHBondContact O-N 2.85Å
143	T	86.6	Confident	84.7	Confident	76 Å²	76	60.1 Å²	60.1	47%	0.466	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-43.4	177.8	-60.9	0	0	0	0	111.3	E139 M140 V141 A146 F147	E139-T143 WeakPolarHBondContact O-CB 3.37Å; E139-T143 PolarHBondContact O-N 2.92Å; E139-T143 PolarHBondContact O-OG1 2.96Å; M140-T143 WeakPolarHBondContact O-CB 3.44Å; M140-T143 PolarHBondContact O-N 3.11Å; V141-T143 VanDerWaalsContact C-N 3.25Å; V141-T143 PolarHBondContact O-N 3.08Å; T143-A146 PolarHBondContact O-N 3.42Å; T143-F147 HydrophobicContact CG2-CE1 4.2Å; T143-F147 WeakPolarHBondContact O-CD1 3.27Å; T143-F147 VanDerWaalsContact O-CE1 3.25Å; T143-F147 WeakPolarHBondContact O-CE1 3.48Å
144	V	84.4	Confident	84.5	Confident	64 Å²	64	61.2 Å²	61.2	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-66.6	-45.7	176.5	176	0	0	0	0	110.6	M140 V141 A146 F147 F150	M140-V144 PolarHBondContact O-N 2.6Å; M140-V144 VanDerWaalsContact O-N 3.12Å; V141-V144 PolarHBondContact O-N 2.83Å; V141-V144 VanDerWaalsContact O-N 3.15Å; V144-A146 PolarHBondContact O-N 3.45Å; V144-F147 HydrophobicContact CB-CE2 4.46Å; V144-F147 HydrophobicContact CG1-CD2 4.3Å; V144-F147 HydrophobicContact CG1-CE2 4.24Å; V144-F147 HydrophobicContact CG2-CE2 4.36Å; V144-F147 HydrophobicContact CG2-CZ 4.33Å; V144-F147 WeakPolarHBondContact O-CB 3.48Å; V144-F147 WeakPolarHBondContact O-CD2 3.37Å; V144-F147 WeakPolarHBondContact O-CG 3.38Å; V144-F147 PolarHBondContact O-N 3.42Å; V144-F150 HydrophobicContact CG1-CZ 4.36Å; V144-F150 VanDerWaalsContact O-CE2 3.26Å; V144-F150 WeakPolarHBondContact O-CE2 3.47Å
145	L	83	Confident	84.4	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-28.8	178.9	-67.7	171	0	0	0	113.2	I92 T114 L116 V141 K142 F147	I92-L145 HydrophobicContact CD1-CD1 4.25Å; I92-L145 HydrophobicContact CG2-CD1 3.6Å; I92-L145 HydrophobicContact CG2-CD2 4.02Å; I92-L145 HydrophobicContact CG2-CG 4.48Å; T114-L145 HydrophobicContact CG2-CD2 4.48Å; T114-L145 WeakPolarHBondContact OG1-CB 3.33Å; L116-L145 HydrophobicContact CD1-CD1 3.78Å; L116-L145 HydrophobicContact CD2-CD1 4.29Å; L116-L145 HydrophobicContact CG-CD1 4.25Å; V141-L145 HydrophobicContact CG1-CD1 3.83Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CG 3.37Å; V141-L145 PolarHBondContact O-N 3.02Å; K142-L145 PolarHBondContact O-N 3.15Å; L145-F147 PolarHBondContact O-N 3.13Å
146	A	84.3	Confident	84.5	Confident	78 Å²	78	60.9 Å²	60.9	65%	0.645	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-2.5	174.3	0	0	0	0	0	113.4	K142 T143 V144 E148	K142-A146 WeakPolarHBondContact O-CB 3.37Å; K142-A146 PolarHBondContact O-N 2.85Å; T143-A146 PolarHBondContact O-N 3.42Å; V144-A146 PolarHBondContact O-N 3.45Å; A146-E148 PolarHBondContact O-N 2.94Å
147	F	82.5	Confident	84.7	Confident	93 Å²	93	57.3 Å²	57.3	41%	0.408	30%	0.303	S	S	.	.			trans	-61.4	130.6	170.4	-67.1	-8.3	0	0	0	109.8	T143 V144 L145 F150	T143-F147 HydrophobicContact CG2-CE1 4.2Å; T143-F147 WeakPolarHBondContact O-CD1 3.27Å; T143-F147 VanDerWaalsContact O-CE1 3.25Å; T143-F147 WeakPolarHBondContact O-CE1 3.48Å; V144-F147 HydrophobicContact CB-CE2 4.46Å; V144-F147 HydrophobicContact CG1-CD2 4.3Å; V144-F147 HydrophobicContact CG1-CE2 4.24Å; V144-F147 HydrophobicContact CG2-CE2 4.36Å; V144-F147 HydrophobicContact CG2-CZ 4.33Å; V144-F147 WeakPolarHBondContact O-CB 3.48Å; V144-F147 WeakPolarHBondContact O-CD2 3.37Å; V144-F147 WeakPolarHBondContact O-CG 3.38Å; V144-F147 PolarHBondContact O-N 3.42Å; L145-F147 PolarHBondContact O-N 3.13Å; F147-F150 HydrophobicContact CB-CE2 3.91Å; F147-F150 WeakPolarHBondContact O-CD2 3.06Å
148	E	76.9	Confident	85	Confident	164 Å²	164	54.1 Å²	54.1	77%	0.766	29%	0.291	S	S	*	.	S	Bend	trans	-64.5	154.5	172	-63.9	-177	178.1	0	0	110.6	A146	A146-E148 PolarHBondContact O-N 2.94Å
149	S	85	Confident	85.4	Confident	26 Å²	26	52.6 Å²	52.6	18%	0.182	28%	0.283	C	S	.	.			trans	76.6	35.5	168.7	-46.1	0	0	0	0	116.1	Y151 G222	S149-Y151 VanDerWaalsContact O-CD2 3.22Å; S149-Y151 WeakPolarHBondContact O-CD2 3.24Å; S149-Y151 WeakPolarHBondContact O-CE2 3.49Å; S149-G222 WeakPolarHBondContact CB-O 3.47Å; S149-G222 PolarHBondContact O-N 2.96Å
150	F	88.5	Confident	85.7	Confident	15 Å²	15	47 Å²	47	7%	0.066	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.9	154.2	-72.1	-69.3	0	0	0	110.8	R110 I111 V144 F147 W187 V219 M220 L221	R110-F150 WeakPolarHBondContact CA-O 3.43Å; I111-F150 HydrophobicContact CB-CB 4.1Å; I111-F150 HydrophobicContact CD1-CB 3.81Å; I111-F150 HydrophobicContact CG1-CB 4.13Å; I111-F150 PolarHBondContact N-O 2.79Å; V144-F150 HydrophobicContact CG1-CZ 4.36Å; V144-F150 VanDerWaalsContact O-CE2 3.26Å; V144-F150 WeakPolarHBondContact O-CE2 3.47Å; F147-F150 HydrophobicContact CB-CE2 3.91Å; F147-F150 WeakPolarHBondContact O-CD2 3.06Å; F150-W187 HydrophobicContact CE1-CB 4.15Å; F150-W187 HydrophobicContact CE1-CE3 4.47Å; F150-W187 HydrophobicContact CE1-CG 4.46Å; F150-V219 HydrophobicContact CB-CG1 3.79Å; F150-V219 HydrophobicContact CD1-CG1 3.43Å; F150-V219 VanDerWaalsContact CD1-CG1 3.43Å; F150-V219 HydrophobicContact CE1-CG1 4.27Å; F150-V219 HydrophobicContact CG-CG1 3.92Å; F150-M220 WeakPolarHBondContact CA-O 3.17Å; F150-L221 HydrophobicContact CD1-CB 3.81Å; F150-L221 HydrophobicContact CD1-CD1 3.65Å; F150-L221 HydrophobicContact CD1-CG 4.31Å; F150-L221 HydrophobicContact CD2-CD1 4.21Å; F150-L221 HydrophobicContact CE1-CB 3.69Å; F150-L221 HydrophobicContact CE1-CD1 3.63Å; F150-L221 HydrophobicContact CE1-CD2 4.41Å; F150-L221 HydrophobicContact CE1-CG 4.09Å; F150-L221 HydrophobicContact CE2-CD1 4.15Å; F150-L221 HydrophobicContact CG-CD1 3.98Å; F150-L221 HydrophobicContact CZ-CD1 3.88Å
151	Y	88.1	Confident	86	Confident	6 Å²	6	42.1 Å²	42.1	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.1	179.3	-56.8	-91.2	0	0	0	110.6	V100 F109 R110 S149 M220 M224	V100-Y151 HydrophobicContact CG2-CD1 3.95Å; V100-Y151 HydrophobicContact CG2-CE1 3.83Å; F109-Y151 WeakPolarHBondContact O-CA 3.49Å; F109-Y151 WeakPolarHBondContact O-CB 3.31Å; R110-Y151 HydrophobicContact CB-CD1 3.83Å; R110-Y151 HydrophobicContact CB-CE1 3.68Å; R110-Y151 HydrophobicContact CG-CD1 4.2Å; R110-Y151 HydrophobicContact CG-CE1 3.77Å; S149-Y151 VanDerWaalsContact O-CD2 3.22Å; S149-Y151 WeakPolarHBondContact O-CD2 3.24Å; S149-Y151 WeakPolarHBondContact O-CE2 3.49Å; Y151-M220 HydrophobicContact CD2-CE 4.11Å; Y151-M220 HydrophobicContact CD2-SD 4.48Å; Y151-M220 HydrophobicContact CG-CE 4.42Å; Y151-M220 PolarHBondContact N-O 3.26Å; Y151-M220 PolarHBondContact O-N 3.29Å; Y151-M224 HydrophobicContact CD1-CB 3.9Å; Y151-M224 HydrophobicContact CD1-CE 4.01Å; Y151-M224 HydrophobicContact CD2-CB 4.32Å; Y151-M224 HydrophobicContact CE1-CB 3.75Å; Y151-M224 HydrophobicContact CE1-CE 4.46Å; Y151-M224 HydrophobicContact CE2-CB 4.2Å; Y151-M224 HydrophobicContact CG-CB 4.19Å; Y151-M224 PolarHBondContact OH-N 2.98Å
152	Y	88.9	Confident	86.3	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.035	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.8	174	75.8	-78	0	0	0	110.3	A73 I94 S97 V108 F109 I111 P154 L217	A73-Y152 HydrophobicContact CB-CE2 3.74Å; I94-Y152 HydrophobicContact CD1-CD1 3.62Å; I94-Y152 HydrophobicContact CD1-CD2 4.37Å; I94-Y152 HydrophobicContact CD1-CE1 3.49Å; I94-Y152 VanDerWaalsContact CD1-CE1 3.49Å; I94-Y152 HydrophobicContact CD1-CE2 4.26Å; I94-Y152 HydrophobicContact CD1-CG 4.05Å; I94-Y152 HydrophobicContact CG2-CE1 4.29Å; S97-Y152 PolarHBondContact OG-OH 2.97Å; S97-Y152 VanDerWaalsContact OG-OH 3.06Å; V108-Y152 WeakPolarHBondContact CG1-O 3.38Å; F109-Y152 HydrophobicContact CB-CD1 4Å; F109-Y152 HydrophobicContact CB-CE1 3.52Å; F109-Y152 HydrophobicContact CB-CE2 4.48Å; F109-Y152 HydrophobicContact CD2-CE2 4.31Å; F109-Y152 HydrophobicContact CG-CE1 4.38Å; F109-Y152 PolarHBondContact N-O 2.98Å; F109-Y152 PolarHBondContact O-N 3.35Å; I111-Y152 HydrophobicContact CD1-CD1 4.09Å; I111-Y152 HydrophobicContact CG1-CD1 3.6Å; I111-Y152 HydrophobicContact CG1-CE1 3.92Å; Y152-P154 HydrophobicContact CE2-CG 4.24Å; Y152-L217 HydrophobicContact CD2-CD1 3.72Å; Y152-L217 HydrophobicContact CD2-CD2 4.39Å; Y152-L217 HydrophobicContact CD2-CG 4.46Å; Y152-L217 HydrophobicContact CE2-CD1 3.74Å
153	S	87.1	Confident	86.4	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	22%	0.22	C	C	.	.			trans	-140.8	135.1	165.4	174.7	0	0	0	0	108	K107 T155 Y156	K107-S153 VanDerWaalsContact O-CB 3.29Å; K107-S153 WeakPolarHBondContact O-CB 3.31Å; K107-S153 PolarHBondContact O-OG 3.36Å; S153-T155 PolarHBondContact O-N 3.19Å; S153-T155 PolarHBondContact OG-N 3.38Å; S153-Y156 WeakPolarHBondContact CB-O 3.42Å; S153-Y156 WeakPolarHBondContact OG-CB 3.44Å; S153-Y156 PolarHBondContact OG-N 3.21Å
154	P	78.5	Confident	86.6	Confident	64 Å²	64	37.5 Å²	37.5	42%	0.416	21%	0.205	S	C	.	.	S	Bend	trans	-65.2	-21.9	175.7	-21.2	33.1	0	0	0	113.5	Y152 L217	Y152-P154 HydrophobicContact CE2-CG 4.24Å; P154-L217 HydrophobicContact CB-CD2 4.26Å
155	T	80	Confident	86.8	Confident	76 Å²	76	35.9 Å²	35.9	47%	0.466	19%	0.194	S	C	.	.	S	Bend	trans	-126.5	-24.8	-167.8	52.2	0	0	0	0	113.6	Q106 S153	Q106-T155 PolarHBondContact OE1-OG1 3.19Å; S153-T155 PolarHBondContact O-N 3.19Å; S153-T155 PolarHBondContact OG-N 3.38Å
156	Y	85.5	Confident	86.8	Confident	17 Å²	17	39.4 Å²	39.4	7%	0.067	21%	0.213	C	C	.	.	S	Bend	trans	-107.3	128.8	-179.5	-176.5	-106.5	0	0	0	112	I103 Q106 V108 S153 L158 L165	I103-Y156 HydrophobicContact CD1-CE1 4.43Å; I103-Y156 HydrophobicContact CG2-CE1 4.47Å; Q106-Y156 HydrophobicContact CB-CG 4.41Å; V108-Y156 HydrophobicContact CG2-CD1 4.42Å; S153-Y156 WeakPolarHBondContact CB-O 3.42Å; S153-Y156 WeakPolarHBondContact OG-CB 3.44Å; S153-Y156 PolarHBondContact OG-N 3.21Å; Y156-L158 HydrophobicContact CD1-CD2 3.6Å; Y156-L158 HydrophobicContact CD1-CG 4.29Å; Y156-L158 HydrophobicContact CE1-CD2 3.87Å; Y156-L158 PolarHBondContact O-N 3Å; Y156-L165 HydrophobicContact CE2-CD1 3.81Å
157	D	89.5	Confident	86.8	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.206	C	C	.	.			trans	-79	97.1	178.1	-167.4	-16	0	0	0	111.6	T159 H160 L165 L177 V181	D157-T159 VanDerWaalsContact CG-OG1 3.3Å; D157-T159 PolarHBondContact O-N 3.32Å; D157-T159 WeakPolarHBondContact OD1-CA 3.4Å; D157-T159 VanDerWaalsContact OD1-CB 3.28Å; D157-T159 WeakPolarHBondContact OD1-CB 3.43Å; D157-T159 WeakPolarHBondContact OD1-CG2 3.46Å; D157-T159 PolarHBondContact OD1-N 3.08Å; D157-T159 PolarHBondContact OD1-OG1 2.94Å; D157-T159 PolarHBondContact OD2-OG1 3.3Å; D157-H160 PolarHBondContact O-N 3.35Å; D157-H160 IonicContact OD2-CD2 3.3Å; D157-H160 PolarHBondContact OD2-CD2 3.49Å; D157-H160 IonicContact OD2-NE2 2.78Å; D157-L165 HydrophobicContact CB-CD2 4.42Å; D157-L177 HydrophobicContact CB-CD1 3.74Å; D157-V181 WeakPolarHBondContact OD2-CA 3.27Å
158	L	90.7	Very high	86.8	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.031	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.8	176.7	-64.9	176.9	0	0	0	114.2	V108 Y156 M220 M224 R243	V108-L158 HydrophobicContact CG1-CD1 3.62Å; V108-L158 HydrophobicContact CG1-CD2 3.57Å; V108-L158 HydrophobicContact CG1-CG 4.09Å; V108-L158 HydrophobicContact CG2-CD2 4.13Å; Y156-L158 HydrophobicContact CD1-CD2 3.6Å; Y156-L158 HydrophobicContact CD1-CG 4.29Å; Y156-L158 HydrophobicContact CE1-CD2 3.87Å; Y156-L158 PolarHBondContact O-N 3Å; L158-M220 HydrophobicContact CB-CB 4.26Å; L158-M220 HydrophobicContact CB-CE 4.43Å; L158-M220 HydrophobicContact CD1-CE 4.46Å; L158-M224 HydrophobicContact CD2-SD 4.17Å; L158-R243 VanDerWaalsContact O-CD 3.28Å; L158-R243 WeakPolarHBondContact O-CD 3.48Å; L158-R243 PolarHBondContact O-NE 3.19Å
159	T	92.6	Very high	87.1	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-16.6	-178.6	72.3	0	0	0	0	112.4	D157 V181 Y182 F185	D157-T159 VanDerWaalsContact CG-OG1 3.3Å; D157-T159 PolarHBondContact O-N 3.32Å; D157-T159 WeakPolarHBondContact OD1-CA 3.4Å; D157-T159 VanDerWaalsContact OD1-CB 3.28Å; D157-T159 WeakPolarHBondContact OD1-CB 3.43Å; D157-T159 WeakPolarHBondContact OD1-CG2 3.46Å; D157-T159 PolarHBondContact OD1-N 3.08Å; D157-T159 PolarHBondContact OD1-OG1 2.94Å; D157-T159 PolarHBondContact OD2-OG1 3.3Å; T159-V181 HydrophobicContact CG2-CB 4.48Å; T159-Y182 PolarHBondContact OG1-N 2.93Å; T159-F185 VanDerWaalsContact O-CD2 3.29Å; T159-F185 WeakPolarHBondContact O-CD2 3.2Å
160	H	92.8	Very high	86.9	Confident	12 Å²	12	35.6 Å²	35.6	6%	0.056	20%	0.2	C	C	.	.	S	Bend	trans	-105.4	154.4	177.7	-72.1	-65.8	0	0	0	113	D157 R164 L165 F172 R180 Y182 R243	D157-H160 PolarHBondContact O-N 3.35Å; D157-H160 IonicContact OD2-CD2 3.3Å; D157-H160 PolarHBondContact OD2-CD2 3.49Å; D157-H160 IonicContact OD2-NE2 2.78Å; H160-R164 WeakPolarHBondContact ND1-CD 3.36Å; H160-L165 HydrophobicContact CB-CD1 4.24Å; H160-L165 HydrophobicContact CB-CD2 3.7Å; H160-L165 HydrophobicContact CB-CG 3.61Å; H160-F172 AromaticContact NE2-CZ 3.75Å; H160-R180 PolarHBondContact NE2-O 3.16Å; H160-Y182 VanDerWaalsContact CE1-CB 3.48Å; H160-Y182 WeakPolarHBondContact CE1-CB 3.39Å; H160-Y182 AromaticContact CE1-CG 3.92Å; H160-R243 PolarHBondContact O-NE 3.15Å; H160-R243 PolarHBondContact O-NH2 3.13Å
161	T	92.4	Very high	86.5	Confident	9 Å²	9	40.8 Å²	40.8	6%	0.055	22%	0.224	C	C	.	.			trans	-80.2	160.3	167.6	61.1	0	0	0	0	110.9	Q163 R164 L165 E269 E271 V284	T161-Q163 VanDerWaalsContact C-N 3.3Å; T161-Q163 PolarHBondContact O-N 3.45Å; T161-R164 PolarHBondContact O-N 3.45Å; T161-R164 VanDerWaalsContact O-N 3.11Å; T161-R164 VanDerWaalsContact OG1-CB 3.29Å; T161-R164 WeakPolarHBondContact OG1-CB 3.29Å; T161-R164 PolarHBondContact OG1-N 2.76Å; T161-L165 PolarHBondContact O-N 2.76Å; T161-E269 HydrophobicContact CG2-CG 4.42Å; T161-E269 WeakPolarHBondContact CG2-OE1 3.44Å; T161-E271 VanDerWaalsContact CA-OE2 3.25Å; T161-E271 WeakPolarHBondContact CA-OE2 3.26Å; T161-V284 HydrophobicContact CG2-CG1 4.34Å; T161-V284 HydrophobicContact CG2-CG2 3.78Å
162	L	89.1	Confident	86.2	Confident	22 Å²	22	42.2 Å²	42.2	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-51.2	-50.2	173.6	-173	72.6	0	0	0	112	Y104 R164 L165 N166 E271 L280	Y104-L162 HydrophobicContact CD2-CD1 4.45Å; Y104-L162 HydrophobicContact CE2-CD1 3.23Å; Y104-L162 WeakPolarHBondContact OH-CD1 3.39Å; L162-R164 VanDerWaalsContact C-N 3.3Å; L162-R164 PolarHBondContact O-N 3.3Å; L162-L165 PolarHBondContact O-N 3.37Å; L162-N166 WeakPolarHBondContact O-CB 3.36Å; L162-N166 PolarHBondContact O-N 2.87Å; L162-E271 WeakPolarHBondContact CB-OE1 3.02Å; L162-E271 PolarHBondContact N-OE1 2.92Å; L162-L280 HydrophobicContact CD2-CB 4.27Å
163	Q	88.9	Confident	85.5	Confident	50 Å²	50	46.6 Å²	46.6	23%	0.234	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-36.5	-178.3	-178.4	175	-49.7	0	0	111.7	T161 N166 N167 Q406	T161-Q163 VanDerWaalsContact C-N 3.3Å; T161-Q163 PolarHBondContact O-N 3.45Å; Q163-N166 PolarHBondContact O-N 2.86Å; Q163-N167 WeakPolarHBondContact O-CB 3.4Å; Q163-N167 PolarHBondContact O-N 2.99Å; Q163-N167 PolarHBondContact O-ND2 3.2Å; Q163-Q406 PolarHBondContact NE2-O 3.14Å; Q163-Q406 VanDerWaalsContact OE1-CB 3.31Å
164	R	90.3	Very high	85	Confident	40 Å²	40	53.9 Å²	53.9	15%	0.151	29%	0.292	C	S	.	.	H	α-helix	trans	-69.7	-42.6	179.4	-162.8	-174.5	-68.5	136.6	8.4	110.9	H160 T161 L162 N166 N167 T168 Y182 E269	H160-R164 WeakPolarHBondContact ND1-CD 3.36Å; T161-R164 PolarHBondContact O-N 3.45Å; T161-R164 VanDerWaalsContact O-N 3.11Å; T161-R164 VanDerWaalsContact OG1-CB 3.29Å; T161-R164 WeakPolarHBondContact OG1-CB 3.29Å; T161-R164 PolarHBondContact OG1-N 2.76Å; L162-R164 VanDerWaalsContact C-N 3.3Å; L162-R164 PolarHBondContact O-N 3.3Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.23Å; R164-N167 PolarHBondContact O-N 3.41Å; R164-N167 VanDerWaalsContact O-N 3.16Å; R164-T168 WeakPolarHBondContact O-CG2 3.4Å; R164-T168 PolarHBondContact O-N 2.78Å; R164-Y182 VanDerWaalsContact NH1-CD1 3.3Å; R164-E269 IonicContact CZ-OE2 3.72Å; R164-E269 IonicContact NH2-OE2 2.98Å; R164-E269 PolarHBondContact NH2-OE2 3.24Å
165	L	87.6	Confident	85.1	Confident	30 Å²	30	54.1 Å²	54.1	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-35.9	172.1	-70.1	173.3	0	0	0	112.5	Y156 D157 H160 T161 L162 N167 T168 F172	Y156-L165 HydrophobicContact CE2-CD1 3.81Å; D157-L165 HydrophobicContact CB-CD2 4.42Å; H160-L165 HydrophobicContact CB-CD1 4.24Å; H160-L165 HydrophobicContact CB-CD2 3.7Å; H160-L165 HydrophobicContact CB-CG 3.61Å; T161-L165 PolarHBondContact O-N 2.76Å; L162-L165 PolarHBondContact O-N 3.37Å; L165-N167 VanDerWaalsContact C-N 3.29Å; L165-N167 PolarHBondContact O-N 3.33Å; L165-T168 PolarHBondContact O-OG1 3.31Å; L165-F172 HydrophobicContact CD2-CE1 4.49Å
166	N	83.7	Confident	84.9	Confident	104 Å²	104	52 Å²	52	56%	0.556	28%	0.277	S	S	*	.	H	α-helix	trans	-72.8	-23.4	176.9	-169.8	66.6	0	0	0	113.1	L162 Q163 R164	L162-N166 WeakPolarHBondContact O-CB 3.36Å; L162-N166 PolarHBondContact O-N 2.87Å; Q163-N166 PolarHBondContact O-N 2.86Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.23Å
167	N	83.9	Confident	84.5	Confident	96 Å²	96	52.5 Å²	52.5	51%	0.513	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	1.4	-179.9	-70.1	-15.1	0	0	0	113.3	Q163 R164 L165	Q163-N167 WeakPolarHBondContact O-CB 3.4Å; Q163-N167 PolarHBondContact O-N 2.99Å; Q163-N167 PolarHBondContact O-ND2 3.2Å; R164-N167 PolarHBondContact O-N 3.41Å; R164-N167 VanDerWaalsContact O-N 3.16Å; L165-N167 VanDerWaalsContact C-N 3.29Å; L165-N167 PolarHBondContact O-N 3.33Å
168	T	83.3	Confident	83.8	Confident	35 Å²	35	53.7 Å²	53.7	22%	0.215	29%	0.286	C	S	.	.	S	Bend	trans	-82.5	154.1	175.5	54.7	0	0	0	0	111.4	R164 L165 F172	R164-T168 WeakPolarHBondContact O-CG2 3.4Å; R164-T168 PolarHBondContact O-N 2.78Å; L165-T168 PolarHBondContact O-OG1 3.31Å; T168-F172 HydrophobicContact CG2-CB 4.48Å; T168-F172 HydrophobicContact CG2-CD1 3.43Å; T168-F172 VanDerWaalsContact CG2-CD1 3.43Å; T168-F172 HydrophobicContact CG2-CD2 4.28Å; T168-F172 HydrophobicContact CG2-CE1 3.53Å; T168-F172 HydrophobicContact CG2-CE2 4.35Å; T168-F172 HydrophobicContact CG2-CG 3.82Å; T168-F172 HydrophobicContact CG2-CZ 3.99Å; T168-F172 WeakPolarHBondContact OG1-CD1 3.46Å
169	S	83.5	Confident	83.2	Confident	56 Å²	56	58.4 Å²	58.4	39%	0.392	31%	0.308	S	S	.	.			trans	-71.9	160.2	179.7	79.2	0	0	0	0	112	E171 F172 L173	S169-E171 WeakPolarHBondContact CB-OE2 3.48Å; S169-E171 PolarHBondContact O-N 2.71Å; S169-E171 PolarHBondContact OG-OE2 2.75Å; S169-F172 VanDerWaalsContact O-CB 3.24Å; S169-F172 WeakPolarHBondContact O-CB 3.46Å; S169-F172 PolarHBondContact O-N 2.63Å; S169-F172 PolarHBondContact OG-N 3.03Å; S169-L173 PolarHBondContact O-N 3.33Å
170	P	80.4	Confident	82.8	Confident	95 Å²	95	60.1 Å²	60.1	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-57.2	-34.7	175	-24.9	35.3	0	0	0	113	F172 L173 L174	P170-F172 VanDerWaalsContact C-N 3.28Å; P170-F172 PolarHBondContact O-N 3.5Å; P170-L173 WeakPolarHBondContact O-CB 3.42Å; P170-L173 PolarHBondContact O-N 2.83Å; P170-L174 PolarHBondContact O-N 3.39Å
171	E	81	Confident	82.5	Confident	123 Å²	123	60.3 Å²	60.3	58%	0.575	32%	0.316	S	S	*	.	H	α-helix	trans	-62.8	-37.8	176.1	-56.6	73.1	-156.5	0	0	111.1	S169 L173 L174 M175	S169-E171 WeakPolarHBondContact CB-OE2 3.48Å; S169-E171 PolarHBondContact O-N 2.71Å; S169-E171 PolarHBondContact OG-OE2 2.75Å; E171-L173 PolarHBondContact O-N 3.16Å; E171-L174 WeakPolarHBondContact O-CB 3.5Å; E171-L174 PolarHBondContact O-N 3.47Å; E171-M175 PolarHBondContact O-N 3.35Å
172	F	81.2	Confident	82.4	Confident	37 Å²	37	62.6 Å²	62.6	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-33.1	174.2	-176.4	-91.8	0	0	0	111.4	H160 L165 T168 S169 P170 L174 M175 R180	H160-F172 AromaticContact NE2-CZ 3.75Å; L165-F172 HydrophobicContact CD2-CE1 4.49Å; T168-F172 HydrophobicContact CG2-CB 4.48Å; T168-F172 HydrophobicContact CG2-CD1 3.43Å; T168-F172 VanDerWaalsContact CG2-CD1 3.43Å; T168-F172 HydrophobicContact CG2-CD2 4.28Å; T168-F172 HydrophobicContact CG2-CE1 3.53Å; T168-F172 HydrophobicContact CG2-CE2 4.35Å; T168-F172 HydrophobicContact CG2-CG 3.82Å; T168-F172 HydrophobicContact CG2-CZ 3.99Å; T168-F172 WeakPolarHBondContact OG1-CD1 3.46Å; S169-F172 VanDerWaalsContact O-CB 3.24Å; S169-F172 WeakPolarHBondContact O-CB 3.46Å; S169-F172 PolarHBondContact O-N 2.63Å; S169-F172 PolarHBondContact OG-N 3.03Å; P170-F172 VanDerWaalsContact C-N 3.28Å; P170-F172 PolarHBondContact O-N 3.5Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 PolarHBondContact O-N 2.96Å; F172-M175 HydrophobicContact CD2-SD 4.17Å; F172-M175 WeakPolarHBondContact O-CB 3.48Å; F172-M175 PolarHBondContact O-N 3.4Å; F172-R180 HydrophobicContact CD1-CG 4.08Å; F172-R180 HydrophobicContact CD2-CG 4.25Å; F172-R180 HydrophobicContact CE1-CB 3.76Å; F172-R180 HydrophobicContact CE1-CG 3.74Å; F172-R180 HydrophobicContact CE2-CB 3.98Å; F172-R180 HydrophobicContact CE2-CG 3.92Å; F172-R180 HydrophobicContact CG-CG 4.34Å; F172-R180 HydrophobicContact CZ-CB 3.42Å; F172-R180 VanDerWaalsContact CZ-CB 3.42Å; F172-R180 HydrophobicContact CZ-CG 3.67Å; F172-R180 WeakPolarHBondContact CZ-O 3.36Å; F172-R180 WeakPolarHBondContact O-CD 3.41Å; F172-R180 WeakPolarHBondContact O-CG 3.2Å
173	L	74.5	Confident	82.4	Confident	101 Å²	101	66.6 Å²	66.6	53%	0.529	35%	0.346	S	S	.	.	H	α-helix	trans	-75.6	-19.3	177.7	-62.2	176.4	0	0	0	113.6	S169 P170 E171	S169-L173 PolarHBondContact O-N 3.33Å; P170-L173 WeakPolarHBondContact O-CB 3.42Å; P170-L173 PolarHBondContact O-N 2.83Å; E171-L173 PolarHBondContact O-N 3.16Å
174	L	76.5	Confident	82.5	Confident	154 Å²	154	65.1 Å²	65.1	81%	0.806	34%	0.338	S	S	*	.	H	α-helix	trans	-82.8	-20.2	174.4	-61.9	175.3	0	0	0	112.3	P170 E171 F172	P170-L174 PolarHBondContact O-N 3.39Å; E171-L174 WeakPolarHBondContact O-CB 3.5Å; E171-L174 PolarHBondContact O-N 3.47Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 PolarHBondContact O-N 2.96Å
175	M	79.7	Confident	82.6	Confident	69 Å²	69	63.2 Å²	63.2	34%	0.34	33%	0.331	S	S	.	.	S	Bend	trans	-64.3	146.6	173.6	-66.3	170.1	67.8	0	0	109.9	E171 F172 E179 R180	E171-M175 PolarHBondContact O-N 3.35Å; F172-M175 HydrophobicContact CD2-SD 4.17Å; F172-M175 WeakPolarHBondContact O-CB 3.48Å; F172-M175 PolarHBondContact O-N 3.4Å; M175-E179 HydrophobicContact CB-CB 4.21Å; M175-E179 HydrophobicContact CE-CB 3.32Å; M175-E179 HydrophobicContact CE-CG 4.27Å; M175-R180 HydrophobicContact CB-CG 3.72Å; M175-R180 VanDerWaalsContact O-CD 3.28Å; M175-R180 WeakPolarHBondContact O-CD 3.43Å; M175-R180 PolarHBondContact O-NE 3.19Å
176	S	75.5	Confident	82.8	Confident	32 Å²	32	61.9 Å²	61.9	22%	0.224	32%	0.324	C	S	.	.			trans	-61.5	158.3	176.3	61.5	0	0	0	0	110.8	H178 E179 R180	S176-H178 WeakPolarHBondContact CB-ND1 3.38Å; S176-H178 PolarHBondContact O-N 3.1Å; S176-H178 VanDerWaalsContact O-N 3.1Å; S176-H178 PolarHBondContact OG-CE1 3.37Å; S176-H178 PolarHBondContact OG-ND1 3.23Å; S176-E179 PolarHBondContact N-OE2 3.49Å; S176-E179 PolarHBondContact O-N 3.14Å; S176-E179 WeakPolarHBondContact OG-CG 3.4Å; S176-E179 PolarHBondContact OG-OE2 3.27Å; S176-R180 WeakPolarHBondContact O-CG 3.48Å; S176-R180 PolarHBondContact O-N 3.26Å; S176-R180 PolarHBondContact O-NE 2.88Å
177	L	77	Confident	83	Confident	27 Å²	27	59.6 Å²	59.6	14%	0.141	31%	0.308	C	S	.	.	H	α-helix	trans	-55.6	-33.8	-178.2	-171.6	67.2	0	0	0	111.8	D157 R180 V181 P218	D157-L177 HydrophobicContact CB-CD1 3.74Å; L177-R180 PolarHBondContact O-N 3.34Å; L177-V181 WeakPolarHBondContact O-CG1 3.48Å; L177-V181 PolarHBondContact O-N 3.11Å; L177-P218 HydrophobicContact CD2-CG 3.86Å; L177-P218 HydrophobicContact CG-CG 3.91Å
178	H	74.4	Confident	83.2	Confident	28 Å²	28	55.3 Å²	55.3	13%	0.13	29%	0.285	C	S	.	.	H	α-helix	trans	-68.2	-39.4	-178.9	80.7	-94.3	0	0	0	114.5	S176 R180 V181 F196 T213	S176-H178 WeakPolarHBondContact CB-ND1 3.38Å; S176-H178 PolarHBondContact O-N 3.1Å; S176-H178 VanDerWaalsContact O-N 3.1Å; S176-H178 PolarHBondContact OG-CE1 3.37Å; S176-H178 PolarHBondContact OG-ND1 3.23Å; H178-R180 PolarHBondContact O-N 3.15Å; H178-V181 WeakPolarHBondContact O-CG2 3.25Å; H178-F196 HydrophobicContact CB-CD1 3.92Å; H178-F196 HydrophobicContact CB-CE1 3.24Å; H178-F196 HydrophobicContact CB-CZ 3.58Å; H178-F196 AromaticContact CD2-CD1 3.89Å; H178-F196 AromaticContact CG-CD1 3.97Å; H178-F196 AromaticContact CG-CE1 3.8Å; H178-T213 WeakPolarHBondContact CE1-CG2 3.43Å; H178-T213 WeakPolarHBondContact ND1-CG2 3.27Å
179	E	78.4	Confident	83.2	Confident	105 Å²	105	55 Å²	55	49%	0.491	29%	0.285	S	S	.	.	H	α-helix	trans	-74.7	-20.3	-179.1	-55.9	163.3	112.3	0	0	111.3	M175 S176	M175-E179 HydrophobicContact CB-CB 4.21Å; M175-E179 HydrophobicContact CE-CB 3.32Å; M175-E179 HydrophobicContact CE-CG 4.27Å; S176-E179 PolarHBondContact N-OE2 3.49Å; S176-E179 PolarHBondContact O-N 3.14Å; S176-E179 WeakPolarHBondContact OG-CG 3.4Å; S176-E179 PolarHBondContact OG-OE2 3.27Å
180	R	84.7	Confident	83.1	Confident	38 Å²	38	57.9 Å²	57.9	14%	0.143	29%	0.292	C	S	.	.	H	α-helix	trans	-85.3	-26.3	-177.5	-65.1	-176.7	-52	155.2	-10.3	112.9	H160 F172 M175 S176 L177 H178 Y182	H160-R180 PolarHBondContact NE2-O 3.16Å; F172-R180 HydrophobicContact CD1-CG 4.08Å; F172-R180 HydrophobicContact CD2-CG 4.25Å; F172-R180 HydrophobicContact CE1-CB 3.76Å; F172-R180 HydrophobicContact CE1-CG 3.74Å; F172-R180 HydrophobicContact CE2-CB 3.98Å; F172-R180 HydrophobicContact CE2-CG 3.92Å; F172-R180 HydrophobicContact CG-CG 4.34Å; F172-R180 HydrophobicContact CZ-CB 3.42Å; F172-R180 VanDerWaalsContact CZ-CB 3.42Å; F172-R180 HydrophobicContact CZ-CG 3.67Å; F172-R180 WeakPolarHBondContact CZ-O 3.36Å; F172-R180 WeakPolarHBondContact O-CD 3.41Å; F172-R180 WeakPolarHBondContact O-CG 3.2Å; M175-R180 HydrophobicContact CB-CG 3.72Å; M175-R180 VanDerWaalsContact O-CD 3.28Å; M175-R180 WeakPolarHBondContact O-CD 3.43Å; M175-R180 PolarHBondContact O-NE 3.19Å; S176-R180 WeakPolarHBondContact O-CG 3.48Å; S176-R180 PolarHBondContact O-N 3.26Å; S176-R180 PolarHBondContact O-NE 2.88Å; L177-R180 PolarHBondContact O-N 3.34Å; H178-R180 PolarHBondContact O-N 3.15Å; R180-Y182 PolarHBondContact O-N 2.84Å
181	V	86.6	Confident	83	Confident	16 Å²	16	55.2 Å²	55.2	10%	0.097	27%	0.273	C	S	.	.			trans	-51.6	138.2	-172.6	-61.3	0	0	0	0	113.5	D157 T159 L177 H178 N183 L186 P218	D157-V181 WeakPolarHBondContact OD2-CA 3.27Å; T159-V181 HydrophobicContact CG2-CB 4.48Å; L177-V181 WeakPolarHBondContact O-CG1 3.48Å; L177-V181 PolarHBondContact O-N 3.11Å; H178-V181 WeakPolarHBondContact O-CG2 3.25Å; V181-N183 PolarHBondContact O-N 3.38Å; V181-L186 HydrophobicContact CB-CD2 4.14Å; V181-L186 HydrophobicContact CG1-CD2 4.47Å; V181-L186 HydrophobicContact CG2-CD2 3.59Å; V181-P218 HydrophobicContact CG1-CB 3.63Å; V181-P218 HydrophobicContact CG1-CG 3.31Å
182	Y	89.9	Confident	82.9	Confident	56 Å²	56	49.3 Å²	49.3	22%	0.22	25%	0.245	C	C	.	.			trans	-84	102.1	169.4	-158.7	-135	0	0	0	110.7	T159 H160 R164 R180 R184 F185 L186	T159-Y182 PolarHBondContact OG1-N 2.93Å; H160-Y182 VanDerWaalsContact CE1-CB 3.48Å; H160-Y182 WeakPolarHBondContact CE1-CB 3.39Å; H160-Y182 AromaticContact CE1-CG 3.92Å; R164-Y182 VanDerWaalsContact NH1-CD1 3.3Å; R180-Y182 PolarHBondContact O-N 2.84Å; Y182-R184 HydrophobicContact CD1-CB 3.78Å; Y182-R184 HydrophobicContact CE1-CB 3.58Å; Y182-R184 HydrophobicContact CE1-CG 4.27Å; Y182-R184 HydrophobicContact CG-CB 4.49Å; Y182-R184 PolarHBondContact O-N 2.81Å; Y182-R184 PolarHBondContact OH-NH1 2.82Å; Y182-F185 AromaticContact CD1-CD2 3.65Å; Y182-F185 HydrophobicContact CD1-CD2 3.65Å; Y182-F185 AromaticContact CD1-CE2 3.73Å; Y182-F185 HydrophobicContact CD1-CE2 3.73Å; Y182-F185 HydrophobicContact CE1-CD2 4.28Å; Y182-F185 AromaticContact CE1-CE2 3.93Å; Y182-F185 HydrophobicContact CE1-CE2 3.93Å; Y182-F185 PolarHBondContact O-N 3.18Å; Y182-L186 PolarHBondContact O-N 3.16Å
183	N	89.4	Confident	82.7	Confident	107 Å²	107	52 Å²	52	57%	0.572	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-48.4	-30.3	-178	-79.5	-52.6	0	0	0	114.5	V181 F185 L186 C246	V181-N183 PolarHBondContact O-N 3.38Å; N183-F185 PolarHBondContact O-N 2.84Å; N183-F185 VanDerWaalsContact O-N 3.14Å; N183-L186 PolarHBondContact O-N 3.43Å; N183-C246 PolarHBondContact O-SG 3.48Å
184	R	91.1	Very high	82.6	Confident	18 Å²	18	48.8 Å²	48.8	7%	0.068	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-56.1	-30	177.4	179.4	175.7	-75.5	162.9	0.4	113.3	Y182 S245 C246 Q247 S323 T327	Y182-R184 HydrophobicContact CD1-CB 3.78Å; Y182-R184 HydrophobicContact CE1-CB 3.58Å; Y182-R184 HydrophobicContact CE1-CG 4.27Å; Y182-R184 HydrophobicContact CG-CB 4.49Å; Y182-R184 PolarHBondContact O-N 2.81Å; Y182-R184 PolarHBondContact OH-NH1 2.82Å; R184-S245 WeakPolarHBondContact O-CA 2.85Å; R184-S245 PolarHBondContact O-OG 2.96Å; R184-C246 PolarHBondContact O-N 2.57Å; R184-C246 PolarHBondContact O-SG 3.26Å; R184-C246 VanDerWaalsContact O-SG 3.39Å; R184-Q247 HydrophobicContact CG-CG 4.35Å; R184-S323 PolarHBondContact NH2-OG 3.06Å; R184-T327 PolarHBondContact NH1-OG1 3.04Å
185	F	93.3	Very high	82.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-119.6	8.4	-176.9	-55	-65.2	0	0	0	113.6	T159 Y182 N183 R243 F267 E269	T159-F185 VanDerWaalsContact O-CD2 3.29Å; T159-F185 WeakPolarHBondContact O-CD2 3.2Å; Y182-F185 AromaticContact CD1-CD2 3.65Å; Y182-F185 HydrophobicContact CD1-CD2 3.65Å; Y182-F185 AromaticContact CD1-CE2 3.73Å; Y182-F185 HydrophobicContact CD1-CE2 3.73Å; Y182-F185 HydrophobicContact CE1-CD2 4.28Å; Y182-F185 AromaticContact CE1-CE2 3.93Å; Y182-F185 HydrophobicContact CE1-CE2 3.93Å; Y182-F185 PolarHBondContact O-N 3.18Å; N183-F185 PolarHBondContact O-N 2.84Å; N183-F185 VanDerWaalsContact O-N 3.14Å; F185-R243 HydrophobicContact CB-CB 4.15Å; F185-R243 HydrophobicContact CD1-CB 3.48Å; F185-R243 VanDerWaalsContact CD1-CB 3.48Å; F185-R243 HydrophobicContact CD2-CB 4.23Å; F185-R243 HydrophobicContact CE1-CB 3.86Å; F185-R243 WeakPolarHBondContact CE1-O 3.49Å; F185-R243 HydrophobicContact CG-CB 3.69Å; F185-R243 HydrophobicContact CZ-CB 4.39Å; F185-F267 HydrophobicContact CE1-CD1 4.3Å; F185-F267 HydrophobicContact CE1-CE1 4.26Å; F185-F267 HydrophobicContact CZ-CE1 4.07Å; F185-E269 HydrophobicContact CE1-CB 3.96Å; F185-E269 HydrophobicContact CE2-CB 4.3Å; F185-E269 HydrophobicContact CZ-CB 3.5Å; F185-E269 VanDerWaalsContact CZ-CB 3.5Å; F185-E269 HydrophobicContact CZ-CG 4.29Å
186	L	91	Very high	82	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.197	C	C	.	.			trans	-88.8	104.3	176.8	-176	63.1	0	0	0	109.9	V181 Y182 N183 N188 A189 P218	V181-L186 HydrophobicContact CB-CD2 4.14Å; V181-L186 HydrophobicContact CG1-CD2 4.47Å; V181-L186 HydrophobicContact CG2-CD2 3.59Å; Y182-L186 PolarHBondContact O-N 3.16Å; N183-L186 PolarHBondContact O-N 3.43Å; L186-N188 WeakPolarHBondContact CD1-OD1 3.34Å; L186-A189 HydrophobicContact CB-CB 4.1Å; L186-A189 HydrophobicContact CD2-CB 3.54Å; L186-A189 HydrophobicContact CG-CB 3.67Å; L186-P218 HydrophobicContact CD1-CB 3.6Å
187	W	88.8	Confident	82	Confident	57 Å²	57	42.8 Å²	42.8	22%	0.216	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-27.1	-173.8	-86.3	69.1	0	0	0	113.7	F150 V219 L221 R244 C246 A249	F150-W187 HydrophobicContact CE1-CB 4.15Å; F150-W187 HydrophobicContact CE1-CE3 4.47Å; F150-W187 HydrophobicContact CE1-CG 4.46Å; W187-V219 PolarHBondContact N-O 3.26Å; W187-L221 HydrophobicContact CB-CB 4.48Å; W187-L221 HydrophobicContact CD2-CB 3.55Å; W187-L221 HydrophobicContact CD2-CD2 3.86Å; W187-L221 HydrophobicContact CD2-CG 4.35Å; W187-L221 HydrophobicContact CE3-CB 4.2Å; W187-L221 HydrophobicContact CE3-CD2 3.75Å; W187-L221 HydrophobicContact CG-CB 3.63Å; W187-L221 HydrophobicContact CH2-CD2 3.44Å; W187-L221 VanDerWaalsContact CH2-CD2 3.44Å; W187-L221 HydrophobicContact CZ2-CB 4.21Å; W187-L221 HydrophobicContact CZ2-CD2 3.58Å; W187-L221 HydrophobicContact CZ2-CG 4.45Å; W187-L221 HydrophobicContact CZ3-CD2 3.53Å; W187-R244 HydrophobicContact CZ2-CB 4.22Å; W187-R244 HydrophobicContact CZ2-CG 3.95Å; W187-R244 PolarHBondContact NE1-O 2.86Å; W187-C246 HydrophobicContact CD2-CB 4.39Å; W187-C246 HydrophobicContact CG-CB 4.48Å; W187-A249 HydrophobicContact CH2-CB 3.58Å; W187-A249 HydrophobicContact CZ2-CB 4.05Å; W187-A249 HydrophobicContact CZ3-CB 4.35Å
188	N	86.3	Confident	81.7	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.032	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	22.8	175.6	65.5	-29.6	0	0	0	112.4	L75 L76 L186 H190 L191 L192 L217 V219	L75-N188 HydrophobicContact CD2-CB 4.34Å; L75-N188 VanDerWaalsContact CD2-ND2 3.27Å; L75-N188 WeakPolarHBondContact CD2-ND2 3.4Å; L76-N188 HydrophobicContact CD1-CB 3.98Å; L186-N188 WeakPolarHBondContact CD1-OD1 3.34Å; N188-H190 PolarHBondContact O-N 3.46Å; N188-L191 HydrophobicContact CB-CB 4.15Å; N188-L191 HydrophobicContact CB-CD1 4.04Å; N188-L191 WeakPolarHBondContact O-CB 3.1Å; N188-L191 PolarHBondContact O-N 3.41Å; N188-L192 WeakPolarHBondContact ND2-CD1 3.49Å; N188-L192 WeakPolarHBondContact O-CG 3.27Å; N188-L192 PolarHBondContact O-N 2.96Å; N188-L217 PolarHBondContact ND2-O 3.38Å; N188-V219 HydrophobicContact CB-CB 4.45Å; N188-V219 PolarHBondContact OD1-N 2.93Å
189	A	85	Confident	81.6	Confident	27 Å²	27	40.8 Å²	40.8	22%	0.223	20%	0.203	C	C	.	.	H	α-helix	trans	-56.9	-50.4	-177.8	0	0	0	0	0	112.3	L186 L191 L192 N193	L186-A189 HydrophobicContact CB-CB 4.1Å; L186-A189 HydrophobicContact CD2-CB 3.54Å; L186-A189 HydrophobicContact CG-CB 3.67Å; A189-L191 VanDerWaalsContact C-N 3.26Å; A189-L191 PolarHBondContact O-N 3.35Å; A189-L192 PolarHBondContact O-N 3.47Å; A189-N193 PolarHBondContact O-N 2.89Å
190	H	81	Confident	81.5	Confident	118 Å²	118	42.2 Å²	42.2	55%	0.546	21%	0.21	S	C	.	.	H	α-helix	trans	-59.4	-42.5	178.7	-178.8	61.5	0	0	0	111.8	N188 L192 N193	N188-H190 PolarHBondContact O-N 3.46Å; H190-L192 VanDerWaalsContact C-N 3.32Å; H190-L192 PolarHBondContact O-N 3.19Å; H190-N193 WeakPolarHBondContact O-CB 3.29Å; H190-N193 PolarHBondContact O-N 3.19Å
191	L	78.2	Confident	81.1	Confident	38 Å²	38	43.6 Å²	43.6	20%	0.199	22%	0.222	C	C	.	.	H	α-helix	trans	-67.6	-31.8	-177	-67.1	-172.5	0	0	0	112.3	L76 D78 N188 A189	L76-L191 HydrophobicContact CD1-CB 3.16Å; L76-L191 HydrophobicContact CD1-CD1 3.97Å; L76-L191 HydrophobicContact CD1-CG 4.19Å; L76-L191 HydrophobicContact CD2-CB 3.4Å; L76-L191 VanDerWaalsContact CD2-CB 3.4Å; L76-L191 HydrophobicContact CD2-CD1 4.18Å; L76-L191 HydrophobicContact CD2-CD2 4Å; L76-L191 HydrophobicContact CD2-CG 4.09Å; L76-L191 WeakPolarHBondContact CD2-O 3.28Å; L76-L191 HydrophobicContact CG-CB 3.61Å; L76-L191 VanDerWaalsContact CG-O 3.3Å; L76-L191 WeakPolarHBondContact CG-O 3.18Å; D78-L191 HydrophobicContact CB-CD2 4.23Å; D78-L191 WeakPolarHBondContact OD1-CD2 3.34Å; D78-L191 WeakPolarHBondContact OD2-CD2 3.25Å; N188-L191 HydrophobicContact CB-CB 4.15Å; N188-L191 HydrophobicContact CB-CD1 4.04Å; N188-L191 WeakPolarHBondContact O-CB 3.1Å; N188-L191 PolarHBondContact O-N 3.41Å; A189-L191 VanDerWaalsContact C-N 3.26Å; A189-L191 PolarHBondContact O-N 3.35Å
192	L	78.3	Confident	80.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-83.8	-11.4	177.1	-66.6	177.3	0	0	0	113.8	L76 N188 A189 H190 D194 I195 F196 A216	L76-L192 HydrophobicContact CD1-CD2 3.71Å; L76-L192 HydrophobicContact CD1-CG 4.04Å; L76-L192 HydrophobicContact CG-CD2 4.32Å; N188-L192 WeakPolarHBondContact ND2-CD1 3.49Å; N188-L192 WeakPolarHBondContact O-CG 3.27Å; N188-L192 PolarHBondContact O-N 2.96Å; A189-L192 PolarHBondContact O-N 3.47Å; H190-L192 VanDerWaalsContact C-N 3.32Å; H190-L192 PolarHBondContact O-N 3.19Å; L192-D194 VanDerWaalsContact C-N 3.31Å; L192-D194 PolarHBondContact O-N 3.3Å; L192-I195 HydrophobicContact CD2-CD1 4.31Å; L192-I195 WeakPolarHBondContact O-CB 3.28Å; L192-I195 PolarHBondContact O-N 2.86Å; L192-F196 HydrophobicContact CB-CD2 3.95Å; L192-F196 HydrophobicContact CB-CE1 4.06Å; L192-F196 HydrophobicContact CB-CE2 3.35Å; L192-F196 HydrophobicContact CB-CZ 3.43Å; L192-F196 VanDerWaalsContact CB-CZ 3.43Å; L192-F196 HydrophobicContact CD1-CE1 4.34Å; L192-F196 HydrophobicContact CD1-CE2 4.08Å; L192-F196 HydrophobicContact CD1-CZ 3.52Å; L192-F196 HydrophobicContact CG-CE2 4.37Å; L192-F196 HydrophobicContact CG-CZ 4.06Å; L192-F196 WeakPolarHBondContact O-CD2 3.16Å; L192-F196 WeakPolarHBondContact O-CG 3.2Å; L192-F196 PolarHBondContact O-N 2.89Å; L192-A216 HydrophobicContact CD2-CB 4.12Å
193	N	77.9	Confident	79.5	Confident	93 Å²	93	44.9 Å²	44.9	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-39.2	-170.7	-168.6	40.8	0	0	0	113.3	A189 H190 F196 L197	A189-N193 PolarHBondContact O-N 2.89Å; H190-N193 WeakPolarHBondContact O-CB 3.29Å; H190-N193 PolarHBondContact O-N 3.19Å; N193-F196 PolarHBondContact O-N 3.39Å; N193-L197 WeakPolarHBondContact O-CB 3.31Å; N193-L197 PolarHBondContact O-N 3.3Å
194	D	71.7	Confident	78.7	Confident	33 Å²	33	44.8 Å²	44.8	18%	0.176	23%	0.234	C	C	.	.	H	α-helix	trans	-68.8	-35.1	177.8	-74	-26.1	0	0	0	112.4	F58 R79 L192 A198	F58-D194 HydrophobicContact CE1-CB 4.46Å; F58-D194 HydrophobicContact CZ-CB 4.12Å; R79-D194 WeakPolarHBondContact CB-OD2 3.45Å; R79-D194 VanDerWaalsContact CD-OD2 3.24Å; R79-D194 WeakPolarHBondContact CD-OD2 3.36Å; R79-D194 WeakPolarHBondContact CG-OD2 3.45Å; L192-D194 VanDerWaalsContact C-N 3.31Å; L192-D194 PolarHBondContact O-N 3.3Å; D194-A198 WeakPolarHBondContact O-CB 3.25Å; D194-A198 PolarHBondContact O-N 3.08Å
195	I	70.3	Confident	77.9	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-42.4	175.7	-61.5	-179.1	0	0	0	109.6	V77 L192 A198 A199 A216	V77-I195 HydrophobicContact CB-CG1 4.37Å; V77-I195 HydrophobicContact CG2-CD1 4.44Å; V77-I195 HydrophobicContact CG2-CG1 4.37Å; L192-I195 HydrophobicContact CD2-CD1 4.31Å; L192-I195 WeakPolarHBondContact O-CB 3.28Å; L192-I195 PolarHBondContact O-N 2.86Å; I195-A198 PolarHBondContact O-N 3.45Å; I195-A199 WeakPolarHBondContact O-CB 3.41Å; I195-A199 PolarHBondContact O-N 2.86Å; I195-A216 HydrophobicContact CG2-CB 3.92Å
196	F	74	Confident	76.6	Confident	26 Å²	26	56.2 Å²	56.2	11%	0.114	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-42	177.2	-59.8	-30	0	0	0	111.8	H178 L192 N193 A198 A199 E200 A216	H178-F196 HydrophobicContact CB-CD1 3.92Å; H178-F196 HydrophobicContact CB-CE1 3.24Å; H178-F196 HydrophobicContact CB-CZ 3.58Å; H178-F196 AromaticContact CD2-CD1 3.89Å; H178-F196 AromaticContact CG-CD1 3.97Å; H178-F196 AromaticContact CG-CE1 3.8Å; L192-F196 HydrophobicContact CB-CD2 3.95Å; L192-F196 HydrophobicContact CB-CE1 4.06Å; L192-F196 HydrophobicContact CB-CE2 3.35Å; L192-F196 HydrophobicContact CB-CZ 3.43Å; L192-F196 VanDerWaalsContact CB-CZ 3.43Å; L192-F196 HydrophobicContact CD1-CE1 4.34Å; L192-F196 HydrophobicContact CD1-CE2 4.08Å; L192-F196 HydrophobicContact CD1-CZ 3.52Å; L192-F196 HydrophobicContact CG-CE2 4.37Å; L192-F196 HydrophobicContact CG-CZ 4.06Å; L192-F196 WeakPolarHBondContact O-CD2 3.16Å; L192-F196 WeakPolarHBondContact O-CG 3.2Å; L192-F196 PolarHBondContact O-N 2.89Å; N193-F196 PolarHBondContact O-N 3.39Å; F196-A198 VanDerWaalsContact C-N 3.31Å; F196-A198 PolarHBondContact O-N 2.93Å; F196-A199 WeakPolarHBondContact O-CB 3.45Å; F196-A199 PolarHBondContact O-N 2.86Å; F196-E200 WeakPolarHBondContact O-CG 3.27Å; F196-E200 PolarHBondContact O-N 3.35Å; F196-A216 HydrophobicContact CD1-CB 4.18Å; F196-A216 HydrophobicContact CE1-CB 3.48Å; F196-A216 VanDerWaalsContact CE1-CB 3.48Å; F196-A216 HydrophobicContact CZ-CB 4.35Å
197	L	74.5	Confident	75.4	Confident	96 Å²	96	61.8 Å²	61.8	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-40.2	174.3	-168.3	76.3	0	0	0	111.7	N193 T201	N193-L197 WeakPolarHBondContact O-CB 3.31Å; N193-L197 PolarHBondContact O-N 3.3Å; L197-T201 WeakPolarHBondContact O-CB 3.48Å; L197-T201 VanDerWaalsContact O-CG2 3.29Å; L197-T201 WeakPolarHBondContact O-CG2 3.4Å; L197-T201 PolarHBondContact O-N 3.01Å; L197-T201 PolarHBondContact O-OG1 2.91Å
198	A	71.7	Confident	74.1	Confident	9 Å²	9	63.5 Å²	63.5	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-65.4	-41.6	174.8	0	0	0	0	0	111.6	D194 I195 F196 T201 E202 Y212	D194-A198 WeakPolarHBondContact O-CB 3.25Å; D194-A198 PolarHBondContact O-N 3.08Å; I195-A198 PolarHBondContact O-N 3.45Å; F196-A198 VanDerWaalsContact C-N 3.31Å; F196-A198 PolarHBondContact O-N 2.93Å; A198-T201 PolarHBondContact O-N 2.97Å; A198-E202 WeakPolarHBondContact O-CA 3.31Å; A198-E202 VanDerWaalsContact O-CB 3.25Å; A198-E202 WeakPolarHBondContact O-CB 3.26Å; A198-E202 PolarHBondContact O-N 2.87Å; A198-Y212 HydrophobicContact CB-CD2 4.45Å; A198-Y212 HydrophobicContact CB-CE2 4.34Å
199	A	72.4	Confident	72.9	Confident	5 Å²	5	69 Å²	69	4%	0.041	37%	0.367	C	S	.	.	H	α-helix	trans	-56.5	-53.3	175.3	0	0	0	0	0	111.2	I195 F196 T201 E203 Y212 T213	I195-A199 WeakPolarHBondContact O-CB 3.41Å; I195-A199 PolarHBondContact O-N 2.86Å; F196-A199 WeakPolarHBondContact O-CB 3.45Å; F196-A199 PolarHBondContact O-N 2.86Å; A199-T201 VanDerWaalsContact C-N 3.34Å; A199-T201 PolarHBondContact O-N 3.3Å; A199-E203 HydrophobicContact CB-CG 4.49Å; A199-E203 VanDerWaalsContact O-CB 3.26Å; A199-E203 WeakPolarHBondContact O-CB 3.3Å; A199-E203 WeakPolarHBondContact O-CG 3.44Å; A199-E203 PolarHBondContact O-N 3.46Å; A199-Y212 HydrophobicContact CB-CD2 4.49Å; A199-T213 HydrophobicContact CB-CG2 3.83Å
200	E	76.1	Confident	71.7	Confident	135 Å²	135	69.2 Å²	69.2	63%	0.631	37%	0.365	S	S	*	.	H	α-helix	trans	-63	-37.8	-179.7	-71.7	179.2	-174.6	0	0	113.2	F196 P204	F196-E200 WeakPolarHBondContact O-CG 3.27Å; F196-E200 PolarHBondContact O-N 3.35Å; E200-P204 WeakPolarHBondContact O-CD 3.4Å; E200-P204 WeakPolarHBondContact O-CG 3.42Å
201	T	76.7	Confident	71	Confident	66 Å²	66	65.7 Å²	65.7	41%	0.405	35%	0.351	S	S	.	.	H	α-helix	trans	-94.3	-25	-171.1	61.1	0	0	0	0	114.6	L197 A198 A199 K205	L197-T201 WeakPolarHBondContact O-CB 3.48Å; L197-T201 VanDerWaalsContact O-CG2 3.29Å; L197-T201 WeakPolarHBondContact O-CG2 3.4Å; L197-T201 PolarHBondContact O-N 3.01Å; L197-T201 PolarHBondContact O-OG1 2.91Å; A198-T201 PolarHBondContact O-N 2.97Å; A199-T201 VanDerWaalsContact C-N 3.34Å; A199-T201 PolarHBondContact O-N 3.3Å; T201-K205 WeakPolarHBondContact O-CD 3.44Å; T201-K205 WeakPolarHBondContact O-CE 3.33Å; T201-K205 PolarHBondContact O-NZ 3.16Å
202	E	72	Confident	70.5	Confident	49 Å²	49	65.1 Å²	65.1	23%	0.229	35%	0.347	C	S	.	.	H	α-helix	trans	-111.7	-36.8	-173.4	-57	-164.3	162.3	0	0	114	A198 K205 Q206 Y212	A198-E202 WeakPolarHBondContact O-CA 3.31Å; A198-E202 VanDerWaalsContact O-CB 3.25Å; A198-E202 WeakPolarHBondContact O-CB 3.26Å; A198-E202 PolarHBondContact O-N 2.87Å; E202-K205 WeakPolarHBondContact O-CB 3.46Å; E202-K205 PolarHBondContact O-N 3.29Å; E202-Q206 PolarHBondContact O-N 2.63Å; E202-Q206 VanDerWaalsContact O-N 3.16Å; E202-Y212 HydrophobicContact CB-CE2 4.11Å; E202-Y212 PolarHBondContact OE2-OH 3.14Å
203	E	69.7	Low	70	Confident	51 Å²	51	66.5 Å²	66.5	24%	0.238	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-59.3	-42	-179	-66.2	178.9	178.4	0	0	113.3	A199 K205 Q206 T211 Y212	A199-E203 HydrophobicContact CB-CG 4.49Å; A199-E203 VanDerWaalsContact O-CB 3.26Å; A199-E203 WeakPolarHBondContact O-CB 3.3Å; A199-E203 WeakPolarHBondContact O-CG 3.44Å; A199-E203 PolarHBondContact O-N 3.46Å; E203-K205 PolarHBondContact O-N 3.13Å; E203-K205 VanDerWaalsContact O-N 3.11Å; E203-Q206 CarbonylContact O-C 3.59Å; E203-Q206 PolarHBondContact O-N 3.49Å; E203-T211 VanDerWaalsContact OE1-CB 3.29Å; E203-T211 WeakPolarHBondContact OE1-CB 3.33Å; E203-Y212 HydrophobicContact CG-CD2 3.69Å; E203-Y212 HydrophobicContact CG-CE2 4.23Å; E203-Y212 WeakPolarHBondContact OE1-CB 3.29Å; E203-Y212 WeakPolarHBondContact OE1-CD2 3.41Å; E203-Y212 PolarHBondContact OE1-N 3.38Å
204	P	73.7	Confident	69.6	Low	105 Å²	105	66.4 Å²	66.4	68%	0.682	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-62.1	-22.5	176.6	-23.6	34.7	0	0	0	113.3	E200	E200-P204 WeakPolarHBondContact O-CD 3.4Å; E200-P204 WeakPolarHBondContact O-CG 3.42Å
205	K	74.1	Confident	69.5	Low	154 Å²	154	65.5 Å²	65.5	67%	0.67	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-87.3	-29.9	-178.3	-62.5	174.8	-178.3	143.2	0	112.3	T201 E202 E203	T201-K205 WeakPolarHBondContact O-CD 3.44Å; T201-K205 WeakPolarHBondContact O-CE 3.33Å; T201-K205 PolarHBondContact O-NZ 3.16Å; E202-K205 WeakPolarHBondContact O-CB 3.46Å; E202-K205 PolarHBondContact O-N 3.29Å; E203-K205 PolarHBondContact O-N 3.13Å; E203-K205 VanDerWaalsContact O-N 3.11Å
206	Q	66.3	Low	69.7	Low	104 Å²	104	65.2 Å²	65.2	49%	0.486	35%	0.348	S	S	.	.	S	Bend	trans	-143.6	84	-177.8	-66.1	-166.7	8.9	0	0	110.4	E202 E203 F208	E202-Q206 PolarHBondContact O-N 2.63Å; E202-Q206 VanDerWaalsContact O-N 3.16Å; E203-Q206 CarbonylContact O-C 3.59Å; E203-Q206 PolarHBondContact O-N 3.49Å; Q206-F208 PolarHBondContact O-N 3.5Å; Q206-F208 VanDerWaalsContact O-N 3.13Å
207	P	65.3	Low	69.9	Low	118 Å²	118	64.4 Å²	64.4	77%	0.766	35%	0.345	S	S	*	.			trans	-62.7	118.1	176.9	23.3	-31	0	0	0	109.9
208	F	61.4	Low	70.6	Confident	93 Å²	93	60.2 Å²	60.2	41%	0.408	32%	0.323	S	S	.	.			trans	-111.2	156	173.6	-115.8	-101.7	0	0	0	109.4	Q61 Q206 I210	Q61-F208 HydrophobicContact CG-CE1 4.21Å; Q61-F208 HydrophobicContact CG-CZ 4.37Å; Q206-F208 PolarHBondContact O-N 3.5Å; Q206-F208 VanDerWaalsContact O-N 3.13Å; F208-I210 PolarHBondContact O-N 3.05Å
209	P	61.1	Low	71.4	Confident	121 Å²	121	60 Å²	60	79%	0.786	32%	0.321	S	S	*	.	S	Bend	trans	-63	-24.4	179.2	-21	32.1	0	0	0	114
210	I	59	Low	72.3	Confident	33 Å²	33	59.8 Å²	59.8	17%	0.169	32%	0.319	C	S	.	.	S	Bend	trans	-117.6	127.9	177.3	-51.6	167.6	0	0	0	107.2	P62 P69 F208 D214 F215	P62-I210 HydrophobicContact CB-CD1 3.77Å; P62-I210 HydrophobicContact CG-CB 3.74Å; P62-I210 HydrophobicContact CG-CD1 3.57Å; P62-I210 HydrophobicContact CG-CG1 4.2Å; P62-I210 HydrophobicContact CG-CG2 4.08Å; P69-I210 HydrophobicContact CB-CD1 3.97Å; P69-I210 HydrophobicContact CB-CG1 4.33Å; F208-I210 PolarHBondContact O-N 3.05Å; I210-D214 HydrophobicContact CG2-CB 3.97Å; I210-F215 HydrophobicContact CB-CE2 4.35Å; I210-F215 HydrophobicContact CG2-CD2 4.2Å; I210-F215 HydrophobicContact CG2-CE2 3.25Å; I210-F215 HydrophobicContact CG2-CZ 3.6Å
211	T	66.1	Low	72.9	Confident	43 Å²	43	53.8 Å²	53.8	26%	0.264	29%	0.292	S	S	.	.			trans	-90.2	158.2	-179.4	67	0	0	0	0	110.5	E203 T213 D214 F215	E203-T211 VanDerWaalsContact OE1-CB 3.29Å; E203-T211 WeakPolarHBondContact OE1-CB 3.33Å; T211-T213 PolarHBondContact O-N 2.96Å; T211-T213 PolarHBondContact OG1-N 3.11Å; T211-T213 PolarHBondContact OG1-OG1 3.1Å; T211-D214 PolarHBondContact N-OD2 2.98Å; T211-D214 WeakPolarHBondContact O-CB 3.35Å; T211-D214 PolarHBondContact O-N 2.81Å; T211-D214 PolarHBondContact OG1-N 3.16Å; T211-D214 PolarHBondContact OG1-OD2 2.86Å; T211-F215 WeakPolarHBondContact O-CD2 3.47Å
212	Y	68.6	Low	73.5	Confident	27 Å²	27	51.7 Å²	51.7	11%	0.106	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.2	-31.5	169.8	-69.4	-69.7	0	0	0	111	I60 A198 A199 E202 E203 D214 F215 A216	I60-Y212 HydrophobicContact CB-CE1 4.42Å; A198-Y212 HydrophobicContact CB-CD2 4.45Å; A198-Y212 HydrophobicContact CB-CE2 4.34Å; A199-Y212 HydrophobicContact CB-CD2 4.49Å; E202-Y212 HydrophobicContact CB-CE2 4.11Å; E202-Y212 PolarHBondContact OE2-OH 3.14Å; E203-Y212 HydrophobicContact CG-CD2 3.69Å; E203-Y212 HydrophobicContact CG-CE2 4.23Å; E203-Y212 WeakPolarHBondContact OE1-CB 3.29Å; E203-Y212 WeakPolarHBondContact OE1-CD2 3.41Å; E203-Y212 PolarHBondContact OE1-N 3.38Å; Y212-D214 VanDerWaalsContact C-N 3.28Å; Y212-D214 PolarHBondContact O-N 3.39Å; Y212-F215 PolarHBondContact O-N 3.46Å; Y212-F215 VanDerWaalsContact O-N 3.14Å; Y212-A216 PolarHBondContact O-N 2.87Å
213	T	68.3	Low	74.3	Confident	29 Å²	29	54.5 Å²	54.5	18%	0.178	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-68.1	-26.1	-178.9	75.9	0	0	0	0	113.3	H178 A199 T211 F215 A216	H178-T213 WeakPolarHBondContact CE1-CG2 3.43Å; H178-T213 WeakPolarHBondContact ND1-CG2 3.27Å; A199-T213 HydrophobicContact CB-CG2 3.83Å; T211-T213 PolarHBondContact O-N 2.96Å; T211-T213 PolarHBondContact OG1-N 3.11Å; T211-T213 PolarHBondContact OG1-OG1 3.1Å; T213-F215 PolarHBondContact O-N 3.33Å; T213-A216 PolarHBondContact O-N 3.23Å; T213-A216 VanDerWaalsContact O-N 3.1Å
214	D	69.3	Low	75.1	Confident	90 Å²	90	52.4 Å²	52.4	48%	0.481	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-65.5	-22.2	174.3	-63.1	-46.3	0	0	0	112.4	I210 T211 Y212	I210-D214 HydrophobicContact CG2-CB 3.97Å; T211-D214 PolarHBondContact N-OD2 2.98Å; T211-D214 WeakPolarHBondContact O-CB 3.35Å; T211-D214 PolarHBondContact O-N 2.81Å; T211-D214 PolarHBondContact OG1-N 3.16Å; T211-D214 PolarHBondContact OG1-OD2 2.86Å; Y212-D214 VanDerWaalsContact C-N 3.28Å; Y212-D214 PolarHBondContact O-N 3.39Å
215	F	69	Low	75.7	Confident	14 Å²	14	48.2 Å²	48.2	6%	0.061	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-102.1	-1.5	176.6	-60.4	-77.5	0	0	0	113.2	P62 V71 C74 I210 T211 Y212 T213 L217	P62-F215 HydrophobicContact CB-CE1 4.45Å; P62-F215 HydrophobicContact CB-CE2 3.94Å; P62-F215 HydrophobicContact CB-CZ 3.44Å; P62-F215 VanDerWaalsContact CB-CZ 3.44Å; P62-F215 HydrophobicContact CG-CE2 3.89Å; P62-F215 HydrophobicContact CG-CZ 3.9Å; V71-F215 HydrophobicContact CB-CE1 4.15Å; V71-F215 HydrophobicContact CG1-CD1 4.09Å; V71-F215 HydrophobicContact CG1-CE1 3.57Å; V71-F215 HydrophobicContact CG2-CE1 3.75Å; V71-F215 HydrophobicContact CG2-CZ 4.02Å; C74-F215 CarbonylContact C-O 3.51Å; C74-F215 HydrophobicContact CB-CB 4Å; C74-F215 HydrophobicContact CB-CD1 3.66Å; C74-F215 HydrophobicContact CB-CG 4.26Å; C74-F215 CarbonylContact O-C 3.55Å; I210-F215 HydrophobicContact CB-CE2 4.35Å; I210-F215 HydrophobicContact CG2-CD2 4.2Å; I210-F215 HydrophobicContact CG2-CE2 3.25Å; I210-F215 HydrophobicContact CG2-CZ 3.6Å; T211-F215 WeakPolarHBondContact O-CD2 3.47Å; Y212-F215 PolarHBondContact O-N 3.46Å; Y212-F215 VanDerWaalsContact O-N 3.14Å; T213-F215 PolarHBondContact O-N 3.33Å; F215-L217 PolarHBondContact O-N 2.89Å
216	A	73.7	Confident	76.4	Confident	2 Å²	2	41.6 Å²	41.6	2%	0.017	23%	0.228	C	C	.	.			trans	-100.2	74	-174.8	0	0	0	0	0	110.1	L192 I195 F196 Y212 T213 P218	L192-A216 HydrophobicContact CD2-CB 4.12Å; I195-A216 HydrophobicContact CG2-CB 3.92Å; F196-A216 HydrophobicContact CD1-CB 4.18Å; F196-A216 HydrophobicContact CE1-CB 3.48Å; F196-A216 VanDerWaalsContact CE1-CB 3.48Å; F196-A216 HydrophobicContact CZ-CB 4.35Å; Y212-A216 PolarHBondContact O-N 2.87Å; T213-A216 PolarHBondContact O-N 3.23Å; T213-A216 VanDerWaalsContact O-N 3.1Å; A216-P218 VanDerWaalsContact O-CD 3.28Å; A216-P218 WeakPolarHBondContact O-CD 3.46Å
217	L	80	Confident	77.4	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.042	24%	0.235	C	C	.	.			trans	-79.8	121.7	-173	-70.4	173.2	0	0	0	112.8	A73 L75 Y152 P154 N188 F215 V219	A73-L217 HydrophobicContact CB-CD1 3.15Å; L75-L217 HydrophobicContact CD1-CB 3.91Å; Y152-L217 HydrophobicContact CD2-CD1 3.72Å; Y152-L217 HydrophobicContact CD2-CD2 4.39Å; Y152-L217 HydrophobicContact CD2-CG 4.46Å; Y152-L217 HydrophobicContact CE2-CD1 3.74Å; P154-L217 HydrophobicContact CB-CD2 4.26Å; N188-L217 PolarHBondContact ND2-O 3.38Å; F215-L217 PolarHBondContact O-N 2.89Å; L217-V219 PolarHBondContact O-N 3.37Å
218	P	87.6	Confident	78.6	Confident	8 Å²	8	44.9 Å²	44.9	5%	0.052	23%	0.225	C	C	.	.			trans	-65.1	126.9	172.1	-25.8	39.8	0	0	0	111.6	L177 V181 L186 A216	L177-P218 HydrophobicContact CD2-CG 3.86Å; L177-P218 HydrophobicContact CG-CG 3.91Å; V181-P218 HydrophobicContact CG1-CB 3.63Å; V181-P218 HydrophobicContact CG1-CG 3.31Å; L186-P218 HydrophobicContact CD1-CB 3.6Å; A216-P218 VanDerWaalsContact O-CD 3.28Å; A216-P218 WeakPolarHBondContact O-CD 3.46Å
219	V	89.7	Confident	79.6	Confident	6 Å²	6	43.9 Å²	43.9	4%	0.036	23%	0.227	C	C	.	.			trans	-112.7	128.3	179	177.2	0	0	0	0	110.5	L75 I111 F150 W187 N188 L217	L75-V219 HydrophobicContact CD1-CG2 3.61Å; L75-V219 HydrophobicContact CD2-CG2 3.75Å; L75-V219 HydrophobicContact CG-CG2 4.26Å; I111-V219 HydrophobicContact CD1-CG1 4Å; I111-V219 HydrophobicContact CD1-CG2 3.96Å; F150-V219 HydrophobicContact CB-CG1 3.79Å; F150-V219 HydrophobicContact CD1-CG1 3.43Å; F150-V219 VanDerWaalsContact CD1-CG1 3.43Å; F150-V219 HydrophobicContact CE1-CG1 4.27Å; F150-V219 HydrophobicContact CG-CG1 3.92Å; W187-V219 PolarHBondContact N-O 3.26Å; N188-V219 HydrophobicContact CB-CB 4.45Å; N188-V219 PolarHBondContact OD1-N 2.93Å; L217-V219 PolarHBondContact O-N 3.37Å
220	M	91.4	Very high	80.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.7	174.1	178.6	-86.7	-69.1	0	0	109.5	F150 Y151 L158 I241 R243	F150-M220 WeakPolarHBondContact CA-O 3.17Å; Y151-M220 HydrophobicContact CD2-CE 4.11Å; Y151-M220 HydrophobicContact CD2-SD 4.48Å; Y151-M220 HydrophobicContact CG-CE 4.42Å; Y151-M220 PolarHBondContact N-O 3.26Å; Y151-M220 PolarHBondContact O-N 3.29Å; L158-M220 HydrophobicContact CB-CB 4.26Å; L158-M220 HydrophobicContact CB-CE 4.43Å; L158-M220 HydrophobicContact CD1-CE 4.46Å; M220-I241 HydrophobicContact CE-CG2 3.85Å; M220-R243 HydrophobicContact CE-CG 4.45Å; M220-R243 HydrophobicContact CG-CB 4.18Å; M220-R243 HydrophobicContact CG-CG 4.12Å; M220-R243 HydrophobicContact SD-CB 4.37Å; M220-R243 HydrophobicContact SD-CG 4.28Å
221	L	89.1	Confident	81.3	Confident	9 Å²	9	45.9 Å²	45.9	5%	0.047	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.4	168.5	-176.1	69.6	0	0	0	109.9	F150 W187 R244	F150-L221 HydrophobicContact CD1-CB 3.81Å; F150-L221 HydrophobicContact CD1-CD1 3.65Å; F150-L221 HydrophobicContact CD1-CG 4.31Å; F150-L221 HydrophobicContact CD2-CD1 4.21Å; F150-L221 HydrophobicContact CE1-CB 3.69Å; F150-L221 HydrophobicContact CE1-CD1 3.63Å; F150-L221 HydrophobicContact CE1-CD2 4.41Å; F150-L221 HydrophobicContact CE1-CG 4.09Å; F150-L221 HydrophobicContact CE2-CD1 4.15Å; F150-L221 HydrophobicContact CG-CD1 3.98Å; F150-L221 HydrophobicContact CZ-CD1 3.88Å; W187-L221 HydrophobicContact CB-CB 4.48Å; W187-L221 HydrophobicContact CD2-CB 3.55Å; W187-L221 HydrophobicContact CD2-CD2 3.86Å; W187-L221 HydrophobicContact CD2-CG 4.35Å; W187-L221 HydrophobicContact CE3-CB 4.2Å; W187-L221 HydrophobicContact CE3-CD2 3.75Å; W187-L221 HydrophobicContact CG-CB 3.63Å; W187-L221 HydrophobicContact CH2-CD2 3.44Å; W187-L221 VanDerWaalsContact CH2-CD2 3.44Å; W187-L221 HydrophobicContact CZ2-CB 4.21Å; W187-L221 HydrophobicContact CZ2-CD2 3.58Å; W187-L221 HydrophobicContact CZ2-CG 4.45Å; W187-L221 HydrophobicContact CZ3-CD2 3.53Å; L221-R244 VanDerWaalsContact O-CB 3.27Å; L221-R244 WeakPolarHBondContact O-CB 3.23Å; L221-R244 PolarHBondContact O-N 2.91Å
222	G	88.7	Confident	81.7	Confident	22 Å²	22	47.4 Å²	47.4	23%	0.227	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.8	-121.2	173.1	0	0	0	0	0	113.5	S149 S242	S149-G222 WeakPolarHBondContact CB-O 3.47Å; S149-G222 PolarHBondContact O-N 2.96Å; G222-S242 CarbonylContact C-O 3.53Å; G222-S242 WeakPolarHBondContact CA-O 3.22Å
223	Y	88.1	Confident	81.8	Confident	108 Å²	108	50.5 Å²	50.5	42%	0.424	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.4	176	176.7	-98	0	0	0	109.8	S225 L240 I241 S242	Y223-S225 VanDerWaalsContact OH-CB 3.27Å; Y223-S225 WeakPolarHBondContact OH-CB 3.43Å; Y223-L240 HydrophobicContact CE1-CD2 4.34Å; Y223-I241 CarbonylContact O-C 3.56Å; Y223-S242 PolarHBondContact N-O 2.97Å; Y223-S242 PolarHBondContact O-N 2.89Å
224	M	86.1	Confident	81.9	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	133.8	170.9	-162.7	-178.2	69.2	0	0	110.2	V100 I103 V108 Y151 L158 I226 L240 I241	V100-M224 HydrophobicContact CB-CE 3.44Å; V100-M224 VanDerWaalsContact CB-CE 3.44Å; V100-M224 HydrophobicContact CG1-CE 3.44Å; V100-M224 VanDerWaalsContact CG1-CE 3.44Å; V100-M224 HydrophobicContact CG2-CE 3.78Å; I103-M224 HydrophobicContact CD1-SD 4.32Å; V108-M224 HydrophobicContact CB-CE 3.63Å; V108-M224 HydrophobicContact CB-SD 4.22Å; V108-M224 HydrophobicContact CG1-CE 3.28Å; V108-M224 HydrophobicContact CG1-SD 3.64Å; Y151-M224 HydrophobicContact CD1-CB 3.9Å; Y151-M224 HydrophobicContact CD1-CE 4.01Å; Y151-M224 HydrophobicContact CD2-CB 4.32Å; Y151-M224 HydrophobicContact CE1-CB 3.75Å; Y151-M224 HydrophobicContact CE1-CE 4.46Å; Y151-M224 HydrophobicContact CE2-CB 4.2Å; Y151-M224 HydrophobicContact CG-CB 4.19Å; Y151-M224 PolarHBondContact OH-N 2.98Å; L158-M224 HydrophobicContact CD2-SD 4.17Å; M224-I226 HydrophobicContact CE-CD1 4.38Å; M224-L240 VanDerWaalsContact CA-O 3.28Å; M224-L240 WeakPolarHBondContact CA-O 2.98Å; M224-I241 HydrophobicContact CG-CG1 4.06Å; M224-I241 HydrophobicContact CG-CG2 4.48Å; M224-I241 HydrophobicContact SD-CG1 4.39Å
225	S	87.2	Confident	82.6	Confident	18 Å²	18	53 Å²	53	13%	0.126	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	134.7	170.6	-174.2	0	0	0	0	109.6	Y223 A239 L240	Y223-S225 VanDerWaalsContact OH-CB 3.27Å; Y223-S225 WeakPolarHBondContact OH-CB 3.43Å; S225-A239 CarbonylContact O-C 3.53Å; S225-A239 WeakPolarHBondContact O-CA 3.34Å; S225-L240 PolarHBondContact N-O 2.78Å; S225-L240 PolarHBondContact O-N 2.85Å
226	I	89.3	Confident	83.3	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.077	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	175.6	-56.4	174.8	0	0	0	106.1	V100 I103 M224 K237 L238 A239	V100-I226 HydrophobicContact CG1-CG1 4.42Å; I103-I226 HydrophobicContact CD1-CD1 4.1Å; I103-I226 HydrophobicContact CG1-CD1 3.64Å; M224-I226 HydrophobicContact CE-CD1 4.38Å; I226-K237 HydrophobicContact CG2-CD 3.7Å; I226-K237 HydrophobicContact CG2-CG 3.56Å; I226-L238 WeakPolarHBondContact CA-O 3.3Å; I226-A239 HydrophobicContact CG1-CB 3.87Å
227	R	87	Confident	84	Confident	168 Å²	168	54.2 Å²	54.2	63%	0.634	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.2	178.4	-64.7	-62.7	-176.6	-154.7	2.7	108.8	K237 L238	R227-K237 WeakPolarHBondContact O-CA 3.08Å; R227-L238 PolarHBondContact N-O 2.83Å; R227-L238 PolarHBondContact O-N 3.08Å
228	E	88.9	Confident	84.5	Confident	122 Å²	122	56.3 Å²	56.3	57%	0.57	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	129.8	169.8	-64.8	-174.2	-175.8	0	0	108.6	L236 K237	E228-L236 CarbonylContact C-O 3.47Å; E228-L236 WeakPolarHBondContact CA-O 3.45Å; E228-K237 HydrophobicContact CG-CB 4.11Å; E228-K237 HydrophobicContact CG-CG 3.92Å; E228-K237 VanDerWaalsContact OE1-CE 3.27Å; E228-K237 WeakPolarHBondContact OE1-CE 3.06Å
229	V	83.5	Confident	84.6	Confident	72 Å²	72	56.1 Å²	56.1	44%	0.436	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.2	-179.1	-173.7	0	0	0	0	108.3	V231 L236	V229-V231 HydrophobicContact CB-CG2 4.38Å; V229-V231 HydrophobicContact CG1-CG2 3.81Å; V229-V231 PolarHBondContact O-N 3.33Å; V229-L236 PolarHBondContact N-O 3.33Å; V229-L236 PolarHBondContact O-N 3.33Å
230	D	79.4	Confident	84.6	Confident	118 Å²	118	58.6 Å²	58.6	63%	0.631	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	107.1	170.9	-68.2	-53.1	0	0	0	109.7	R234 K235	D230-R234 CarbonylContact C-O 3.56Å; D230-R234 VanDerWaalsContact CA-O 3.31Å; D230-R234 WeakPolarHBondContact CA-O 3.2Å; D230-K235 VanDerWaalsContact OD1-CG 3.24Å; D230-K235 WeakPolarHBondContact OD1-CG 3.29Å
231	V	75.5	Confident	84.6	Confident	79 Å²	79	58.6 Å²	58.6	48%	0.479	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.9	177.4	-177.5	0	0	0	0	109	V229 D233 R234	V229-V231 HydrophobicContact CB-CG2 4.38Å; V229-V231 HydrophobicContact CG1-CG2 3.81Å; V229-V231 PolarHBondContact O-N 3.33Å; V231-D233 PolarHBondContact O-N 3.01Å; V231-R234 PolarHBondContact N-O 2.87Å; V231-R234 WeakPolarHBondContact O-CB 3.2Å; V231-R234 PolarHBondContact O-N 3.37Å
232	A	75.1	Confident	84.7	Confident	74 Å²	74	58.7 Å²	58.7	61%	0.612	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	50.1	-179.2	0	0	0	0	0	112	R234	A232-R234 PolarHBondContact O-N 3.29Å
233	D	70.8	Confident	85	Confident	92 Å²	92	57.6 Å²	57.6	49%	0.492	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	4.9	-179.5	-76.2	-55.6	0	0	0	117	V231 K469	V231-D233 PolarHBondContact O-N 3.01Å; D233-K469 HydrophobicContact CB-CB 4.47Å; D233-K469 HydrophobicContact CB-CD 3.58Å; D233-K469 HydrophobicContact CB-CG 3.95Å; D233-K469 WeakPolarHBondContact O-CE 3.07Å; D233-K469 PolarHBondContact O-NZ 2.91Å; D233-K469 IonicContact OD1-NZ 2.9Å; D233-K469 PolarHBondContact OD1-NZ 3.48Å
234	R	70.6	Confident	85	Confident	27 Å²	27	55.4 Å²	55.4	10%	0.102	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.7	174.6	-67.8	178.1	158.8	147.3	5.2	111.6	D230 V231 A232 L236 V276 D277 F440 F464 T465 R466 T467	D230-R234 CarbonylContact C-O 3.56Å; D230-R234 VanDerWaalsContact CA-O 3.31Å; D230-R234 WeakPolarHBondContact CA-O 3.2Å; V231-R234 PolarHBondContact N-O 2.87Å; V231-R234 WeakPolarHBondContact O-CB 3.2Å; V231-R234 PolarHBondContact O-N 3.37Å; A232-R234 PolarHBondContact O-N 3.29Å; R234-L236 PolarHBondContact O-N 2.85Å; R234-V276 HydrophobicContact CB-CG1 4.48Å; R234-D277 WeakPolarHBondContact CD-OD2 3.32Å; R234-D277 IonicContact CZ-OD2 3.94Å; R234-D277 IonicContact NE-OD2 3.95Å; R234-D277 PolarHBondContact NE-OD2 3.41Å; R234-D277 IonicContact NH2-OD2 3.19Å; R234-F440 VanDerWaalsContact CZ-CE1 3.47Å; R234-F464 PolarHBondContact NH2-O 3.35Å; R234-T465 VanDerWaalsContact NH2-C 3.31Å; R234-T465 PolarHBondContact NH2-O 3.42Å; R234-R466 PolarHBondContact NH1-O 3.44Å; R234-R466 PolarHBondContact NH2-O 3.14Å; R234-T467 WeakPolarHBondContact CG-O 3.37Å
235	K	82.9	Confident	85.3	Confident	144 Å²	144	55.3 Å²	55.3	63%	0.626	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	105.1	168.4	-71.8	-174.1	174.4	-162.5	0	108.7	D230	D230-K235 VanDerWaalsContact OD1-CG 3.24Å; D230-K235 WeakPolarHBondContact OD1-CG 3.29Å
236	L	85	Confident	85.4	Confident	18 Å²	18	56.5 Å²	56.5	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.6	169.6	-176.9	149.2	0	0	0	107.9	E228 V229 R234 L238 V274 V276 L437	E228-L236 CarbonylContact C-O 3.47Å; E228-L236 WeakPolarHBondContact CA-O 3.45Å; V229-L236 PolarHBondContact N-O 3.33Å; V229-L236 PolarHBondContact O-N 3.33Å; R234-L236 PolarHBondContact O-N 2.85Å; L236-L238 HydrophobicContact CD2-CB 3.89Å; L236-V274 HydrophobicContact CD1-CG1 4.02Å; L236-V274 HydrophobicContact CD2-CG1 4.44Å; L236-V274 HydrophobicContact CG-CG1 4.12Å; L236-V276 HydrophobicContact CB-CG2 4.03Å; L236-V276 HydrophobicContact CD1-CG2 3.64Å; L236-V276 HydrophobicContact CG-CG2 3.62Å; L236-L437 HydrophobicContact CD1-CD2 4.02Å
237	K	88.9	Confident	85.4	Confident	24 Å²	24	59.7 Å²	59.7	10%	0.104	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.9	170.3	-174.8	-166.3	-57.7	161.7	0	108.6	T102 I226 R227 E228 E275	T102-K237 WeakPolarHBondContact O-CD 3.49Å; T102-K237 PolarHBondContact O-NZ 3.31Å; I226-K237 HydrophobicContact CG2-CD 3.7Å; I226-K237 HydrophobicContact CG2-CG 3.56Å; R227-K237 WeakPolarHBondContact O-CA 3.08Å; E228-K237 HydrophobicContact CG-CB 4.11Å; E228-K237 HydrophobicContact CG-CG 3.92Å; E228-K237 VanDerWaalsContact OE1-CE 3.27Å; E228-K237 WeakPolarHBondContact OE1-CE 3.06Å; K237-E275 HydrophobicContact CB-CB 4.14Å; K237-E275 WeakPolarHBondContact CD-OE2 3.41Å; K237-E275 WeakPolarHBondContact CE-OE2 3.35Å; K237-E275 PolarHBondContact N-O 3.01Å; K237-E275 IonicContact NZ-OE1 2.62Å; K237-E275 IonicContact NZ-OE2 3.7Å; K237-E275 PolarHBondContact NZ-OE2 2.82Å; K237-E275 PolarHBondContact O-N 3.1Å
238	L	88.6	Confident	85.5	Confident	53 Å²	53	55.2 Å²	55.2	28%	0.277	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.7	175.1	-178	68.7	0	0	0	108.2	I226 R227 L236 Q272 I273 V274	I226-L238 WeakPolarHBondContact CA-O 3.3Å; R227-L238 PolarHBondContact N-O 2.83Å; R227-L238 PolarHBondContact O-N 3.08Å; L236-L238 HydrophobicContact CD2-CB 3.89Å; L238-Q272 HydrophobicContact CD1-CG 3.73Å; L238-I273 WeakPolarHBondContact CA-O 3.38Å; L238-V274 HydrophobicContact CD1-CG2 3.73Å
239	A	91.1	Very high	85.2	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131	170.4	0	0	0	0	0	109.7	I103 S225 I226 I273	I103-A239 HydrophobicContact CD1-CB 4.35Å; S225-A239 CarbonylContact O-C 3.53Å; S225-A239 WeakPolarHBondContact O-CA 3.34Å; I226-A239 HydrophobicContact CG1-CB 3.87Å; A239-I273 HydrophobicContact CB-CB 4.23Å; A239-I273 PolarHBondContact N-O 3.12Å; A239-I273 PolarHBondContact O-N 3.3Å
240	L	88.5	Confident	85	Confident	59 Å²	59	48.8 Å²	48.8	31%	0.309	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.1	171.8	-171.4	73	0	0	0	108.3	Y223 M224 S225 T270 Q272	Y223-L240 HydrophobicContact CE1-CD2 4.34Å; M224-L240 VanDerWaalsContact CA-O 3.28Å; M224-L240 WeakPolarHBondContact CA-O 2.98Å; S225-L240 PolarHBondContact N-O 2.78Å; S225-L240 PolarHBondContact O-N 2.85Å; L240-T270 HydrophobicContact CD1-CG2 3.61Å; L240-T270 HydrophobicContact CG-CG2 4.17Å; L240-Q272 HydrophobicContact CD1-CB 4.07Å; L240-Q272 HydrophobicContact CD1-CG 4.5Å
241	I	93.2	Very high	85.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.6	179.1	-45.1	177.8	0	0	0	107.5	I103 M220 Y223 M224 R243 T270 E271 I273	I103-I241 HydrophobicContact CD1-CD1 3.72Å; I103-I241 HydrophobicContact CD1-CG1 4.39Å; M220-I241 HydrophobicContact CE-CG2 3.85Å; Y223-I241 CarbonylContact O-C 3.56Å; M224-I241 HydrophobicContact CG-CG1 4.06Å; M224-I241 HydrophobicContact CG-CG2 4.48Å; M224-I241 HydrophobicContact SD-CG1 4.39Å; I241-R243 HydrophobicContact CG2-CG 4.09Å; I241-T270 CarbonylContact O-C 3.56Å; I241-T270 VanDerWaalsContact O-CA 3.29Å; I241-T270 WeakPolarHBondContact O-CA 3.15Å; I241-E271 PolarHBondContact N-O 3.34Å; I241-E271 PolarHBondContact O-N 2.99Å; I241-I273 HydrophobicContact CD1-CD1 3.85Å
242	S	90.8	Very high	85	Confident	10 Å²	10	50 Å²	50	7%	0.07	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	109.4	173.3	-64.6	0	0	0	0	109.2	G222 Y223 E269 T270	G222-S242 CarbonylContact C-O 3.53Å; G222-S242 WeakPolarHBondContact CA-O 3.22Å; Y223-S242 PolarHBondContact N-O 2.97Å; Y223-S242 PolarHBondContact O-N 2.89Å; S242-E269 CarbonylContact C-O 3.58Å; S242-E269 WeakPolarHBondContact CA-O 3.24Å; S242-T270 WeakPolarHBondContact OG-CG2 3.39Å; S242-T270 PolarHBondContact OG-OG1 3.17Å
243	R	93.7	Very high	85.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.2	-177.7	-52.2	173.7	-176.8	87	11.1	109.5	L158 H160 F185 M220 I241 V268 E269 E271	L158-R243 VanDerWaalsContact O-CD 3.28Å; L158-R243 WeakPolarHBondContact O-CD 3.48Å; L158-R243 PolarHBondContact O-NE 3.19Å; H160-R243 PolarHBondContact O-NE 3.15Å; H160-R243 PolarHBondContact O-NH2 3.13Å; F185-R243 HydrophobicContact CB-CB 4.15Å; F185-R243 HydrophobicContact CD1-CB 3.48Å; F185-R243 VanDerWaalsContact CD1-CB 3.48Å; F185-R243 HydrophobicContact CD2-CB 4.23Å; F185-R243 HydrophobicContact CE1-CB 3.86Å; F185-R243 WeakPolarHBondContact CE1-O 3.49Å; F185-R243 HydrophobicContact CG-CB 3.69Å; F185-R243 HydrophobicContact CZ-CB 4.39Å; M220-R243 HydrophobicContact CE-CG 4.45Å; M220-R243 HydrophobicContact CG-CB 4.18Å; M220-R243 HydrophobicContact CG-CG 4.12Å; M220-R243 HydrophobicContact SD-CB 4.37Å; M220-R243 HydrophobicContact SD-CG 4.28Å; I241-R243 HydrophobicContact CG2-CG 4.09Å; R243-V268 VanDerWaalsContact O-CA 3.3Å; R243-V268 WeakPolarHBondContact O-CA 3.19Å; R243-E269 IonicContact CZ-OE1 3.44Å; R243-E269 PolarHBondContact N-O 3.24Å; R243-E269 IonicContact NE-OE1 2.69Å; R243-E269 IonicContact NH1-OE1 3.63Å; R243-E269 PolarHBondContact NH1-OE1 3.27Å; R243-E269 PolarHBondContact O-N 3.39Å; R243-E271 IonicContact CZ-OE2 3.11Å; R243-E271 VanDerWaalsContact CZ-OE2 3.25Å; R243-E271 IonicContact NH1-OE2 3.93Å; R243-E271 PolarHBondContact NH1-OE2 2.91Å; R243-E271 IonicContact NH2-OE2 3.12Å; R243-E271 PolarHBondContact NH2-OE2 3.17Å
244	R	89.8	Confident	85.8	Confident	62 Å²	62	49.6 Å²	49.6	23%	0.234	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	131.1	175.7	-168.6	-179.9	177	-163	0.7	109.5	W187 L221 G250 N266 V268	W187-R244 HydrophobicContact CZ2-CB 4.22Å; W187-R244 HydrophobicContact CZ2-CG 3.95Å; W187-R244 PolarHBondContact NE1-O 2.86Å; L221-R244 VanDerWaalsContact O-CB 3.27Å; L221-R244 WeakPolarHBondContact O-CB 3.23Å; L221-R244 PolarHBondContact O-N 2.91Å; R244-G250 PolarHBondContact NH2-O 2.97Å; R244-N266 PolarHBondContact NH2-OD1 3.47Å; R244-V268 HydrophobicContact CB-CG2 4.43Å; R244-V268 HydrophobicContact CG-CG2 4.22Å
245	S	91.3	Very high	86.4	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.028	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-72	140.2	177.1	171	0	0	0	0	111.7	R184 Q247 F267	R184-S245 WeakPolarHBondContact O-CA 2.85Å; R184-S245 PolarHBondContact O-OG 2.96Å; S245-Q247 PolarHBondContact OG-N 2.85Å; S245-F267 PolarHBondContact N-O 3.23Å
246	C	89.7	Confident	86.6	Confident	43 Å²	43	43.1 Å²	43.1	29%	0.291	22%	0.219	S	C	.	.	S	Bend	trans	-87.3	-16.8	173.7	60.6	0	0	0	0	113.1	N183 R184 W187 R248 A249	N183-C246 PolarHBondContact O-SG 3.48Å; R184-C246 PolarHBondContact O-N 2.57Å; R184-C246 PolarHBondContact O-SG 3.26Å; R184-C246 VanDerWaalsContact O-SG 3.39Å; W187-C246 HydrophobicContact CD2-CB 4.39Å; W187-C246 HydrophobicContact CG-CB 4.48Å; C246-R248 VanDerWaalsContact C-N 3.33Å; C246-R248 PolarHBondContact O-N 3.35Å; C246-A249 PolarHBondContact O-N 2.94Å
247	Q	89.6	Confident	86.8	Confident	81 Å²	81	42.2 Å²	42.2	38%	0.379	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-37.8	-172.5	-60.8	-174.8	-77.8	0	0	113.7	R184 S245 N263	R184-Q247 HydrophobicContact CG-CG 4.35Å; S245-Q247 PolarHBondContact OG-N 2.85Å; Q247-N263 HydrophobicContact CB-CB 4.06Å; Q247-N263 VanDerWaalsContact CD-OD1 3.27Å; Q247-N263 PolarHBondContact NE2-OD1 3.39Å; Q247-N263 PolarHBondContact OE1-OD1 3.1Å
248	R	88.8	Confident	87	Confident	75 Å²	75	41.3 Å²	41.3	28%	0.283	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.4	52.1	175.1	-165.6	164.2	-173.9	66.2	-6.4	111.3	C246 T255 D259 N263 A265 N266	C246-R248 VanDerWaalsContact C-N 3.33Å; C246-R248 PolarHBondContact O-N 3.35Å; R248-T255 HydrophobicContact CG-CG2 3.83Å; R248-D259 IonicContact NH1-OD2 3.99Å; R248-N263 HydrophobicContact CB-CB 4.05Å; R248-N263 WeakPolarHBondContact CD-O 3.37Å; R248-A265 HydrophobicContact CG-CB 4.15Å; R248-A265 WeakPolarHBondContact O-CA 3.33Å; R248-N266 PolarHBondContact O-N 2.87Å
249	A	83.6	Confident	87.2	Confident	39 Å²	39	40 Å²	40	32%	0.322	20%	0.204	S	C	.	.			trans	-68.6	150.1	174.6	0	0	0	0	0	111.5	W187 C246	W187-A249 HydrophobicContact CH2-CB 3.58Å; W187-A249 HydrophobicContact CZ2-CB 4.05Å; W187-A249 HydrophobicContact CZ3-CB 4.35Å; C246-A249 PolarHBondContact O-N 2.94Å
250	G	79.2	Confident	87.2	Confident	20 Å²	20	47.9 Å²	47.9	21%	0.206	24%	0.241	C	C	.	.			trans	164.9	176.9	173.3	0	0	0	0	0	113.4	R244 T255 N266	R244-G250 PolarHBondContact NH2-O 2.97Å; G250-T255 WeakPolarHBondContact CA-OG1 3.37Å; G250-N266 PolarHBondContact O-OD1 3.11Å; G250-N266 VanDerWaalsContact O-OD1 3.08Å
251	V	80.2	Confident	87.4	Confident	106 Å²	106	52 Å²	52	64%	0.642	26%	0.258	S	S	*	.			trans	-88.3	153.8	-177.3	-59.9	0	0	0	0	111.8	F253 Q254 T255	V251-F253 PolarHBondContact O-N 2.66Å; V251-Q254 HydrophobicContact CG2-CB 3.46Å; V251-Q254 VanDerWaalsContact CG2-CB 3.46Å; V251-Q254 HydrophobicContact CG2-CG 4.43Å; V251-Q254 PolarHBondContact O-N 2.81Å; V251-T255 PolarHBondContact O-N 3.05Å
252	R	73.8	Confident	87.3	Confident	115 Å²	115	52.1 Å²	52.1	43%	0.434	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.3	-57.7	-167.5	-178.1	178	-178.3	-169	-0.8	115.8	R256 D416	R252-R256 VanDerWaalsContact CG-NH2 3.33Å; R252-R256 WeakPolarHBondContact O-CG 3.13Å; R252-R256 PolarHBondContact O-NE 2.9Å; R252-D416 IonicContact CZ-OD1 3.94Å; R252-D416 IonicContact CZ-OD2 3.26Å; R252-D416 VanDerWaalsContact CZ-OD2 3.26Å; R252-D416 IonicContact NE-OD1 3.05Å; R252-D416 PolarHBondContact NE-OD1 3.15Å; R252-D416 IonicContact NE-OD2 3.14Å; R252-D416 PolarHBondContact NE-OD2 2.93Å; R252-D416 VanDerWaalsContact NE-OD2 3.14Å; R252-D416 IonicContact NH2-OD2 2.65Å; R252-D416 PolarHBondContact NH2-OD2 2.86Å
253	F	80.5	Confident	87.4	Confident	48 Å²	48	52.4 Å²	52.4	21%	0.211	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-15.6	-176.3	-66	-54.7	0	0	0	113.4	V251 Q296 K297 P298	V251-F253 PolarHBondContact O-N 2.66Å; F253-Q296 WeakPolarHBondContact CB-O 3.36Å; F253-Q296 HydrophobicContact CD1-CG 4.24Å; F253-Q296 CarbonylContact O-C 3.39Å; F253-Q296 VanDerWaalsContact O-O 3.09Å; F253-K297 WeakPolarHBondContact O-CA 2.93Å; F253-P298 HydrophobicContact CB-CG 3.74Å
254	Q	81.7	Confident	87.3	Confident	110 Å²	110	52.6 Å²	52.6	51%	0.514	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-38.8	-179.9	-169.9	64.6	3.8	0	0	111.8	V251	V251-Q254 HydrophobicContact CG2-CB 3.46Å; V251-Q254 VanDerWaalsContact CG2-CB 3.46Å; V251-Q254 HydrophobicContact CG2-CG 4.43Å; V251-Q254 PolarHBondContact O-N 2.81Å
255	T	82.7	Confident	87.2	Confident	22 Å²	22	49.6 Å²	49.6	14%	0.135	25%	0.251	C	S	.	.	S	Bend	trans	-126.2	108.2	-173.2	-48.4	0	0	0	0	110.3	R248 G250 V251 A265	R248-T255 HydrophobicContact CG-CG2 3.83Å; G250-T255 WeakPolarHBondContact CA-OG1 3.37Å; V251-T255 PolarHBondContact O-N 3.05Å; T255-A265 HydrophobicContact CG2-CB 3.85Å
256	R	87.4	Confident	86.7	Confident	13 Å²	13	50.9 Å²	50.9	5%	0.049	26%	0.257	C	S	.	.			trans	-139.9	163.5	176.7	-64.6	-169.6	177.1	-100.6	6.9	110.4	R252 W294 Q296 M415 D416	R252-R256 VanDerWaalsContact CG-NH2 3.33Å; R252-R256 WeakPolarHBondContact O-CG 3.13Å; R252-R256 PolarHBondContact O-NE 2.9Å; R256-W294 CarbonylContact C-O 3.58Å; R256-W294 HydrophobicContact CB-CD2 4.32Å; R256-W294 HydrophobicContact CB-CE3 4.36Å; R256-W294 HydrophobicContact CB-CH2 4.19Å; R256-W294 HydrophobicContact CB-CZ2 4.08Å; R256-W294 HydrophobicContact CB-CZ3 4.31Å; R256-W294 HydrophobicContact CG-CH2 4.27Å; R256-W294 HydrophobicContact CG-CZ3 4.47Å; R256-Q296 VanDerWaalsContact NH2-OE1 3.09Å; R256-M415 PolarHBondContact NH1-O 3.37Å; R256-D416 IonicContact CZ-OD1 3.15Å; R256-D416 IonicContact NH1-OD1 2.82Å; R256-D416 PolarHBondContact NH1-OD1 3.12Å; R256-D416 IonicContact NH2-OD1 2.64Å; R256-D416 PolarHBondContact NH2-OD1 3.3Å; R256-D416 IonicContact NH2-OD2 3.81Å
257	G	89.8	Confident	86.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	71.5	-159.4	-180	0	0	0	0	0	113.3	A265 S289 L292 W294	G257-A265 WeakPolarHBondContact O-CB 3.28Å; G257-A265 PolarHBondContact O-N 2.64Å; G257-S289 PolarHBondContact N-OG 3Å; G257-S289 VanDerWaalsContact N-OG 3.1Å; G257-L292 CarbonylContact C-O 3.34Å; G257-L292 WeakPolarHBondContact CA-O 3.27Å; G257-W294 VanDerWaalsContact CA-CD1 3.47Å; G257-W294 VanDerWaalsContact CA-NE1 3.33Å
258	I	92.8	Very high	86.8	Confident	4 Å²	4	46 Å²	46	2%	0.021	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-102.6	162.1	175.4	49.5	166.4	0	0	0	112	N263 A264 P291 L292 F293 G316	I258-N263 VanDerWaalsContact CA-O 3.28Å; I258-N263 WeakPolarHBondContact CA-O 3.46Å; I258-A264 HydrophobicContact CG2-CB 4.11Å; I258-P291 VanDerWaalsContact CG2-CA 3.44Å; I258-P291 HydrophobicContact CG2-CB 3.59Å; I258-L292 VanDerWaalsContact CG1-C 3.44Å; I258-L292 WeakPolarHBondContact CG1-O 3.24Å; I258-L292 PolarHBondContact N-O 3Å; I258-F293 HydrophobicContact CD1-CD2 4.17Å; I258-F293 HydrophobicContact CD1-CE1 4.17Å; I258-F293 HydrophobicContact CD1-CE2 3.78Å; I258-F293 HydrophobicContact CD1-CZ 3.78Å; I258-F293 HydrophobicContact CG1-CD1 4.07Å; I258-F293 HydrophobicContact CG1-CD2 4.42Å; I258-F293 HydrophobicContact CG1-CE1 4.02Å; I258-F293 HydrophobicContact CG1-CE2 4.36Å; I258-F293 HydrophobicContact CG1-CG 4.27Å; I258-F293 HydrophobicContact CG1-CZ 4.16Å; I258-G316 VanDerWaalsContact CD1-C 3.5Å
259	D	92.5	Very high	87	Confident	26 Å²	26	42.4 Å²	42.4	14%	0.139	22%	0.217	C	C	.	.			trans	-94.3	-177.4	160.3	54.9	27.4	0	0	0	111.5	R248 E261 G262 N263 F293	R248-D259 IonicContact NH1-OD2 3.99Å; D259-E261 PolarHBondContact O-N 3.06Å; D259-E261 PolarHBondContact OD1-N 3.27Å; D259-G262 PolarHBondContact O-N 3.46Å; D259-G262 VanDerWaalsContact O-N 3.09Å; D259-G262 PolarHBondContact OD1-N 3.13Å; D259-N263 PolarHBondContact N-O 2.76Å; D259-N263 WeakPolarHBondContact OD1-CB 2.97Å; D259-N263 PolarHBondContact OD1-N 2.72Å; D259-N263 PolarHBondContact OD1-ND2 2.84Å; D259-N263 WeakPolarHBondContact OD2-CB 3.4Å; D259-N263 PolarHBondContact OD2-ND2 2.77Å; D259-N263 VanDerWaalsContact OD2-ND2 3.15Å; D259-F293 VanDerWaalsContact O-CE1 3.31Å; D259-F293 WeakPolarHBondContact O-CE1 3.28Å
260	E	91.6	Very high	87.4	Confident	169 Å²	169	41.2 Å²	41.2	79%	0.79	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.8	-178.2	-61.8	178.9	179.6	0	0	112.8	G262	E260-G262 VanDerWaalsContact C-N 3.31Å
261	E	91.9	Very high	88	Confident	144 Å²	144	40.3 Å²	40.3	67%	0.673	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-8.2	175.3	-64	175.8	-173.1	0	0	112.7	D259 N263	D259-E261 PolarHBondContact O-N 3.06Å; D259-E261 PolarHBondContact OD1-N 3.27Å; E261-N263 PolarHBondContact OE2-ND2 2.92Å; E261-N263 VanDerWaalsContact OE2-ND2 3.09Å
262	G	92.1	Very high	88.5	Confident	3 Å²	3	36.2 Å²	36.2	3%	0.031	17%	0.17	C	C	.	.			trans	84.6	13.5	-179.4	0	0	0	0	0	114.2	D259 E260 A264 H320	D259-G262 PolarHBondContact O-N 3.46Å; D259-G262 VanDerWaalsContact O-N 3.09Å; D259-G262 PolarHBondContact OD1-N 3.13Å; E260-G262 VanDerWaalsContact C-N 3.31Å; G262-A264 PolarHBondContact O-N 3.44Å; G262-H320 WeakPolarHBondContact O-CB 3.29Å; G262-H320 PolarHBondContact O-ND1 2.83Å
263	N	91.9	Very high	89.3	Confident	16 Å²	16	31 Å²	31	9%	0.086	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-74.4	124.2	173.7	-51	-60.8	0	0	0	109.3	Q247 R248 I258 D259 E261	Q247-N263 HydrophobicContact CB-CB 4.06Å; Q247-N263 VanDerWaalsContact CD-OD1 3.27Å; Q247-N263 PolarHBondContact NE2-OD1 3.39Å; Q247-N263 PolarHBondContact OE1-OD1 3.1Å; R248-N263 HydrophobicContact CB-CB 4.05Å; R248-N263 WeakPolarHBondContact CD-O 3.37Å; I258-N263 VanDerWaalsContact CA-O 3.28Å; I258-N263 WeakPolarHBondContact CA-O 3.46Å; D259-N263 PolarHBondContact N-O 2.76Å; D259-N263 WeakPolarHBondContact OD1-CB 2.97Å; D259-N263 PolarHBondContact OD1-N 2.72Å; D259-N263 PolarHBondContact OD1-ND2 2.84Å; D259-N263 WeakPolarHBondContact OD2-CB 3.4Å; D259-N263 PolarHBondContact OD2-ND2 2.77Å; D259-N263 VanDerWaalsContact OD2-ND2 3.15Å; E261-N263 PolarHBondContact OE2-ND2 2.92Å; E261-N263 VanDerWaalsContact OE2-ND2 3.09Å
264	A	91.5	Very high	89.7	Confident	4 Å²	4	28.7 Å²	28.7	3%	0.033	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-81.9	135.6	177.9	0	0	0	0	0	110.7	I258 G262 F267	I258-A264 HydrophobicContact CG2-CB 4.11Å; G262-A264 PolarHBondContact O-N 3.44Å; A264-F267 WeakPolarHBondContact O-CB 3.48Å; A264-F267 PolarHBondContact O-N 3.34Å
265	A	87.9	Confident	89.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	143.1	175.6	0	0	0	0	0	111.8	R248 T255 G257 F267 S289	R248-A265 HydrophobicContact CG-CB 4.15Å; R248-A265 WeakPolarHBondContact O-CA 3.33Å; T255-A265 HydrophobicContact CG2-CB 3.85Å; G257-A265 WeakPolarHBondContact O-CB 3.28Å; G257-A265 PolarHBondContact O-N 2.64Å; A265-F267 PolarHBondContact O-N 2.88Å; A265-S289 WeakPolarHBondContact O-CB 3.21Å; A265-S289 PolarHBondContact O-N 3.29Å
266	N	82.4	Confident	89.8	Confident	30 Å²	30	25.2 Å²	25.2	16%	0.16	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	37.2	179	-64.5	-45.2	0	0	0	113.7	R244 R248 G250 V268	R244-N266 PolarHBondContact NH2-OD1 3.47Å; R248-N266 PolarHBondContact O-N 2.87Å; G250-N266 PolarHBondContact O-OD1 3.11Å; G250-N266 VanDerWaalsContact O-OD1 3.08Å; N266-V268 PolarHBondContact O-N 3.3Å
267	F	89.7	Confident	89.2	Confident	9 Å²	9	28.3 Å²	28.3	4%	0.039	14%	0.141	C	C	.	.			trans	-65.3	132.6	173.8	-177	-88.7	0	0	0	110.7	F185 S245 A264 A265 E269 T286 R287 Y328	F185-F267 HydrophobicContact CE1-CD1 4.3Å; F185-F267 HydrophobicContact CE1-CE1 4.26Å; F185-F267 HydrophobicContact CZ-CE1 4.07Å; S245-F267 PolarHBondContact N-O 3.23Å; A264-F267 WeakPolarHBondContact O-CB 3.48Å; A264-F267 PolarHBondContact O-N 3.34Å; A265-F267 PolarHBondContact O-N 2.88Å; F267-E269 HydrophobicContact CE1-CB 4.33Å; F267-T286 HydrophobicContact CE1-CG2 4.31Å; F267-T286 HydrophobicContact CE2-CG2 4.03Å; F267-T286 HydrophobicContact CZ-CG2 3.48Å; F267-T286 VanDerWaalsContact CZ-CG2 3.48Å; F267-R287 CarbonylContact C-O 3.49Å; F267-R287 VanDerWaalsContact CA-O 3.29Å; F267-R287 WeakPolarHBondContact CA-O 3.3Å; F267-Y328 HydrophobicContact CZ-CE2 4.05Å
268	V	90.5	Very high	88.6	Confident	13 Å²	13	31.5 Å²	31.5	8%	0.079	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131	176.3	-176	0	0	0	0	108.8	R243 R244 N266 T286 R287	R243-V268 VanDerWaalsContact O-CA 3.3Å; R243-V268 WeakPolarHBondContact O-CA 3.19Å; R244-V268 HydrophobicContact CB-CG2 4.43Å; R244-V268 HydrophobicContact CG-CG2 4.22Å; N266-V268 PolarHBondContact O-N 3.3Å; V268-T286 WeakPolarHBondContact O-CA 3.35Å; V268-R287 HydrophobicContact CB-CG 3.79Å; V268-R287 HydrophobicContact CG2-CG 4.39Å; V268-R287 PolarHBondContact N-O 3.44Å; V268-R287 PolarHBondContact O-N 2.79Å
269	E	93.4	Very high	87.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.8	169.9	-177.1	-168.3	88.3	0	0	108.2	T161 R164 F185 S242 R243 F267 V284 T286 Y328	T161-E269 HydrophobicContact CG2-CG 4.42Å; T161-E269 WeakPolarHBondContact CG2-OE1 3.44Å; R164-E269 IonicContact CZ-OE2 3.72Å; R164-E269 IonicContact NH2-OE2 2.98Å; R164-E269 PolarHBondContact NH2-OE2 3.24Å; F185-E269 HydrophobicContact CE1-CB 3.96Å; F185-E269 HydrophobicContact CE2-CB 4.3Å; F185-E269 HydrophobicContact CZ-CB 3.5Å; F185-E269 VanDerWaalsContact CZ-CB 3.5Å; F185-E269 HydrophobicContact CZ-CG 4.29Å; S242-E269 CarbonylContact C-O 3.58Å; S242-E269 WeakPolarHBondContact CA-O 3.24Å; R243-E269 IonicContact CZ-OE1 3.44Å; R243-E269 PolarHBondContact N-O 3.24Å; R243-E269 IonicContact NE-OE1 2.69Å; R243-E269 IonicContact NH1-OE1 3.63Å; R243-E269 PolarHBondContact NH1-OE1 3.27Å; R243-E269 PolarHBondContact O-N 3.39Å; F267-E269 HydrophobicContact CE1-CB 4.33Å; E269-V284 HydrophobicContact CG-CG1 3.65Å; E269-T286 HydrophobicContact CB-CG2 4.44Å; E269-T286 HydrophobicContact CG-CG2 4.4Å; E269-Y328 HydrophobicContact CG-CE1 4.34Å; E269-Y328 WeakPolarHBondContact OE2-CE1 3.32Å; E269-Y328 VanDerWaalsContact OE2-CZ 3.26Å; E269-Y328 PolarHBondContact OE2-OH 3.44Å
270	T	91.4	Very high	87.4	Confident	14 Å²	14	36.6 Å²	36.6	9%	0.086	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	178.3	-61.5	0	0	0	0	109.4	L240 I241 S242 V284 Q285	L240-T270 HydrophobicContact CD1-CG2 3.61Å; L240-T270 HydrophobicContact CG-CG2 4.17Å; I241-T270 CarbonylContact O-C 3.56Å; I241-T270 VanDerWaalsContact O-CA 3.29Å; I241-T270 WeakPolarHBondContact O-CA 3.15Å; S242-T270 WeakPolarHBondContact OG-CG2 3.39Å; S242-T270 PolarHBondContact OG-OG1 3.17Å; T270-V284 CarbonylContact O-C 3.56Å; T270-V284 WeakPolarHBondContact O-CA 3.28Å; T270-Q285 PolarHBondContact N-O 2.84Å; T270-Q285 PolarHBondContact O-N 3.06Å
271	E	93.1	Very high	87.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.6	176.5	-177.3	174.6	-158.6	0	0	110.1	T161 L162 I241 R243 I273 S282 F283 V284	T161-E271 VanDerWaalsContact CA-OE2 3.25Å; T161-E271 WeakPolarHBondContact CA-OE2 3.26Å; L162-E271 WeakPolarHBondContact CB-OE1 3.02Å; L162-E271 PolarHBondContact N-OE1 2.92Å; I241-E271 PolarHBondContact N-O 3.34Å; I241-E271 PolarHBondContact O-N 2.99Å; R243-E271 IonicContact CZ-OE2 3.11Å; R243-E271 VanDerWaalsContact CZ-OE2 3.25Å; R243-E271 IonicContact NH1-OE2 3.93Å; R243-E271 PolarHBondContact NH1-OE2 2.91Å; R243-E271 IonicContact NH2-OE2 3.12Å; R243-E271 PolarHBondContact NH2-OE2 3.17Å; E271-I273 HydrophobicContact CG-CD1 4.33Å; E271-I273 HydrophobicContact CG-CG1 3.8Å; E271-S282 WeakPolarHBondContact CG-OG 3.29Å; E271-S282 WeakPolarHBondContact OE1-CB 3.28Å; E271-S282 PolarHBondContact OE1-OG 2.94Å; E271-F283 WeakPolarHBondContact CA-O 3.48Å; E271-V284 HydrophobicContact CB-CG2 4.15Å; E271-V284 HydrophobicContact CG-CG2 3.94Å
272	Q	90.5	Very high	86.9	Confident	21 Å²	21	24.2 Å²	24.2	10%	0.098	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.2	171.3	-176.7	-176.6	-60.6	0	0	108.3	L238 L240 S282 F283 G429	L238-Q272 HydrophobicContact CD1-CG 3.73Å; L240-Q272 HydrophobicContact CD1-CB 4.07Å; L240-Q272 HydrophobicContact CD1-CG 4.5Å; Q272-S282 CarbonylContact O-C 3.59Å; Q272-S282 WeakPolarHBondContact O-CA 3.25Å; Q272-F283 PolarHBondContact N-O 3.49Å; Q272-F283 PolarHBondContact O-N 3.49Å; Q272-G429 PolarHBondContact NE2-O 3.18Å; Q272-G429 PolarHBondContact OE1-O 3.08Å
273	I	90.3	Very high	86.9	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.4	177.3	-52	178	0	0	0	108.6	I103 L238 A239 I241 E271 L280 F281	I103-I273 HydrophobicContact CG2-CD1 4.38Å; L238-I273 WeakPolarHBondContact CA-O 3.38Å; A239-I273 HydrophobicContact CB-CB 4.23Å; A239-I273 PolarHBondContact N-O 3.12Å; A239-I273 PolarHBondContact O-N 3.3Å; I241-I273 HydrophobicContact CD1-CD1 3.85Å; E271-I273 HydrophobicContact CG-CD1 4.33Å; E271-I273 HydrophobicContact CG-CG1 3.8Å; I273-L280 HydrophobicContact CG2-CD2 3.67Å; I273-F281 CarbonylContact C-O 3.5Å; I273-F281 VanDerWaalsContact CA-O 3.25Å; I273-F281 WeakPolarHBondContact CA-O 3.46Å
274	V	87.8	Confident	87	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	115.9	177.3	-179.7	0	0	0	0	107.5	L236 L238 V276 L280 F281 L433	L236-V274 HydrophobicContact CD1-CG1 4.02Å; L236-V274 HydrophobicContact CD2-CG1 4.44Å; L236-V274 HydrophobicContact CG-CG1 4.12Å; L238-V274 HydrophobicContact CD1-CG2 3.73Å; V274-V276 HydrophobicContact CG1-CG2 3.77Å; V274-L280 WeakPolarHBondContact O-CA 3.49Å; V274-F281 HydrophobicContact CB-CB 4.26Å; V274-F281 HydrophobicContact CB-CD2 4.28Å; V274-F281 HydrophobicContact CG1-CD2 4.34Å; V274-F281 PolarHBondContact N-O 2.83Å; V274-F281 PolarHBondContact O-N 3.34Å; V274-L433 HydrophobicContact CB-CD1 4.48Å; V274-L433 HydrophobicContact CG1-CD1 4.2Å; V274-L433 HydrophobicContact CG2-CD1 3.5Å; V274-L433 VanDerWaalsContact CG2-CD1 3.5Å
275	E	86	Confident	87	Confident	50 Å²	50	24.3 Å²	24.3	23%	0.234	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.8	175.3	-171.4	-170.9	154.5	0	0	108.7	K237 F279 L280	K237-E275 HydrophobicContact CB-CB 4.14Å; K237-E275 WeakPolarHBondContact CD-OE2 3.41Å; K237-E275 WeakPolarHBondContact CE-OE2 3.35Å; K237-E275 PolarHBondContact N-O 3.01Å; K237-E275 IonicContact NZ-OE1 2.62Å; K237-E275 IonicContact NZ-OE2 3.7Å; K237-E275 PolarHBondContact NZ-OE2 2.82Å; K237-E275 PolarHBondContact O-N 3.1Å; E275-F279 WeakPolarHBondContact CA-O 3.28Å; E275-L280 HydrophobicContact CB-CD2 3.53Å; E275-L280 HydrophobicContact CB-CG 4.34Å; E275-L280 HydrophobicContact CG-CD2 3.74Å; E275-L280 HydrophobicContact CG-CG 4.13Å
276	V	81.7	Confident	87.3	Confident	9 Å²	9	24.3 Å²	24.3	6%	0.055	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	124.2	178.6	-171.5	0	0	0	0	108.8	R234 L236 V274 G278 F279	R234-V276 HydrophobicContact CB-CG1 4.48Å; L236-V276 HydrophobicContact CB-CG2 4.03Å; L236-V276 HydrophobicContact CD1-CG2 3.64Å; L236-V276 HydrophobicContact CG-CG2 3.62Å; V274-V276 HydrophobicContact CG1-CG2 3.77Å; V276-G278 PolarHBondContact O-N 3.34Å; V276-G278 VanDerWaalsContact O-N 3.11Å; V276-F279 PolarHBondContact N-O 3.46Å; V276-F279 WeakPolarHBondContact O-CB 3.35Å; V276-F279 PolarHBondContact O-N 2.92Å
277	D	75.4	Confident	87.6	Confident	78 Å²	78	25 Å²	25	42%	0.417	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	35.5	177.1	-61.1	-18.4	0	0	0	113.8	R234 F279	R234-D277 WeakPolarHBondContact CD-OD2 3.32Å; R234-D277 IonicContact CZ-OD2 3.94Å; R234-D277 IonicContact NE-OD2 3.95Å; R234-D277 PolarHBondContact NE-OD2 3.41Å; R234-D277 IonicContact NH2-OD2 3.19Å; D277-F279 VanDerWaalsContact C-N 3.26Å; D277-F279 PolarHBondContact O-N 3.38Å
278	G	75.6	Confident	87.5	Confident	68 Å²	68	24.5 Å²	24.5	70%	0.701	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	-6.8	-177.5	0	0	0	0	0	115.3	V276	V276-G278 PolarHBondContact O-N 3.34Å; V276-G278 VanDerWaalsContact O-N 3.11Å
279	F	77.9	Confident	87.4	Confident	93 Å²	93	24.2 Å²	24.2	41%	0.408	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.1	171.3	-64.6	-88.5	0	0	0	110.6	E275 V276 D277 F281 F440	E275-F279 WeakPolarHBondContact CA-O 3.28Å; V276-F279 PolarHBondContact N-O 3.46Å; V276-F279 WeakPolarHBondContact O-CB 3.35Å; V276-F279 PolarHBondContact O-N 2.92Å; D277-F279 VanDerWaalsContact C-N 3.26Å; D277-F279 PolarHBondContact O-N 3.38Å; F279-F281 HydrophobicContact CB-CE2 3.97Å; F279-F281 HydrophobicContact CB-CZ 4.13Å; F279-F440 AromaticContact CD2-CE2 3.67Å; F279-F440 HydrophobicContact CD2-CE2 3.67Å; F279-F440 HydrophobicContact CD2-CZ 4.5Å; F279-F440 HydrophobicContact CE2-CE2 4.03Å; F279-F440 HydrophobicContact CG-CE2 4.29Å
280	L	82.5	Confident	87.2	Confident	44 Å²	44	24.2 Å²	24.2	23%	0.23	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.4	-179.7	-79.9	153.6	0	0	0	110.7	Y104 L162 I273 V274 E275	Y104-L280 HydrophobicContact CD1-CD1 3.76Å; Y104-L280 HydrophobicContact CD2-CD1 4.44Å; Y104-L280 HydrophobicContact CE1-CD1 3.07Å; Y104-L280 HydrophobicContact CE2-CD1 3.85Å; Y104-L280 HydrophobicContact CG-CD1 4.39Å; Y104-L280 WeakPolarHBondContact OH-CD1 3.49Å; L162-L280 HydrophobicContact CD2-CB 4.27Å; I273-L280 HydrophobicContact CG2-CD2 3.67Å; V274-L280 WeakPolarHBondContact O-CA 3.49Å; E275-L280 HydrophobicContact CB-CD2 3.53Å; E275-L280 HydrophobicContact CB-CG 4.34Å; E275-L280 HydrophobicContact CG-CD2 3.74Å; E275-L280 HydrophobicContact CG-CG 4.13Å
281	F	85.3	Confident	87.3	Confident	28 Å²	28	23.6 Å²	23.6	12%	0.123	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128	174.2	-51.1	-86.5	0	0	0	108.2	I273 V274 F279 Q436 F440	I273-F281 CarbonylContact C-O 3.5Å; I273-F281 VanDerWaalsContact CA-O 3.25Å; I273-F281 WeakPolarHBondContact CA-O 3.46Å; V274-F281 HydrophobicContact CB-CB 4.26Å; V274-F281 HydrophobicContact CB-CD2 4.28Å; V274-F281 HydrophobicContact CG1-CD2 4.34Å; V274-F281 PolarHBondContact N-O 2.83Å; V274-F281 PolarHBondContact O-N 3.34Å; F279-F281 HydrophobicContact CB-CE2 3.97Å; F279-F281 HydrophobicContact CB-CZ 4.13Å; F281-Q436 HydrophobicContact CB-CB 4.45Å; F281-Q436 HydrophobicContact CB-CG 4Å; F281-Q436 HydrophobicContact CD1-CB 4.44Å; F281-Q436 HydrophobicContact CD1-CG 4.34Å; F281-Q436 HydrophobicContact CG-CB 4.3Å; F281-Q436 HydrophobicContact CG-CG 4.27Å; F281-F440 HydrophobicContact CZ-CD2 4.39Å
282	S	88.9	Confident	87.4	Confident	25 Å²	25	23.6 Å²	23.6	18%	0.175	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.4	169.8	170.9	0	0	0	0	109.6	E271 Q272	E271-S282 WeakPolarHBondContact CG-OG 3.29Å; E271-S282 WeakPolarHBondContact OE1-CB 3.28Å; E271-S282 PolarHBondContact OE1-OG 2.94Å; Q272-S282 CarbonylContact O-C 3.59Å; Q272-S282 WeakPolarHBondContact O-CA 3.25Å
283	F	91.1	Very high	87.6	Confident	7 Å²	7	24 Å²	24	3%	0.031	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	124	171.7	177.1	-113.4	0	0	0	109.8	E271 Q272 Q285 Q406 F410 I428 A432	E271-F283 WeakPolarHBondContact CA-O 3.48Å; Q272-F283 PolarHBondContact N-O 3.49Å; Q272-F283 PolarHBondContact O-N 3.49Å; F283-Q285 HydrophobicContact CD1-CG 4.16Å; F283-Q285 HydrophobicContact CE1-CG 3.46Å; F283-Q285 VanDerWaalsContact CE1-CG 3.46Å; F283-Q285 VanDerWaalsContact CE1-NE2 3.34Å; F283-Q285 HydrophobicContact CZ-CG 3.81Å; F283-Q406 VanDerWaalsContact CD2-OE1 3.23Å; F283-F410 HydrophobicContact CE2-CD2 4.49Å; F283-F410 AromaticContact CZ-CD2 3.96Å; F283-F410 HydrophobicContact CZ-CD2 3.96Å; F283-F410 HydrophobicContact CZ-CE2 4.22Å; F283-I428 HydrophobicContact CE1-CG2 3.91Å; F283-I428 HydrophobicContact CZ-CG2 3.83Å; F283-A432 HydrophobicContact CB-CB 4.41Å; F283-A432 HydrophobicContact CD1-CB 3.42Å; F283-A432 VanDerWaalsContact CD1-CB 3.42Å; F283-A432 HydrophobicContact CD2-CB 4.03Å; F283-A432 HydrophobicContact CE1-CB 3.47Å; F283-A432 VanDerWaalsContact CE1-CB 3.47Å; F283-A432 HydrophobicContact CE2-CB 4.11Å; F283-A432 HydrophobicContact CG-CB 3.69Å; F283-A432 HydrophobicContact CZ-CB 3.84Å
284	V	93.7	Very high	87.8	Confident	9 Å²	9	24 Å²	24	6%	0.055	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.1	-173.2	-177.4	0	0	0	0	110.8	T161 E269 T270 E271 Y328 Q406 L409	T161-V284 HydrophobicContact CG2-CG1 4.34Å; T161-V284 HydrophobicContact CG2-CG2 3.78Å; E269-V284 HydrophobicContact CG-CG1 3.65Å; T270-V284 CarbonylContact O-C 3.56Å; T270-V284 WeakPolarHBondContact O-CA 3.28Å; E271-V284 HydrophobicContact CB-CG2 4.15Å; E271-V284 HydrophobicContact CG-CG2 3.94Å; V284-Y328 HydrophobicContact CG1-CE1 4.47Å; V284-Q406 PolarHBondContact O-NE2 2.64Å; V284-L409 HydrophobicContact CG1-CD2 4.45Å
285	Q	92.6	Very high	88	Confident	8 Å²	8	25.4 Å²	25.4	4%	0.037	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	152.2	171.7	-60.7	-178.3	66.7	0	0	109.6	T270 F283 F410 Q425	T270-Q285 PolarHBondContact N-O 2.84Å; T270-Q285 PolarHBondContact O-N 3.06Å; F283-Q285 HydrophobicContact CD1-CG 4.16Å; F283-Q285 HydrophobicContact CE1-CG 3.46Å; F283-Q285 VanDerWaalsContact CE1-CG 3.46Å; F283-Q285 VanDerWaalsContact CE1-NE2 3.34Å; F283-Q285 HydrophobicContact CZ-CG 3.81Å; Q285-F410 HydrophobicContact CG-CB 4.49Å; Q285-Q425 PolarHBondContact NE2-O 2.59Å
286	T	93.4	Very high	88.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.7	174.8	61.7	0	0	0	0	110.9	F267 V268 E269 Y328 L409 F410 R411 T412 Q425	F267-T286 HydrophobicContact CE1-CG2 4.31Å; F267-T286 HydrophobicContact CE2-CG2 4.03Å; F267-T286 HydrophobicContact CZ-CG2 3.48Å; F267-T286 VanDerWaalsContact CZ-CG2 3.48Å; V268-T286 WeakPolarHBondContact O-CA 3.35Å; E269-T286 HydrophobicContact CB-CG2 4.44Å; E269-T286 HydrophobicContact CG-CG2 4.4Å; T286-Y328 HydrophobicContact CG2-CE1 4.36Å; T286-Y328 HydrophobicContact CG2-CE2 4Å; T286-L409 HydrophobicContact CG2-CD1 4.24Å; T286-L409 HydrophobicContact CG2-CD2 3.6Å; T286-L409 VanDerWaalsContact OG1-CD1 3.29Å; T286-L409 WeakPolarHBondContact OG1-CD1 3.42Å; T286-F410 PolarHBondContact N-O 3Å; T286-R411 CarbonylContact O-C 3.48Å; T286-R411 WeakPolarHBondContact O-CA 3.44Å; T286-T412 PolarHBondContact O-N 3.13Å; T286-Q425 PolarHBondContact O-NE2 2.79Å
287	R	89.2	Confident	88.4	Confident	44 Å²	44	28.8 Å²	28.8	17%	0.166	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	158.8	168.2	59.4	167.4	178.6	-144.1	14.8	110.1	F267 V268 T412 C417 T421 Q425	F267-R287 CarbonylContact C-O 3.49Å; F267-R287 VanDerWaalsContact CA-O 3.29Å; F267-R287 WeakPolarHBondContact CA-O 3.3Å; V268-R287 HydrophobicContact CB-CG 3.79Å; V268-R287 HydrophobicContact CG2-CG 4.39Å; V268-R287 PolarHBondContact N-O 3.44Å; V268-R287 PolarHBondContact O-N 2.79Å; R287-T412 WeakPolarHBondContact CA-O 3.26Å; R287-T412 WeakPolarHBondContact CB-O 3.39Å; R287-C417 HydrophobicContact CB-CB 4.43Å; R287-T421 HydrophobicContact CB-CG2 4.49Å; R287-Q425 VanDerWaalsContact CD-OE1 3.27Å
288	G	86.9	Confident	88.8	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.3	-178.5	172.5	0	0	0	0	0	111.6
289	S	87.9	Confident	89.3	Confident	6 Å²	6	30 Å²	30	4%	0.042	15%	0.151	C	C	.	.	S	Bend	trans	-60.1	153.9	171.7	-160	0	0	0	0	111.2	G257 A265 W294 R411	G257-S289 PolarHBondContact N-OG 3Å; G257-S289 VanDerWaalsContact N-OG 3.1Å; A265-S289 WeakPolarHBondContact O-CB 3.21Å; A265-S289 PolarHBondContact O-N 3.29Å; S289-W294 WeakPolarHBondContact OG-CZ2 3.41Å; S289-R411 PolarHBondContact O-NH2 2.73Å
290	V	90.8	Very high	89.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.			trans	-56.7	124.6	171.6	-176.9	0	0	0	0	108.2	L292 W294 L337 I346 F350 N413	V290-L292 HydrophobicContact CG1-CD1 4.12Å; V290-L292 HydrophobicContact CG1-CG 4.2Å; V290-L292 PolarHBondContact O-N 2.99Å; V290-W294 PolarHBondContact O-NE1 3.4Å; V290-L337 HydrophobicContact CG2-CD1 3.77Å; V290-L337 HydrophobicContact CG2-CD2 3.92Å; V290-L337 HydrophobicContact CG2-CG 4.21Å; V290-I346 HydrophobicContact CB-CG2 4.1Å; V290-I346 HydrophobicContact CG1-CG2 3.86Å; V290-I346 HydrophobicContact CG2-CG2 4.11Å; V290-F350 HydrophobicContact CG1-CB 3.83Å; V290-F350 HydrophobicContact CG1-CD1 3.94Å; V290-F350 HydrophobicContact CG1-CD2 3.88Å; V290-F350 HydrophobicContact CG1-CE1 4.48Å; V290-F350 HydrophobicContact CG1-CE2 4.46Å; V290-F350 HydrophobicContact CG1-CG 3.6Å; V290-N413 HydrophobicContact CG2-CB 4.46Å
291	P	92.9	Very high	89.7	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.013	19%	0.19	C	C	.	.	S	Bend	trans	-80.6	62.7	-169.6	33.7	-36.9	0	0	0	112.1	I258 I317 H320 F350 N413	I258-P291 VanDerWaalsContact CG2-CA 3.44Å; I258-P291 HydrophobicContact CG2-CB 3.59Å; P291-I317 WeakPolarHBondContact O-CG1 3.4Å; P291-H320 HydrophobicContact CB-CB 4.33Å; P291-F350 HydrophobicContact CG-CD2 4.33Å; P291-F350 HydrophobicContact CG-CE2 3.47Å; P291-F350 VanDerWaalsContact CG-CE2 3.47Å; P291-F350 HydrophobicContact CG-CZ 3.91Å; P291-N413 WeakPolarHBondContact CD-ND2 3.39Å
292	L	94.5	Very high	89.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-122.6	158.2	172.5	-70.3	173.7	0	0	0	109.4	G257 I258 V290 W294 H313 I317 I346 K349 F350	G257-L292 CarbonylContact C-O 3.34Å; G257-L292 WeakPolarHBondContact CA-O 3.27Å; I258-L292 VanDerWaalsContact CG1-C 3.44Å; I258-L292 WeakPolarHBondContact CG1-O 3.24Å; I258-L292 PolarHBondContact N-O 3Å; V290-L292 HydrophobicContact CG1-CD1 4.12Å; V290-L292 HydrophobicContact CG1-CG 4.2Å; V290-L292 PolarHBondContact O-N 2.99Å; L292-W294 PolarHBondContact O-N 3.18Å; L292-H313 HydrophobicContact CD2-CB 3.86Å; L292-I317 HydrophobicContact CD2-CD1 3.67Å; L292-I317 HydrophobicContact CD2-CG1 4.25Å; L292-I346 HydrophobicContact CD1-CG2 4.27Å; L292-K349 HydrophobicContact CD1-CB 4.1Å; L292-K349 HydrophobicContact CD1-CG 4.05Å; L292-K349 HydrophobicContact CD2-CG 4.46Å; L292-F350 HydrophobicContact CD1-CB 3.78Å; L292-F350 HydrophobicContact CG-CB 4.38Å; L292-F350 HydrophobicContact CG-CD2 4.28Å
293	F	94.9	Very high	89	Confident	28 Å²	28	48 Å²	48	12%	0.123	24%	0.235	C	C	.	.	S	Bend	trans	-72.8	92.2	165.5	-61.9	-74.6	0	0	0	110	I258 D259 L309 A311 N312 H313	I258-F293 HydrophobicContact CD1-CD2 4.17Å; I258-F293 HydrophobicContact CD1-CE1 4.17Å; I258-F293 HydrophobicContact CD1-CE2 3.78Å; I258-F293 HydrophobicContact CD1-CZ 3.78Å; I258-F293 HydrophobicContact CG1-CD1 4.07Å; I258-F293 HydrophobicContact CG1-CD2 4.42Å; I258-F293 HydrophobicContact CG1-CE1 4.02Å; I258-F293 HydrophobicContact CG1-CE2 4.36Å; I258-F293 HydrophobicContact CG1-CG 4.27Å; I258-F293 HydrophobicContact CG1-CZ 4.16Å; D259-F293 VanDerWaalsContact O-CE1 3.31Å; D259-F293 WeakPolarHBondContact O-CE1 3.28Å; F293-L309 HydrophobicContact CB-CB 4.26Å; F293-L309 WeakPolarHBondContact O-CB 3.48Å; F293-L309 PolarHBondContact O-N 3.41Å; F293-A311 HydrophobicContact CB-CB 3.75Å; F293-A311 HydrophobicContact CD2-CB 3.72Å; F293-A311 HydrophobicContact CE2-CB 4.5Å; F293-A311 HydrophobicContact CG-CB 3.76Å; F293-N312 WeakPolarHBondContact CE2-O 3.48Å; F293-H313 AromaticContact CD2-ND1 3.94Å; F293-H313 PolarHBondContact N-ND1 3.02Å; F293-H313 PolarHBondContact O-CE1 3.37Å; F293-H313 VanDerWaalsContact O-CE1 3.28Å
294	W	94.5	Very high	88.6	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	156.7	179	71.1	-80	0	0	0	111.2	R256 G257 S289 V290 L292 Q296 P306 K307 I346 M415	R256-W294 CarbonylContact C-O 3.58Å; R256-W294 HydrophobicContact CB-CD2 4.32Å; R256-W294 HydrophobicContact CB-CE3 4.36Å; R256-W294 HydrophobicContact CB-CH2 4.19Å; R256-W294 HydrophobicContact CB-CZ2 4.08Å; R256-W294 HydrophobicContact CB-CZ3 4.31Å; R256-W294 HydrophobicContact CG-CH2 4.27Å; R256-W294 HydrophobicContact CG-CZ3 4.47Å; G257-W294 VanDerWaalsContact CA-CD1 3.47Å; G257-W294 VanDerWaalsContact CA-NE1 3.33Å; S289-W294 WeakPolarHBondContact OG-CZ2 3.41Å; V290-W294 PolarHBondContact O-NE1 3.4Å; L292-W294 PolarHBondContact O-N 3.18Å; W294-Q296 HydrophobicContact CZ3-CB 4.16Å; W294-P306 HydrophobicContact CE3-CB 4.12Å; W294-P306 HydrophobicContact CZ3-CB 4.09Å; W294-K307 CarbonylContact C-O 3.55Å; W294-K307 VanDerWaalsContact CA-O 3.3Å; W294-K307 WeakPolarHBondContact CA-O 3.34Å; W294-K307 WeakPolarHBondContact CB-O 3.26Å; W294-I346 HydrophobicContact CB-CD1 4.32Å; W294-I346 HydrophobicContact CD2-CD1 3.52Å; W294-I346 HydrophobicContact CE3-CD1 3.29Å; W294-I346 HydrophobicContact CG-CD1 3.99Å; W294-I346 HydrophobicContact CH2-CD1 4.25Å; W294-I346 HydrophobicContact CZ2-CD1 4.48Å; W294-I346 HydrophobicContact CZ3-CD1 3.69Å; W294-M415 HydrophobicContact CE3-CE 4.24Å; W294-M415 HydrophobicContact CH2-CE 3.01Å; W294-M415 HydrophobicContact CH2-CG 4.07Å; W294-M415 HydrophobicContact CH2-SD 3.87Å; W294-M415 HydrophobicContact CZ2-CE 3.54Å; W294-M415 HydrophobicContact CZ3-CE 3.45Å; W294-M415 VanDerWaalsContact CZ3-CE 3.45Å; W294-M415 HydrophobicContact CZ3-SD 4.08Å
295	T	91.6	Very high	88.3	Confident	31 Å²	31	55.3 Å²	55.3	19%	0.19	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.2	-178.1	-166.3	0	0	0	0	111.6	K297 K307 L309	T295-K297 WeakPolarHBondContact OG1-CG 3.27Å; T295-K307 HydrophobicContact CG2-CB 4.27Å; T295-K307 PolarHBondContact N-O 3Å; T295-K307 PolarHBondContact O-N 2.78Å; T295-L309 HydrophobicContact CG2-CD2 3.89Å
296	Q	88.9	Confident	88.3	Confident	4 Å²	4	56 Å²	56	2%	0.019	27%	0.267	C	S	.	.			trans	-149	59.7	176.2	-168.1	-178.6	23.5	0	0	108.3	F253 R256 W294 P304	F253-Q296 WeakPolarHBondContact CB-O 3.36Å; F253-Q296 HydrophobicContact CD1-CG 4.24Å; F253-Q296 CarbonylContact O-C 3.39Å; F253-Q296 VanDerWaalsContact O-O 3.09Å; R256-Q296 VanDerWaalsContact NH2-OE1 3.09Å; W294-Q296 HydrophobicContact CZ3-CB 4.16Å; Q296-P304 HydrophobicContact CG-CB 3.95Å; Q296-P304 HydrophobicContact CG-CG 4.49Å; Q296-P304 PolarHBondContact NE2-O 2.84Å
297	K	87.9	Confident	88.2	Confident	126 Å²	126	62.5 Å²	62.5	55%	0.548	30%	0.295	S	S	.	.			trans	-63.3	146.7	-176	-64.5	-160.3	176.6	-175.4	0	111.5	F253 T295 N299 P304	F253-K297 WeakPolarHBondContact O-CA 2.93Å; T295-K297 WeakPolarHBondContact OG1-CG 3.27Å; K297-N299 PolarHBondContact O-N 3.47Å; K297-P304 VanDerWaalsContact O-CB 3.31Å; K297-P304 WeakPolarHBondContact O-CB 3.12Å; K297-P304 VanDerWaalsContact O-CG 3.3Å; K297-P304 WeakPolarHBondContact O-CG 3.22Å
298	P	85.2	Confident	88.4	Confident	83 Å²	83	62.1 Å²	62.1	54%	0.539	30%	0.298	S	S	.	.			trans	-55.9	133.6	173.1	-22.3	33.1	0	0	0	111.4	F253	F253-P298 HydrophobicContact CB-CG 3.74Å
299	N	86.1	Confident	88.7	Confident	87 Å²	87	65.4 Å²	65.4	47%	0.465	32%	0.315	S	S	.	.			trans	-137.3	28.4	177.2	69.8	-15.7	0	0	0	111.6	K297 C301 P304	K297-N299 PolarHBondContact O-N 3.47Å; N299-C301 PolarHBondContact O-N 2.85Å; N299-C301 WeakPolarHBondContact OD1-CB 3.33Å; N299-C301 PolarHBondContact OD1-N 2.74Å; N299-C301 PolarHBondContact OD1-SG 2.69Å; N299-P304 WeakPolarHBondContact OD1-CB 3.18Å; N299-P304 WeakPolarHBondContact OD1-CG 3.48Å
300	L	84.5	Confident	88.9	Confident	183 Å²	183	73.6 Å²	73.6	96%	0.958	36%	0.359	S	S	*	.	S	Bend	trans	64.9	-8.7	-173.6	-53	172.7	0	0	0	115.7
301	C	83.1	Confident	88.9	Confident	73 Å²	73	75.5 Å²	75.5	49%	0.493	37%	0.374	S	S	.	.	S	Bend	trans	-70.5	144.5	169.4	-58.8	0	0	0	0	110.7	N299 Q303	N299-C301 PolarHBondContact O-N 2.85Å; N299-C301 WeakPolarHBondContact OD1-CB 3.33Å; N299-C301 PolarHBondContact OD1-N 2.74Å; N299-C301 PolarHBondContact OD1-SG 2.69Å; C301-Q303 PolarHBondContact O-N 2.9Å
302	W	77.5	Confident	89	Confident	248 Å²	248	79.7 Å²	79.7	94%	0.939	40%	0.396	S	S	*	.	S	Bend	trans	-46.8	-39.7	174.8	176.2	-101.5	0	0	0	113.3
303	Q	81.5	Confident	89	Confident	64 Å²	64	80.3 Å²	80.3	30%	0.299	40%	0.399	S	S	.	.	S	Bend	trans	-144.5	108.8	172	-170.5	179.7	26.7	0	0	108.4	C301 R342	C301-Q303 PolarHBondContact O-N 2.9Å; Q303-R342 PolarHBondContact O-NH1 2.88Å
304	P	84.1	Confident	88.9	Confident	4 Å²	4	80.4 Å²	80.4	3%	0.026	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-61.7	158	176.6	-18.7	28.8	0	0	0	111.4	Q296 K297 N299	Q296-P304 HydrophobicContact CG-CB 3.95Å; Q296-P304 HydrophobicContact CG-CG 4.49Å; Q296-P304 PolarHBondContact NE2-O 2.84Å; K297-P304 VanDerWaalsContact O-CB 3.31Å; K297-P304 WeakPolarHBondContact O-CB 3.12Å; K297-P304 VanDerWaalsContact O-CG 3.3Å; K297-P304 WeakPolarHBondContact O-CG 3.22Å; N299-P304 WeakPolarHBondContact OD1-CB 3.18Å; N299-P304 WeakPolarHBondContact OD1-CG 3.48Å
305	W	87.1	Confident	88.9	Confident	167 Å²	167	84.3 Å²	84.3	63%	0.633	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-78.7	135.9	175	-79	89.1	0	0	0	111	K307 R342	W305-K307 PolarHBondContact O-N 3.28Å; W305-R342 HydrophobicContact CD2-CG 4.4Å; W305-R342 HydrophobicContact CE3-CB 3.91Å; W305-R342 HydrophobicContact CE3-CG 3.8Å; W305-R342 HydrophobicContact CH2-CB 4.45Å; W305-R342 HydrophobicContact CH2-CG 3.65Å; W305-R342 HydrophobicContact CZ2-CG 4.23Å; W305-R342 HydrophobicContact CZ3-CB 3.73Å; W305-R342 HydrophobicContact CZ3-CG 3.41Å; W305-R342 VanDerWaalsContact CZ3-CG 3.41Å
306	P	91.2	Very high	89	Confident	21 Å²	21	82.9 Å²	82.9	14%	0.136	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-65.3	134.7	172.1	24.8	-30.1	0	0	0	110.5	W294 R342 I346	W294-P306 HydrophobicContact CE3-CB 4.12Å; W294-P306 HydrophobicContact CZ3-CB 4.09Å; P306-R342 HydrophobicContact CG-CB 4.2Å; P306-R342 VanDerWaalsContact CG-O 3.24Å; P306-R342 WeakPolarHBondContact CG-O 3.46Å; P306-I346 HydrophobicContact CB-CD1 3.41Å; P306-I346 VanDerWaalsContact CB-CD1 3.41Å; P306-I346 HydrophobicContact CB-CG1 4.4Å; P306-I346 HydrophobicContact CG-CD1 4.2Å
307	K	91.5	Very high	89.3	Confident	137 Å²	137	82.7 Å²	82.7	60%	0.596	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.8	175.4	-178.9	176.1	178.9	-179.4	0	109.4	W294 T295 W305	W294-K307 CarbonylContact C-O 3.55Å; W294-K307 VanDerWaalsContact CA-O 3.3Å; W294-K307 WeakPolarHBondContact CA-O 3.34Å; W294-K307 WeakPolarHBondContact CB-O 3.26Å; T295-K307 HydrophobicContact CG2-CB 4.27Å; T295-K307 PolarHBondContact N-O 3Å; T295-K307 PolarHBondContact O-N 2.78Å; W305-K307 PolarHBondContact O-N 3.28Å
308	V	93.5	Very high	89.6	Confident	37 Å²	37	81.4 Å²	81.4	22%	0.224	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.1	165.9	-176.5	0	0	0	0	107.4	H313 I346 K349	V308-H313 WeakPolarHBondContact CG1-CE1 3.2Å; V308-H313 VanDerWaalsContact CG1-NE2 3.33Å; V308-H313 WeakPolarHBondContact CG1-NE2 3.21Å; V308-I346 HydrophobicContact CG2-CG1 3.88Å; V308-K349 HydrophobicContact CG1-CG 4.36Å
309	L	93.7	Very high	90	Very high	69 Å²	69	82.8 Å²	82.8	36%	0.361	40%	0.397	S	S	.	.			trans	-82.4	150.4	-179.8	-59.4	176.8	0	0	0	109.8	F293 T295 A311 H313	F293-L309 HydrophobicContact CB-CB 4.26Å; F293-L309 WeakPolarHBondContact O-CB 3.48Å; F293-L309 PolarHBondContact O-N 3.41Å; T295-L309 HydrophobicContact CG2-CD2 3.89Å; L309-A311 PolarHBondContact O-N 3.17Å; L309-H313 PolarHBondContact O-CE1 3.31Å; L309-H313 VanDerWaalsContact O-CE1 3.3Å; L309-H313 PolarHBondContact O-NE2 3.37Å
310	D	91.9	Very high	90.4	Very high	178 Å²	178	78.8 Å²	78.8	95%	0.952	38%	0.376	S	S	*	.	S	Bend	trans	-77.6	91.9	171.6	-170.1	19.2	0	0	0	108.9
311	A	92	Very high	90.9	Very high	39 Å²	39	70.1 Å²	70.1	32%	0.322	33%	0.33	S	S	.	.	S	Bend	trans	-148.9	166.2	-176	0	0	0	0	0	110.6	F293 L309 H313	F293-A311 HydrophobicContact CB-CB 3.75Å; F293-A311 HydrophobicContact CD2-CB 3.72Å; F293-A311 HydrophobicContact CE2-CB 4.5Å; F293-A311 HydrophobicContact CG-CB 3.76Å; L309-A311 PolarHBondContact O-N 3.17Å; A311-H313 VanDerWaalsContact C-N 3.26Å; A311-H313 PolarHBondContact O-CD2 3.07Å; A311-H313 PolarHBondContact O-N 3.39Å
312	N	93.6	Very high	91.3	Very high	90 Å²	90	71.8 Å²	71.8	48%	0.481	33%	0.329	S	S	.	.			trans	-75.5	76.1	178.8	-168.3	-12.9	0	0	0	112	F293 L314 Q315 G316	F293-N312 WeakPolarHBondContact CE2-O 3.48Å; N312-L314 PolarHBondContact O-N 2.85Å; N312-L314 PolarHBondContact OD1-N 3.06Å; N312-Q315 HydrophobicContact CB-CB 4.24Å; N312-Q315 PolarHBondContact ND2-OE1 2.75Å; N312-Q315 VanDerWaalsContact ND2-OE1 3.13Å; N312-Q315 PolarHBondContact O-N 3.02Å; N312-Q315 PolarHBondContact OD1-N 2.88Å; N312-Q315 VanDerWaalsContact OD1-N 3.13Å; N312-G316 PolarHBondContact O-N 3.17Å; N312-G316 VanDerWaalsContact O-N 3.12Å
313	H	94.5	Very high	92.1	Very high	14 Å²	14	61.8 Å²	61.8	7%	0.065	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-35.9	179.3	-60.9	-75	0	0	0	113.6	L292 F293 V308 L309 A311 G316 I317 T353	L292-H313 HydrophobicContact CD2-CB 3.86Å; F293-H313 AromaticContact CD2-ND1 3.94Å; F293-H313 PolarHBondContact N-ND1 3.02Å; F293-H313 PolarHBondContact O-CE1 3.37Å; F293-H313 VanDerWaalsContact O-CE1 3.28Å; V308-H313 WeakPolarHBondContact CG1-CE1 3.2Å; V308-H313 VanDerWaalsContact CG1-NE2 3.33Å; V308-H313 WeakPolarHBondContact CG1-NE2 3.21Å; L309-H313 PolarHBondContact O-CE1 3.31Å; L309-H313 VanDerWaalsContact O-CE1 3.3Å; L309-H313 PolarHBondContact O-NE2 3.37Å; A311-H313 VanDerWaalsContact C-N 3.26Å; A311-H313 PolarHBondContact O-CD2 3.07Å; A311-H313 PolarHBondContact O-N 3.39Å; H313-G316 PolarHBondContact O-N 3.02Å; H313-I317 WeakPolarHBondContact O-CB 3.4Å; H313-I317 WeakPolarHBondContact O-CG1 3.34Å; H313-I317 PolarHBondContact O-N 3.12Å; H313-T353 HydrophobicContact CB-CG2 4.07Å
314	L	94.2	Very high	92.6	Very high	30 Å²	30	58.9 Å²	58.9	16%	0.157	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-45.7	-178.9	-179.1	64.2	0	0	0	110.7	N312 R318 T353 E356 A357	N312-L314 PolarHBondContact O-N 2.85Å; N312-L314 PolarHBondContact OD1-N 3.06Å; L314-R318 WeakPolarHBondContact O-CB 2.93Å; L314-R318 WeakPolarHBondContact O-CG 3.39Å; L314-R318 PolarHBondContact O-N 3.17Å; L314-T353 HydrophobicContact CB-CG2 4.16Å; L314-T353 HydrophobicContact CD1-CG2 4.16Å; L314-E356 HydrophobicContact CD1-CB 4.13Å; L314-E356 HydrophobicContact CD1-CG 3.94Å; L314-E356 HydrophobicContact CD2-CG 4.13Å; L314-A357 HydrophobicContact CD1-CB 3.97Å
315	Q	94	Very high	93	Very high	85 Å²	85	60.7 Å²	60.7	40%	0.397	29%	0.291	S	S	.	.	H	α-helix	trans	-65.9	-45.5	176.7	-174.6	171.7	11.5	0	0	111.8	N312 I317 R318 Y319	N312-Q315 HydrophobicContact CB-CB 4.24Å; N312-Q315 PolarHBondContact ND2-OE1 2.75Å; N312-Q315 VanDerWaalsContact ND2-OE1 3.13Å; N312-Q315 PolarHBondContact O-N 3.02Å; N312-Q315 PolarHBondContact OD1-N 2.88Å; N312-Q315 VanDerWaalsContact OD1-N 3.13Å; Q315-I317 VanDerWaalsContact C-N 3.34Å; Q315-I317 PolarHBondContact O-N 3.02Å; Q315-R318 WeakPolarHBondContact O-CB 3.25Å; Q315-R318 PolarHBondContact O-N 3.02Å; Q315-R318 VanDerWaalsContact O-N 3.13Å; Q315-Y319 HydrophobicContact CG-CD2 4.18Å; Q315-Y319 HydrophobicContact CG-CE2 3.77Å; Q315-Y319 PolarHBondContact NE2-OH 3.34Å; Q315-Y319 VanDerWaalsContact NE2-OH 3.12Å; Q315-Y319 PolarHBondContact O-N 3.36Å
316	G	94.1	Very high	93.2	Very high	2 Å²	2	62.8 Å²	62.8	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-42.3	177.6	0	0	0	0	0	113	I258 N312 H313 Y319 H320	I258-G316 VanDerWaalsContact CD1-C 3.5Å; N312-G316 PolarHBondContact O-N 3.17Å; N312-G316 VanDerWaalsContact O-N 3.12Å; H313-G316 PolarHBondContact O-N 3.02Å; G316-Y319 PolarHBondContact O-N 3.09Å; G316-H320 VanDerWaalsContact O-CB 3.28Å; G316-H320 WeakPolarHBondContact O-CB 3.35Å; G316-H320 PolarHBondContact O-N 3.23Å
317	I	94.1	Very high	93.2	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-41.8	174.1	-79.8	-171.5	0	0	0	111.3	P291 L292 H313 Q315 H320 L321 F350 T353 L354 A357	P291-I317 WeakPolarHBondContact O-CG1 3.4Å; L292-I317 HydrophobicContact CD2-CD1 3.67Å; L292-I317 HydrophobicContact CD2-CG1 4.25Å; H313-I317 WeakPolarHBondContact O-CB 3.4Å; H313-I317 WeakPolarHBondContact O-CG1 3.34Å; H313-I317 PolarHBondContact O-N 3.12Å; Q315-I317 VanDerWaalsContact C-N 3.34Å; Q315-I317 PolarHBondContact O-N 3.02Å; I317-H320 PolarHBondContact O-N 2.78Å; I317-L321 HydrophobicContact CG2-CD1 3.37Å; I317-L321 HydrophobicContact CG2-CG 4.17Å; I317-L321 WeakPolarHBondContact O-CB 3.32Å; I317-L321 WeakPolarHBondContact O-CD1 3.38Å; I317-L321 WeakPolarHBondContact O-CG 3.43Å; I317-L321 PolarHBondContact O-N 3.32Å; I317-F350 HydrophobicContact CD1-CD2 3.78Å; I317-F350 HydrophobicContact CD1-CE2 3.95Å; I317-T353 HydrophobicContact CB-CG2 4.44Å; I317-T353 HydrophobicContact CD1-CG2 3.65Å; I317-T353 HydrophobicContact CG1-CG2 4.36Å; I317-L354 HydrophobicContact CG2-CD2 4.08Å; I317-A357 HydrophobicContact CG2-CB 4.27Å
318	R	93.8	Very high	93.3	Very high	99 Å²	99	57.9 Å²	57.9	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-49.7	177.2	-79.2	175.4	173.1	161	1.8	111.6	L314 Q315 H320 L321 F322	L314-R318 WeakPolarHBondContact O-CB 2.93Å; L314-R318 WeakPolarHBondContact O-CG 3.39Å; L314-R318 PolarHBondContact O-N 3.17Å; Q315-R318 WeakPolarHBondContact O-CB 3.25Å; Q315-R318 PolarHBondContact O-N 3.02Å; Q315-R318 VanDerWaalsContact O-N 3.13Å; R318-H320 VanDerWaalsContact C-N 3.34Å; R318-H320 PolarHBondContact O-N 2.62Å; R318-L321 PolarHBondContact O-N 2.83Å; R318-F322 HydrophobicContact CB-CD2 4.26Å; R318-F322 HydrophobicContact CB-CE2 3.93Å; R318-F322 WeakPolarHBondContact O-CB 3.48Å; R318-F322 WeakPolarHBondContact O-CD2 3.36Å; R318-F322 VanDerWaalsContact O-CG 3.28Å; R318-F322 WeakPolarHBondContact O-CG 3.39Å; R318-F322 PolarHBondContact O-N 3.11Å
319	Y	94.3	Very high	93.2	Very high	111 Å²	111	57.3 Å²	57.3	44%	0.435	28%	0.28	S	S	.	.	H	α-helix	trans	-59.6	-45.4	176.6	-70.7	-28	0	0	0	112.4	Q315 G316 L321 F322 S323	Q315-Y319 HydrophobicContact CG-CD2 4.18Å; Q315-Y319 HydrophobicContact CG-CE2 3.77Å; Q315-Y319 PolarHBondContact NE2-OH 3.34Å; Q315-Y319 VanDerWaalsContact NE2-OH 3.12Å; Q315-Y319 PolarHBondContact O-N 3.36Å; G316-Y319 PolarHBondContact O-N 3.09Å; Y319-L321 PolarHBondContact O-N 2.83Å; Y319-F322 PolarHBondContact O-N 3.32Å; Y319-S323 PolarHBondContact O-N 2.6Å
320	H	94.8	Very high	93.2	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.019	28%	0.275	C	S	.	.	H	α-helix	trans	-55.6	-51.8	175.5	-179.8	65.4	0	0	0	111.8	G262 P291 G316 I317 R318 S323 Q324 R411	G262-H320 WeakPolarHBondContact O-CB 3.29Å; G262-H320 PolarHBondContact O-ND1 2.83Å; P291-H320 HydrophobicContact CB-CB 4.33Å; G316-H320 VanDerWaalsContact O-CB 3.28Å; G316-H320 WeakPolarHBondContact O-CB 3.35Å; G316-H320 PolarHBondContact O-N 3.23Å; I317-H320 PolarHBondContact O-N 2.78Å; R318-H320 VanDerWaalsContact C-N 3.34Å; R318-H320 PolarHBondContact O-N 2.62Å; H320-S323 WeakPolarHBondContact O-CB 3.04Å; H320-S323 PolarHBondContact O-N 2.9Å; H320-Q324 WeakPolarHBondContact O-CG 3.11Å; H320-Q324 PolarHBondContact O-N 3.47Å; H320-R411 VanDerWaalsContact CE1-CZ 3.43Å; H320-R411 PolarHBondContact CE1-NH1 2.95Å; H320-R411 PolarHBondContact NE2-NH1 2.79Å; H320-R411 PolarHBondContact NE2-NH2 3.43Å
321	L	93.7	Very high	93.2	Very high	1 Å²	1	48 Å²	48	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-68.7	-38.4	-177.3	-68.9	167.6	0	0	0	112.5	I317 R318 Y319 S323 Q324 F325 I333 L354 L359 I362	I317-L321 HydrophobicContact CG2-CD1 3.37Å; I317-L321 HydrophobicContact CG2-CG 4.17Å; I317-L321 WeakPolarHBondContact O-CB 3.32Å; I317-L321 WeakPolarHBondContact O-CD1 3.38Å; I317-L321 WeakPolarHBondContact O-CG 3.43Å; I317-L321 PolarHBondContact O-N 3.32Å; R318-L321 PolarHBondContact O-N 2.83Å; Y319-L321 PolarHBondContact O-N 2.83Å; L321-S323 VanDerWaalsContact C-N 3.31Å; L321-S323 PolarHBondContact O-N 2.84Å; L321-Q324 CarbonylContact O-C 3.59Å; L321-Q324 PolarHBondContact O-N 3.21Å; L321-Q324 VanDerWaalsContact O-N 3.14Å; L321-F325 HydrophobicContact CB-CD2 4.41Å; L321-F325 HydrophobicContact CB-CE2 4.05Å; L321-F325 WeakPolarHBondContact O-CD2 3.36Å; L321-F325 VanDerWaalsContact O-CG 3.26Å; L321-F325 WeakPolarHBondContact O-CG 2.99Å; L321-F325 PolarHBondContact O-N 3.44Å; L321-I333 HydrophobicContact CD2-CD1 3.95Å; L321-L354 HydrophobicContact CD1-CD2 3.92Å; L321-L359 HydrophobicContact CB-CD1 3.9Å; L321-L359 HydrophobicContact CD1-CD1 3.65Å; L321-L359 HydrophobicContact CG-CD1 4.43Å; L321-I362 HydrophobicContact CD1-CD1 3.45Å; L321-I362 VanDerWaalsContact CD1-CD1 3.45Å; L321-I362 HydrophobicContact CD2-CD1 3.72Å; L321-I362 HydrophobicContact CG-CD1 4.09Å
322	F	93.1	Very high	93.3	Very high	108 Å²	108	46.2 Å²	46.2	47%	0.474	21%	0.214	S	C	.	.	H	α-helix	trans	-59.6	-43	173	-71.9	-47.9	0	0	0	111.5	R318 Y319 Q324 F325 Y326 L359	R318-F322 HydrophobicContact CB-CD2 4.26Å; R318-F322 HydrophobicContact CB-CE2 3.93Å; R318-F322 WeakPolarHBondContact O-CB 3.48Å; R318-F322 WeakPolarHBondContact O-CD2 3.36Å; R318-F322 VanDerWaalsContact O-CG 3.28Å; R318-F322 WeakPolarHBondContact O-CG 3.39Å; R318-F322 PolarHBondContact O-N 3.11Å; Y319-F322 PolarHBondContact O-N 3.32Å; F322-Q324 VanDerWaalsContact C-N 3.33Å; F322-Q324 PolarHBondContact O-N 3.16Å; F322-F325 HydrophobicContact CD1-CD2 4.4Å; F322-F325 PolarHBondContact O-N 3.37Å; F322-Y326 VanDerWaalsContact O-CB 3.28Å; F322-Y326 WeakPolarHBondContact O-CB 3.37Å; F322-Y326 PolarHBondContact O-N 3.32Å; F322-L359 HydrophobicContact CE1-CD2 4.48Å
323	S	92.5	Very high	93.3	Very high	37 Å²	37	42 Å²	42	26%	0.259	19%	0.191	S	C	.	.	H	α-helix	trans	-61.4	-41.2	173.8	-169.4	0	0	0	0	112.1	R184 Y319 H320 L321 T327	R184-S323 PolarHBondContact NH2-OG 3.06Å; Y319-S323 PolarHBondContact O-N 2.6Å; H320-S323 WeakPolarHBondContact O-CB 3.04Å; H320-S323 PolarHBondContact O-N 2.9Å; L321-S323 VanDerWaalsContact C-N 3.31Å; L321-S323 PolarHBondContact O-N 2.84Å; S323-T327 WeakPolarHBondContact O-CB 3.45Å; S323-T327 PolarHBondContact O-N 2.76Å; S323-T327 PolarHBondContact O-OG1 3.27Å
324	Q	93.3	Very high	93.1	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.019	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-44.8	175.8	-64	-62.1	-84.8	0	0	112.2	H320 L321 F322 T327 Y328 Q331	H320-Q324 WeakPolarHBondContact O-CG 3.11Å; H320-Q324 PolarHBondContact O-N 3.47Å; L321-Q324 CarbonylContact O-C 3.59Å; L321-Q324 PolarHBondContact O-N 3.21Å; L321-Q324 VanDerWaalsContact O-N 3.14Å; F322-Q324 VanDerWaalsContact C-N 3.33Å; F322-Q324 PolarHBondContact O-N 3.16Å; Q324-T327 PolarHBondContact O-N 3.42Å; Q324-Y328 WeakPolarHBondContact O-CB 2.79Å; Q324-Y328 WeakPolarHBondContact O-CD2 3.29Å; Q324-Y328 PolarHBondContact O-N 3.04Å; Q324-Q331 HydrophobicContact CB-CG 4.1Å
325	F	92.4	Very high	92.9	Very high	41 Å²	41	40 Å²	40	18%	0.18	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-45	177.9	-66.8	-46.6	0	0	0	112	L321 F322 T327 G329 Q331 L359 D361 I362	L321-F325 HydrophobicContact CB-CD2 4.41Å; L321-F325 HydrophobicContact CB-CE2 4.05Å; L321-F325 WeakPolarHBondContact O-CD2 3.36Å; L321-F325 VanDerWaalsContact O-CG 3.26Å; L321-F325 WeakPolarHBondContact O-CG 2.99Å; L321-F325 PolarHBondContact O-N 3.44Å; F322-F325 HydrophobicContact CD1-CD2 4.4Å; F322-F325 PolarHBondContact O-N 3.37Å; F325-T327 VanDerWaalsContact C-N 3.31Å; F325-T327 PolarHBondContact O-N 3.39Å; F325-G329 WeakPolarHBondContact CD1-O 3.32Å; F325-G329 VanDerWaalsContact O-CA 3.29Å; F325-G329 WeakPolarHBondContact O-CA 3.39Å; F325-G329 PolarHBondContact O-N 2.98Å; F325-Q331 HydrophobicContact CD1-CG 3.79Å; F325-Q331 HydrophobicContact CE1-CB 4.08Å; F325-Q331 HydrophobicContact CE1-CG 3.67Å; F325-L359 HydrophobicContact CE2-CB 4.28Å; F325-L359 HydrophobicContact CE2-CD1 3.67Å; F325-L359 HydrophobicContact CE2-CG 4.42Å; F325-L359 HydrophobicContact CZ-CB 4.28Å; F325-L359 HydrophobicContact CZ-CD1 4.3Å; F325-D361 HydrophobicContact CD1-CB 4.5Å; F325-D361 HydrophobicContact CE1-CB 3.81Å; F325-D361 HydrophobicContact CZ-CB 4.1Å; F325-I362 HydrophobicContact CE1-CG1 3.98Å; F325-I362 HydrophobicContact CE2-CD1 4.41Å; F325-I362 HydrophobicContact CZ-CD1 3.72Å; F325-I362 HydrophobicContact CZ-CG1 3.44Å; F325-I362 VanDerWaalsContact CZ-CG1 3.44Å
326	Y	91.6	Very high	92.4	Very high	212 Å²	212	35.9 Å²	35.9	83%	0.831	16%	0.162	S	C	*	.	H	α-helix	trans	-61.4	-41.6	178.2	-179.5	-97.8	0	0	0	111.7	F322	F322-Y326 VanDerWaalsContact O-CB 3.28Å; F322-Y326 WeakPolarHBondContact O-CB 3.37Å; F322-Y326 PolarHBondContact O-N 3.32Å
327	T	91.7	Very high	91.9	Very high	28 Å²	28	36.2 Å²	36.2	17%	0.172	16%	0.164	C	C	.	.	H	α-helix	trans	-80.3	-34.8	-176.4	-47.5	0	0	0	0	112.9	R184 S323 Q324 F325	R184-T327 PolarHBondContact NH1-OG1 3.04Å; S323-T327 WeakPolarHBondContact O-CB 3.45Å; S323-T327 PolarHBondContact O-N 2.76Å; S323-T327 PolarHBondContact O-OG1 3.27Å; Q324-T327 PolarHBondContact O-N 3.42Å; F325-T327 VanDerWaalsContact C-N 3.31Å; F325-T327 PolarHBondContact O-N 3.39Å
328	Y	92.2	Very high	91.3	Very high	26 Å²	26	37.6 Å²	37.6	10%	0.102	17%	0.171	C	C	.	.	H	α-helix	trans	-131.3	-13.5	-164.4	-55.7	-68.4	0	0	0	115.4	F267 E269 V284 T286 Q324 I407 G408 L409	F267-Y328 HydrophobicContact CZ-CE2 4.05Å; E269-Y328 HydrophobicContact CG-CE1 4.34Å; E269-Y328 WeakPolarHBondContact OE2-CE1 3.32Å; E269-Y328 VanDerWaalsContact OE2-CZ 3.26Å; E269-Y328 PolarHBondContact OE2-OH 3.44Å; V284-Y328 HydrophobicContact CG1-CE1 4.47Å; T286-Y328 HydrophobicContact CG2-CE1 4.36Å; T286-Y328 HydrophobicContact CG2-CE2 4Å; Q324-Y328 WeakPolarHBondContact O-CB 2.79Å; Q324-Y328 WeakPolarHBondContact O-CD2 3.29Å; Q324-Y328 PolarHBondContact O-N 3.04Å; Y328-I407 CarbonylContact O-C 3.53Å; Y328-G408 VanDerWaalsContact O-CA 3.25Å; Y328-G408 WeakPolarHBondContact O-CA 3.4Å; Y328-G408 PolarHBondContact O-N 3.05Å; Y328-L409 VanDerWaalsContact CB-CD2 3.4Å; Y328-L409 HydrophobicContact CD1-CD2 3.35Å; Y328-L409 HydrophobicContact CD2-CD2 3.7Å; Y328-L409 HydrophobicContact CE1-CD2 3.96Å; Y328-L409 HydrophobicContact CE2-CD2 4.28Å; Y328-L409 HydrophobicContact CG-CD2 3.19Å; Y328-L409 HydrophobicContact CG-CG 4.11Å
329	G	92	Very high	90.7	Very high	25 Å²	25	38.9 Å²	38.9	26%	0.258	18%	0.179	S	C	.	.			trans	78.3	-148.1	-171.8	0	0	0	0	0	113.1	F325 Q331 I407	F325-G329 WeakPolarHBondContact CD1-O 3.32Å; F325-G329 VanDerWaalsContact O-CA 3.29Å; F325-G329 WeakPolarHBondContact O-CA 3.39Å; F325-G329 PolarHBondContact O-N 2.98Å; G329-Q331 PolarHBondContact O-NE2 3.06Å; G329-I407 CarbonylContact C-O 3.51Å; G329-I407 WeakPolarHBondContact CA-O 3.36Å
330	H	93.1	Very high	89.9	Confident	53 Å²	53	36.8 Å²	36.8	25%	0.245	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53	145.8	-170.9	-57	-73.1	0	0	0	113	D361 L395 I407 G408 L409	H330-D361 IonicContact CE1-OD1 3.46Å; H330-D361 PolarHBondContact CE1-OD1 3.49Å; H330-D361 VanDerWaalsContact ND1-CG 3.34Å; H330-D361 IonicContact ND1-OD1 2.92Å; H330-D361 PolarHBondContact ND1-OD1 3.23Å; H330-L395 HydrophobicContact CB-CD2 4.03Å; H330-I407 PolarHBondContact CD2-O 2.96Å; H330-I407 PolarHBondContact N-O 2.84Å; H330-G408 CarbonylContact O-C 3.56Å; H330-G408 WeakPolarHBondContact O-CA 3.33Å; H330-L409 PolarHBondContact O-N 3.08Å
331	Q	92.2	Very high	89.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.7	-173.6	-64.1	-64.6	-55.5	0	0	111.3	Q324 F325 G329 I333 D361 I362 K363 L409	Q324-Q331 HydrophobicContact CB-CG 4.1Å; F325-Q331 HydrophobicContact CD1-CG 3.79Å; F325-Q331 HydrophobicContact CE1-CB 4.08Å; F325-Q331 HydrophobicContact CE1-CG 3.67Å; G329-Q331 PolarHBondContact O-NE2 3.06Å; Q331-I333 HydrophobicContact CB-CG1 4.4Å; Q331-D361 PolarHBondContact N-O 3.28Å; Q331-D361 VanDerWaalsContact N-O 3.1Å; Q331-I362 WeakPolarHBondContact O-CA 3.42Å; Q331-K363 PolarHBondContact O-N 3.39Å; Q331-L409 VanDerWaalsContact OE1-CD1 3.26Å
332	V	93.7	Very high	88.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	101.7	165.3	-175.9	0	0	0	0	107.9	V334 K363 L388 D391 L395 L409 F410 R411	V332-V334 HydrophobicContact CG1-CG2 4.49Å; V332-V334 PolarHBondContact O-N 3.14Å; V332-K363 CarbonylContact C-O 3.5Å; V332-K363 WeakPolarHBondContact CA-O 3.39Å; V332-K363 HydrophobicContact CG1-CB 4.3Å; V332-K363 HydrophobicContact CG1-CD 4.33Å; V332-K363 HydrophobicContact CG1-CG 4.5Å; V332-K363 HydrophobicContact CG2-CB 4.21Å; V332-L388 HydrophobicContact CG1-CD2 4.35Å; V332-D391 HydrophobicContact CG2-CB 4.24Å; V332-L395 HydrophobicContact CG2-CD1 3.96Å; V332-L395 HydrophobicContact CG2-CD2 4.49Å; V332-L409 PolarHBondContact N-O 3.28Å; V332-F410 HydrophobicContact CB-CD1 3.72Å; V332-F410 HydrophobicContact CB-CE1 3.88Å; V332-F410 HydrophobicContact CB-CG 4.45Å; V332-F410 HydrophobicContact CG1-CD1 3.65Å; V332-F410 HydrophobicContact CG1-CE1 3.63Å; V332-F410 HydrophobicContact CG2-CE1 4.32Å; V332-F410 CarbonylContact O-C 3.58Å; V332-F410 WeakPolarHBondContact O-CA 3.29Å; V332-R411 PolarHBondContact O-N 3.2Å
333	I	93.1	Very high	88.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	110.8	-177.1	-57.4	177.3	0	0	0	108.8	L321 Q331 F350 L354 I362 K363 Y364 F365 R411	L321-I333 HydrophobicContact CD2-CD1 3.95Å; Q331-I333 HydrophobicContact CB-CG1 4.4Å; I333-F350 HydrophobicContact CG2-CE1 3.93Å; I333-F350 HydrophobicContact CG2-CZ 4Å; I333-L354 HydrophobicContact CD1-CD1 4.2Å; I333-L354 HydrophobicContact CD1-CD2 4Å; I333-I362 HydrophobicContact CD1-CG2 3.62Å; I333-I362 HydrophobicContact CG1-CG2 4.02Å; I333-K363 PolarHBondContact N-O 3.34Å; I333-Y364 HydrophobicContact CB-CD2 4.28Å; I333-Y364 HydrophobicContact CG2-CD2 4.09Å; I333-Y364 HydrophobicContact CG2-CE2 4.43Å; I333-F365 PolarHBondContact O-N 3.47Å; I333-R411 CarbonylContact C-O 3.54Å; I333-R411 WeakPolarHBondContact CA-O 3.25Å
334	V	90.3	Very high	88.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	109.8	174.8	-176.5	0	0	0	0	108.7	V332 L336 F365 I367 L388 F410 R411 T412 N413 V424	V332-V334 HydrophobicContact CG1-CG2 4.49Å; V332-V334 PolarHBondContact O-N 3.14Å; V334-L336 HydrophobicContact CG1-CD2 3.82Å; V334-L336 HydrophobicContact CG1-CG 4.49Å; V334-F365 CarbonylContact C-O 3.58Å; V334-F365 WeakPolarHBondContact CA-O 3.32Å; V334-I367 HydrophobicContact CG1-CD1 3.83Å; V334-I367 HydrophobicContact CG1-CG1 4.38Å; V334-L388 HydrophobicContact CG2-CD1 3.88Å; V334-F410 HydrophobicContact CG2-CD1 4.13Å; V334-R411 PolarHBondContact N-O 3.25Å; V334-T412 HydrophobicContact CB-CG2 4.33Å; V334-T412 HydrophobicContact CG1-CG2 4.4Å; V334-T412 CarbonylContact O-C 3.55Å; V334-T412 WeakPolarHBondContact O-CA 3.29Å; V334-N413 PolarHBondContact O-N 3.25Å; V334-V424 HydrophobicContact CG1-CG1 4.28Å
335	S	90.2	Very high	88.1	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120.9	178.5	-175.1	0	0	0	0	110.3	Y364 F365 I367	S335-Y364 WeakPolarHBondContact CB-OH 3.48Å; S335-F365 PolarHBondContact N-O 2.88Å; S335-I367 PolarHBondContact O-N 2.84Å
336	L	84.3	Confident	88	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.			trans	-104.3	24.4	179.5	-52.3	-178.6	0	0	0	112.4	V334 I367 T412 N413 C414 R420 T421 V424	V334-L336 HydrophobicContact CG1-CD2 3.82Å; V334-L336 HydrophobicContact CG1-CG 4.49Å; L336-I367 HydrophobicContact CD2-CB 3.95Å; L336-I367 HydrophobicContact CD2-CD1 4.02Å; L336-I367 HydrophobicContact CD2-CG1 4.35Å; L336-T412 HydrophobicContact CD1-CG2 3.57Å; L336-T412 HydrophobicContact CG-CG2 3.92Å; L336-N413 PolarHBondContact N-O 3Å; L336-C414 HydrophobicContact CB-CB 4.17Å; L336-R420 HydrophobicContact CB-CB 4.43Å; L336-R420 HydrophobicContact CD1-CB 3.94Å; L336-R420 WeakPolarHBondContact CD1-O 3.5Å; L336-R420 PolarHBondContact O-NH1 3.47Å; L336-T421 HydrophobicContact CD1-CG2 4.38Å; L336-V424 HydrophobicContact CD1-CB 3.91Å; L336-V424 HydrophobicContact CD1-CG1 4.49Å; L336-V424 HydrophobicContact CD1-CG2 3.63Å; L336-V424 HydrophobicContact CD2-CG2 3.86Å; L336-V424 HydrophobicContact CG-CG2 4.4Å
337	L	84	Confident	88	Confident	9 Å²	9	33.7 Å²	33.7	5%	0.047	20%	0.197	C	C	.	.			trans	-75.1	139.3	177.1	-64.3	170.5	0	0	0	110.1	V290 E343 I346 G347 M415	V290-L337 HydrophobicContact CG2-CD1 3.77Å; V290-L337 HydrophobicContact CG2-CD2 3.92Å; V290-L337 HydrophobicContact CG2-CG 4.21Å; L337-E343 WeakPolarHBondContact CA-OE2 3.34Å; L337-E343 HydrophobicContact CB-CB 4.41Å; L337-E343 HydrophobicContact CD2-CB 4.29Å; L337-I346 HydrophobicContact CD1-CG2 4.12Å; L337-G347 VanDerWaalsContact CD1-CA 3.49Å; L337-M415 HydrophobicContact CD2-CB 4Å; L337-M415 HydrophobicContact CD2-CE 4.12Å
338	N	81.9	Confident	88	Confident	28 Å²	28	37.7 Å²	37.7	15%	0.15	21%	0.214	C	C	.	.			trans	-66.8	135.5	175.6	-69.5	-10.7	0	0	0	110.3	A340 E343 H370	N338-A340 PolarHBondContact O-N 2.82Å; N338-E343 HydrophobicContact CB-CB 4.28Å; N338-E343 HydrophobicContact CB-CG 4.48Å; N338-E343 PolarHBondContact N-OE2 3.5Å; N338-H370 PolarHBondContact ND2-ND1 2.89Å; N338-H370 PolarHBondContact OD1-ND1 2.82Å
339	K	80.5	Confident	88	Confident	126 Å²	126	40.1 Å²	40.1	55%	0.548	23%	0.225	S	C	.	.	S	Bend	trans	-77.1	-10	178.2	-62.6	179.8	-179.1	174	0	112.8	K344 D368	K339-K344 WeakPolarHBondContact O-CD 3.11Å; K339-K344 WeakPolarHBondContact O-CG 3.32Å; K339-D368 WeakPolarHBondContact CB-OD2 3.41Å; K339-D368 HydrophobicContact CD-CB 4.15Å; K339-D368 HydrophobicContact CG-CB 4.18Å; K339-D368 PolarHBondContact N-OD2 2.89Å
340	A	78.3	Confident	88.1	Confident	67 Å²	67	39 Å²	39	55%	0.554	21%	0.213	S	C	*	.	S	Bend	trans	-122.2	157.9	175.8	0	0	0	0	0	111.8	N338	N338-A340 PolarHBondContact O-N 2.82Å
341	G	82.9	Confident	88.1	Confident	61 Å²	61	39.5 Å²	39.5	63%	0.629	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	77.5	-144.6	176	0	0	0	0	0	113.8	E343 K344	G341-E343 VanDerWaalsContact C-N 3.34Å; G341-E343 PolarHBondContact O-N 2.77Å; G341-K344 WeakPolarHBondContact O-CB 3.2Å; G341-K344 PolarHBondContact O-N 2.88Å
342	R	82.3	Confident	88.2	Confident	89 Å²	89	42 Å²	42	34%	0.336	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-70.1	-29	-166.8	-43	-163.5	179.3	174.8	-0.2	114	Q303 W305 P306 K344	Q303-R342 PolarHBondContact O-NH1 2.88Å; W305-R342 HydrophobicContact CD2-CG 4.4Å; W305-R342 HydrophobicContact CE3-CB 3.91Å; W305-R342 HydrophobicContact CE3-CG 3.8Å; W305-R342 HydrophobicContact CH2-CB 4.45Å; W305-R342 HydrophobicContact CH2-CG 3.65Å; W305-R342 HydrophobicContact CZ2-CG 4.23Å; W305-R342 HydrophobicContact CZ3-CB 3.73Å; W305-R342 HydrophobicContact CZ3-CG 3.41Å; W305-R342 VanDerWaalsContact CZ3-CG 3.41Å; P306-R342 HydrophobicContact CG-CB 4.2Å; P306-R342 VanDerWaalsContact CG-O 3.24Å; P306-R342 WeakPolarHBondContact CG-O 3.46Å; R342-K344 VanDerWaalsContact C-N 3.34Å
343	E	85.5	Confident	88.2	Confident	15 Å²	15	42.1 Å²	42.1	7%	0.07	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-81.9	-18.7	-176.4	-51.8	-169.4	173.2	0	0	112.3	L337 N338 G341 C345 I346 G347 M415 R420	L337-E343 WeakPolarHBondContact CA-OE2 3.34Å; L337-E343 HydrophobicContact CB-CB 4.41Å; L337-E343 HydrophobicContact CD2-CB 4.29Å; N338-E343 HydrophobicContact CB-CB 4.28Å; N338-E343 HydrophobicContact CB-CG 4.48Å; N338-E343 PolarHBondContact N-OE2 3.5Å; G341-E343 VanDerWaalsContact C-N 3.34Å; G341-E343 PolarHBondContact O-N 2.77Å; E343-C345 VanDerWaalsContact C-N 3.35Å; E343-C345 PolarHBondContact O-N 2.93Å; E343-I346 PolarHBondContact O-N 2.54Å; E343-I346 VanDerWaalsContact O-N 3.09Å; E343-G347 PolarHBondContact O-N 2.84Å; E343-M415 HydrophobicContact CB-SD 4.45Å; E343-M415 HydrophobicContact CG-CB 4.31Å; E343-M415 HydrophobicContact CG-CG 4.43Å; E343-M415 HydrophobicContact CG-SD 3.79Å; E343-M415 VanDerWaalsContact OE1-CB 3.32Å; E343-M415 WeakPolarHBondContact OE1-CB 3.38Å; E343-R420 IonicContact OE1-CZ 3.72Å; E343-R420 IonicContact OE1-NH1 3.93Å; E343-R420 PolarHBondContact OE1-NH1 2.97Å; E343-R420 IonicContact OE1-NH2 3.39Å; E343-R420 PolarHBondContact OE1-NH2 2.84Å; E343-R420 IonicContact OE2-CZ 3.71Å; E343-R420 IonicContact OE2-NH1 2.64Å; E343-R420 PolarHBondContact OE2-NH1 3.5Å; E343-R420 IonicContact OE2-NH2 2.96Å
344	K	87.4	Confident	88.1	Confident	91 Å²	91	42.9 Å²	42.9	40%	0.396	24%	0.238	S	C	.	.	H	α-helix	trans	-54.4	-48.6	-176.8	-178.3	-179.6	175	177.6	0	112	K339 G341 R342 I346 G347 E348	K339-K344 WeakPolarHBondContact O-CD 3.11Å; K339-K344 WeakPolarHBondContact O-CG 3.32Å; G341-K344 WeakPolarHBondContact O-CB 3.2Å; G341-K344 PolarHBondContact O-N 2.88Å; R342-K344 VanDerWaalsContact C-N 3.34Å; K344-I346 VanDerWaalsContact C-N 3.26Å; K344-I346 PolarHBondContact O-N 3.49Å; K344-G347 PolarHBondContact O-N 2.72Å; K344-G347 VanDerWaalsContact O-N 3.15Å; K344-E348 WeakPolarHBondContact CE-OE1 3.33Å; K344-E348 WeakPolarHBondContact CE-OE2 3.2Å; K344-E348 HydrophobicContact CG-CG 4.12Å; K344-E348 IonicContact NZ-OE1 3.57Å; K344-E348 WeakPolarHBondContact O-CB 3.23Å; K344-E348 WeakPolarHBondContact O-CG 3.44Å; K344-E348 PolarHBondContact O-N 3.43Å
345	C	90.1	Very high	88.2	Confident	76 Å²	76	49.8 Å²	49.8	51%	0.514	27%	0.268	S	S	.	.	H	α-helix	trans	-57.4	-40.3	-179.7	177.8	0	0	0	0	112.2	E343 K349	E343-C345 VanDerWaalsContact C-N 3.35Å; E343-C345 PolarHBondContact O-N 2.93Å; C345-K349 VanDerWaalsContact O-CB 3.26Å; C345-K349 WeakPolarHBondContact O-CB 3.35Å; C345-K349 PolarHBondContact O-N 3.2Å; C345-K349 VanDerWaalsContact O-N 3.09Å
346	I	91.7	Very high	88.3	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-74.7	-41.1	178.1	-71.1	177.6	0	0	0	111.1	V290 L292 W294 P306 V308 L337 E343 K344 K349 F350 M415	V290-I346 HydrophobicContact CB-CG2 4.1Å; V290-I346 HydrophobicContact CG1-CG2 3.86Å; V290-I346 HydrophobicContact CG2-CG2 4.11Å; L292-I346 HydrophobicContact CD1-CG2 4.27Å; W294-I346 HydrophobicContact CB-CD1 4.32Å; W294-I346 HydrophobicContact CD2-CD1 3.52Å; W294-I346 HydrophobicContact CE3-CD1 3.29Å; W294-I346 HydrophobicContact CG-CD1 3.99Å; W294-I346 HydrophobicContact CH2-CD1 4.25Å; W294-I346 HydrophobicContact CZ2-CD1 4.48Å; W294-I346 HydrophobicContact CZ3-CD1 3.69Å; P306-I346 HydrophobicContact CB-CD1 3.41Å; P306-I346 VanDerWaalsContact CB-CD1 3.41Å; P306-I346 HydrophobicContact CB-CG1 4.4Å; P306-I346 HydrophobicContact CG-CD1 4.2Å; V308-I346 HydrophobicContact CG2-CG1 3.88Å; L337-I346 HydrophobicContact CD1-CG2 4.12Å; E343-I346 PolarHBondContact O-N 2.54Å; E343-I346 VanDerWaalsContact O-N 3.09Å; K344-I346 VanDerWaalsContact C-N 3.26Å; K344-I346 PolarHBondContact O-N 3.49Å; I346-K349 PolarHBondContact O-N 3.48Å; I346-F350 WeakPolarHBondContact O-CB 3.49Å; I346-F350 PolarHBondContact O-N 3.29Å; I346-M415 HydrophobicContact CB-CE 4.22Å; I346-M415 HydrophobicContact CD1-CE 3.36Å; I346-M415 HydrophobicContact CD1-SD 4.44Å; I346-M415 HydrophobicContact CG1-CE 4.36Å; I346-M415 HydrophobicContact CG2-CE 4.04Å
347	G	90.9	Very high	88.6	Confident	10 Å²	10	55.6 Å²	55.6	10%	0.103	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-47.9	177.8	0	0	0	0	0	112.6	L337 E343 K344 F350 E351	L337-G347 VanDerWaalsContact CD1-CA 3.49Å; E343-G347 PolarHBondContact O-N 2.84Å; K344-G347 PolarHBondContact O-N 2.72Å; K344-G347 VanDerWaalsContact O-N 3.15Å; G347-F350 PolarHBondContact O-N 3.21Å; G347-E351 WeakPolarHBondContact O-CB 3.41Å; G347-E351 PolarHBondContact O-N 3.2Å
348	E	91.7	Very high	88.6	Confident	111 Å²	111	58.1 Å²	58.1	52%	0.519	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-44.4	176.9	-71.1	179	150.5	0	0	111.2	K344 F350 E351 S352	K344-E348 WeakPolarHBondContact CE-OE1 3.33Å; K344-E348 WeakPolarHBondContact CE-OE2 3.2Å; K344-E348 HydrophobicContact CG-CG 4.12Å; K344-E348 IonicContact NZ-OE1 3.57Å; K344-E348 WeakPolarHBondContact O-CB 3.23Å; K344-E348 WeakPolarHBondContact O-CG 3.44Å; K344-E348 PolarHBondContact O-N 3.43Å; E348-F350 VanDerWaalsContact C-N 3.35Å; E348-F350 PolarHBondContact O-N 3.12Å; E348-E351 PolarHBondContact O-N 2.79Å; E348-S352 VanDerWaalsContact O-CB 3.31Å; E348-S352 WeakPolarHBondContact O-CB 3.18Å; E348-S352 PolarHBondContact O-N 2.91Å; E348-S352 PolarHBondContact O-OG 3.38Å
349	K	92.9	Very high	88.6	Confident	78 Å²	78	58.9 Å²	58.9	34%	0.339	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-45	176.6	-173.1	61.4	174.1	178.5	0	110.8	L292 V308 C345 I346 S352 T353	L292-K349 HydrophobicContact CD1-CB 4.1Å; L292-K349 HydrophobicContact CD1-CG 4.05Å; L292-K349 HydrophobicContact CD2-CG 4.46Å; V308-K349 HydrophobicContact CG1-CG 4.36Å; C345-K349 VanDerWaalsContact O-CB 3.26Å; C345-K349 WeakPolarHBondContact O-CB 3.35Å; C345-K349 PolarHBondContact O-N 3.2Å; C345-K349 VanDerWaalsContact O-N 3.09Å; I346-K349 PolarHBondContact O-N 3.48Å; K349-S352 WeakPolarHBondContact CA-OG 3.25Å; K349-S352 PolarHBondContact O-N 3.39Å; K349-S352 PolarHBondContact O-OG 2.99Å; K349-T353 WeakPolarHBondContact O-CB 3.48Å; K349-T353 PolarHBondContact O-N 3.42Å; K349-T353 PolarHBondContact O-OG1 3.14Å
350	F	93.8	Very high	88.4	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-47.3	-179.7	-178.5	-130.9	0	0	0	111.6	V290 P291 L292 I317 I333 I346 G347 E348 T353 L354 Y364 N413	V290-F350 HydrophobicContact CG1-CB 3.83Å; V290-F350 HydrophobicContact CG1-CD1 3.94Å; V290-F350 HydrophobicContact CG1-CD2 3.88Å; V290-F350 HydrophobicContact CG1-CE1 4.48Å; V290-F350 HydrophobicContact CG1-CE2 4.46Å; V290-F350 HydrophobicContact CG1-CG 3.6Å; P291-F350 HydrophobicContact CG-CD2 4.33Å; P291-F350 HydrophobicContact CG-CE2 3.47Å; P291-F350 VanDerWaalsContact CG-CE2 3.47Å; P291-F350 HydrophobicContact CG-CZ 3.91Å; L292-F350 HydrophobicContact CD1-CB 3.78Å; L292-F350 HydrophobicContact CG-CB 4.38Å; L292-F350 HydrophobicContact CG-CD2 4.28Å; I317-F350 HydrophobicContact CD1-CD2 3.78Å; I317-F350 HydrophobicContact CD1-CE2 3.95Å; I333-F350 HydrophobicContact CG2-CE1 3.93Å; I333-F350 HydrophobicContact CG2-CZ 4Å; I346-F350 WeakPolarHBondContact O-CB 3.49Å; I346-F350 PolarHBondContact O-N 3.29Å; G347-F350 PolarHBondContact O-N 3.21Å; E348-F350 VanDerWaalsContact C-N 3.35Å; E348-F350 PolarHBondContact O-N 3.12Å; F350-T353 PolarHBondContact O-N 3.26Å; F350-L354 HydrophobicContact CD1-CD1 4.11Å; F350-L354 HydrophobicContact CD2-CD1 4.2Å; F350-L354 HydrophobicContact CD2-CG 4.08Å; F350-L354 HydrophobicContact CE1-CD1 3.67Å; F350-L354 HydrophobicContact CE2-CD1 3.73Å; F350-L354 HydrophobicContact CE2-CD2 3.93Å; F350-L354 HydrophobicContact CE2-CG 3.7Å; F350-L354 HydrophobicContact CG-CD1 4.37Å; F350-L354 HydrophobicContact CZ-CD1 3.46Å; F350-L354 VanDerWaalsContact CZ-CD1 3.46Å; F350-L354 HydrophobicContact CZ-CD2 4.2Å; F350-L354 HydrophobicContact CZ-CG 3.97Å; F350-L354 WeakPolarHBondContact O-CB 3.42Å; F350-L354 VanDerWaalsContact O-CG 3.32Å; F350-L354 WeakPolarHBondContact O-CG 3.16Å; F350-L354 PolarHBondContact O-N 3.37Å; F350-Y364 HydrophobicContact CD1-CE2 4.07Å; F350-Y364 AromaticContact CE1-CE2 3.91Å; F350-Y364 HydrophobicContact CE1-CE2 3.91Å; F350-N413 WeakPolarHBondContact CE1-ND2 3.38Å; F350-N413 WeakPolarHBondContact CZ-ND2 3.29Å
351	E	92.5	Very high	88.7	Confident	63 Å²	63	58.5 Å²	58.5	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-43.1	177.5	-175.1	176.4	163.3	0	0	111.8	G347 E348 L354 K355 Y364	G347-E351 WeakPolarHBondContact O-CB 3.41Å; G347-E351 PolarHBondContact O-N 3.2Å; E348-E351 PolarHBondContact O-N 2.79Å; E351-L354 PolarHBondContact O-N 2.94Å; E351-K355 HydrophobicContact CG-CD 4.44Å; E351-K355 WeakPolarHBondContact O-CG 3.24Å; E351-K355 PolarHBondContact O-N 2.93Å; E351-K355 VanDerWaalsContact OE1-CE 3.31Å; E351-K355 WeakPolarHBondContact OE1-CE 3.5Å; E351-K355 IonicContact OE1-NZ 2.69Å; E351-K355 PolarHBondContact OE1-NZ 2.93Å; E351-Y364 HydrophobicContact CB-CE1 4.11Å; E351-Y364 HydrophobicContact CG-CD1 4.23Å; E351-Y364 HydrophobicContact CG-CE1 3.73Å
352	S	93.7	Very high	89	Confident	54 Å²	54	57.4 Å²	57.4	38%	0.378	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-45.7	177.8	70.5	0	0	0	0	111.9	E348 K349 K355 E356	E348-S352 VanDerWaalsContact O-CB 3.31Å; E348-S352 WeakPolarHBondContact O-CB 3.18Å; E348-S352 PolarHBondContact O-N 2.91Å; E348-S352 PolarHBondContact O-OG 3.38Å; K349-S352 WeakPolarHBondContact CA-OG 3.25Å; K349-S352 PolarHBondContact O-N 3.39Å; K349-S352 PolarHBondContact O-OG 2.99Å; S352-K355 PolarHBondContact O-N 3.34Å; S352-E356 WeakPolarHBondContact O-CB 3.3Å; S352-E356 PolarHBondContact O-N 2.81Å
353	T	93.4	Very high	89.4	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-72.2	-31.1	-179.6	-51.7	0	0	0	0	112.3	H313 L314 I317 K349 F350 E356 A357	H313-T353 HydrophobicContact CB-CG2 4.07Å; L314-T353 HydrophobicContact CB-CG2 4.16Å; L314-T353 HydrophobicContact CD1-CG2 4.16Å; I317-T353 HydrophobicContact CB-CG2 4.44Å; I317-T353 HydrophobicContact CD1-CG2 3.65Å; I317-T353 HydrophobicContact CG1-CG2 4.36Å; K349-T353 WeakPolarHBondContact O-CB 3.48Å; K349-T353 PolarHBondContact O-N 3.42Å; K349-T353 PolarHBondContact O-OG1 3.14Å; F350-T353 PolarHBondContact O-N 3.26Å; T353-E356 PolarHBondContact O-N 3.14Å; T353-A357 WeakPolarHBondContact O-CB 3.37Å; T353-A357 PolarHBondContact O-N 2.75Å
354	L	92.5	Very high	89.6	Confident	18 Å²	18	59 Å²	59	9%	0.094	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-42.4	170.8	-79.2	177.9	0	0	0	112.1	I317 L321 I333 F350 E351 A357 G358 Y364	I317-L354 HydrophobicContact CG2-CD2 4.08Å; L321-L354 HydrophobicContact CD1-CD2 3.92Å; I333-L354 HydrophobicContact CD1-CD1 4.2Å; I333-L354 HydrophobicContact CD1-CD2 4Å; F350-L354 HydrophobicContact CD1-CD1 4.11Å; F350-L354 HydrophobicContact CD2-CD1 4.2Å; F350-L354 HydrophobicContact CD2-CG 4.08Å; F350-L354 HydrophobicContact CE1-CD1 3.67Å; F350-L354 HydrophobicContact CE2-CD1 3.73Å; F350-L354 HydrophobicContact CE2-CD2 3.93Å; F350-L354 HydrophobicContact CE2-CG 3.7Å; F350-L354 HydrophobicContact CG-CD1 4.37Å; F350-L354 HydrophobicContact CZ-CD1 3.46Å; F350-L354 VanDerWaalsContact CZ-CD1 3.46Å; F350-L354 HydrophobicContact CZ-CD2 4.2Å; F350-L354 HydrophobicContact CZ-CG 3.97Å; F350-L354 WeakPolarHBondContact O-CB 3.42Å; F350-L354 VanDerWaalsContact O-CG 3.32Å; F350-L354 WeakPolarHBondContact O-CG 3.16Å; F350-L354 PolarHBondContact O-N 3.37Å; E351-L354 PolarHBondContact O-N 2.94Å; L354-A357 PolarHBondContact O-N 3.1Å; L354-G358 PolarHBondContact O-N 2.78Å; L354-Y364 HydrophobicContact CD1-CD2 3.51Å; L354-Y364 HydrophobicContact CD1-CE2 3.88Å; L354-Y364 HydrophobicContact CD1-CG 4.21Å
355	K	91.6	Very high	89.6	Confident	144 Å²	144	56.4 Å²	56.4	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-64	-42.9	176	-72.1	174.1	-174.7	169.7	0	111.2	E351 S352 A357 G358	E351-K355 HydrophobicContact CG-CD 4.44Å; E351-K355 WeakPolarHBondContact O-CG 3.24Å; E351-K355 PolarHBondContact O-N 2.93Å; E351-K355 VanDerWaalsContact OE1-CE 3.31Å; E351-K355 WeakPolarHBondContact OE1-CE 3.5Å; E351-K355 IonicContact OE1-NZ 2.69Å; E351-K355 PolarHBondContact OE1-NZ 2.93Å; S352-K355 PolarHBondContact O-N 3.34Å; K355-A357 VanDerWaalsContact C-N 3.32Å; K355-A357 PolarHBondContact O-N 3.25Å; K355-G358 PolarHBondContact O-N 3.24Å
356	E	92.8	Very high	89.5	Confident	118 Å²	118	54.6 Å²	54.6	55%	0.551	30%	0.303	S	S	*	.	H	α-helix	trans	-65.1	-33.9	176.4	-171.3	-178.9	179.9	0	0	112.8	L314 S352 T353 G358	L314-E356 HydrophobicContact CD1-CB 4.13Å; L314-E356 HydrophobicContact CD1-CG 3.94Å; L314-E356 HydrophobicContact CD2-CG 4.13Å; S352-E356 WeakPolarHBondContact O-CB 3.3Å; S352-E356 PolarHBondContact O-N 2.81Å; T353-E356 PolarHBondContact O-N 3.14Å; E356-G358 PolarHBondContact O-N 3.25Å
357	A	90.5	Very high	88.9	Confident	6 Å²	6	54.8 Å²	54.8	5%	0.05	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-29.5	175.4	0	0	0	0	0	112.5	L314 I317 T353 L354 K355 L359	L314-A357 HydrophobicContact CD1-CB 3.97Å; I317-A357 HydrophobicContact CG2-CB 4.27Å; T353-A357 WeakPolarHBondContact O-CB 3.37Å; T353-A357 PolarHBondContact O-N 2.75Å; L354-A357 PolarHBondContact O-N 3.1Å; K355-A357 VanDerWaalsContact C-N 3.32Å; K355-A357 PolarHBondContact O-N 3.25Å; A357-L359 VanDerWaalsContact C-N 3.31Å; A357-L359 HydrophobicContact CB-CG 4.46Å; A357-L359 PolarHBondContact O-N 3.39Å
358	G	83.6	Confident	88.2	Confident	62 Å²	62	55.1 Å²	55.1	64%	0.639	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	26.7	167.9	0	0	0	0	0	115.3	L354 K355 E356	L354-G358 PolarHBondContact O-N 2.78Å; K355-G358 PolarHBondContact O-N 3.24Å; E356-G358 PolarHBondContact O-N 3.25Å
359	L	82.4	Confident	87.1	Confident	44 Å²	44	50.9 Å²	50.9	23%	0.23	28%	0.283	C	S	.	.			trans	-84.1	122.3	-176.2	-60.5	173	0	0	0	110.8	L321 F322 F325 A357 D361 I362	L321-L359 HydrophobicContact CB-CD1 3.9Å; L321-L359 HydrophobicContact CD1-CD1 3.65Å; L321-L359 HydrophobicContact CG-CD1 4.43Å; F322-L359 HydrophobicContact CE1-CD2 4.48Å; F325-L359 HydrophobicContact CE2-CB 4.28Å; F325-L359 HydrophobicContact CE2-CD1 3.67Å; F325-L359 HydrophobicContact CE2-CG 4.42Å; F325-L359 HydrophobicContact CZ-CB 4.28Å; F325-L359 HydrophobicContact CZ-CD1 4.3Å; A357-L359 VanDerWaalsContact C-N 3.31Å; A357-L359 HydrophobicContact CB-CG 4.46Å; A357-L359 PolarHBondContact O-N 3.39Å; L359-D361 VanDerWaalsContact C-N 3.32Å; L359-D361 PolarHBondContact O-N 3.47Å; L359-I362 HydrophobicContact CB-CD1 3.82Å; L359-I362 HydrophobicContact CB-CG1 4.09Å; L359-I362 HydrophobicContact CD1-CD1 4.05Å
360	A	76.8	Confident	85.9	Confident	101 Å²	101	52 Å²	52	84%	0.835	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.1	-173.3	0	0	0	0	0	114.3	I362	A360-I362 PolarHBondContact O-N 3.02Å
361	D	83.3	Confident	84.5	Confident	85 Å²	85	57 Å²	57	46%	0.455	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	20.1	-174.4	-72.6	-46.5	0	0	0	114.6	F325 H330 Q331 L359	F325-D361 HydrophobicContact CD1-CB 4.5Å; F325-D361 HydrophobicContact CE1-CB 3.81Å; F325-D361 HydrophobicContact CZ-CB 4.1Å; H330-D361 IonicContact CE1-OD1 3.46Å; H330-D361 PolarHBondContact CE1-OD1 3.49Å; H330-D361 VanDerWaalsContact ND1-CG 3.34Å; H330-D361 IonicContact ND1-OD1 2.92Å; H330-D361 PolarHBondContact ND1-OD1 3.23Å; Q331-D361 PolarHBondContact N-O 3.28Å; Q331-D361 VanDerWaalsContact N-O 3.1Å; L359-D361 VanDerWaalsContact C-N 3.32Å; L359-D361 PolarHBondContact O-N 3.47Å
362	I	88.8	Confident	83.2	Confident	37 Å²	37	56.9 Å²	56.9	19%	0.19	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.5	-179.1	-53.3	-172.8	0	0	0	110.8	L321 F325 Q331 I333 L359 A360	L321-I362 HydrophobicContact CD1-CD1 3.45Å; L321-I362 VanDerWaalsContact CD1-CD1 3.45Å; L321-I362 HydrophobicContact CD2-CD1 3.72Å; L321-I362 HydrophobicContact CG-CD1 4.09Å; F325-I362 HydrophobicContact CE1-CG1 3.98Å; F325-I362 HydrophobicContact CE2-CD1 4.41Å; F325-I362 HydrophobicContact CZ-CD1 3.72Å; F325-I362 HydrophobicContact CZ-CG1 3.44Å; F325-I362 VanDerWaalsContact CZ-CG1 3.44Å; Q331-I362 WeakPolarHBondContact O-CA 3.42Å; I333-I362 HydrophobicContact CD1-CG2 3.62Å; I333-I362 HydrophobicContact CG1-CG2 4.02Å; L359-I362 HydrophobicContact CB-CD1 3.82Å; L359-I362 HydrophobicContact CB-CG1 4.09Å; L359-I362 HydrophobicContact CD1-CD1 4.05Å; A360-I362 PolarHBondContact O-N 3.02Å
363	K	90.6	Very high	81.5	Confident	75 Å²	75	55.2 Å²	55.2	33%	0.326	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116	163.2	-172.3	179.8	-172.9	179.5	0	108.9	Q331 V332 I333 D391	Q331-K363 PolarHBondContact O-N 3.39Å; V332-K363 CarbonylContact C-O 3.5Å; V332-K363 WeakPolarHBondContact CA-O 3.39Å; V332-K363 HydrophobicContact CG1-CB 4.3Å; V332-K363 HydrophobicContact CG1-CD 4.33Å; V332-K363 HydrophobicContact CG1-CG 4.5Å; V332-K363 HydrophobicContact CG2-CB 4.21Å; I333-K363 PolarHBondContact N-O 3.34Å; K363-D391 WeakPolarHBondContact CD-OD1 3.34Å; K363-D391 IonicContact NZ-OD1 2.63Å; K363-D391 PolarHBondContact NZ-OD1 2.86Å; K363-D391 IonicContact NZ-OD2 3.66Å; K363-D391 PolarHBondContact NZ-OD2 2.69Å
364	Y	90.4	Very high	80	Confident	62 Å²	62	61.5 Å²	61.5	24%	0.243	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.4	173.4	-179.3	-108.8	0	0	0	110.6	I333 S335 F350 E351 L354 A366	I333-Y364 HydrophobicContact CB-CD2 4.28Å; I333-Y364 HydrophobicContact CG2-CD2 4.09Å; I333-Y364 HydrophobicContact CG2-CE2 4.43Å; S335-Y364 WeakPolarHBondContact CB-OH 3.48Å; F350-Y364 HydrophobicContact CD1-CE2 4.07Å; F350-Y364 AromaticContact CE1-CE2 3.91Å; F350-Y364 HydrophobicContact CE1-CE2 3.91Å; E351-Y364 HydrophobicContact CB-CE1 4.11Å; E351-Y364 HydrophobicContact CG-CD1 4.23Å; E351-Y364 HydrophobicContact CG-CE1 3.73Å; L354-Y364 HydrophobicContact CD1-CD2 3.51Å; L354-Y364 HydrophobicContact CD1-CE2 3.88Å; L354-Y364 HydrophobicContact CD1-CG 4.21Å; Y364-A366 HydrophobicContact CE1-CB 3.72Å
365	F	88.4	Confident	78.4	Confident	37 Å²	37	66.3 Å²	66.3	16%	0.162	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	103.5	179.9	-165.9	-100.6	0	0	0	110	I333 V334 S335 I367 V384 R387 L388	I333-F365 PolarHBondContact O-N 3.47Å; V334-F365 CarbonylContact C-O 3.58Å; V334-F365 WeakPolarHBondContact CA-O 3.32Å; S335-F365 PolarHBondContact N-O 2.88Å; F365-I367 HydrophobicContact CD1-CD1 3.8Å; F365-I367 HydrophobicContact CD1-CG1 3.57Å; F365-I367 HydrophobicContact CE1-CD1 3.58Å; F365-I367 HydrophobicContact CE1-CG1 3.44Å; F365-I367 VanDerWaalsContact CE1-CG1 3.44Å; F365-V384 HydrophobicContact CE1-CG1 3.84Å; F365-V384 HydrophobicContact CZ-CG1 3.92Å; F365-R387 HydrophobicContact CZ-CB 4.34Å; F365-L388 HydrophobicContact CB-CD2 4.37Å; F365-L388 HydrophobicContact CD1-CD1 4.37Å; F365-L388 HydrophobicContact CD1-CD2 3.97Å; F365-L388 HydrophobicContact CD1-CG 4.44Å; F365-L388 HydrophobicContact CD2-CD2 4.16Å; F365-L388 HydrophobicContact CE1-CD2 4.24Å; F365-L388 HydrophobicContact CE1-CG 4.38Å; F365-L388 HydrophobicContact CE2-CD2 4.43Å; F365-L388 HydrophobicContact CG-CD2 3.92Å; F365-L388 HydrophobicContact CZ-CD2 4.46Å
366	A	86.5	Confident	76.7	Confident	38 Å²	38	65.8 Å²	65.8	31%	0.314	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124	179.3	0	0	0	0	0	111.4	Y364	Y364-A366 HydrophobicContact CE1-CB 3.72Å
367	I	80.8	Confident	75.2	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	35%	0.354	C	S	.	.			trans	-115.8	121.8	176.3	-52.2	175.9	0	0	0	107.8	V334 S335 L336 F365 F369 E372 V384 L385	V334-I367 HydrophobicContact CG1-CD1 3.83Å; V334-I367 HydrophobicContact CG1-CG1 4.38Å; S335-I367 PolarHBondContact O-N 2.84Å; L336-I367 HydrophobicContact CD2-CB 3.95Å; L336-I367 HydrophobicContact CD2-CD1 4.02Å; L336-I367 HydrophobicContact CD2-CG1 4.35Å; F365-I367 HydrophobicContact CD1-CD1 3.8Å; F365-I367 HydrophobicContact CD1-CG1 3.57Å; F365-I367 HydrophobicContact CE1-CD1 3.58Å; F365-I367 HydrophobicContact CE1-CG1 3.44Å; F365-I367 VanDerWaalsContact CE1-CG1 3.44Å; I367-F369 VanDerWaalsContact C-N 3.31Å; I367-F369 PolarHBondContact O-N 3.39Å; I367-E372 HydrophobicContact CG2-CG 4.05Å; I367-V384 HydrophobicContact CD1-CG1 4.1Å; I367-V384 HydrophobicContact CG1-CG1 4.16Å; I367-V384 HydrophobicContact CG2-CG1 4.35Å; I367-L385 HydrophobicContact CD1-CD2 3.92Å
368	D	75	Confident	73.9	Confident	16 Å²	16	68.5 Å²	68.5	9%	0.086	37%	0.373	C	S	.	.			trans	-77.3	90.6	167.9	-165	-44.1	0	0	0	108.5	K339 H370 E371 E372	K339-D368 WeakPolarHBondContact CB-OD2 3.41Å; K339-D368 HydrophobicContact CD-CB 4.15Å; K339-D368 HydrophobicContact CG-CB 4.18Å; K339-D368 PolarHBondContact N-OD2 2.89Å; D368-H370 PolarHBondContact O-N 3.11Å; D368-H370 PolarHBondContact OD1-N 3.2Å; D368-E371 HydrophobicContact CB-CB 3.95Å; D368-E371 PolarHBondContact O-N 2.79Å; D368-E371 PolarHBondContact OD1-N 2.88Å; D368-E371 VanDerWaalsContact OD1-N 3.14Å; D368-E372 WeakPolarHBondContact O-CG 3.32Å; D368-E372 PolarHBondContact O-N 3.47Å
369	F	68.4	Low	73.1	Confident	22 Å²	22	73.4 Å²	73.4	10%	0.096	38%	0.377	C	S	.	.	H	α-helix	trans	-57.8	-37.3	-174.8	-172.9	-87.4	0	0	0	111.8	I367 C373 W378 I381 R420 V423 V424	I367-F369 VanDerWaalsContact C-N 3.31Å; I367-F369 PolarHBondContact O-N 3.39Å; F369-C373 HydrophobicContact CD1-CB 4.37Å; F369-C373 HydrophobicContact CE1-CB 4.22Å; F369-C373 WeakPolarHBondContact CE1-SG 3.44Å; F369-C373 WeakPolarHBondContact CZ-SG 3.46Å; F369-C373 WeakPolarHBondContact O-CB 3.28Å; F369-C373 PolarHBondContact O-N 2.88Å; F369-C373 PolarHBondContact O-SG 2.86Å; F369-W378 HydrophobicContact CZ-CZ3 4.47Å; F369-I381 HydrophobicContact CE2-CD1 4.17Å; F369-R420 HydrophobicContact CD1-CB 4.34Å; F369-R420 HydrophobicContact CD1-CG 3.55Å; F369-R420 HydrophobicContact CD2-CB 4.19Å; F369-R420 HydrophobicContact CD2-CG 4.28Å; F369-R420 HydrophobicContact CE1-CB 4.4Å; F369-R420 HydrophobicContact CE1-CG 3.68Å; F369-R420 HydrophobicContact CE2-CB 4.24Å; F369-R420 HydrophobicContact CE2-CG 4.38Å; F369-R420 HydrophobicContact CG-CB 4.22Å; F369-R420 HydrophobicContact CG-CG 3.87Å; F369-R420 HydrophobicContact CZ-CB 4.34Å; F369-R420 HydrophobicContact CZ-CG 4.09Å; F369-V423 HydrophobicContact CE2-CB 4.3Å; F369-V423 HydrophobicContact CE2-CG1 4.3Å; F369-V423 HydrophobicContact CZ-CB 4.37Å; F369-V423 HydrophobicContact CZ-CG1 4.45Å; F369-V423 HydrophobicContact CZ-CG2 4.47Å; F369-V424 HydrophobicContact CD2-CG2 4.3Å; F369-V424 HydrophobicContact CE2-CG2 4.22Å
370	H	69.1	Low	72.6	Confident	101 Å²	101	77.4 Å²	77.4	47%	0.468	39%	0.389	S	S	.	.	H	α-helix	trans	-71.4	-37	-178.8	-80.7	53.1	0	0	0	112	N338 D368 K374	N338-H370 PolarHBondContact ND2-ND1 2.89Å; N338-H370 PolarHBondContact OD1-ND1 2.82Å; D368-H370 PolarHBondContact O-N 3.11Å; D368-H370 PolarHBondContact OD1-N 3.2Å; H370-K374 VanDerWaalsContact O-CG 3.23Å; H370-K374 WeakPolarHBondContact O-CG 3.31Å; H370-K374 PolarHBondContact O-N 2.94Å
371	E	63.7	Low	72.3	Confident	107 Å²	107	72.7 Å²	72.7	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-69.4	-44.7	177.2	-169.4	167.4	-157.3	0	0	112.3	D368 C373 K374	D368-E371 HydrophobicContact CB-CB 3.95Å; D368-E371 PolarHBondContact O-N 2.79Å; D368-E371 PolarHBondContact OD1-N 2.88Å; D368-E371 VanDerWaalsContact OD1-N 3.14Å; E371-C373 VanDerWaalsContact C-N 3.35Å; E371-K374 PolarHBondContact O-N 2.83Å
372	E	64.2	Low	71.8	Confident	61 Å²	61	69 Å²	69	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-71	-30.6	-179.7	-65	-64.2	170.1	0	0	112.6	I367 D368 V384	I367-E372 HydrophobicContact CG2-CG 4.05Å; D368-E372 WeakPolarHBondContact O-CG 3.32Å; D368-E372 PolarHBondContact O-N 3.47Å; E372-V384 HydrophobicContact CG-CG2 4.43Å
373	C	59.6	Low	71.2	Confident	19 Å²	19	73.4 Å²	73.4	13%	0.128	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	3.1	178.6	-61.5	0	0	0	0	114.6	F369 E371 S375 M376 I381	F369-C373 HydrophobicContact CD1-CB 4.37Å; F369-C373 HydrophobicContact CE1-CB 4.22Å; F369-C373 WeakPolarHBondContact CE1-SG 3.44Å; F369-C373 WeakPolarHBondContact CZ-SG 3.46Å; F369-C373 WeakPolarHBondContact O-CB 3.28Å; F369-C373 PolarHBondContact O-N 2.88Å; F369-C373 PolarHBondContact O-SG 2.86Å; E371-C373 VanDerWaalsContact C-N 3.35Å; C373-S375 PolarHBondContact O-N 2.86Å; C373-S375 VanDerWaalsContact O-N 3.1Å; C373-M376 PolarHBondContact O-N 2.66Å; C373-I381 WeakPolarHBondContact SG-CD1 3.38Å
374	K	60.8	Low	70.6	Confident	132 Å²	132	70.7 Å²	70.7	57%	0.574	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	125.7	178.7	-74.7	-175	-178.7	164.5	0	109.4	H370 E371	H370-K374 VanDerWaalsContact O-CG 3.23Å; H370-K374 WeakPolarHBondContact O-CG 3.31Å; H370-K374 PolarHBondContact O-N 2.94Å; E371-K374 PolarHBondContact O-N 2.83Å
375	S	58.3	Low	70	Confident	120 Å²	120	68 Å²	68	84%	0.839	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	30.3	-176.8	-47.6	0	0	0	0	116.3	C373 N377	C373-S375 PolarHBondContact O-N 2.86Å; C373-S375 VanDerWaalsContact O-N 3.1Å; S375-N377 PolarHBondContact O-N 2.88Å
376	M	56.7	Low	69.8	Low	132 Å²	132	69 Å²	69	65%	0.65	34%	0.338	S	S	*	.	S	Bend	trans	58.6	30.1	175.1	-63	-75.7	-90.3	0	0	113.2	C373 W378	C373-M376 PolarHBondContact O-N 2.66Å; M376-W378 VanDerWaalsContact C-N 3.29Å; M376-W378 HydrophobicContact CE-CH2 4.5Å; M376-W378 HydrophobicContact CE-CZ2 3.58Å; M376-W378 PolarHBondContact O-N 2.89Å; M376-W378 PolarHBondContact O-NE1 3.37Å; M376-W378 HydrophobicContact SD-CH2 4.18Å; M376-W378 HydrophobicContact SD-CZ2 3.62Å
377	N	61.9	Low	69.7	Low	63 Å²	63	75.3 Å²	75.3	34%	0.337	35%	0.354	S	S	.	.			trans	-86.6	69.1	-171.9	-149.8	-12	0	0	0	111.5	S375 K379 R380	S375-N377 PolarHBondContact O-N 2.88Å; N377-K379 PolarHBondContact O-N 2.82Å; N377-R380 PolarHBondContact O-N 2.85Å
378	W	63.2	Low	69.9	Low	119 Å²	119	75.1 Å²	75.1	45%	0.451	35%	0.353	S	S	.	.	H	α-helix	trans	-51.5	-27.7	-176.6	-52.3	111.9	0	0	0	114.3	F369 M376 R380 I381 G382 V423	F369-W378 HydrophobicContact CZ-CZ3 4.47Å; M376-W378 VanDerWaalsContact C-N 3.29Å; M376-W378 HydrophobicContact CE-CH2 4.5Å; M376-W378 HydrophobicContact CE-CZ2 3.58Å; M376-W378 PolarHBondContact O-N 2.89Å; M376-W378 PolarHBondContact O-NE1 3.37Å; M376-W378 HydrophobicContact SD-CH2 4.18Å; M376-W378 HydrophobicContact SD-CZ2 3.62Å; W378-R380 VanDerWaalsContact C-N 3.29Å; W378-R380 PolarHBondContact O-N 2.58Å; W378-I381 HydrophobicContact CE3-CD1 3.68Å; W378-I381 HydrophobicContact CZ3-CD1 4.06Å; W378-I381 PolarHBondContact O-N 3.39Å; W378-G382 PolarHBondContact O-N 3.23Å; W378-G382 VanDerWaalsContact O-N 3.08Å; W378-V423 HydrophobicContact CE3-CG1 4.11Å; W378-V423 HydrophobicContact CZ3-CG1 3.84Å; W378-V423 HydrophobicContact CZ3-CG2 4.22Å
379	K	66.4	Low	70.3	Confident	164 Å²	164	75.9 Å²	75.9	71%	0.713	36%	0.358	S	S	*	.	H	α-helix	trans	-59.7	-36.5	175.9	-67.8	-174.5	177.4	-177.8	0	112.6	N377 G382 H383	N377-K379 PolarHBondContact O-N 2.82Å; K379-G382 PolarHBondContact O-N 2.82Å; K379-H383 PolarHBondContact O-CD2 2.92Å; K379-H383 PolarHBondContact O-N 2.87Å; K379-H383 VanDerWaalsContact O-N 3.1Å
380	R	71.1	Confident	71	Confident	129 Å²	129	78.7 Å²	78.7	49%	0.487	38%	0.379	S	S	.	.	H	α-helix	trans	-66	-44.8	178.3	-72.3	-172.3	-174.2	-178.9	1.5	111.9	N377 W378 G382 H383 V384	N377-R380 PolarHBondContact O-N 2.85Å; W378-R380 VanDerWaalsContact C-N 3.29Å; W378-R380 PolarHBondContact O-N 2.58Å; R380-G382 VanDerWaalsContact C-N 3.26Å; R380-G382 PolarHBondContact O-N 2.89Å; R380-H383 WeakPolarHBondContact O-CB 3.35Å; R380-H383 PolarHBondContact O-N 2.83Å; R380-H383 VanDerWaalsContact O-N 3.14Å; R380-V384 WeakPolarHBondContact O-CG2 3.26Å; R380-V384 PolarHBondContact O-N 2.77Å
381	I	71.9	Confident	71.8	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-58.8	-43.4	174.5	-53.1	169.6	0	0	0	109.9	F369 C373 W378 H383 V384 L385 V423 L427	F369-I381 HydrophobicContact CE2-CD1 4.17Å; C373-I381 WeakPolarHBondContact SG-CD1 3.38Å; W378-I381 HydrophobicContact CE3-CD1 3.68Å; W378-I381 HydrophobicContact CZ3-CD1 4.06Å; W378-I381 PolarHBondContact O-N 3.39Å; I381-H383 VanDerWaalsContact C-N 3.32Å; I381-H383 PolarHBondContact O-N 2.86Å; I381-V384 PolarHBondContact O-N 3.48Å; I381-V384 VanDerWaalsContact O-N 3.1Å; I381-L385 HydrophobicContact CG2-CD1 3.76Å; I381-L385 HydrophobicContact CG2-CG 4.02Å; I381-L385 WeakPolarHBondContact O-CB 3.45Å; I381-L385 WeakPolarHBondContact O-CG 3.28Å; I381-L385 PolarHBondContact O-N 3.3Å; I381-V423 HydrophobicContact CD1-CG1 4.42Å; I381-L427 HydrophobicContact CB-CD1 4.4Å; I381-L427 HydrophobicContact CG2-CD1 3.84Å
382	G	72.8	Confident	72.7	Confident	9 Å²	9	69.3 Å²	69.3	9%	0.093	34%	0.335	C	S	.	.	H	α-helix	trans	-51	-51.1	174.3	0	0	0	0	0	111.9	W378 K379 R380 V384 L385 D386	W378-G382 PolarHBondContact O-N 3.23Å; W378-G382 VanDerWaalsContact O-N 3.08Å; K379-G382 PolarHBondContact O-N 2.82Å; R380-G382 VanDerWaalsContact C-N 3.26Å; R380-G382 PolarHBondContact O-N 2.89Å; G382-V384 VanDerWaalsContact C-N 3.34Å; G382-V384 PolarHBondContact O-N 2.97Å; G382-L385 CarbonylContact O-C 3.04Å; G382-L385 PolarHBondContact O-N 2.88Å; G382-L385 VanDerWaalsContact O-N 3.16Å; G382-D386 PolarHBondContact O-N 2.96Å
383	H	76	Confident	73.4	Confident	129 Å²	129	72 Å²	72	60%	0.597	35%	0.346	S	S	*	.	H	α-helix	trans	-62.7	-35.7	177.1	-68.5	-54.7	0	0	0	114.1	K379 R380 I381 D386	K379-H383 PolarHBondContact O-CD2 2.92Å; K379-H383 PolarHBondContact O-N 2.87Å; K379-H383 VanDerWaalsContact O-N 3.1Å; R380-H383 WeakPolarHBondContact O-CB 3.35Å; R380-H383 PolarHBondContact O-N 2.83Å; R380-H383 VanDerWaalsContact O-N 3.14Å; I381-H383 VanDerWaalsContact C-N 3.32Å; I381-H383 PolarHBondContact O-N 2.86Å; H383-D386 IonicContact ND1-OD2 3.55Å
384	V	76.9	Confident	74.4	Confident	18 Å²	18	77 Å²	77	11%	0.109	36%	0.362	C	S	.	.	H	α-helix	trans	-67.8	-41	174.7	175	0	0	0	0	110.5	F365 I367 E372 R380 I381 G382 D386 R387	F365-V384 HydrophobicContact CE1-CG1 3.84Å; F365-V384 HydrophobicContact CZ-CG1 3.92Å; I367-V384 HydrophobicContact CD1-CG1 4.1Å; I367-V384 HydrophobicContact CG1-CG1 4.16Å; I367-V384 HydrophobicContact CG2-CG1 4.35Å; E372-V384 HydrophobicContact CG-CG2 4.43Å; R380-V384 WeakPolarHBondContact O-CG2 3.26Å; R380-V384 PolarHBondContact O-N 2.77Å; I381-V384 PolarHBondContact O-N 3.48Å; I381-V384 VanDerWaalsContact O-N 3.1Å; G382-V384 VanDerWaalsContact C-N 3.34Å; G382-V384 PolarHBondContact O-N 2.97Å; V384-D386 VanDerWaalsContact C-N 3.35Å; V384-R387 VanDerWaalsContact O-CB 3.27Å; V384-R387 WeakPolarHBondContact O-CB 3.43Å; V384-R387 WeakPolarHBondContact O-CG 3.37Å; V384-R387 PolarHBondContact O-N 3.33Å
385	L	78.7	Confident	75.2	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-74	-23.2	178	-66.3	178.4	0	0	0	113.2	I367 I381 G382 R387 L388 V424 L427 I428	I367-L385 HydrophobicContact CD1-CD2 3.92Å; I381-L385 HydrophobicContact CG2-CD1 3.76Å; I381-L385 HydrophobicContact CG2-CG 4.02Å; I381-L385 WeakPolarHBondContact O-CB 3.45Å; I381-L385 WeakPolarHBondContact O-CG 3.28Å; I381-L385 PolarHBondContact O-N 3.3Å; G382-L385 CarbonylContact O-C 3.04Å; G382-L385 PolarHBondContact O-N 2.88Å; G382-L385 VanDerWaalsContact O-N 3.16Å; L385-R387 PolarHBondContact O-N 3.39Å; L385-R387 VanDerWaalsContact O-N 3.12Å; L385-L388 HydrophobicContact CD2-CD1 3.67Å; L385-L388 WeakPolarHBondContact O-CA 3.38Å; L385-L388 VanDerWaalsContact O-CB 3.3Å; L385-L388 WeakPolarHBondContact O-CB 3.35Å; L385-L388 PolarHBondContact O-N 3.4Å; L385-V424 HydrophobicContact CD1-CG1 4.38Å; L385-V424 HydrophobicContact CD2-CG1 3.87Å; L385-L427 HydrophobicContact CD1-CB 3.38Å; L385-L427 HydrophobicContact CD1-CD1 3.53Å; L385-L427 HydrophobicContact CD1-CG 4.09Å; L385-I428 HydrophobicContact CD2-CG1 4.43Å
386	D	82.9	Confident	75.9	Confident	59 Å²	59	67.7 Å²	67.7	32%	0.316	31%	0.305	S	S	.	.	H	α-helix	trans	-59.5	-24.3	172.1	-66.7	-24.8	0	0	0	111	G382 H383 V384 L388 V389 R431	G382-D386 PolarHBondContact O-N 2.96Å; H383-D386 IonicContact ND1-OD2 3.55Å; V384-D386 VanDerWaalsContact C-N 3.35Å; D386-L388 PolarHBondContact O-N 2.7Å; D386-V389 WeakPolarHBondContact O-CB 3.4Å; D386-V389 PolarHBondContact O-N 3.41Å; D386-R431 IonicContact OD1-CZ 3.78Å; D386-R431 IonicContact OD1-NE 3.94Å; D386-R431 PolarHBondContact OD1-NE 3.1Å; D386-R431 IonicContact OD1-NH2 3.37Å; D386-R431 PolarHBondContact OD1-NH2 2.87Å
387	R	84.9	Confident	76.3	Confident	171 Å²	171	68.4 Å²	68.4	65%	0.645	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.3	171.3	-58.2	178.8	176.3	177.6	-0.5	113.8	F365 V384 L385	F365-R387 HydrophobicContact CZ-CB 4.34Å; V384-R387 VanDerWaalsContact O-CB 3.27Å; V384-R387 WeakPolarHBondContact O-CB 3.43Å; V384-R387 WeakPolarHBondContact O-CG 3.37Å; V384-R387 PolarHBondContact O-N 3.33Å; L385-R387 PolarHBondContact O-N 3.39Å; L385-R387 VanDerWaalsContact O-N 3.12Å
388	L	85.3	Confident	76.1	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-13.3	176.4	-58.7	179.7	0	0	0	112.6	V332 V334 F365 L385 D386 P390 D391 I392 F410 I428	V332-L388 HydrophobicContact CG1-CD2 4.35Å; V334-L388 HydrophobicContact CG2-CD1 3.88Å; F365-L388 HydrophobicContact CB-CD2 4.37Å; F365-L388 HydrophobicContact CD1-CD1 4.37Å; F365-L388 HydrophobicContact CD1-CD2 3.97Å; F365-L388 HydrophobicContact CD1-CG 4.44Å; F365-L388 HydrophobicContact CD2-CD2 4.16Å; F365-L388 HydrophobicContact CE1-CD2 4.24Å; F365-L388 HydrophobicContact CE1-CG 4.38Å; F365-L388 HydrophobicContact CE2-CD2 4.43Å; F365-L388 HydrophobicContact CG-CD2 3.92Å; F365-L388 HydrophobicContact CZ-CD2 4.46Å; L385-L388 HydrophobicContact CD2-CD1 3.67Å; L385-L388 WeakPolarHBondContact O-CA 3.38Å; L385-L388 VanDerWaalsContact O-CB 3.3Å; L385-L388 WeakPolarHBondContact O-CB 3.35Å; L385-L388 PolarHBondContact O-N 3.4Å; D386-L388 PolarHBondContact O-N 2.7Å; L388-P390 VanDerWaalsContact C-CD 3.47Å; L388-P390 VanDerWaalsContact C-N 3.34Å; L388-D391 WeakPolarHBondContact O-CA 3.36Å; L388-D391 WeakPolarHBondContact O-CB 3.36Å; L388-D391 PolarHBondContact O-N 2.71Å; L388-I392 PolarHBondContact O-N 2.78Å; L388-F410 HydrophobicContact CB-CE1 3.89Å; L388-F410 HydrophobicContact CB-CZ 4.26Å; L388-F410 HydrophobicContact CD1-CD1 4.39Å; L388-F410 HydrophobicContact CD1-CE1 4.12Å; L388-F410 HydrophobicContact CD2-CE1 4.22Å; L388-F410 HydrophobicContact CG-CE1 4.3Å; L388-I428 HydrophobicContact CD1-CD1 4.25Å
389	V	82.4	Confident	75.4	Confident	31 Å²	31	69.9 Å²	69.9	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-56.5	-40.6	177.4	174	0	0	0	0	112.8	D386 D391 I392 K393 R431	D386-V389 WeakPolarHBondContact O-CB 3.4Å; D386-V389 PolarHBondContact O-N 3.41Å; V389-D391 PolarHBondContact O-N 3.21Å; V389-I392 WeakPolarHBondContact O-CB 3.33Å; V389-I392 PolarHBondContact O-N 3.3Å; V389-K393 PolarHBondContact O-N 3.49Å; V389-R431 HydrophobicContact CG2-CB 4.26Å; V389-R431 HydrophobicContact CG2-CG 4.14Å
390	P	84.3	Confident	74.5	Confident	82 Å²	82	70.2 Å²	70.2	53%	0.532	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-35.5	172.3	-24.2	35.1	0	0	0	112.7	L388 K393 R394	L388-P390 VanDerWaalsContact C-CD 3.47Å; L388-P390 VanDerWaalsContact C-N 3.34Å; P390-K393 PolarHBondContact O-N 2.87Å; P390-R394 WeakPolarHBondContact O-CB 3.42Å; P390-R394 PolarHBondContact O-N 2.93Å
391	D	85.5	Confident	73.4	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-37.4	176.1	-58	-69	0	0	0	111.4	V332 K363 L388 V389 K393 R394 L395 F410	V332-D391 HydrophobicContact CG2-CB 4.24Å; K363-D391 WeakPolarHBondContact CD-OD1 3.34Å; K363-D391 IonicContact NZ-OD1 2.63Å; K363-D391 PolarHBondContact NZ-OD1 2.86Å; K363-D391 IonicContact NZ-OD2 3.66Å; K363-D391 PolarHBondContact NZ-OD2 2.69Å; L388-D391 WeakPolarHBondContact O-CA 3.36Å; L388-D391 WeakPolarHBondContact O-CB 3.36Å; L388-D391 PolarHBondContact O-N 2.71Å; V389-D391 PolarHBondContact O-N 3.21Å; D391-K393 PolarHBondContact O-N 3.22Å; D391-R394 PolarHBondContact O-N 3.32Å; D391-R394 VanDerWaalsContact O-N 3.17Å; D391-R394 IonicContact OD1-NE 3.4Å; D391-L395 VanDerWaalsContact O-CB 3.28Å; D391-L395 WeakPolarHBondContact O-CB 3.24Å; D391-L395 WeakPolarHBondContact O-CG 3.37Å; D391-L395 PolarHBondContact O-N 3.1Å; D391-F410 HydrophobicContact CB-CE1 4.08Å; D391-F410 HydrophobicContact CB-CZ 3.73Å
392	I	82.2	Confident	72.5	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-55.1	-42.4	173.8	-64.2	173.6	0	0	0	110.6	L388 V389 F410 I428 R431 A432 V435	L388-I392 PolarHBondContact O-N 2.78Å; V389-I392 WeakPolarHBondContact O-CB 3.33Å; V389-I392 PolarHBondContact O-N 3.3Å; I392-F410 HydrophobicContact CB-CE2 4.4Å; I392-F410 HydrophobicContact CG1-CE2 3.54Å; I392-F410 HydrophobicContact CG1-CZ 3.66Å; I392-I428 HydrophobicContact CD1-CG2 4.25Å; I392-R431 HydrophobicContact CD1-CB 3.63Å; I392-A432 HydrophobicContact CG2-CB 4.18Å; I392-V435 HydrophobicContact CG2-CG2 4.47Å
393	K	79.2	Confident	72	Confident	116 Å²	116	81.1 Å²	81.1	50%	0.504	39%	0.388	S	S	.	.	H	α-helix	trans	-71.4	-45.2	176.3	-66	-176.5	178.7	-175	0	112	V389 P390 D391 L395 R396 V435	V389-K393 PolarHBondContact O-N 3.49Å; P390-K393 PolarHBondContact O-N 2.87Å; D391-K393 PolarHBondContact O-N 3.22Å; K393-L395 VanDerWaalsContact C-N 3.27Å; K393-L395 PolarHBondContact O-N 3.43Å; K393-R396 PolarHBondContact O-N 2.79Å; K393-R396 VanDerWaalsContact O-N 3.11Å; K393-V435 HydrophobicContact CG-CG1 4.2Å; K393-V435 HydrophobicContact CG-CG2 4.49Å
394	R	80.1	Confident	71.9	Confident	125 Å²	125	77.1 Å²	77.1	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-34.9	179.6	-174.1	-180	75.2	98.5	-0.2	112.9	P390 D391 R396	P390-R394 WeakPolarHBondContact O-CB 3.42Å; P390-R394 PolarHBondContact O-N 2.93Å; D391-R394 PolarHBondContact O-N 3.32Å; D391-R394 VanDerWaalsContact O-N 3.17Å; D391-R394 IonicContact OD1-NE 3.4Å; R394-R396 PolarHBondContact O-N 3.46Å
395	L	78.9	Confident	72.2	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.005	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	2.8	179.9	-68.4	179.1	0	0	0	112.9	H330 V332 D391 K393 Q406 I407 F410	H330-L395 HydrophobicContact CB-CD2 4.03Å; V332-L395 HydrophobicContact CG2-CD1 3.96Å; V332-L395 HydrophobicContact CG2-CD2 4.49Å; D391-L395 VanDerWaalsContact O-CB 3.28Å; D391-L395 WeakPolarHBondContact O-CB 3.24Å; D391-L395 WeakPolarHBondContact O-CG 3.37Å; D391-L395 PolarHBondContact O-N 3.1Å; K393-L395 VanDerWaalsContact C-N 3.27Å; K393-L395 PolarHBondContact O-N 3.43Å; L395-Q406 CarbonylContact O-C 3.58Å; L395-Q406 VanDerWaalsContact O-CA 3.24Å; L395-Q406 WeakPolarHBondContact O-CA 3.5Å; L395-I407 WeakPolarHBondContact O-CG1 3.49Å; L395-I407 PolarHBondContact O-N 3.14Å; L395-F410 HydrophobicContact CD1-CD2 4.08Å; L395-F410 HydrophobicContact CD1-CE2 3.7Å; L395-F410 HydrophobicContact CD1-CZ 4.07Å
396	R	73.3	Confident	72.6	Confident	56 Å²	56	79.5 Å²	79.5	21%	0.211	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.9	172.1	-62	177.2	68.8	160.2	0	109.3	K393 R394 S404 N405 Q436	K393-R396 PolarHBondContact O-N 2.79Å; K393-R396 VanDerWaalsContact O-N 3.11Å; R394-R396 PolarHBondContact O-N 3.46Å; R396-S404 PolarHBondContact NE-OG 2.65Å; R396-S404 PolarHBondContact NH2-OG 2.95Å; R396-N405 CarbonylContact C-O 3.5Å; R396-N405 WeakPolarHBondContact CA-O 3.48Å; R396-Q436 VanDerWaalsContact NH1-CG 3.26Å
397	K	64.2	Low	72.9	Confident	146 Å²	146	79.1 Å²	79.1	64%	0.635	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.8	175.2	-173.6	178.9	179	-178.8	0	109.2	S404 N405 I407	K397-S404 CarbonylContact O-C 3.59Å; K397-S404 WeakPolarHBondContact O-CA 3.19Å; K397-N405 PolarHBondContact N-O 2.92Å; K397-N405 PolarHBondContact O-N 2.84Å; K397-I407 HydrophobicContact CB-CB 4.48Å; K397-I407 HydrophobicContact CB-CD1 4.19Å; K397-I407 HydrophobicContact CB-CG1 4.31Å; K397-I407 HydrophobicContact CB-CG2 3.42Å; K397-I407 VanDerWaalsContact CB-CG2 3.42Å; K397-I407 HydrophobicContact CD-CG2 3.94Å; K397-I407 HydrophobicContact CG-CG2 4.32Å
398	G	57.5	Low	73.1	Confident	44 Å²	44	71 Å²	71	45%	0.454	35%	0.353	S	S	.	.			trans	163.2	123.4	174	0	0	0	0	0	111.3
399	D	48.8	Very low	73.5	Confident	170 Å²	170	71 Å²	71	91%	0.909	35%	0.353	S	S	*	.	S	Bend	trans	-86	-20.9	173.7	-68.9	-26.3	0	0	0	112
400	K	47.1	Very low	73.9	Confident	171 Å²	171	69.5 Å²	69.5	74%	0.743	34%	0.344	S	S	*	.	S	Bend	trans	-101.3	132.1	-178.8	-66.9	-175.8	178.7	-178.3	0	109.8	E402 I403	K400-E402 PolarHBondContact O-N 2.69Å; K400-I403 PolarHBondContact O-N 2.83Å
401	F	48.9	Very low	74.2	Confident	97 Å²	97	65.6 Å²	65.6	43%	0.425	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-25.7	-177.8	-77	-99.8	0	0	0	114.1	C439 V442 W443	F401-C439 WeakPolarHBondContact CE1-O 3.35Å; F401-V442 HydrophobicContact CZ-CG1 4.44Å; F401-W443 HydrophobicContact CB-CE3 4.09Å; F401-W443 HydrophobicContact CB-CZ3 4.08Å; F401-W443 HydrophobicContact CD1-CB 4.2Å; F401-W443 HydrophobicContact CD1-CD2 4.28Å; F401-W443 AromaticContact CD1-CE3 3.67Å; F401-W443 HydrophobicContact CD1-CE3 3.67Å; F401-W443 HydrophobicContact CD1-CZ3 4.39Å; F401-W443 HydrophobicContact CD2-CD2 4.48Å; F401-W443 AromaticContact CD2-CE3 3.26Å; F401-W443 HydrophobicContact CD2-CE3 3.26Å; F401-W443 HydrophobicContact CD2-CH2 4.4Å; F401-W443 AromaticContact CD2-CZ3 3.21Å; F401-W443 HydrophobicContact CD2-CZ3 3.21Å; F401-W443 HydrophobicContact CE1-CB 3.98Å; F401-W443 AromaticContact CE1-CE3 3.83Å; F401-W443 HydrophobicContact CE1-CE3 3.83Å; F401-W443 AromaticContact CE2-CE3 3.44Å; F401-W443 HydrophobicContact CE2-CE3 3.44Å; F401-W443 VanDerWaalsContact CE2-CE3 3.44Å; F401-W443 AromaticContact CE2-CZ3 3.64Å; F401-W443 HydrophobicContact CE2-CZ3 3.64Å; F401-W443 HydrophobicContact CG-CD2 4.26Å; F401-W443 AromaticContact CG-CE3 3.38Å; F401-W443 HydrophobicContact CG-CE3 3.38Å; F401-W443 AromaticContact CG-CZ3 3.65Å; F401-W443 HydrophobicContact CG-CZ3 3.65Å; F401-W443 AromaticContact CZ-CE3 3.72Å; F401-W443 HydrophobicContact CZ-CE3 3.72Å; F401-W443 HydrophobicContact CZ-CZ3 4.38Å
402	E	52.8	Low	74.2	Confident	161 Å²	161	65.3 Å²	65.3	75%	0.752	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-30.9	-170	-69.7	178.9	158.3	0	0	114.2	K400	K400-E402 PolarHBondContact O-N 2.69Å
403	I	62.5	Low	74.1	Confident	109 Å²	109	65.1 Å²	65.1	56%	0.559	32%	0.316	S	S	*	.			trans	-145.2	95.8	-177.8	-49.5	177.4	0	0	0	110	K400	K400-I403 PolarHBondContact O-N 2.83Å
404	S	72.7	Confident	73.5	Confident	45 Å²	45	59.6 Å²	59.6	32%	0.315	29%	0.292	S	S	.	.			trans	-100.1	120.7	167.4	75.1	0	0	0	0	109.7	R396 K397	R396-S404 PolarHBondContact NE-OG 2.65Å; R396-S404 PolarHBondContact NH2-OG 2.95Å; K397-S404 CarbonylContact O-C 3.59Å; K397-S404 WeakPolarHBondContact O-CA 3.19Å
405	N	84.4	Confident	72.8	Confident	55 Å²	55	53.8 Å²	53.8	29%	0.294	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.2	173.9	-74.5	-35.6	0	0	0	110.2	R396 K397 I407	R396-N405 CarbonylContact C-O 3.5Å; R396-N405 WeakPolarHBondContact CA-O 3.48Å; K397-N405 PolarHBondContact N-O 2.92Å; K397-N405 PolarHBondContact O-N 2.84Å; N405-I407 PolarHBondContact O-N 2.82Å
406	Q	86.9	Confident	71.8	Confident	18 Å²	18	54.8 Å²	54.8	8%	0.084	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	111.5	165.9	-176.3	172.9	-31.1	0	0	108.7	Q163 F283 V284 L395 G408	Q163-Q406 PolarHBondContact NE2-O 3.14Å; Q163-Q406 VanDerWaalsContact OE1-CB 3.31Å; F283-Q406 VanDerWaalsContact CD2-OE1 3.23Å; V284-Q406 PolarHBondContact O-NE2 2.64Å; L395-Q406 CarbonylContact O-C 3.58Å; L395-Q406 VanDerWaalsContact O-CA 3.24Å; L395-Q406 WeakPolarHBondContact O-CA 3.5Å; Q406-G408 WeakPolarHBondContact CG-O 3.47Å; Q406-G408 PolarHBondContact NE2-O 2.88Å
407	I	89.2	Confident	71	Confident	51 Å²	51	53 Å²	53	26%	0.262	27%	0.272	S	S	.	.			trans	-93.5	4.3	-176.5	58.3	163.5	0	0	0	113.4	Y328 G329 H330 L395 K397 N405	Y328-I407 CarbonylContact O-C 3.53Å; G329-I407 CarbonylContact C-O 3.51Å; G329-I407 WeakPolarHBondContact CA-O 3.36Å; H330-I407 PolarHBondContact CD2-O 2.96Å; H330-I407 PolarHBondContact N-O 2.84Å; L395-I407 WeakPolarHBondContact O-CG1 3.49Å; L395-I407 PolarHBondContact O-N 3.14Å; K397-I407 HydrophobicContact CB-CB 4.48Å; K397-I407 HydrophobicContact CB-CD1 4.19Å; K397-I407 HydrophobicContact CB-CG1 4.31Å; K397-I407 HydrophobicContact CB-CG2 3.42Å; K397-I407 VanDerWaalsContact CB-CG2 3.42Å; K397-I407 HydrophobicContact CD-CG2 3.94Å; K397-I407 HydrophobicContact CG-CG2 4.32Å; N405-I407 PolarHBondContact O-N 2.82Å
408	G	89.6	Confident	70.7	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	174.3	175.2	0	0	0	0	0	111.5	Y328 H330 Q406	Y328-G408 VanDerWaalsContact O-CA 3.25Å; Y328-G408 WeakPolarHBondContact O-CA 3.4Å; Y328-G408 PolarHBondContact O-N 3.05Å; H330-G408 CarbonylContact O-C 3.56Å; H330-G408 WeakPolarHBondContact O-CA 3.33Å; Q406-G408 WeakPolarHBondContact CG-O 3.47Å; Q406-G408 PolarHBondContact NE2-O 2.88Å
409	L	92.3	Very high	70.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	169.4	-173.8	63.5	71.6	0	0	0	113.9	V284 T286 Y328 H330 Q331 V332 R411	V284-L409 HydrophobicContact CG1-CD2 4.45Å; T286-L409 HydrophobicContact CG2-CD1 4.24Å; T286-L409 HydrophobicContact CG2-CD2 3.6Å; T286-L409 VanDerWaalsContact OG1-CD1 3.29Å; T286-L409 WeakPolarHBondContact OG1-CD1 3.42Å; Y328-L409 VanDerWaalsContact CB-CD2 3.4Å; Y328-L409 HydrophobicContact CD1-CD2 3.35Å; Y328-L409 HydrophobicContact CD2-CD2 3.7Å; Y328-L409 HydrophobicContact CE1-CD2 3.96Å; Y328-L409 HydrophobicContact CE2-CD2 4.28Å; Y328-L409 HydrophobicContact CG-CD2 3.19Å; Y328-L409 HydrophobicContact CG-CG 4.11Å; H330-L409 PolarHBondContact O-N 3.08Å; Q331-L409 VanDerWaalsContact OE1-CD1 3.26Å; V332-L409 PolarHBondContact N-O 3.28Å; L409-R411 HydrophobicContact CD1-CB 4.11Å
410	F	91.6	Very high	71.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119	167.8	-64.5	-88.4	0	0	0	109.8	F283 Q285 T286 V332 V334 L388 D391 I392 L395 I428	F283-F410 HydrophobicContact CE2-CD2 4.49Å; F283-F410 AromaticContact CZ-CD2 3.96Å; F283-F410 HydrophobicContact CZ-CD2 3.96Å; F283-F410 HydrophobicContact CZ-CE2 4.22Å; Q285-F410 HydrophobicContact CG-CB 4.49Å; T286-F410 PolarHBondContact N-O 3Å; V332-F410 HydrophobicContact CB-CD1 3.72Å; V332-F410 HydrophobicContact CB-CE1 3.88Å; V332-F410 HydrophobicContact CB-CG 4.45Å; V332-F410 HydrophobicContact CG1-CD1 3.65Å; V332-F410 HydrophobicContact CG1-CE1 3.63Å; V332-F410 HydrophobicContact CG2-CE1 4.32Å; V332-F410 CarbonylContact O-C 3.58Å; V332-F410 WeakPolarHBondContact O-CA 3.29Å; V334-F410 HydrophobicContact CG2-CD1 4.13Å; L388-F410 HydrophobicContact CB-CE1 3.89Å; L388-F410 HydrophobicContact CB-CZ 4.26Å; L388-F410 HydrophobicContact CD1-CD1 4.39Å; L388-F410 HydrophobicContact CD1-CE1 4.12Å; L388-F410 HydrophobicContact CD2-CE1 4.22Å; L388-F410 HydrophobicContact CG-CE1 4.3Å; D391-F410 HydrophobicContact CB-CE1 4.08Å; D391-F410 HydrophobicContact CB-CZ 3.73Å; I392-F410 HydrophobicContact CB-CE2 4.4Å; I392-F410 HydrophobicContact CG1-CE2 3.54Å; I392-F410 HydrophobicContact CG1-CZ 3.66Å; L395-F410 HydrophobicContact CD1-CD2 4.08Å; L395-F410 HydrophobicContact CD1-CE2 3.7Å; L395-F410 HydrophobicContact CD1-CZ 4.07Å; F410-I428 HydrophobicContact CB-CD1 4.37Å; F410-I428 HydrophobicContact CD1-CD1 4.32Å; F410-I428 HydrophobicContact CD2-CG2 3.91Å; F410-I428 HydrophobicContact CE2-CG2 4.21Å; F410-I428 HydrophobicContact CG-CD1 4.31Å; F410-I428 HydrophobicContact CG-CG2 4.25Å
411	R	91.5	Very high	72.9	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	109.7	168.9	-177.6	-170.5	170.8	91.7	-2.8	108.4	T286 S289 H320 V332 I333 V334 L409 N413	T286-R411 CarbonylContact O-C 3.48Å; T286-R411 WeakPolarHBondContact O-CA 3.44Å; S289-R411 PolarHBondContact O-NH2 2.73Å; H320-R411 VanDerWaalsContact CE1-CZ 3.43Å; H320-R411 PolarHBondContact CE1-NH1 2.95Å; H320-R411 PolarHBondContact NE2-NH1 2.79Å; H320-R411 PolarHBondContact NE2-NH2 3.43Å; V332-R411 PolarHBondContact O-N 3.2Å; I333-R411 CarbonylContact C-O 3.54Å; I333-R411 WeakPolarHBondContact CA-O 3.25Å; V334-R411 PolarHBondContact N-O 3.25Å; L409-R411 HydrophobicContact CD1-CB 4.11Å; R411-N413 WeakPolarHBondContact CG-OD1 3.48Å; R411-N413 PolarHBondContact NE-OD1 2.94Å
412	T	84.4	Confident	74	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114	179.3	-48.7	0	0	0	0	110.3	T286 R287 V334 L336 T421 V424	T286-T412 PolarHBondContact O-N 3.13Å; R287-T412 WeakPolarHBondContact CA-O 3.26Å; R287-T412 WeakPolarHBondContact CB-O 3.39Å; V334-T412 HydrophobicContact CB-CG2 4.33Å; V334-T412 HydrophobicContact CG1-CG2 4.4Å; V334-T412 CarbonylContact O-C 3.55Å; V334-T412 WeakPolarHBondContact O-CA 3.29Å; L336-T412 HydrophobicContact CD1-CG2 3.57Å; L336-T412 HydrophobicContact CG-CG2 3.92Å; T412-T421 HydrophobicContact CG2-CG2 3.92Å; T412-V424 HydrophobicContact CG2-CB 4.43Å; T412-V424 HydrophobicContact CG2-CG1 4.19Å
413	N	79.4	Confident	74.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	141.9	175.9	-64.1	-8.3	0	0	0	109.8	V290 P291 V334 L336 F350 R411	V290-N413 HydrophobicContact CG2-CB 4.46Å; P291-N413 WeakPolarHBondContact CD-ND2 3.39Å; V334-N413 PolarHBondContact O-N 3.25Å; L336-N413 PolarHBondContact N-O 3Å; F350-N413 WeakPolarHBondContact CE1-ND2 3.38Å; F350-N413 WeakPolarHBondContact CZ-ND2 3.29Å; R411-N413 WeakPolarHBondContact CG-OD1 3.48Å; R411-N413 PolarHBondContact NE-OD1 2.94Å
414	C	67.3	Low	75.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.			trans	-143.6	172.2	166.7	-166.3	0	0	0	0	108.7	L336 D416 R420 T421	L336-C414 HydrophobicContact CB-CB 4.17Å; C414-D416 VanDerWaalsContact C-N 3.33Å; C414-D416 WeakPolarHBondContact CB-O 3.3Å; C414-R420 VanDerWaalsContact SG-CD 3.58Å; C414-R420 PolarHBondContact SG-NE 3.4Å; C414-T421 HydrophobicContact CB-CG2 3.61Å
415	M	65.9	Low	75.9	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.02	14%	0.14	C	C	.	.	S	Bend	trans	-60.8	-50.1	173.6	-175.3	105.7	-65.6	0	0	109.8	R256 W294 L337 E343 I346	R256-M415 PolarHBondContact NH1-O 3.37Å; W294-M415 HydrophobicContact CE3-CE 4.24Å; W294-M415 HydrophobicContact CH2-CE 3.01Å; W294-M415 HydrophobicContact CH2-CG 4.07Å; W294-M415 HydrophobicContact CH2-SD 3.87Å; W294-M415 HydrophobicContact CZ2-CE 3.54Å; W294-M415 HydrophobicContact CZ3-CE 3.45Å; W294-M415 VanDerWaalsContact CZ3-CE 3.45Å; W294-M415 HydrophobicContact CZ3-SD 4.08Å; L337-M415 HydrophobicContact CD2-CB 4Å; L337-M415 HydrophobicContact CD2-CE 4.12Å; E343-M415 HydrophobicContact CB-SD 4.45Å; E343-M415 HydrophobicContact CG-CB 4.31Å; E343-M415 HydrophobicContact CG-CG 4.43Å; E343-M415 HydrophobicContact CG-SD 3.79Å; E343-M415 VanDerWaalsContact OE1-CB 3.32Å; E343-M415 WeakPolarHBondContact OE1-CB 3.38Å; I346-M415 HydrophobicContact CB-CE 4.22Å; I346-M415 HydrophobicContact CD1-CE 3.36Å; I346-M415 HydrophobicContact CD1-SD 4.44Å; I346-M415 HydrophobicContact CG1-CE 4.36Å; I346-M415 HydrophobicContact CG2-CE 4.04Å
416	D	56.7	Low	75.6	Confident	21 Å²	21	27.1 Å²	27.1	11%	0.112	15%	0.149	C	C	.	.	S	Bend	trans	-112.9	112.6	167.9	-65.1	-51.8	0	0	0	107.5	R252 R256 C414 L418	R252-D416 IonicContact CZ-OD1 3.94Å; R252-D416 IonicContact CZ-OD2 3.26Å; R252-D416 VanDerWaalsContact CZ-OD2 3.26Å; R252-D416 IonicContact NE-OD1 3.05Å; R252-D416 PolarHBondContact NE-OD1 3.15Å; R252-D416 IonicContact NE-OD2 3.14Å; R252-D416 PolarHBondContact NE-OD2 2.93Å; R252-D416 VanDerWaalsContact NE-OD2 3.14Å; R252-D416 IonicContact NH2-OD2 2.65Å; R252-D416 PolarHBondContact NH2-OD2 2.86Å; R256-D416 IonicContact CZ-OD1 3.15Å; R256-D416 IonicContact NH1-OD1 2.82Å; R256-D416 PolarHBondContact NH1-OD1 3.12Å; R256-D416 IonicContact NH2-OD1 2.64Å; R256-D416 PolarHBondContact NH2-OD1 3.3Å; R256-D416 IonicContact NH2-OD2 3.81Å; C414-D416 VanDerWaalsContact C-N 3.33Å; C414-D416 WeakPolarHBondContact CB-O 3.3Å; D416-L418 HydrophobicContact CB-CB 4.47Å; D416-L418 PolarHBondContact O-N 2.99Å
417	C	57	Low	75.3	Confident	19 Å²	19	28.2 Å²	28.2	13%	0.128	16%	0.155	C	C	.	.	S	Bend	trans	-73.6	47.4	175.6	60.2	0	0	0	0	111.9	R287 T421	R287-C417 HydrophobicContact CB-CB 4.43Å; C417-T421 WeakPolarHBondContact CA-OG1 3.39Å; C417-T421 HydrophobicContact CB-CG2 4.02Å; C417-T421 PolarHBondContact O-OG1 2.92Å
418	L	57.8	Low	75.1	Confident	105 Å²	105	25.9 Å²	25.9	55%	0.55	14%	0.143	S	C	.	.	S	Bend	trans	-112.1	-82	-178.3	-169.6	70.7	0	0	0	109.9	D416 T421 N422	D416-L418 HydrophobicContact CB-CB 4.47Å; D416-L418 PolarHBondContact O-N 2.99Å; L418-T421 PolarHBondContact N-OG1 2.93Å; L418-T421 PolarHBondContact O-OG1 3.23Å; L418-N422 VanDerWaalsContact O-CB 3.3Å; L418-N422 WeakPolarHBondContact O-CB 3.21Å; L418-N422 PolarHBondContact O-N 3.1Å
419	D	62.1	Low	74.8	Confident	113 Å²	113	26 Å²	26	60%	0.604	14%	0.144	S	C	*	.	H	α-helix	trans	-80.8	-56.3	-167.3	-51.3	-55.6	0	0	0	113.3	T421 N422 V423	D419-T421 VanDerWaalsContact C-N 3.34Å; D419-T421 PolarHBondContact O-N 2.76Å; D419-N422 WeakPolarHBondContact O-CB 3.43Å; D419-N422 PolarHBondContact O-N 3.26Å; D419-N422 VanDerWaalsContact O-N 3.17Å; D419-V423 PolarHBondContact O-N 3.36Å
420	R	70.4	Confident	74.5	Confident	29 Å²	29	29.7 Å²	29.7	11%	0.109	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-40	-175.5	-65.3	-179.3	-100.6	169.1	-3.6	111.8	L336 E343 F369 C414 N422 V423 V424	L336-R420 HydrophobicContact CB-CB 4.43Å; L336-R420 HydrophobicContact CD1-CB 3.94Å; L336-R420 WeakPolarHBondContact CD1-O 3.5Å; L336-R420 PolarHBondContact O-NH1 3.47Å; E343-R420 IonicContact OE1-CZ 3.72Å; E343-R420 IonicContact OE1-NH1 3.93Å; E343-R420 PolarHBondContact OE1-NH1 2.97Å; E343-R420 IonicContact OE1-NH2 3.39Å; E343-R420 PolarHBondContact OE1-NH2 2.84Å; E343-R420 IonicContact OE2-CZ 3.71Å; E343-R420 IonicContact OE2-NH1 2.64Å; E343-R420 PolarHBondContact OE2-NH1 3.5Å; E343-R420 IonicContact OE2-NH2 2.96Å; F369-R420 HydrophobicContact CD1-CB 4.34Å; F369-R420 HydrophobicContact CD1-CG 3.55Å; F369-R420 HydrophobicContact CD2-CB 4.19Å; F369-R420 HydrophobicContact CD2-CG 4.28Å; F369-R420 HydrophobicContact CE1-CB 4.4Å; F369-R420 HydrophobicContact CE1-CG 3.68Å; F369-R420 HydrophobicContact CE2-CB 4.24Å; F369-R420 HydrophobicContact CE2-CG 4.38Å; F369-R420 HydrophobicContact CG-CB 4.22Å; F369-R420 HydrophobicContact CG-CG 3.87Å; F369-R420 HydrophobicContact CZ-CB 4.34Å; F369-R420 HydrophobicContact CZ-CG 4.09Å; C414-R420 VanDerWaalsContact SG-CD 3.58Å; C414-R420 PolarHBondContact SG-NE 3.4Å; R420-N422 VanDerWaalsContact C-N 3.33Å; R420-V423 PolarHBondContact O-N 2.84Å; R420-V424 PolarHBondContact O-N 2.69Å
421	T	67.5	Low	74.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-38.8	176.2	46.8	0	0	0	0	111.5	R287 L336 T412 C414 C417 L418 D419 V423 V424 Q425	R287-T421 HydrophobicContact CB-CG2 4.49Å; L336-T421 HydrophobicContact CD1-CG2 4.38Å; T412-T421 HydrophobicContact CG2-CG2 3.92Å; C414-T421 HydrophobicContact CB-CG2 3.61Å; C417-T421 WeakPolarHBondContact CA-OG1 3.39Å; C417-T421 HydrophobicContact CB-CG2 4.02Å; C417-T421 PolarHBondContact O-OG1 2.92Å; L418-T421 PolarHBondContact N-OG1 2.93Å; L418-T421 PolarHBondContact O-OG1 3.23Å; D419-T421 VanDerWaalsContact C-N 3.34Å; D419-T421 PolarHBondContact O-N 2.76Å; T421-V423 PolarHBondContact O-N 2.76Å; T421-V424 PolarHBondContact O-N 3.43Å; T421-Q425 WeakPolarHBondContact O-CB 3.38Å; T421-Q425 WeakPolarHBondContact O-CG 3.4Å; T421-Q425 PolarHBondContact O-N 3.36Å
422	N	71.8	Confident	73.8	Confident	97 Å²	97	32.2 Å²	32.2	52%	0.519	17%	0.173	S	C	.	.	H	α-helix	trans	-63.2	-42.7	179.9	-169.8	53.4	0	0	0	111.9	L418 D419 R420 S426	L418-N422 VanDerWaalsContact O-CB 3.3Å; L418-N422 WeakPolarHBondContact O-CB 3.21Å; L418-N422 PolarHBondContact O-N 3.1Å; D419-N422 WeakPolarHBondContact O-CB 3.43Å; D419-N422 PolarHBondContact O-N 3.26Å; D419-N422 VanDerWaalsContact O-N 3.17Å; R420-N422 VanDerWaalsContact C-N 3.33Å; N422-S426 VanDerWaalsContact O-CB 3.28Å; N422-S426 WeakPolarHBondContact O-CB 2.89Å; N422-S426 PolarHBondContact O-N 2.91Å; N422-S426 PolarHBondContact O-OG 3.34Å; N422-S426 VanDerWaalsContact O-OG 3.13Å
423	V	70.6	Confident	73.8	Confident	33 Å²	33	33.7 Å²	33.7	20%	0.2	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-48.9	176.5	176.1	0	0	0	0	111.4	F369 W378 I381 D419 R420 T421 S426 L427	F369-V423 HydrophobicContact CE2-CB 4.3Å; F369-V423 HydrophobicContact CE2-CG1 4.3Å; F369-V423 HydrophobicContact CZ-CB 4.37Å; F369-V423 HydrophobicContact CZ-CG1 4.45Å; F369-V423 HydrophobicContact CZ-CG2 4.47Å; W378-V423 HydrophobicContact CE3-CG1 4.11Å; W378-V423 HydrophobicContact CZ3-CG1 3.84Å; W378-V423 HydrophobicContact CZ3-CG2 4.22Å; I381-V423 HydrophobicContact CD1-CG1 4.42Å; D419-V423 PolarHBondContact O-N 3.36Å; R420-V423 PolarHBondContact O-N 2.84Å; T421-V423 PolarHBondContact O-N 2.76Å; V423-S426 PolarHBondContact O-OG 2.74Å; V423-L427 HydrophobicContact CG1-CD1 4.14Å; V423-L427 WeakPolarHBondContact O-CG 3.46Å; V423-L427 PolarHBondContact O-N 3.23Å; V423-L427 VanDerWaalsContact O-N 3.15Å
424	V	77.3	Confident	74	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70	-42.1	-176.5	170.6	0	0	0	0	111.3	V334 L336 F369 L385 T412 R420 T421 S426 L427 I428	V334-V424 HydrophobicContact CG1-CG1 4.28Å; L336-V424 HydrophobicContact CD1-CB 3.91Å; L336-V424 HydrophobicContact CD1-CG1 4.49Å; L336-V424 HydrophobicContact CD1-CG2 3.63Å; L336-V424 HydrophobicContact CD2-CG2 3.86Å; L336-V424 HydrophobicContact CG-CG2 4.4Å; F369-V424 HydrophobicContact CD2-CG2 4.3Å; F369-V424 HydrophobicContact CE2-CG2 4.22Å; L385-V424 HydrophobicContact CD1-CG1 4.38Å; L385-V424 HydrophobicContact CD2-CG1 3.87Å; T412-V424 HydrophobicContact CG2-CB 4.43Å; T412-V424 HydrophobicContact CG2-CG1 4.19Å; R420-V424 PolarHBondContact O-N 2.69Å; T421-V424 PolarHBondContact O-N 3.43Å; V424-S426 VanDerWaalsContact C-N 3.34Å; V424-S426 PolarHBondContact O-N 3.38Å; V424-L427 PolarHBondContact O-N 3.06Å; V424-I428 HydrophobicContact CG1-CD1 3.76Å; V424-I428 HydrophobicContact CG1-CG1 4.38Å; V424-I428 VanDerWaalsContact O-CG1 3.29Å; V424-I428 WeakPolarHBondContact O-CG1 3Å; V424-I428 PolarHBondContact O-N 2.89Å
425	Q	79.7	Confident	74.6	Confident	10 Å²	10	37.8 Å²	37.8	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-35.8	177.9	-72.4	-176.2	-57	0	0	112.5	Q285 T286 R287 T421 I428 G429	Q285-Q425 PolarHBondContact NE2-O 2.59Å; T286-Q425 PolarHBondContact O-NE2 2.79Å; R287-Q425 VanDerWaalsContact CD-OE1 3.27Å; T421-Q425 WeakPolarHBondContact O-CB 3.38Å; T421-Q425 WeakPolarHBondContact O-CG 3.4Å; T421-Q425 PolarHBondContact O-N 3.36Å; Q425-I428 PolarHBondContact O-N 3.01Å; Q425-G429 PolarHBondContact O-N 3.37Å
426	S	78.8	Confident	75.1	Confident	68 Å²	68	37.7 Å²	37.7	48%	0.476	20%	0.2	S	C	.	.	H	α-helix	trans	-68.1	-39.8	176.2	69.1	0	0	0	0	111.9	N422 V423 V424 G429 L430	N422-S426 VanDerWaalsContact O-CB 3.28Å; N422-S426 WeakPolarHBondContact O-CB 2.89Å; N422-S426 PolarHBondContact O-N 2.91Å; N422-S426 PolarHBondContact O-OG 3.34Å; N422-S426 VanDerWaalsContact O-OG 3.13Å; V423-S426 PolarHBondContact O-OG 2.74Å; V424-S426 VanDerWaalsContact C-N 3.34Å; V424-S426 PolarHBondContact O-N 3.38Å; S426-G429 PolarHBondContact O-N 3.36Å; S426-L430 WeakPolarHBondContact O-CB 3.01Å; S426-L430 PolarHBondContact O-N 3.22Å
427	L	81.1	Confident	76	Confident	40 Å²	40	39.8 Å²	39.8	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-42.3	174.3	-70.8	172.2	0	0	0	112	I381 L385 V423 V424 G429 L430 R431	I381-L427 HydrophobicContact CB-CD1 4.4Å; I381-L427 HydrophobicContact CG2-CD1 3.84Å; L385-L427 HydrophobicContact CD1-CB 3.38Å; L385-L427 HydrophobicContact CD1-CD1 3.53Å; L385-L427 HydrophobicContact CD1-CG 4.09Å; V423-L427 HydrophobicContact CG1-CD1 4.14Å; V423-L427 WeakPolarHBondContact O-CG 3.46Å; V423-L427 PolarHBondContact O-N 3.23Å; V423-L427 VanDerWaalsContact O-N 3.15Å; V424-L427 PolarHBondContact O-N 3.06Å; L427-G429 VanDerWaalsContact C-N 3.34Å; L427-L430 PolarHBondContact O-N 3.4Å; L427-R431 WeakPolarHBondContact O-CG 3.16Å; L427-R431 PolarHBondContact O-N 3.34Å
428	I	84.5	Confident	76.6	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-42.1	174	-65.6	168.6	0	0	0	110.3	F283 L385 L388 I392 F410 V424 Q425 L430 R431 A432	F283-I428 HydrophobicContact CE1-CG2 3.91Å; F283-I428 HydrophobicContact CZ-CG2 3.83Å; L385-I428 HydrophobicContact CD2-CG1 4.43Å; L388-I428 HydrophobicContact CD1-CD1 4.25Å; I392-I428 HydrophobicContact CD1-CG2 4.25Å; F410-I428 HydrophobicContact CB-CD1 4.37Å; F410-I428 HydrophobicContact CD1-CD1 4.32Å; F410-I428 HydrophobicContact CD2-CG2 3.91Å; F410-I428 HydrophobicContact CE2-CG2 4.21Å; F410-I428 HydrophobicContact CG-CD1 4.31Å; F410-I428 HydrophobicContact CG-CG2 4.25Å; V424-I428 HydrophobicContact CG1-CD1 3.76Å; V424-I428 HydrophobicContact CG1-CG1 4.38Å; V424-I428 VanDerWaalsContact O-CG1 3.29Å; V424-I428 WeakPolarHBondContact O-CG1 3Å; V424-I428 PolarHBondContact O-N 2.89Å; Q425-I428 PolarHBondContact O-N 3.01Å; I428-L430 PolarHBondContact O-N 3.4Å; I428-R431 PolarHBondContact O-N 2.75Å; I428-A432 WeakPolarHBondContact O-CB 3.3Å; I428-A432 PolarHBondContact O-N 3.25Å
429	G	83.9	Confident	76.8	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-40.3	176.4	0	0	0	0	0	112.8	Q272 Q425 S426 L427 A432 L433	Q272-G429 PolarHBondContact NE2-O 3.18Å; Q272-G429 PolarHBondContact OE1-O 3.08Å; Q425-G429 PolarHBondContact O-N 3.37Å; S426-G429 PolarHBondContact O-N 3.36Å; L427-G429 VanDerWaalsContact C-N 3.34Å; G429-A432 PolarHBondContact O-N 3.19Å; G429-L433 WeakPolarHBondContact O-CB 3.42Å; G429-L433 PolarHBondContact O-N 3.37Å
430	L	84.5	Confident	76.7	Confident	78 Å²	78	37.6 Å²	37.6	41%	0.408	20%	0.197	S	C	.	.	H	α-helix	trans	-63.2	-45.6	174	-178.7	63.6	0	0	0	111.7	S426 L427 I428 A432 L433 E434	S426-L430 WeakPolarHBondContact O-CB 3.01Å; S426-L430 PolarHBondContact O-N 3.22Å; L427-L430 PolarHBondContact O-N 3.4Å; I428-L430 PolarHBondContact O-N 3.4Å; L430-A432 VanDerWaalsContact C-N 3.32Å; L430-A432 PolarHBondContact O-N 3.02Å; L430-L433 WeakPolarHBondContact O-CB 3.31Å; L430-L433 PolarHBondContact O-N 3.39Å; L430-E434 WeakPolarHBondContact O-CG 3.46Å; L430-E434 PolarHBondContact O-N 3.15Å
431	R	84.8	Confident	76.2	Confident	54 Å²	54	40.4 Å²	40.4	20%	0.204	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-37.3	175.7	-68.1	-64.1	-177.4	-107.8	-2.8	112.1	D386 V389 I392 L427 I428 E434 V435	D386-R431 IonicContact OD1-CZ 3.78Å; D386-R431 IonicContact OD1-NE 3.94Å; D386-R431 PolarHBondContact OD1-NE 3.1Å; D386-R431 IonicContact OD1-NH2 3.37Å; D386-R431 PolarHBondContact OD1-NH2 2.87Å; V389-R431 HydrophobicContact CG2-CB 4.26Å; V389-R431 HydrophobicContact CG2-CG 4.14Å; I392-R431 HydrophobicContact CD1-CB 3.63Å; L427-R431 WeakPolarHBondContact O-CG 3.16Å; L427-R431 PolarHBondContact O-N 3.34Å; I428-R431 PolarHBondContact O-N 2.75Å; R431-E434 VanDerWaalsContact CD-OE2 3.29Å; R431-E434 WeakPolarHBondContact CD-OE2 3.42Å; R431-E434 IonicContact CZ-OE2 2.73Å; R431-E434 IonicContact NE-OE2 3.74Å; R431-E434 IonicContact NH1-OE1 2.76Å; R431-E434 PolarHBondContact NH1-OE1 2.91Å; R431-E434 IonicContact NH1-OE2 3.55Å; R431-E434 PolarHBondContact NH1-OE2 3.43Å; R431-E434 PolarHBondContact O-N 2.74Å; R431-V435 WeakPolarHBondContact O-CG2 3.28Å; R431-V435 PolarHBondContact O-N 3.48Å; R431-V435 VanDerWaalsContact O-N 3.08Å
432	A	85.4	Confident	75.7	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-41.1	174	0	0	0	0	0	111.8	F283 I392 I428 G429 L430 V435 Q436	F283-A432 HydrophobicContact CB-CB 4.41Å; F283-A432 HydrophobicContact CD1-CB 3.42Å; F283-A432 VanDerWaalsContact CD1-CB 3.42Å; F283-A432 HydrophobicContact CD2-CB 4.03Å; F283-A432 HydrophobicContact CE1-CB 3.47Å; F283-A432 VanDerWaalsContact CE1-CB 3.47Å; F283-A432 HydrophobicContact CE2-CB 4.11Å; F283-A432 HydrophobicContact CG-CB 3.69Å; F283-A432 HydrophobicContact CZ-CB 3.84Å; I392-A432 HydrophobicContact CG2-CB 4.18Å; I428-A432 WeakPolarHBondContact O-CB 3.3Å; I428-A432 PolarHBondContact O-N 3.25Å; G429-A432 PolarHBondContact O-N 3.19Å; L430-A432 VanDerWaalsContact C-N 3.32Å; L430-A432 PolarHBondContact O-N 3.02Å; A432-V435 PolarHBondContact O-N 3.42Å; A432-Q436 VanDerWaalsContact O-CG 3.27Å; A432-Q436 WeakPolarHBondContact O-CG 3.38Å; A432-Q436 PolarHBondContact O-N 3.31Å
433	L	84.4	Confident	74.8	Confident	30 Å²	30	45.2 Å²	45.2	16%	0.157	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-46.5	174.2	-177.5	62.5	0	0	0	111.5	V274 G429 L430 V435 Q436 L437	V274-L433 HydrophobicContact CB-CD1 4.48Å; V274-L433 HydrophobicContact CG1-CD1 4.2Å; V274-L433 HydrophobicContact CG2-CD1 3.5Å; V274-L433 VanDerWaalsContact CG2-CD1 3.5Å; G429-L433 WeakPolarHBondContact O-CB 3.42Å; G429-L433 PolarHBondContact O-N 3.37Å; L430-L433 WeakPolarHBondContact O-CB 3.31Å; L430-L433 PolarHBondContact O-N 3.39Å; L433-V435 VanDerWaalsContact C-N 3.31Å; L433-V435 PolarHBondContact O-N 3.19Å; L433-Q436 PolarHBondContact O-N 3.26Å; L433-L437 HydrophobicContact CD1-CD1 4.15Å; L433-L437 HydrophobicContact CD1-CG 4.19Å; L433-L437 HydrophobicContact CG-CD1 4Å; L433-L437 HydrophobicContact CG-CG 4.42Å; L433-L437 WeakPolarHBondContact O-CG 3.18Å; L433-L437 PolarHBondContact O-N 3.28Å
434	E	83	Confident	74.2	Confident	76 Å²	76	43.8 Å²	43.8	36%	0.355	23%	0.225	S	C	.	.	H	α-helix	trans	-56.5	-45.1	175.8	-73.2	169.5	-171	0	0	111.3	L430 R431 L437 Q438	L430-E434 WeakPolarHBondContact O-CG 3.46Å; L430-E434 PolarHBondContact O-N 3.15Å; R431-E434 VanDerWaalsContact CD-OE2 3.29Å; R431-E434 WeakPolarHBondContact CD-OE2 3.42Å; R431-E434 IonicContact CZ-OE2 2.73Å; R431-E434 IonicContact NE-OE2 3.74Å; R431-E434 IonicContact NH1-OE1 2.76Å; R431-E434 PolarHBondContact NH1-OE1 2.91Å; R431-E434 IonicContact NH1-OE2 3.55Å; R431-E434 PolarHBondContact NH1-OE2 3.43Å; R431-E434 PolarHBondContact O-N 2.74Å; E434-L437 PolarHBondContact O-N 2.99Å; E434-Q438 WeakPolarHBondContact O-CB 3.29Å; E434-Q438 VanDerWaalsContact O-CG 3.26Å; E434-Q438 WeakPolarHBondContact O-CG 3.47Å; E434-Q438 PolarHBondContact O-N 3.38Å
435	V	79	Confident	73.5	Confident	10 Å²	10	47.8 Å²	47.8	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-42.5	176.7	172.6	0	0	0	0	111.6	I392 K393 R431 A432 L433 Q438 C439	I392-V435 HydrophobicContact CG2-CG2 4.47Å; K393-V435 HydrophobicContact CG-CG1 4.2Å; K393-V435 HydrophobicContact CG-CG2 4.49Å; R431-V435 WeakPolarHBondContact O-CG2 3.28Å; R431-V435 PolarHBondContact O-N 3.48Å; R431-V435 VanDerWaalsContact O-N 3.08Å; A432-V435 PolarHBondContact O-N 3.42Å; L433-V435 VanDerWaalsContact C-N 3.31Å; L433-V435 PolarHBondContact O-N 3.19Å; V435-Q438 PolarHBondContact O-N 3.03Å; V435-C439 PolarHBondContact O-N 2.96Å; V435-C439 VanDerWaalsContact O-N 3.16Å; V435-C439 PolarHBondContact O-SG 2.94Å; V435-C439 VanDerWaalsContact O-SG 3.35Å
436	Q	77.5	Confident	72.7	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-45.3	177.2	-73.9	166.5	-23.5	0	0	111.7	F281 R396 A432 L433 C439 F440	F281-Q436 HydrophobicContact CB-CB 4.45Å; F281-Q436 HydrophobicContact CB-CG 4Å; F281-Q436 HydrophobicContact CD1-CB 4.44Å; F281-Q436 HydrophobicContact CD1-CG 4.34Å; F281-Q436 HydrophobicContact CG-CB 4.3Å; F281-Q436 HydrophobicContact CG-CG 4.27Å; R396-Q436 VanDerWaalsContact NH1-CG 3.26Å; A432-Q436 VanDerWaalsContact O-CG 3.27Å; A432-Q436 WeakPolarHBondContact O-CG 3.38Å; A432-Q436 PolarHBondContact O-N 3.31Å; L433-Q436 PolarHBondContact O-N 3.26Å; Q436-C439 PolarHBondContact O-N 3.21Å; Q436-F440 PolarHBondContact O-N 2.82Å
437	L	74	Confident	71.8	Confident	65 Å²	65	48.9 Å²	48.9	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-69.5	-35	178.9	-67.8	175.1	0	0	0	112.6	L236 L433 E434 F440 I441	L236-L437 HydrophobicContact CD1-CD2 4.02Å; L433-L437 HydrophobicContact CD1-CD1 4.15Å; L433-L437 HydrophobicContact CD1-CG 4.19Å; L433-L437 HydrophobicContact CG-CD1 4Å; L433-L437 HydrophobicContact CG-CG 4.42Å; L433-L437 WeakPolarHBondContact O-CG 3.18Å; L433-L437 PolarHBondContact O-N 3.28Å; E434-L437 PolarHBondContact O-N 2.99Å; L437-F440 WeakPolarHBondContact O-CB 3.4Å; L437-F440 PolarHBondContact O-N 3.37Å; L437-I441 PolarHBondContact O-N 2.97Å
438	Q	70.3	Confident	71.2	Confident	105 Å²	105	48.5 Å²	48.5	49%	0.491	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-43.5	174.2	-79.7	175.9	0.1	0	0	112.2	E434 V435 F440 I441 V442	E434-Q438 WeakPolarHBondContact O-CB 3.29Å; E434-Q438 VanDerWaalsContact O-CG 3.26Å; E434-Q438 WeakPolarHBondContact O-CG 3.47Å; E434-Q438 PolarHBondContact O-N 3.38Å; V435-Q438 PolarHBondContact O-N 3.03Å; Q438-F440 PolarHBondContact O-N 3.24Å; Q438-I441 PolarHBondContact O-N 3.36Å; Q438-I441 VanDerWaalsContact O-N 3.15Å; Q438-V442 WeakPolarHBondContact O-CG2 3.39Å; Q438-V442 PolarHBondContact O-N 2.83Å
439	C	62.2	Low	70.6	Confident	52 Å²	52	52.3 Å²	52.3	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-57.6	-35.9	176.8	-70.4	0	0	0	0	111.9	F401 V435 Q436	F401-C439 WeakPolarHBondContact CE1-O 3.35Å; V435-C439 PolarHBondContact O-N 2.96Å; V435-C439 VanDerWaalsContact O-N 3.16Å; V435-C439 PolarHBondContact O-SG 2.94Å; V435-C439 VanDerWaalsContact O-SG 3.35Å; Q436-C439 PolarHBondContact O-N 3.21Å
440	F	60.1	Low	69.9	Low	34 Å²	34	54.9 Å²	54.9	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-41	177.6	-164.4	-82.7	0	0	0	112.6	R234 F279 F281 Q436 L437 Q438 V442 W443	R234-F440 VanDerWaalsContact CZ-CE1 3.47Å; F279-F440 AromaticContact CD2-CE2 3.67Å; F279-F440 HydrophobicContact CD2-CE2 3.67Å; F279-F440 HydrophobicContact CD2-CZ 4.5Å; F279-F440 HydrophobicContact CE2-CE2 4.03Å; F279-F440 HydrophobicContact CG-CE2 4.29Å; F281-F440 HydrophobicContact CZ-CD2 4.39Å; Q436-F440 PolarHBondContact O-N 2.82Å; L437-F440 WeakPolarHBondContact O-CB 3.4Å; L437-F440 PolarHBondContact O-N 3.37Å; Q438-F440 PolarHBondContact O-N 3.24Å; F440-V442 PolarHBondContact O-N 3.42Å; F440-W443 PolarHBondContact O-N 2.95Å
441	I	60.2	Low	69.2	Low	88 Å²	88	51.4 Å²	51.4	45%	0.451	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-40.6	-178.9	-64.5	170	0	0	0	111.5	L437 Q438 W443 A444 D445	L437-I441 PolarHBondContact O-N 2.97Å; Q438-I441 PolarHBondContact O-N 3.36Å; Q438-I441 VanDerWaalsContact O-N 3.15Å; I441-W443 PolarHBondContact O-N 3.21Å; I441-A444 WeakPolarHBondContact O-CB 3.41Å; I441-A444 PolarHBondContact O-N 3.16Å; I441-A444 VanDerWaalsContact O-N 3.14Å; I441-D445 PolarHBondContact O-N 3.11Å
442	V	55.8	Low	68.7	Low	81 Å²	81	51.6 Å²	51.6	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-62.2	-28.8	-179.4	176.4	0	0	0	0	112.4	F401 Q438 F440 D445 N446	F401-V442 HydrophobicContact CZ-CG1 4.44Å; Q438-V442 WeakPolarHBondContact O-CG2 3.39Å; Q438-V442 PolarHBondContact O-N 2.83Å; F440-V442 PolarHBondContact O-N 3.42Å; V442-D445 PolarHBondContact O-N 3.26Å; V442-N446 PolarHBondContact O-N 3Å
443	W	53.2	Low	68.1	Low	118 Å²	118	58.1 Å²	58.1	45%	0.447	31%	0.313	S	S	.	.	H	α-helix	trans	-67.7	-38.3	176.7	-173.3	-104.7	0	0	0	112.7	F401 F440 I441 D445 N446 G447	F401-W443 HydrophobicContact CB-CE3 4.09Å; F401-W443 HydrophobicContact CB-CZ3 4.08Å; F401-W443 HydrophobicContact CD1-CB 4.2Å; F401-W443 HydrophobicContact CD1-CD2 4.28Å; F401-W443 AromaticContact CD1-CE3 3.67Å; F401-W443 HydrophobicContact CD1-CE3 3.67Å; F401-W443 HydrophobicContact CD1-CZ3 4.39Å; F401-W443 HydrophobicContact CD2-CD2 4.48Å; F401-W443 AromaticContact CD2-CE3 3.26Å; F401-W443 HydrophobicContact CD2-CE3 3.26Å; F401-W443 HydrophobicContact CD2-CH2 4.4Å; F401-W443 AromaticContact CD2-CZ3 3.21Å; F401-W443 HydrophobicContact CD2-CZ3 3.21Å; F401-W443 HydrophobicContact CE1-CB 3.98Å; F401-W443 AromaticContact CE1-CE3 3.83Å; F401-W443 HydrophobicContact CE1-CE3 3.83Å; F401-W443 AromaticContact CE2-CE3 3.44Å; F401-W443 HydrophobicContact CE2-CE3 3.44Å; F401-W443 VanDerWaalsContact CE2-CE3 3.44Å; F401-W443 AromaticContact CE2-CZ3 3.64Å; F401-W443 HydrophobicContact CE2-CZ3 3.64Å; F401-W443 HydrophobicContact CG-CD2 4.26Å; F401-W443 AromaticContact CG-CE3 3.38Å; F401-W443 HydrophobicContact CG-CE3 3.38Å; F401-W443 AromaticContact CG-CZ3 3.65Å; F401-W443 HydrophobicContact CG-CZ3 3.65Å; F401-W443 AromaticContact CZ-CE3 3.72Å; F401-W443 HydrophobicContact CZ-CE3 3.72Å; F401-W443 HydrophobicContact CZ-CZ3 4.38Å; F440-W443 PolarHBondContact O-N 2.95Å; I441-W443 PolarHBondContact O-N 3.21Å; W443-D445 VanDerWaalsContact C-N 3.33Å; W443-N446 PolarHBondContact O-N 3.19Å; W443-G447 PolarHBondContact O-N 2.94Å; W443-G447 VanDerWaalsContact O-N 3.1Å
444	A	57.7	Low	67.5	Low	3 Å²	3	64.7 Å²	64.7	3%	0.025	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-43.1	174.8	0	0	0	0	0	111	I441 N446 G447 D448 T465 R466	I441-A444 WeakPolarHBondContact O-CB 3.41Å; I441-A444 PolarHBondContact O-N 3.16Å; I441-A444 VanDerWaalsContact O-N 3.14Å; A444-N446 PolarHBondContact O-N 2.98Å; A444-G447 PolarHBondContact O-N 3.36Å; A444-D448 PolarHBondContact O-N 3.23Å; A444-D448 VanDerWaalsContact O-N 3.16Å; A444-T465 HydrophobicContact CB-CG2 3.9Å; A444-R466 HydrophobicContact CB-CB 3.96Å; A444-R466 HydrophobicContact CB-CG 4.23Å
445	D	64.1	Low	66.9	Low	83 Å²	83	61.6 Å²	61.6	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-65.4	-38.2	177.4	-64.7	-21.8	0	0	0	112	I441 V442 W443 D448 V449	I441-D445 PolarHBondContact O-N 3.11Å; V442-D445 PolarHBondContact O-N 3.26Å; W443-D445 VanDerWaalsContact C-N 3.33Å; D445-D448 PolarHBondContact O-N 2.72Å; D445-V449 WeakPolarHBondContact O-CG2 3.42Å; D445-V449 PolarHBondContact O-N 3.03Å
446	N	62.4	Low	66.7	Low	68 Å²	68	62.1 Å²	62.1	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-49.8	174.4	-179.7	-4.8	0	0	0	111.4	V442 W443 A444 D448 V449 C450	V442-N446 PolarHBondContact O-N 3Å; W443-N446 PolarHBondContact O-N 3.19Å; A444-N446 PolarHBondContact O-N 2.98Å; N446-D448 VanDerWaalsContact C-N 3.25Å; N446-D448 PolarHBondContact O-N 3.46Å; N446-V449 PolarHBondContact O-N 2.77Å; N446-C450 PolarHBondContact O-N 3.31Å; N446-C450 PolarHBondContact O-SG 3.14Å; N446-C450 PolarHBondContact OD1-SG 2.89Å
447	G	60.7	Low	66.7	Low	34 Å²	34	62.3 Å²	62.3	35%	0.351	33%	0.332	S	S	.	.	H	α-helix	trans	-56.6	-40.5	177.4	0	0	0	0	0	112.6	W443 A444 S451	W443-G447 PolarHBondContact O-N 2.94Å; W443-G447 VanDerWaalsContact O-N 3.1Å; A444-G447 PolarHBondContact O-N 3.36Å; G447-S451 WeakPolarHBondContact O-CB 2.74Å; G447-S451 PolarHBondContact O-N 2.98Å; G447-S451 VanDerWaalsContact O-N 3.08Å
448	D	68.5	Low	66.6	Low	31 Å²	31	61.5 Å²	61.5	17%	0.166	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-47.4	176.4	-84.9	-16.9	0	0	0	112.7	A444 D445 N446 S451 V452 P458 A459 S462	A444-D448 PolarHBondContact O-N 3.23Å; A444-D448 VanDerWaalsContact O-N 3.16Å; D445-D448 PolarHBondContact O-N 2.72Å; N446-D448 VanDerWaalsContact C-N 3.25Å; N446-D448 PolarHBondContact O-N 3.46Å; D448-S451 PolarHBondContact O-N 2.77Å; D448-V452 WeakPolarHBondContact O-CG2 3.48Å; D448-V452 PolarHBondContact O-N 3.44Å; D448-P458 HydrophobicContact CB-CB 4.24Å; D448-A459 WeakPolarHBondContact OD1-CB 3.46Å; D448-A459 PolarHBondContact OD1-N 3.05Å; D448-S462 WeakPolarHBondContact OD1-CB 3.09Å; D448-S462 WeakPolarHBondContact OD2-CB 3.33Å; D448-S462 PolarHBondContact OD2-OG 3.23Å
449	V	71.1	Confident	66.3	Low	83 Å²	83	57.4 Å²	57.4	50%	0.503	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-44.9	-179.5	174	0	0	0	0	111.4	D445 N446 S451 V452 Q453	D445-V449 WeakPolarHBondContact O-CG2 3.42Å; D445-V449 PolarHBondContact O-N 3.03Å; N446-V449 PolarHBondContact O-N 2.77Å; V449-S451 VanDerWaalsContact C-N 3.28Å; V449-S451 PolarHBondContact O-N 2.91Å; V449-V452 PolarHBondContact O-N 3.02Å; V449-Q453 WeakPolarHBondContact O-CG 3.31Å; V449-Q453 PolarHBondContact O-N 2.95Å
450	C	69.5	Low	66.5	Low	57 Å²	57	58 Å²	58	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-59.2	-42.2	176.3	-72.1	0	0	0	0	111.1	N446 V452 Q453 Y454	N446-C450 PolarHBondContact O-N 3.31Å; N446-C450 PolarHBondContact O-SG 3.14Å; N446-C450 PolarHBondContact OD1-SG 2.89Å; C450-V452 PolarHBondContact O-N 3.24Å; C450-Q453 PolarHBondContact O-N 3.47Å; C450-Y454 VanDerWaalsContact O-CD1 3.27Å; C450-Y454 WeakPolarHBondContact O-CD1 3.32Å
451	S	69.9	Low	66.6	Low	4 Å²	4	62 Å²	62	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-39.6	176.6	-179.1	0	0	0	0	112.9	G447 D448 V449 Q453 A455 T457 P458 A459 R485	G447-S451 WeakPolarHBondContact O-CB 2.74Å; G447-S451 PolarHBondContact O-N 2.98Å; G447-S451 VanDerWaalsContact O-N 3.08Å; D448-S451 PolarHBondContact O-N 2.77Å; V449-S451 VanDerWaalsContact C-N 3.28Å; V449-S451 PolarHBondContact O-N 2.91Å; S451-Q453 PolarHBondContact O-N 3.41Å; S451-A455 WeakPolarHBondContact O-CA 3.18Å; S451-A455 VanDerWaalsContact O-CB 3.28Å; S451-A455 WeakPolarHBondContact O-CB 3.39Å; S451-A455 PolarHBondContact O-N 2.95Å; S451-T457 CarbonylContact C-O 3.59Å; S451-T457 WeakPolarHBondContact CB-O 3.09Å; S451-T457 PolarHBondContact OG-O 3.09Å; S451-P458 PolarHBondContact OG-O 3.16Å; S451-A459 WeakPolarHBondContact OG-CA 3.41Å; S451-A459 PolarHBondContact OG-N 2.96Å; S451-R485 PolarHBondContact OG-NH2 3.49Å
452	V	74.6	Confident	66.5	Low	58 Å²	58	58.5 Å²	58.5	35%	0.352	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-36.2	177.4	171.8	0	0	0	0	111.3	D448 V449 C450 G456 T457 P458	D448-V452 WeakPolarHBondContact O-CG2 3.48Å; D448-V452 PolarHBondContact O-N 3.44Å; V449-V452 PolarHBondContact O-N 3.02Å; C450-V452 PolarHBondContact O-N 3.24Å; V452-G456 WeakPolarHBondContact O-CA 3.46Å; V452-G456 PolarHBondContact O-N 3.19Å; V452-T457 WeakPolarHBondContact CA-O 3.36Å; V452-T457 VanDerWaalsContact CG2-C 3.41Å; V452-T457 PolarHBondContact N-O 3.09Å; V452-T457 VanDerWaalsContact N-O 3.09Å; V452-P458 HydrophobicContact CG2-CB 4.44Å; V452-P458 HydrophobicContact CG2-CG 3.99Å; V452-P458 VanDerWaalsContact CG2-N 3.33Å
453	Q	71.2	Confident	66.4	Low	138 Å²	138	55.2 Å²	55.2	65%	0.645	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-44.1	-176.2	-69.9	169.6	2	0	0	112.5	V449 C450 S451	V449-Q453 WeakPolarHBondContact O-CG 3.31Å; V449-Q453 PolarHBondContact O-N 2.95Å; C450-Q453 PolarHBondContact O-N 3.47Å; S451-Q453 PolarHBondContact O-N 3.41Å
454	Y	71.9	Confident	66.2	Low	169 Å²	169	55.2 Å²	55.2	66%	0.663	30%	0.299	S	S	*	.	H	α-helix	trans	-99.4	-28.9	-176.6	85.5	-94.2	0	0	0	114.1	C450	C450-Y454 VanDerWaalsContact O-CD1 3.27Å; C450-Y454 WeakPolarHBondContact O-CD1 3.32Å
455	A	70.3	Confident	65.6	Low	11 Å²	11	57.6 Å²	57.6	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-107.5	-4.4	-178.2	0	0	0	0	0	113.2	S451 T457 R485	S451-A455 WeakPolarHBondContact O-CA 3.18Å; S451-A455 VanDerWaalsContact O-CB 3.28Å; S451-A455 WeakPolarHBondContact O-CB 3.39Å; S451-A455 PolarHBondContact O-N 2.95Å; A455-T457 PolarHBondContact O-N 2.94Å; A455-T457 VanDerWaalsContact O-N 3.1Å; A455-R485 HydrophobicContact CB-CG 4.27Å
456	G	74.5	Confident	64.9	Low	20 Å²	20	60.6 Å²	60.6	21%	0.206	32%	0.318	C	S	.	.	S	Bend	trans	71.6	-2.6	-177.7	0	0	0	0	0	115.2	V452	V452-G456 WeakPolarHBondContact O-CA 3.46Å; V452-G456 PolarHBondContact O-N 3.19Å
457	T	78.9	Confident	64.2	Low	6 Å²	6	58.4 Å²	58.4	4%	0.037	31%	0.307	C	S	.	.	S	Bend	trans	-133.4	156.3	179.2	77.8	0	0	0	0	111.1	S451 V452 A455 M484 R485 I488	S451-T457 CarbonylContact C-O 3.59Å; S451-T457 WeakPolarHBondContact CB-O 3.09Å; S451-T457 PolarHBondContact OG-O 3.09Å; V452-T457 WeakPolarHBondContact CA-O 3.36Å; V452-T457 VanDerWaalsContact CG2-C 3.41Å; V452-T457 PolarHBondContact N-O 3.09Å; V452-T457 VanDerWaalsContact N-O 3.09Å; A455-T457 PolarHBondContact O-N 2.94Å; A455-T457 VanDerWaalsContact O-N 3.1Å; T457-M484 HydrophobicContact CG2-CB 3.72Å; T457-R485 HydrophobicContact CG2-CG 3.8Å; T457-R485 WeakPolarHBondContact OG1-CG 3.44Å; T457-R485 PolarHBondContact OG1-NE 3.37Å; T457-I488 HydrophobicContact CG2-CD1 3.91Å
458	P	72.5	Confident	63.7	Low	49 Å²	49	57.6 Å²	57.6	32%	0.318	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-52.9	164.5	169.1	-25.1	35.2	0	0	0	113	D448 S451 V452 R485	D448-P458 HydrophobicContact CB-CB 4.24Å; S451-P458 PolarHBondContact OG-O 3.16Å; V452-P458 HydrophobicContact CG2-CB 4.44Å; V452-P458 HydrophobicContact CG2-CG 3.99Å; V452-P458 VanDerWaalsContact CG2-N 3.33Å; P458-R485 PolarHBondContact O-NH2 2.85Å
459	A	63.3	Low	62.5	Low	19 Å²	19	60.7 Å²	60.7	16%	0.157	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64.1	138.9	-177.6	0	0	0	0	0	109.8	D448 S451 S462	D448-A459 WeakPolarHBondContact OD1-CB 3.46Å; D448-A459 PolarHBondContact OD1-N 3.05Å; S451-A459 WeakPolarHBondContact OG-CA 3.41Å; S451-A459 PolarHBondContact OG-N 2.96Å; A459-S462 PolarHBondContact O-N 3.16Å
460	L	66	Low	61.6	Low	65 Å²	65	63.8 Å²	63.8	34%	0.34	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	140.6	167.8	-68.7	168.9	0	0	0	108.1	S462 D478 N481 A482	L460-S462 VanDerWaalsContact C-N 3.3Å; L460-D478 WeakPolarHBondContact CA-OD1 3.28Å; L460-D478 HydrophobicContact CD2-CB 3.97Å; L460-D478 WeakPolarHBondContact CD2-O 3.31Å; L460-N481 HydrophobicContact CD2-CB 3.74Å; L460-A482 HydrophobicContact CD2-CB 4.46Å
461	K	62.3	Low	60.9	Low	116 Å²	116	63 Å²	63	50%	0.504	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	27.7	-172.9	-45.9	175	179.7	176.7	0	113.9	D463 F464 T465 D478	K461-D463 WeakPolarHBondContact CA-OD1 3.19Å; K461-D463 PolarHBondContact O-N 3.3Å; K461-F464 HydrophobicContact CB-CB 3.85Å; K461-F464 WeakPolarHBondContact O-CA 3.39Å; K461-F464 VanDerWaalsContact O-CB 3.24Å; K461-F464 WeakPolarHBondContact O-CB 3.47Å; K461-F464 PolarHBondContact O-N 3.21Å; K461-T465 PolarHBondContact O-N 2.82Å; K461-T465 PolarHBondContact O-OG1 3.43Å; K461-D478 PolarHBondContact N-OD1 2.83Å; K461-D478 PolarHBondContact N-OD2 3.15Å
462	S	57.8	Low	60.9	Low	16 Å²	16	68.6 Å²	68.6	11%	0.112	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-25.2	173.4	72.7	0	0	0	0	112.2	D448 A459 L460 T465 R466	D448-S462 WeakPolarHBondContact OD1-CB 3.09Å; D448-S462 WeakPolarHBondContact OD2-CB 3.33Å; D448-S462 PolarHBondContact OD2-OG 3.23Å; A459-S462 PolarHBondContact O-N 3.16Å; L460-S462 VanDerWaalsContact C-N 3.3Å; S462-T465 PolarHBondContact O-N 2.62Å; S462-R466 WeakPolarHBondContact O-CB 3.41Å; S462-R466 PolarHBondContact O-N 3.33Å
463	D	53.1	Low	60.6	Low	12 Å²	12	71 Å²	71	6%	0.064	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-40.3	167.1	67.7	-30.7	0	0	0	111.8	K461 R466 T467 G468 R470 T471 G474	K461-D463 WeakPolarHBondContact CA-OD1 3.19Å; K461-D463 PolarHBondContact O-N 3.3Å; D463-R466 PolarHBondContact O-N 3.42Å; D463-T467 VanDerWaalsContact O-CA 3.31Å; D463-T467 WeakPolarHBondContact O-CA 3.02Å; D463-T467 WeakPolarHBondContact O-CB 3.28Å; D463-T467 PolarHBondContact O-N 3.07Å; D463-T467 PolarHBondContact O-OG1 3.45Å; D463-G468 PolarHBondContact O-N 3.31Å; D463-R470 WeakPolarHBondContact OD2-CA 3.5Å; D463-T471 PolarHBondContact OD2-N 2.79Å; D463-T471 PolarHBondContact OD2-OG1 2.94Å; D463-T471 VanDerWaalsContact OD2-OG1 3.13Å; D463-G474 WeakPolarHBondContact OD2-CA 3.49Å
464	F	50.1	Low	59.8	Low	118 Å²	118	64.6 Å²	64.6	52%	0.518	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-43.7	172	-169.2	-96.5	0	0	0	111.9	R234 K461 R466 G468	R234-F464 PolarHBondContact NH2-O 3.35Å; K461-F464 HydrophobicContact CB-CB 3.85Å; K461-F464 WeakPolarHBondContact O-CA 3.39Å; K461-F464 VanDerWaalsContact O-CB 3.24Å; K461-F464 WeakPolarHBondContact O-CB 3.47Å; K461-F464 PolarHBondContact O-N 3.21Å; F464-R466 VanDerWaalsContact C-N 3.34Å; F464-R466 PolarHBondContact O-N 2.83Å; F464-G468 WeakPolarHBondContact CD2-O 3.49Å; F464-G468 WeakPolarHBondContact CE2-O 3.46Å; F464-G468 WeakPolarHBondContact O-CA 3.26Å; F464-G468 PolarHBondContact O-N 2.89Å
465	T	44.8	Very low	59.9	Low	52 Å²	52	59.5 Å²	59.5	32%	0.319	31%	0.313	S	S	.	.	H	α-helix	trans	-68.9	-32.9	178.1	-45.2	0	0	0	0	112.2	R234 A444 K461 S462	R234-T465 VanDerWaalsContact NH2-C 3.31Å; R234-T465 PolarHBondContact NH2-O 3.42Å; A444-T465 HydrophobicContact CB-CG2 3.9Å; K461-T465 PolarHBondContact O-N 2.82Å; K461-T465 PolarHBondContact O-OG1 3.43Å; S462-T465 PolarHBondContact O-N 2.62Å
466	R	49.2	Very low	60.1	Low	146 Å²	146	65 Å²	65	55%	0.551	34%	0.34	S	S	*	.	H	α-helix	trans	-90	-33	-177.1	-160.3	179.4	74.2	96.2	6.1	114	R234 A444 S462 D463 F464	R234-R466 PolarHBondContact NH1-O 3.44Å; R234-R466 PolarHBondContact NH2-O 3.14Å; A444-R466 HydrophobicContact CB-CB 3.96Å; A444-R466 HydrophobicContact CB-CG 4.23Å; S462-R466 WeakPolarHBondContact O-CB 3.41Å; S462-R466 PolarHBondContact O-N 3.33Å; D463-R466 PolarHBondContact O-N 3.42Å; F464-R466 VanDerWaalsContact C-N 3.34Å; F464-R466 PolarHBondContact O-N 2.83Å
467	T	48.1	Very low	60.2	Low	23 Å²	23	72.1 Å²	72.1	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-127.2	-5.6	-174.6	64.5	0	0	0	0	114.7	R234 D463 K469	R234-T467 WeakPolarHBondContact CG-O 3.37Å; D463-T467 VanDerWaalsContact O-CA 3.31Å; D463-T467 WeakPolarHBondContact O-CA 3.02Å; D463-T467 WeakPolarHBondContact O-CB 3.28Å; D463-T467 PolarHBondContact O-N 3.07Å; D463-T467 PolarHBondContact O-OG1 3.45Å; T467-K469 PolarHBondContact O-N 3.46Å; T467-K469 PolarHBondContact OG1-O 3.35Å
468	G	49.5	Very low	60.2	Low	16 Å²	16	72.3 Å²	72.3	17%	0.165	36%	0.361	C	S	.	.	S	Bend	trans	75.6	-15.7	174.7	0	0	0	0	0	114.4	D463 F464	D463-G468 PolarHBondContact O-N 3.31Å; F464-G468 WeakPolarHBondContact CD2-O 3.49Å; F464-G468 WeakPolarHBondContact CE2-O 3.46Å; F464-G468 WeakPolarHBondContact O-CA 3.26Å; F464-G468 PolarHBondContact O-N 2.89Å
469	K	44.4	Very low	60.5	Low	97 Å²	97	71.6 Å²	71.6	42%	0.422	36%	0.363	S	S	.	.	S	Bend	trans	-116.2	153.1	174	-68.3	-165.4	-169.9	152.1	0	111.8	D233 T467 T471	D233-K469 HydrophobicContact CB-CB 4.47Å; D233-K469 HydrophobicContact CB-CD 3.58Å; D233-K469 HydrophobicContact CB-CG 3.95Å; D233-K469 WeakPolarHBondContact O-CE 3.07Å; D233-K469 PolarHBondContact O-NZ 2.91Å; D233-K469 IonicContact OD1-NZ 2.9Å; D233-K469 PolarHBondContact OD1-NZ 3.48Å; T467-K469 PolarHBondContact O-N 3.46Å; T467-K469 PolarHBondContact OG1-O 3.35Å; K469-T471 PolarHBondContact O-N 2.99Å
470	R	51.9	Low	61.4	Low	148 Å²	148	77.4 Å²	77.4	56%	0.558	38%	0.382	S	S	*	.			trans	-78.3	110.8	166.8	-120.2	-173.9	173.8	-166.7	-4.7	108.9	D463 V475 D478	D463-R470 WeakPolarHBondContact OD2-CA 3.5Å; R470-V475 HydrophobicContact CB-CG2 4.34Å; R470-V475 HydrophobicContact CG-CG2 3.89Å; R470-D478 IonicContact CZ-OD2 2.87Å; R470-D478 IonicContact NE-OD2 3.25Å; R470-D478 IonicContact NH2-OD2 2.69Å; R470-D478 PolarHBondContact NH2-OD2 3.27Å
471	T	55.8	Low	62.1	Low	41 Å²	41	74.9 Å²	74.9	25%	0.252	37%	0.369	S	S	.	.			trans	-87.8	148.2	177.3	52.9	0	0	0	0	109.8	D463 K469 T473 G474 V475	D463-T471 PolarHBondContact OD2-N 2.79Å; D463-T471 PolarHBondContact OD2-OG1 2.94Å; D463-T471 VanDerWaalsContact OD2-OG1 3.13Å; K469-T471 PolarHBondContact O-N 2.99Å; T471-T473 PolarHBondContact O-N 3.2Å; T471-T473 PolarHBondContact OG1-OG1 2.91Å; T471-G474 CarbonylContact O-C 3.59Å; T471-G474 WeakPolarHBondContact O-CA 3.22Å; T471-G474 PolarHBondContact O-N 3.43Å; T471-G474 VanDerWaalsContact OG1-CA 3.31Å; T471-G474 WeakPolarHBondContact OG1-CA 3.41Å; T471-G474 PolarHBondContact OG1-N 3.43Å; T471-V475 WeakPolarHBondContact O-CG2 3.36Å; T471-V475 PolarHBondContact O-N 3.27Å
472	V	68.4	Low	62.9	Low	120 Å²	120	71.5 Å²	71.5	73%	0.727	36%	0.363	S	S	*	.	H	α-helix	trans	-58.7	-40.5	177.1	177.1	0	0	0	0	110.7	G474 V475 L476	V472-G474 VanDerWaalsContact C-N 3.33Å; V472-V475 PolarHBondContact O-N 2.87Å; V472-L476 WeakPolarHBondContact O-CG 3.2Å; V472-L476 PolarHBondContact O-N 3.44Å
473	T	68.7	Low	64	Low	108 Å²	108	75.1 Å²	75.1	66%	0.663	38%	0.384	S	S	*	.	H	α-helix	trans	-62.1	-40.1	172	48.2	0	0	0	0	111.9	T471 L476 R477	T471-T473 PolarHBondContact O-N 3.2Å; T471-T473 PolarHBondContact OG1-OG1 2.91Å; T473-L476 PolarHBondContact O-N 3.47Å; T473-R477 WeakPolarHBondContact O-CB 3.37Å; T473-R477 PolarHBondContact O-N 3.35Å
474	G	55.5	Low	65.3	Low	5 Å²	5	77.6 Å²	77.6	5%	0.052	40%	0.396	C	S	.	.	H	α-helix	trans	-66.5	-39.5	174.4	0	0	0	0	0	113.7	D463 T471 V472 R477 D478	D463-G474 WeakPolarHBondContact OD2-CA 3.49Å; T471-G474 CarbonylContact O-C 3.59Å; T471-G474 WeakPolarHBondContact O-CA 3.22Å; T471-G474 PolarHBondContact O-N 3.43Å; T471-G474 VanDerWaalsContact OG1-CA 3.31Å; T471-G474 WeakPolarHBondContact OG1-CA 3.41Å; T471-G474 PolarHBondContact OG1-N 3.43Å; V472-G474 VanDerWaalsContact C-N 3.33Å; G474-R477 CarbonylContact O-C 3.53Å; G474-R477 PolarHBondContact O-N 3.42Å; G474-D478 WeakPolarHBondContact O-CB 3.42Å; G474-D478 PolarHBondContact O-N 2.93Å
475	V	72.4	Confident	66.7	Low	62 Å²	62	74.4 Å²	74.4	38%	0.376	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-40.4	174	173.9	0	0	0	0	111.2	R470 T471 V472 D478 G479	R470-V475 HydrophobicContact CB-CG2 4.34Å; R470-V475 HydrophobicContact CG-CG2 3.89Å; T471-V475 WeakPolarHBondContact O-CG2 3.36Å; T471-V475 PolarHBondContact O-N 3.27Å; V472-V475 PolarHBondContact O-N 2.87Å; V475-D478 WeakPolarHBondContact O-CB 3.29Å; V475-D478 PolarHBondContact O-N 3.3Å; V475-G479 PolarHBondContact O-N 2.84Å
476	L	75.8	Confident	68.5	Low	127 Å²	127	79.3 Å²	79.3	67%	0.665	39%	0.393	S	S	*	.	H	α-helix	trans	-64.8	-42.7	174	-73.1	172.6	0	0	0	111.6	V472 T473 G479 Y480	V472-L476 WeakPolarHBondContact O-CG 3.2Å; V472-L476 PolarHBondContact O-N 3.44Å; T473-L476 PolarHBondContact O-N 3.47Å; L476-G479 PolarHBondContact O-N 3.48Å; L476-Y480 WeakPolarHBondContact O-CB 3.46Å; L476-Y480 PolarHBondContact O-N 3.09Å
477	R	76.3	Confident	70.1	Confident	169 Å²	169	77.6 Å²	77.6	64%	0.638	39%	0.387	S	S	*	.	H	α-helix	trans	-65.6	-38.6	175.3	-179.2	173.1	-92.8	-178.1	-6.8	111.6	T473 G474 Y480 N481	T473-R477 WeakPolarHBondContact O-CB 3.37Å; T473-R477 PolarHBondContact O-N 3.35Å; G474-R477 CarbonylContact O-C 3.53Å; G474-R477 PolarHBondContact O-N 3.42Å; R477-Y480 PolarHBondContact O-N 2.87Å; R477-N481 VanDerWaalsContact O-CB 3.25Å; R477-N481 WeakPolarHBondContact O-CB 3.36Å; R477-N481 PolarHBondContact O-N 2.76Å; R477-N481 PolarHBondContact O-ND2 2.97Å; R477-N481 PolarHBondContact O-OD1 3.02Å
478	D	79.3	Confident	71.6	Confident	9 Å²	9	77.1 Å²	77.1	5%	0.048	38%	0.384	C	S	.	.	H	α-helix	trans	-60.9	-44.6	171.8	-87.3	-2.9	0	0	0	110.9	L460 K461 R470 G474 V475 N481 A482	L460-D478 WeakPolarHBondContact CA-OD1 3.28Å; L460-D478 HydrophobicContact CD2-CB 3.97Å; L460-D478 WeakPolarHBondContact CD2-O 3.31Å; K461-D478 PolarHBondContact N-OD1 2.83Å; K461-D478 PolarHBondContact N-OD2 3.15Å; R470-D478 IonicContact CZ-OD2 2.87Å; R470-D478 IonicContact NE-OD2 3.25Å; R470-D478 IonicContact NH2-OD2 2.69Å; R470-D478 PolarHBondContact NH2-OD2 3.27Å; G474-D478 WeakPolarHBondContact O-CB 3.42Å; G474-D478 PolarHBondContact O-N 2.93Å; V475-D478 WeakPolarHBondContact O-CB 3.29Å; V475-D478 PolarHBondContact O-N 3.3Å; D478-N481 PolarHBondContact O-N 2.76Å; D478-A482 VanDerWaalsContact O-CB 3.3Å; D478-A482 WeakPolarHBondContact O-CB 3.49Å; D478-A482 PolarHBondContact O-N 3.43Å
479	G	78.4	Confident	72.8	Confident	35 Å²	35	81.4 Å²	81.4	36%	0.361	40%	0.403	S	S	.	.	H	α-helix	trans	-61.6	-47.2	176.5	0	0	0	0	0	111.9	V475 L476 A482 V483	V475-G479 PolarHBondContact O-N 2.84Å; L476-G479 PolarHBondContact O-N 3.48Å; G479-A482 PolarHBondContact O-N 3.22Å; G479-V483 WeakPolarHBondContact O-CG2 3.12Å; G479-V483 PolarHBondContact O-N 2.95Å
480	Y	81.8	Confident	74.6	Confident	141 Å²	141	81.1 Å²	81.1	55%	0.553	41%	0.406	S	S	*	.	H	α-helix	trans	-59.9	-45.8	173.7	176.9	-97	0	0	0	111.9	L476 R477 A482 V483 M484	L476-Y480 WeakPolarHBondContact O-CB 3.46Å; L476-Y480 PolarHBondContact O-N 3.09Å; R477-Y480 PolarHBondContact O-N 2.87Å; Y480-A482 VanDerWaalsContact C-N 3.32Å; Y480-A482 PolarHBondContact O-N 3.09Å; Y480-V483 PolarHBondContact O-N 2.8Å; Y480-M484 HydrophobicContact CD1-CG 4.25Å; Y480-M484 HydrophobicContact CE1-CG 3.77Å; Y480-M484 HydrophobicContact CE2-CE 3.9Å; Y480-M484 HydrophobicContact CE2-CG 4.19Å; Y480-M484 WeakPolarHBondContact O-CB 3.24Å; Y480-M484 WeakPolarHBondContact O-CG 2.97Å; Y480-M484 PolarHBondContact O-N 3.05Å; Y480-M484 WeakPolarHBondContact OH-CE 3.46Å
481	N	79.9	Confident	76	Confident	11 Å²	11	79.4 Å²	79.4	6%	0.059	40%	0.403	C	S	.	.	H	α-helix	trans	-63.2	-38.1	177.1	-73.3	-13.6	0	0	0	111.4	L460 R477 D478 M484 R485	L460-N481 HydrophobicContact CD2-CB 3.74Å; R477-N481 VanDerWaalsContact O-CB 3.25Å; R477-N481 WeakPolarHBondContact O-CB 3.36Å; R477-N481 PolarHBondContact O-N 2.76Å; R477-N481 PolarHBondContact O-ND2 2.97Å; R477-N481 PolarHBondContact O-OD1 3.02Å; D478-N481 PolarHBondContact O-N 2.76Å; N481-M484 PolarHBondContact O-N 3.27Å; N481-R485 WeakPolarHBondContact O-CB 3.17Å; N481-R485 VanDerWaalsContact O-CG 3.24Å; N481-R485 WeakPolarHBondContact O-CG 3.32Å; N481-R485 PolarHBondContact O-N 3.09Å
482	A	79.7	Confident	77.1	Confident	46 Å²	46	80.6 Å²	80.6	38%	0.38	41%	0.408	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176.5	0	0	0	0	0	111.9	L460 D478 G479 Y480 R485 W486	L460-A482 HydrophobicContact CD2-CB 4.46Å; D478-A482 VanDerWaalsContact O-CB 3.3Å; D478-A482 WeakPolarHBondContact O-CB 3.49Å; D478-A482 PolarHBondContact O-N 3.43Å; G479-A482 PolarHBondContact O-N 3.22Å; Y480-A482 VanDerWaalsContact C-N 3.32Å; Y480-A482 PolarHBondContact O-N 3.09Å; A482-R485 PolarHBondContact O-N 3.05Å; A482-W486 PolarHBondContact O-N 2.89Å
483	V	81.8	Confident	77.6	Confident	91 Å²	91	76.8 Å²	76.8	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-64.1	-43	173.6	172.8	0	0	0	0	110.8	G479 Y480 W486 Y487	G479-V483 WeakPolarHBondContact O-CG2 3.12Å; G479-V483 PolarHBondContact O-N 2.95Å; Y480-V483 PolarHBondContact O-N 2.8Å; V483-W486 WeakPolarHBondContact O-CB 3.27Å; V483-W486 PolarHBondContact O-N 2.91Å; V483-Y487 PolarHBondContact O-N 2.71Å
484	M	80.8	Confident	78	Confident	64 Å²	64	73.8 Å²	73.8	32%	0.315	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-41.7	176.2	-82.2	-66.1	159	0	0	112.1	T457 Y480 N481 W486 Y487 I488	T457-M484 HydrophobicContact CG2-CB 3.72Å; Y480-M484 HydrophobicContact CD1-CG 4.25Å; Y480-M484 HydrophobicContact CE1-CG 3.77Å; Y480-M484 HydrophobicContact CE2-CE 3.9Å; Y480-M484 HydrophobicContact CE2-CG 4.19Å; Y480-M484 WeakPolarHBondContact O-CB 3.24Å; Y480-M484 WeakPolarHBondContact O-CG 2.97Å; Y480-M484 PolarHBondContact O-N 3.05Å; Y480-M484 WeakPolarHBondContact OH-CE 3.46Å; N481-M484 PolarHBondContact O-N 3.27Å; M484-W486 VanDerWaalsContact C-N 3.32Å; M484-W486 PolarHBondContact O-N 3.4Å; M484-Y487 PolarHBondContact O-N 3.15Å; M484-I488 VanDerWaalsContact O-CB 3.28Å; M484-I488 WeakPolarHBondContact O-CB 3.09Å; M484-I488 WeakPolarHBondContact O-CG1 3.41Å; M484-I488 PolarHBondContact O-N 2.77Å
485	R	78.3	Confident	79.2	Confident	51 Å²	51	81 Å²	81	19%	0.192	40%	0.404	C	S	.	.	H	α-helix	trans	-59.7	-42.5	172.2	-75.8	177	-170.1	-154.9	-2.3	111.6	S451 A455 T457 P458 N481 A482 I488 N489	S451-R485 PolarHBondContact OG-NH2 3.49Å; A455-R485 HydrophobicContact CB-CG 4.27Å; T457-R485 HydrophobicContact CG2-CG 3.8Å; T457-R485 WeakPolarHBondContact OG1-CG 3.44Å; T457-R485 PolarHBondContact OG1-NE 3.37Å; P458-R485 PolarHBondContact O-NH2 2.85Å; N481-R485 WeakPolarHBondContact O-CB 3.17Å; N481-R485 VanDerWaalsContact O-CG 3.24Å; N481-R485 WeakPolarHBondContact O-CG 3.32Å; N481-R485 PolarHBondContact O-N 3.09Å; A482-R485 PolarHBondContact O-N 3.05Å; R485-I488 PolarHBondContact O-N 3.41Å; R485-N489 WeakPolarHBondContact O-CB 3.23Å; R485-N489 PolarHBondContact O-N 3.47Å
486	W	83	Confident	79.4	Confident	155 Å²	155	82.7 Å²	82.7	59%	0.587	40%	0.404	S	S	*	.	H	α-helix	trans	-61.9	-44.6	175.6	174.9	87.3	0	0	0	111.8	A482 V483 M484 N490	A482-W486 PolarHBondContact O-N 2.89Å; V483-W486 WeakPolarHBondContact O-CB 3.27Å; V483-W486 PolarHBondContact O-N 2.91Å; M484-W486 VanDerWaalsContact C-N 3.32Å; M484-W486 PolarHBondContact O-N 3.4Å; W486-N490 PolarHBondContact NE1-ND2 3.21Å; W486-N490 PolarHBondContact O-N 3.12Å; W486-N490 VanDerWaalsContact O-N 3.15Å; W486-N490 PolarHBondContact O-ND2 3.34Å
487	Y	82.7	Confident	79.4	Confident	110 Å²	110	81.2 Å²	81.2	43%	0.431	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-48.6	177	178.2	-90.5	0	0	0	111.7	V483 M484 N489 N490 F491	V483-Y487 PolarHBondContact O-N 2.71Å; M484-Y487 PolarHBondContact O-N 3.15Å; Y487-N489 VanDerWaalsContact C-N 3.33Å; Y487-N489 PolarHBondContact O-N 3.05Å; Y487-N490 PolarHBondContact O-N 2.75Å; Y487-F491 AromaticContact CD2-CD2 3.56Å; Y487-F491 HydrophobicContact CD2-CD2 3.56Å; Y487-F491 AromaticContact CD2-CE2 3.95Å; Y487-F491 HydrophobicContact CD2-CE2 3.95Å; Y487-F491 HydrophobicContact CE1-CB 4.5Å; Y487-F491 AromaticContact CE2-CD2 3.62Å; Y487-F491 HydrophobicContact CE2-CD2 3.62Å; Y487-F491 HydrophobicContact CE2-CE2 4.08Å; Y487-F491 HydrophobicContact CE2-CG 4.23Å; Y487-F491 HydrophobicContact CG-CD2 4.13Å; Y487-F491 WeakPolarHBondContact O-CD2 3.23Å; Y487-F491 PolarHBondContact O-N 3.45Å
488	I	78.9	Confident	79.6	Confident	14 Å²	14	75.6 Å²	75.6	7%	0.072	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-45.6	179.6	-72.2	168.7	0	0	0	110.2	T457 M484 R485 N490 F491 N492 D493	T457-I488 HydrophobicContact CG2-CD1 3.91Å; M484-I488 VanDerWaalsContact O-CB 3.28Å; M484-I488 WeakPolarHBondContact O-CB 3.09Å; M484-I488 WeakPolarHBondContact O-CG1 3.41Å; M484-I488 PolarHBondContact O-N 2.77Å; R485-I488 PolarHBondContact O-N 3.41Å; I488-N490 PolarHBondContact O-N 3.28Å; I488-F491 PolarHBondContact O-N 3.24Å; I488-N492 HydrophobicContact CG2-CB 4.43Å; I488-N492 CarbonylContact O-C 3.51Å; I488-N492 WeakPolarHBondContact O-CA 2.96Å; I488-N492 PolarHBondContact O-N 2.85Å; I488-D493 WeakPolarHBondContact CG2-OD1 3.5Å; I488-D493 PolarHBondContact O-N 2.88Å
489	N	76.2	Confident	79.5	Confident	105 Å²	105	77.3 Å²	77.3	56%	0.561	39%	0.392	S	S	*	.	H	α-helix	trans	-60.3	-40.6	177.5	-172.7	35.1	0	0	0	113.6	R485 Y487 D493	R485-N489 WeakPolarHBondContact O-CB 3.23Å; R485-N489 PolarHBondContact O-N 3.47Å; Y487-N489 VanDerWaalsContact C-N 3.33Å; Y487-N489 PolarHBondContact O-N 3.05Å; N489-D493 VanDerWaalsContact CA-OD2 3.25Å; N489-D493 WeakPolarHBondContact CA-OD2 3.24Å
490	N	80.2	Confident	79.3	Confident	92 Å²	92	79.3 Å²	79.3	49%	0.492	39%	0.393	S	S	.	.	H	α-helix	trans	-82.1	-30.7	-177.4	-75.4	-80.5	0	0	0	113.9	W486 Y487 I488	W486-N490 PolarHBondContact NE1-ND2 3.21Å; W486-N490 PolarHBondContact O-N 3.12Å; W486-N490 VanDerWaalsContact O-N 3.15Å; W486-N490 PolarHBondContact O-ND2 3.34Å; Y487-N490 PolarHBondContact O-N 2.75Å; I488-N490 PolarHBondContact O-N 3.28Å
491	F	81.4	Confident	79.2	Confident	112 Å²	112	74.8 Å²	74.8	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-116.6	-28	-168.5	-65	-74.5	0	0	0	114.8	Y487 I488	Y487-F491 AromaticContact CD2-CD2 3.56Å; Y487-F491 HydrophobicContact CD2-CD2 3.56Å; Y487-F491 AromaticContact CD2-CE2 3.95Å; Y487-F491 HydrophobicContact CD2-CE2 3.95Å; Y487-F491 HydrophobicContact CE1-CB 4.5Å; Y487-F491 AromaticContact CE2-CD2 3.62Å; Y487-F491 HydrophobicContact CE2-CD2 3.62Å; Y487-F491 HydrophobicContact CE2-CE2 4.08Å; Y487-F491 HydrophobicContact CE2-CG 4.23Å; Y487-F491 HydrophobicContact CG-CD2 4.13Å; Y487-F491 WeakPolarHBondContact O-CD2 3.23Å; Y487-F491 PolarHBondContact O-N 3.45Å; I488-F491 PolarHBondContact O-N 3.24Å
492	N	78.9	Confident	79.2	Confident	65 Å²	65	79.1 Å²	79.1	35%	0.348	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-30.2	-172.7	-67.8	-15.5	0	0	0	113	I488 G494 F495 R496	I488-N492 HydrophobicContact CG2-CB 4.43Å; I488-N492 CarbonylContact O-C 3.51Å; I488-N492 WeakPolarHBondContact O-CA 2.96Å; I488-N492 PolarHBondContact O-N 2.85Å; N492-G494 VanDerWaalsContact C-N 3.31Å; N492-G494 PolarHBondContact O-N 3.12Å; N492-F495 PolarHBondContact O-N 2.94Å; N492-R496 WeakPolarHBondContact O-CG 3.49Å; N492-R496 PolarHBondContact O-N 3.46Å
493	D	78.8	Confident	79.2	Confident	40 Å²	40	85.6 Å²	85.6	21%	0.214	42%	0.421	C	S	.	.	H	α-helix	trans	-67.9	-29.6	-169.7	-80.8	-3.1	0	0	0	113.5	I488 N489 R496 Q497	I488-D493 WeakPolarHBondContact CG2-OD1 3.5Å; I488-D493 PolarHBondContact O-N 2.88Å; N489-D493 VanDerWaalsContact CA-OD2 3.25Å; N489-D493 WeakPolarHBondContact CA-OD2 3.24Å; D493-R496 PolarHBondContact O-N 3.41Å; D493-Q497 WeakPolarHBondContact O-CB 3.49Å; D493-Q497 PolarHBondContact O-N 3.45Å
494	G	78.3	Confident	79.2	Confident	45 Å²	45	87.4 Å²	87.4	46%	0.464	43%	0.427	S	S	.	.	H	α-helix	trans	-55.7	-56.2	170.9	0	0	0	0	0	111.5	N492 R496 Q497 D498	N492-G494 VanDerWaalsContact C-N 3.31Å; N492-G494 PolarHBondContact O-N 3.12Å; G494-R496 VanDerWaalsContact C-N 3.32Å; G494-R496 PolarHBondContact O-N 3.45Å; G494-Q497 PolarHBondContact O-N 3.46Å; G494-D498 PolarHBondContact O-N 3.1Å; G494-D498 VanDerWaalsContact O-OD2 3.11Å
495	F	79.8	Confident	79.2	Confident	156 Å²	156	87.1 Å²	87.1	68%	0.684	44%	0.441	S	S	*	.	H	α-helix	trans	-63.5	-35.5	177.8	-179	-96.4	0	0	0	113	N492 D498 A499	N492-F495 PolarHBondContact O-N 2.94Å; F495-D498 PolarHBondContact O-N 3.41Å; F495-A499 WeakPolarHBondContact O-CB 3.34Å; F495-A499 PolarHBondContact O-N 3.28Å
496	R	76.2	Confident	79.1	Confident	98 Å²	98	87.2 Å²	87.2	37%	0.37	46%	0.458	S	S	.	.	H	α-helix	trans	-67.8	-42.6	177.2	-68.7	177.5	96.8	145.4	5.6	111.5	N492 D493 G494 D498 A499 I500	N492-R496 WeakPolarHBondContact O-CG 3.49Å; N492-R496 PolarHBondContact O-N 3.46Å; D493-R496 PolarHBondContact O-N 3.41Å; G494-R496 VanDerWaalsContact C-N 3.32Å; G494-R496 PolarHBondContact O-N 3.45Å; R496-D498 VanDerWaalsContact C-N 3.3Å; R496-A499 PolarHBondContact O-N 3.41Å; R496-I500 WeakPolarHBondContact O-CB 3.48Å; R496-I500 WeakPolarHBondContact O-CD1 3.2Å; R496-I500 WeakPolarHBondContact O-CG1 3.47Å; R496-I500 PolarHBondContact O-N 2.86Å
497	Q	77	Confident	78.7	Confident	96 Å²	96	82.1 Å²	82.1	45%	0.449	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.3	-176	58.4	39.9	0	0	109.5	D493 G494 A499 I500 D501	D493-Q497 WeakPolarHBondContact O-CB 3.49Å; D493-Q497 PolarHBondContact O-N 3.45Å; G494-Q497 PolarHBondContact O-N 3.46Å; Q497-A499 VanDerWaalsContact C-N 3.34Å; Q497-A499 PolarHBondContact O-N 2.95Å; Q497-I500 WeakPolarHBondContact O-CB 3.49Å; Q497-I500 PolarHBondContact O-N 3.1Å; Q497-I500 VanDerWaalsContact O-N 3.13Å; Q497-D501 PolarHBondContact NE2-OD1 3.16Å; Q497-D501 PolarHBondContact NE2-OD2 3.05Å; Q497-D501 WeakPolarHBondContact O-CB 3.48Å; Q497-D501 VanDerWaalsContact O-CG 3.31Å; Q497-D501 PolarHBondContact O-N 3.27Å
498	D	79.2	Confident	77.9	Confident	51 Å²	51	79.4 Å²	79.4	27%	0.273	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-41.6	177	-60.1	-34.5	0	0	0	112.1	G494 F495 R496 I500 D501 L502 Y507 F515	G494-D498 PolarHBondContact O-N 3.1Å; G494-D498 VanDerWaalsContact O-OD2 3.11Å; F495-D498 PolarHBondContact O-N 3.41Å; R496-D498 VanDerWaalsContact C-N 3.3Å; D498-I500 VanDerWaalsContact C-N 3.32Å; D498-I500 PolarHBondContact O-N 3.14Å; D498-D501 PolarHBondContact O-N 2.98Å; D498-L502 VanDerWaalsContact O-CB 3.23Å; D498-L502 WeakPolarHBondContact O-CB 3.33Å; D498-L502 PolarHBondContact O-N 3.22Å; D498-Y507 WeakPolarHBondContact CA-OH 3.38Å; D498-Y507 VanDerWaalsContact CB-OH 3.24Å; D498-Y507 WeakPolarHBondContact CB-OH 3.42Å; D498-Y507 WeakPolarHBondContact O-CE2 3.39Å; D498-Y507 PolarHBondContact OD1-OH 3.41Å; D498-F515 HydrophobicContact CB-CZ 3.85Å; D498-F515 VanDerWaalsContact CG-CZ 3.47Å; D498-F515 WeakPolarHBondContact OD2-CZ 3.39Å
499	A	78.1	Confident	77.1	Confident	46 Å²	46	81.5 Å²	81.5	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-64	-37.4	175.5	0	0	0	0	0	112.4	F495 R496 Q497 F503	F495-A499 WeakPolarHBondContact O-CB 3.34Å; F495-A499 PolarHBondContact O-N 3.28Å; R496-A499 PolarHBondContact O-N 3.41Å; Q497-A499 VanDerWaalsContact C-N 3.34Å; Q497-A499 PolarHBondContact O-N 2.95Å; A499-F503 WeakPolarHBondContact O-CB 2.99Å; A499-F503 PolarHBondContact O-N 3.46Å
500	I	75.2	Confident	76.6	Confident	76 Å²	76	80.3 Å²	80.3	39%	0.39	46%	0.461	S	S	.	.	H	α-helix	trans	-67.9	-48.4	175.8	-70.8	163.6	0	0	0	110.1	R496 Q497 D498 L502 F503 L504	R496-I500 WeakPolarHBondContact O-CB 3.48Å; R496-I500 WeakPolarHBondContact O-CD1 3.2Å; R496-I500 WeakPolarHBondContact O-CG1 3.47Å; R496-I500 PolarHBondContact O-N 2.86Å; Q497-I500 WeakPolarHBondContact O-CB 3.49Å; Q497-I500 PolarHBondContact O-N 3.1Å; Q497-I500 VanDerWaalsContact O-N 3.13Å; D498-I500 VanDerWaalsContact C-N 3.32Å; D498-I500 PolarHBondContact O-N 3.14Å; I500-L502 VanDerWaalsContact C-N 3.3Å; I500-L502 PolarHBondContact O-N 3.3Å; I500-F503 PolarHBondContact O-N 3.48Å; I500-F503 VanDerWaalsContact O-N 3.15Å; I500-L504 HydrophobicContact CG2-CD1 3.62Å; I500-L504 HydrophobicContact CG2-CG 4.24Å; I500-L504 WeakPolarHBondContact O-CB 3.5Å; I500-L504 WeakPolarHBondContact O-CG 3.28Å; I500-L504 PolarHBondContact O-N 3Å
501	D	79.2	Confident	75.9	Confident	47 Å²	47	79 Å²	79	25%	0.251	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-38.4	180	-70.6	-26.6	0	0	0	110.9	Q497 D498 G505 G506 Y507	Q497-D501 PolarHBondContact NE2-OD1 3.16Å; Q497-D501 PolarHBondContact NE2-OD2 3.05Å; Q497-D501 WeakPolarHBondContact O-CB 3.48Å; Q497-D501 VanDerWaalsContact O-CG 3.31Å; Q497-D501 PolarHBondContact O-N 3.27Å; D498-D501 PolarHBondContact O-N 2.98Å; D501-G505 CarbonylContact O-C 3.5Å; D501-G505 PolarHBondContact O-N 3.46Å; D501-G506 PolarHBondContact O-N 3.13Å; D501-Y507 HydrophobicContact CB-CD2 4.32Å; D501-Y507 HydrophobicContact CB-CE2 3.76Å
502	L	79.1	Confident	74.9	Confident	102 Å²	102	77.3 Å²	77.3	53%	0.534	45%	0.449	S	S	.	.	H	α-helix	trans	-62.2	-47.4	171.9	-177.2	65.5	0	0	0	112.1	D498 I500 L504 G505 Y507 L512	D498-L502 VanDerWaalsContact O-CB 3.23Å; D498-L502 WeakPolarHBondContact O-CB 3.33Å; D498-L502 PolarHBondContact O-N 3.22Å; I500-L502 VanDerWaalsContact C-N 3.3Å; I500-L502 PolarHBondContact O-N 3.3Å; L502-L504 VanDerWaalsContact C-N 3.35Å; L502-L504 PolarHBondContact O-N 2.89Å; L502-G505 PolarHBondContact O-N 3.01Å; L502-Y507 HydrophobicContact CB-CD2 3.95Å; L502-Y507 HydrophobicContact CB-CE2 3.96Å; L502-Y507 HydrophobicContact CD1-CD2 4.11Å; L502-L512 HydrophobicContact CD1-CD2 3.67Å
503	F	80.8	Confident	74	Confident	181 Å²	181	80 Å²	80	79%	0.794	46%	0.46	S	S	*	.	H	α-helix	trans	-66.2	-37.2	-179.3	-175.5	-95.1	0	0	0	112.6	A499 I500 G505	A499-F503 WeakPolarHBondContact O-CB 2.99Å; A499-F503 PolarHBondContact O-N 3.46Å; I500-F503 PolarHBondContact O-N 3.48Å; I500-F503 VanDerWaalsContact O-N 3.15Å; F503-G505 VanDerWaalsContact C-N 3.31Å
504	L	81.6	Confident	73	Confident	129 Å²	129	85.1 Å²	85.1	68%	0.675	48%	0.484	S	S	*	.	H	α-helix	trans	-85	-1.9	179.8	-64.2	179.3	0	0	0	113.4	I500 L502 G506	I500-L504 HydrophobicContact CG2-CD1 3.62Å; I500-L504 HydrophobicContact CG2-CG 4.24Å; I500-L504 WeakPolarHBondContact O-CB 3.5Å; I500-L504 WeakPolarHBondContact O-CG 3.28Å; I500-L504 PolarHBondContact O-N 3Å; L502-L504 VanDerWaalsContact C-N 3.35Å; L502-L504 PolarHBondContact O-N 2.89Å; L504-G506 VanDerWaalsContact C-N 3.34Å
505	G	80.9	Confident	72	Confident	58 Å²	58	86.2 Å²	86.2	60%	0.598	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	25.3	179.9	0	0	0	0	0	113.9	D501 L502 F503 Y507	D501-G505 CarbonylContact O-C 3.5Å; D501-G505 PolarHBondContact O-N 3.46Å; L502-G505 PolarHBondContact O-N 3.01Å; F503-G505 VanDerWaalsContact C-N 3.31Å; G505-Y507 PolarHBondContact O-N 2.88Å
506	G	75.9	Confident	70.6	Confident	54 Å²	54	85.8 Å²	85.8	56%	0.557	48%	0.478	S	S	*	.			trans	-68.1	-17.2	174.7	0	0	0	0	0	113.9	D501 L504	D501-G506 PolarHBondContact O-N 3.13Å; L504-G506 VanDerWaalsContact C-N 3.34Å
507	Y	74.1	Confident	69.2	Low	47 Å²	47	90 Å²	90	18%	0.184	50%	0.495	C	S	.	.	S	Bend	trans	-89.2	124.9	173.1	-64.6	-58.5	0	0	0	111.8	D498 D501 L502 G505 D511 F515	D498-Y507 WeakPolarHBondContact CA-OH 3.38Å; D498-Y507 VanDerWaalsContact CB-OH 3.24Å; D498-Y507 WeakPolarHBondContact CB-OH 3.42Å; D498-Y507 WeakPolarHBondContact O-CE2 3.39Å; D498-Y507 PolarHBondContact OD1-OH 3.41Å; D501-Y507 HydrophobicContact CB-CD2 4.32Å; D501-Y507 HydrophobicContact CB-CE2 3.76Å; L502-Y507 HydrophobicContact CB-CD2 3.95Å; L502-Y507 HydrophobicContact CB-CE2 3.96Å; L502-Y507 HydrophobicContact CD1-CD2 4.11Å; G505-Y507 PolarHBondContact O-N 2.88Å; Y507-D511 HydrophobicContact CD1-CB 3.63Å; Y507-D511 HydrophobicContact CG-CB 4.23Å; Y507-F515 HydrophobicContact CE1-CD2 4.3Å; Y507-F515 AromaticContact CE1-CE2 3.97Å; Y507-F515 HydrophobicContact CE1-CE2 3.97Å; Y507-F515 HydrophobicContact CE2-CE2 4.46Å; Y507-F515 AromaticContact CZ-CE2 3.72Å; Y507-F515 WeakPolarHBondContact OH-CE2 3.29Å
508	S	65	Low	68	Low	54 Å²	54	88.3 Å²	88.3	38%	0.378	49%	0.494	S	S	.	.			trans	-72.7	162	163.6	70.1	0	0	0	0	110.5	S510 D511 L512	S508-S510 PolarHBondContact O-N 3.41Å; S508-S510 VanDerWaalsContact O-N 3.11Å; S508-S510 PolarHBondContact OG-OG 3.48Å; S508-D511 WeakPolarHBondContact CB-OD2 3.41Å; S508-D511 PolarHBondContact N-OD2 3.28Å; S508-D511 WeakPolarHBondContact O-CB 3.3Å; S508-D511 PolarHBondContact O-N 3.12Å; S508-D511 PolarHBondContact OG-OD2 3.5Å; S508-L512 PolarHBondContact O-N 2.96Å
509	G	63.8	Low	66.4	Low	57 Å²	57	93.6 Å²	93.6	59%	0.588	52%	0.517	S	S	*	.	H	α-helix	trans	-54	-32.7	179.5	0	0	0	0	0	113.8
510	S	65.1	Low	64.6	Low	80 Å²	80	96.2 Å²	96.2	56%	0.559	53%	0.533	S	S	*	.	H	α-helix	trans	-70.6	-30.5	175.3	40.7	0	0	0	0	113.9	S508 E513 M514	S508-S510 PolarHBondContact O-N 3.41Å; S508-S510 VanDerWaalsContact O-N 3.11Å; S508-S510 PolarHBondContact OG-OG 3.48Å; S510-E513 PolarHBondContact O-N 2.94Å; S510-M514 PolarHBondContact O-N 3.3Å
511	D	65.7	Low	62.6	Low	65 Å²	65	103.4 Å²	103.4	35%	0.348	56%	0.555	S	S	.	*	H	α-helix	trans	-72.2	-35	-179.4	-56.4	-42.7	0	0	0	111.1	Y507 S508 M514 F515	Y507-D511 HydrophobicContact CD1-CB 3.63Å; Y507-D511 HydrophobicContact CG-CB 4.23Å; S508-D511 WeakPolarHBondContact CB-OD2 3.41Å; S508-D511 PolarHBondContact N-OD2 3.28Å; S508-D511 WeakPolarHBondContact O-CB 3.3Å; S508-D511 PolarHBondContact O-N 3.12Å; S508-D511 PolarHBondContact OG-OD2 3.5Å; D511-M514 PolarHBondContact O-N 3.28Å; D511-F515 PolarHBondContact O-N 3.37Å
512	L	60.8	Low	60.4	Low	76 Å²	76	112.3 Å²	112.3	40%	0.398	59%	0.585	S	S	.	*	H	α-helix	trans	-65.6	-37.1	175.3	-73.5	166.4	0	0	0	112.4	L502 S508 F515 M516	L502-L512 HydrophobicContact CD1-CD2 3.67Å; S508-L512 PolarHBondContact O-N 2.96Å; L512-F515 WeakPolarHBondContact O-CB 3.31Å; L512-F515 PolarHBondContact O-N 3.11Å; L512-M516 PolarHBondContact O-N 3.36Å
513	E	59.3	Low	58.2	Low	122 Å²	122	111.3 Å²	111.3	57%	0.57	59%	0.587	S	S	*	*	H	α-helix	trans	-62.7	-45.1	174.2	-72.4	-172.5	165.5	0	0	110.9	S510 F515 M516 Y517	S510-E513 PolarHBondContact O-N 2.94Å; E513-F515 VanDerWaalsContact C-N 3.25Å; E513-F515 PolarHBondContact O-N 3.09Å; E513-M516 PolarHBondContact O-N 3.25Å; E513-Y517 WeakPolarHBondContact O-CD2 3.39Å; E513-Y517 PolarHBondContact O-N 2.9Å
514	M	58.3	Low	55.9	Low	147 Å²	147	109.5 Å²	109.5	72%	0.724	58%	0.584	S	S	*	*	H	α-helix	trans	-62.4	-34.7	176.6	-163.1	175.7	179.2	0	0	111.9	S510 D511 Y517 S518	S510-M514 PolarHBondContact O-N 3.3Å; D511-M514 PolarHBondContact O-N 3.28Å; M514-Y517 PolarHBondContact O-N 2.99Å; M514-S518 WeakPolarHBondContact O-CB 3.37Å; M514-S518 PolarHBondContact O-N 2.82Å
515	F	56.7	Low	53.8	Low	68 Å²	68	107.1 Å²	107.1	30%	0.298	57%	0.574	S	S	.	*	H	α-helix	trans	-63.2	-42.2	174.1	-118.9	-82.2	0	0	0	113.3	D498 Y507 D511 L512 E513 Y517 S518 Q519	D498-F515 HydrophobicContact CB-CZ 3.85Å; D498-F515 VanDerWaalsContact CG-CZ 3.47Å; D498-F515 WeakPolarHBondContact OD2-CZ 3.39Å; Y507-F515 HydrophobicContact CE1-CD2 4.3Å; Y507-F515 AromaticContact CE1-CE2 3.97Å; Y507-F515 HydrophobicContact CE1-CE2 3.97Å; Y507-F515 HydrophobicContact CE2-CE2 4.46Å; Y507-F515 AromaticContact CZ-CE2 3.72Å; Y507-F515 WeakPolarHBondContact OH-CE2 3.29Å; D511-F515 PolarHBondContact O-N 3.37Å; L512-F515 WeakPolarHBondContact O-CB 3.31Å; L512-F515 PolarHBondContact O-N 3.11Å; E513-F515 VanDerWaalsContact C-N 3.25Å; E513-F515 PolarHBondContact O-N 3.09Å; F515-Y517 VanDerWaalsContact C-N 3.25Å; F515-Y517 PolarHBondContact O-N 3.17Å; F515-S518 PolarHBondContact O-N 3.37Å; F515-S518 PolarHBondContact O-OG 3.01Å; F515-S518 VanDerWaalsContact O-OG 3.14Å; F515-Q519 PolarHBondContact O-N 3.12Å
516	M	49.7	Very low	51.4	Low	147 Å²	147	110.7 Å²	110.7	72%	0.724	58%	0.58	S	S	*	*	H	α-helix	trans	-63.3	-33.6	176	-70.6	-159.3	-62.8	0	0	112	L512 E513	L512-M516 PolarHBondContact O-N 3.36Å; E513-M516 PolarHBondContact O-N 3.25Å
517	Y	48.7	Very low	49.5	Very low	187 Å²	187	114.5 Å²	114.5	73%	0.733	59%	0.587	S	S	*	*	H	α-helix	trans	-79.9	-27.7	176.3	-73.7	-72.6	0	0	0	113.3	E513 M514 F515 S520	E513-Y517 WeakPolarHBondContact O-CD2 3.39Å; E513-Y517 PolarHBondContact O-N 2.9Å; M514-Y517 PolarHBondContact O-N 2.99Å; F515-Y517 VanDerWaalsContact C-N 3.25Å; F515-Y517 PolarHBondContact O-N 3.17Å; Y517-S520 PolarHBondContact O-OG 3.31Å
518	S	50.5	Low	47.7	Very low	61 Å²	61	118.2 Å²	118.2	43%	0.427	62%	0.615	S	S	.	*	H	α-helix	trans	-79.6	-24.7	-177	77.9	0	0	0	0	114.4	M514 F515 S520 R521	M514-S518 WeakPolarHBondContact O-CB 3.37Å; M514-S518 PolarHBondContact O-N 2.82Å; F515-S518 PolarHBondContact O-N 3.37Å; F515-S518 PolarHBondContact O-OG 3.01Å; F515-S518 VanDerWaalsContact O-OG 3.14Å; S518-S520 PolarHBondContact O-N 3.47Å; S518-R521 PolarHBondContact O-N 3.13Å
519	Q	45.5	Very low	46.4	Very low	161 Å²	161	121.7 Å²	121.7	75%	0.752	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-6.3	175.4	-78.8	-160.1	3.7	0	0	114.3	F515 R521	F515-Q519 PolarHBondContact O-N 3.12Å; Q519-R521 VanDerWaalsContact C-N 3.27Å; Q519-R521 PolarHBondContact O-N 2.83Å
520	S	41.8	Very low	45.2	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-6.2	170.3	65.9	0	0	0	0	114.9	Y517 S518	Y517-S520 PolarHBondContact O-OG 3.31Å; S518-S520 PolarHBondContact O-N 3.47Å
521	R	31.8	Very low	43.8	Very low	228 Å²	228	124.9 Å²	124.9	86%	0.86	65%	0.647	S	S	*	*	S	Bend	trans	-101	98.7	175.7	-77.1	-170.3	173.1	-169.6	-0.8	112.7	S518 Q519	S518-R521 PolarHBondContact O-N 3.13Å; Q519-R521 VanDerWaalsContact C-N 3.27Å; Q519-R521 PolarHBondContact O-N 2.83Å
522	R	32.6	Very low	42.2	Very low	233 Å²	233	128.6 Å²	128.6	88%	0.879	67%	0.672	S	S	*	*			trans	-49.2	138.2	165.7	-72.4	178.5	173.1	175.8	-2.2	111.3	I524	R522-I524 PolarHBondContact O-N 3.28Å
523	S	33	Very low	40.9	Very low	82 Å²	82	133 Å²	133	57%	0.573	72%	0.72	S	S	*	*			trans	-36.4	124.9	173.6	175.5	0	0	0	0	112.9	V525 N526	S523-V525 PolarHBondContact O-N 3.13Å; S523-N526 PolarHBondContact O-N 3.12Å
524	I	34.2	Very low	40	Very low	143 Å²	143	133.6 Å²	133.6	73%	0.733	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-62.5	-7.4	-176.9	-131	164.1	0	0	0	113.2	R522 N526 L527	R522-I524 PolarHBondContact O-N 3.28Å; I524-N526 PolarHBondContact O-N 2.82Å; I524-L527 PolarHBondContact O-N 3.06Å
525	V	35.5	Very low	39.1	Very low	78 Å²	78	132.9 Å²	132.9	47%	0.473	73%	0.727	S	S	.	*	G	3₁₀ helix	trans	-70.4	-17.1	177.8	-175.6	0	0	0	0	112.5	S523	S523-V525 PolarHBondContact O-N 3.13Å
526	N	32.1	Very low	38.1	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-90.9	1.1	177.3	-80.7	-13.6	0	0	0	115.3	S523 I524	S523-N526 PolarHBondContact O-N 3.12Å; I524-N526 PolarHBondContact O-N 2.82Å
527	L	34.8	Very low	37.4	Very low	134 Å²	134	135.9 Å²	135.9	70%	0.702	75%	0.753	S	S	*	*	S	Bend	trans	-95.7	-11.4	177.5	-90.8	161	0	0	0	114.6	I524	I524-L527 PolarHBondContact O-N 3.06Å
528	T	36.4	Very low	36.7	Very low	125 Å²	125	132.7 Å²	132.7	77%	0.767	75%	0.754	S	S	*	*	S	Bend	trans	-94.8	4.7	179.8	32.3	0	0	0	0	115.1
529	V	39	Very low	35.8	Very low	127 Å²	127	137.5 Å²	137.5	77%	0.77	78%	0.776	S	S	*	*	S	Bend	trans	-118.9	12.1	-179.6	-167.6	0	0	0	0	113.9
530	S	37	Very low	35.1	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	78%	0.777	S	S	*	*	S	Bend	trans	-131.8	37.9	-179.6	82.5	0	0	0	0	116.9
531	S	35.7	Very low	34.6	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	78%	0.783	S	S	*	*	S	Bend	trans	-140.1	30.8	167.1	76.7	0	0	0	0	115.2
532	T	33	Very low	34.8	Very low	142 Å²	142	131 Å²	131	87%	0.871	78%	0.776	S	S	*	*			trans	-132.4	72.4	163.5	53.4	0	0	0	0	109.7
533	A	34.4	Very low	35	Very low	170 Å²	170	121.7 Å²	121.7	100%	1.405	77%	0.767	S	S	*	*			trans	-145.5	0	152.4	0	0	0	0	0	105.3

Retrieved 533 of 533 residues in 89.8 ms (Link to these results)

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