A0A087XX77_POEFO Loading...

Polyribonucleotide nucleotidyltransferase 1, mitochondrial

AlphaFold DB , UniProt , Accession A0A087XX77, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 770 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	35.8	Very low	31.2	Very low	240 Å²	240	162.9 Å²	162.9	100%	1.182	83%	0.832	S	S	*	*				0	117.9	0	-78.8	175.9	168	0	0	108
2	R	30.8	Very low	30.9	Very low	225 Å²	225	157.3 Å²	157.3	85%	0.849	83%	0.828	S	S	*	*			cis	-156.6	123.1	-17.1	-101.7	-174.4	172.5	171	-2.3	104.6
3	Y	31.5	Very low	30.6	Very low	200 Å²	200	159.5 Å²	159.5	78%	0.784	82%	0.819	S	S	*	*			trans	56.9	114.8	144.6	-71.5	-96.6	0	0	0	121
4	L	31.4	Very low	30.3	Very low	137 Å²	137	159.1 Å²	159.1	72%	0.717	82%	0.818	S	S	*	*				71.5	104.9	74.8	-81.7	149.3	0	0	0	113
5	V	36.1	Very low	30.1	Very low	141 Å²	141	159.5 Å²	159.5	86%	0.855	82%	0.815	S	S	*	*				77.4	125.2	100.7	170.4	0	0	0	0	114.9
6	G	29.9	Very low	30.2	Very low	54 Å²	54	157.2 Å²	157.2	56%	0.557	81%	0.81	S	S	*	*			trans	138.5	120	142.3	0	0	0	0	0	117.8
7	L	29.7	Very low	30.4	Very low	187 Å²	187	161.5 Å²	161.5	98%	0.979	81%	0.813	S	S	*	*			trans	69.7	131.2	153.2	-61.3	111.6	0	0	0	117.9
8	G	26.1	Very low	30.6	Very low	72 Å²	72	158.7 Å²	158.7	74%	0.742	81%	0.812	S	S	*	*			cis	-164.1	145	9.3	0	0	0	0	0	111.4
9	R	31.6	Very low	31.1	Very low	258 Å²	258	155.9 Å²	155.9	97%	0.974	81%	0.807	S	S	*	*			trans	-76	124	164.9	-78.6	176.1	167.3	-175.8	-3.7	108.1
10	S	27.1	Very low	31.8	Very low	114 Å²	114	157.6 Å²	157.6	80%	0.797	81%	0.81	S	S	*	*			trans	-135.6	111	154.1	-161.8	0	0	0	0	110.4
11	F	33.4	Very low	31.9	Very low	164 Å²	164	159 Å²	159	72%	0.719	81%	0.813	S	S	*	*			trans	5.1	108.1	155.8	-75.2	-100	0	0	0	118.9	R13	F11-R13 HydrophobicContact CD1-CG 4.24Å
12	A	27	Very low	32	Very low	95 Å²	95	151.3 Å²	151.3	79%	0.785	78%	0.783	S	S	*	*			trans	-124.3	84.4	141.4	0	0	0	0	0	107.9	L14	A12-L14 PolarHBondContact O-N 3.47Å; A12-L14 VanDerWaalsContact O-N 3.09Å
13	R	27.2	Very low	32.7	Very low	186 Å²	186	147 Å²	147	70%	0.702	78%	0.775	S	S	*	*			trans	-71.8	96.9	166.5	-84.3	-176.7	-177.5	177.6	1.9	107.6	F11 H15	F11-R13 HydrophobicContact CD1-CG 4.24Å; R13-H15 VanDerWaalsContact C-N 3.29Å; R13-H15 PolarHBondContact O-N 3.24Å
14	L	27	Very low	33.3	Very low	155 Å²	155	143.9 Å²	143.9	81%	0.812	76%	0.763	S	S	*	*			trans	-60.7	95	154	-90.1	135.7	0	0	0	107.8	A12 V16	A12-L14 PolarHBondContact O-N 3.47Å; A12-L14 VanDerWaalsContact O-N 3.09Å; L14-V16 HydrophobicContact CB-CG2 4.48Å; L14-V16 PolarHBondContact O-N 3.08Å
15	H	27.8	Very low	33.5	Very low	165 Å²	165	140.8 Å²	140.8	76%	0.764	76%	0.764	S	S	*	*			trans	-72.7	84.7	159.6	-95.2	29.5	0	0	0	107.7	R13 R17	R13-H15 VanDerWaalsContact C-N 3.29Å; R13-H15 PolarHBondContact O-N 3.24Å; H15-R17 PolarHBondContact O-N 3.21Å
16	V	31.6	Very low	33.8	Very low	122 Å²	122	145.2 Å²	145.2	74%	0.739	77%	0.766	S	S	*	*			trans	-58.7	121.9	165.9	174.1	0	0	0	0	107.6	L14 S18	L14-V16 HydrophobicContact CB-CG2 4.48Å; L14-V16 PolarHBondContact O-N 3.08Å; V16-S18 PolarHBondContact O-N 2.97Å
17	R	33.3	Very low	34.6	Very low	230 Å²	230	146.6 Å²	146.6	87%	0.868	76%	0.76	S	S	*	*			trans	-50.4	104.1	175.7	-74.2	175.6	168.2	177.5	-4.1	110.8	H15 C19	H15-R17 PolarHBondContact O-N 3.21Å; R17-C19 PolarHBondContact O-N 2.91Å
18	S	34.2	Very low	35.5	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	75%	0.748	S	S	*	*			trans	-75.8	74.9	156.8	-179.8	0	0	0	0	108.6	V16	V16-S18 PolarHBondContact O-N 2.97Å
19	C	39.9	Very low	37.2	Very low	106 Å²	106	144 Å²	144	72%	0.716	74%	0.738	S	S	*	*			trans	-138	73	169.7	-86.5	0	0	0	0	108.6	R17	R17-C19 PolarHBondContact O-N 2.91Å
20	H	44	Very low	38.9	Very low	188 Å²	188	135.4 Å²	135.4	87%	0.87	72%	0.716	S	S	*	*			trans	176.9	73.4	148.1	-89.3	-21.9	0	0	0	108.2	S22	H20-S22 PolarHBondContact O-N 3.23Å
21	Q	34.1	Very low	41.6	Very low	187 Å²	187	135.7 Å²	135.7	87%	0.874	70%	0.7	S	S	*	*			trans	-80.6	102.9	143	-86	-173.9	-15.9	0	0	105.6	I23	Q21-I23 PolarHBondContact O-N 2.87Å
22	S	39.3	Very low	44.3	Very low	80 Å²	80	135.6 Å²	135.6	56%	0.559	69%	0.694	S	S	*	*			trans	-59.4	138.2	168	85.2	0	0	0	0	107.5	H20 Y24	H20-S22 PolarHBondContact O-N 3.23Å; S22-Y24 PolarHBondContact O-N 3.15Å; S22-Y24 WeakPolarHBondContact OG-CB 3.47Å; S22-Y24 VanDerWaalsContact OG-CD2 3.27Å; S22-Y24 WeakPolarHBondContact OG-CD2 3.49Å
23	I	43.7	Very low	47.5	Very low	133 Å²	133	131.7 Å²	131.7	68%	0.682	66%	0.661	S	S	*	*	S	Bend	trans	-65	14.5	179.9	-67.2	165.2	0	0	0	111.7	Q21 G25	Q21-I23 PolarHBondContact O-N 2.87Å; I23-G25 PolarHBondContact O-N 3.06Å
24	Y	44	Very low	50.6	Low	136 Å²	136	124.9 Å²	124.9	53%	0.533	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	9.4	-168	-81.7	-96.8	0	0	0	115.6	S22 R51 F52	S22-Y24 PolarHBondContact O-N 3.15Å; S22-Y24 WeakPolarHBondContact OG-CB 3.47Å; S22-Y24 VanDerWaalsContact OG-CD2 3.27Å; S22-Y24 WeakPolarHBondContact OG-CD2 3.49Å; Y24-R51 PolarHBondContact OH-O 3.38Å; Y24-F52 HydrophobicContact CE1-CD1 4.1Å; Y24-F52 AromaticContact CE1-CE1 3.7Å; Y24-F52 HydrophobicContact CE1-CE1 3.7Å; Y24-F52 HydrophobicContact CE1-CZ 4.39Å; Y24-F52 AromaticContact CZ-CD1 3.66Å; Y24-F52 AromaticContact CZ-CE1 3.68Å; Y24-F52 WeakPolarHBondContact OH-CA 3.44Å; Y24-F52 WeakPolarHBondContact OH-CD1 3.38Å; Y24-F52 VanDerWaalsContact OH-CE1 3.29Å; Y24-F52 WeakPolarHBondContact OH-CE1 3.19Å
25	G	37	Very low	53.8	Low	72 Å²	72	117.9 Å²	117.9	74%	0.742	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-9.3	-174.7	0	0	0	0	0	117.9	I23	I23-G25 PolarHBondContact O-N 3.06Å
26	R	42	Very low	56.9	Low	233 Å²	233	115.3 Å²	115.3	88%	0.879	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	-19.3	-167.6	-83.2	-175.1	176.4	178.4	-0.4	118.5
27	N	47.5	Very low	59.5	Low	84 Å²	84	110 Å²	110	45%	0.449	57%	0.571	S	S	.	*			trans	-118.5	58.3	-176.4	-76.1	-5.9	0	0	0	112.8	N29	N27-N29 VanDerWaalsContact C-N 3.29Å; N27-N29 PolarHBondContact O-N 2.84Å
28	S	48.1	Very low	61.8	Low	101 Å²	101	101.8 Å²	101.8	71%	0.706	56%	0.558	S	S	*	*			trans	-82	0.4	176.3	59.7	0	0	0	0	114.6
29	N	60.9	Low	63.9	Low	102 Å²	102	106.2 Å²	106.2	55%	0.545	57%	0.567	S	S	.	*	S	Bend	trans	-96.5	116.9	-178.5	-74	-9	0	0	0	110.6	N27 R31	N27-N29 VanDerWaalsContact C-N 3.29Å; N27-N29 PolarHBondContact O-N 2.84Å; N29-R31 PolarHBondContact O-N 2.98Å
30	P	67.3	Low	66.2	Low	78 Å²	78	103 Å²	103	51%	0.506	54%	0.541	S	S	.	.			trans	-57.4	126.9	171.4	23.5	-32.1	0	0	0	109.9	S48	P30-S48 WeakPolarHBondContact CB-OG 3.47Å
31	R	83.7	Confident	68.5	Low	121 Å²	121	100 Å²	100	46%	0.457	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.6	177	-64.4	-66.4	-177.7	170.7	0.4	109.2	N29 S45 S46 L248	N29-R31 PolarHBondContact O-N 2.98Å; R31-S45 WeakPolarHBondContact O-CA 3.28Å; R31-S45 WeakPolarHBondContact O-CB 3.28Å; R31-S46 PolarHBondContact N-O 3.17Å; R31-S46 PolarHBondContact O-N 2.69Å; R31-S46 VanDerWaalsContact O-N 3.1Å; R31-L248 HydrophobicContact CB-CD2 4.16Å
32	R	91.1	Very high	71.5	Confident	161 Å²	161	91.1 Å²	91.1	61%	0.608	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	135.6	-174.5	-34.4	-176.8	97.4	-163.2	0.8	107.7	I44	R32-I44 CarbonylContact C-O 3.57Å; R32-I44 VanDerWaalsContact CA-O 3.29Å; R32-I44 WeakPolarHBondContact CA-O 3.39Å
33	V	94.5	Very high	74.2	Confident	13 Å²	13	89.8 Å²	89.8	8%	0.079	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.1	169.4	71.2	0	0	0	0	108.2	I44 A244 L248	V33-I44 HydrophobicContact CG1-CB 3.89Å; V33-I44 HydrophobicContact CG1-CG1 4.42Å; V33-I44 PolarHBondContact N-O 3.03Å; V33-I44 PolarHBondContact O-N 3.19Å; V33-A244 HydrophobicContact CG1-CB 3.93Å; V33-A244 HydrophobicContact CG2-CB 3.96Å; V33-L248 HydrophobicContact CB-CD1 4.3Å; V33-L248 HydrophobicContact CB-CD2 4.13Å; V33-L248 HydrophobicContact CB-CG 3.96Å; V33-L248 HydrophobicContact CG1-CD1 3.44Å; V33-L248 VanDerWaalsContact CG1-CD1 3.44Å; V33-L248 HydrophobicContact CG1-CD2 4.17Å; V33-L248 HydrophobicContact CG1-CG 3.57Å
34	G	92.5	Very high	76.8	Confident	43 Å²	43	83.4 Å²	83.4	44%	0.443	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.9	172	0	0	0	0	0	110.1	L42	G34-L42 CarbonylContact C-O 3.57Å; G34-L42 WeakPolarHBondContact CA-O 2.82Å
35	V	93.9	Very high	79.2	Confident	8 Å²	8	78 Å²	78	5%	0.048	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.5	171.1	-165.4	0	0	0	0	107.5	L37 L42 I44 Q240 I241 A244	V35-L37 HydrophobicContact CG1-CD2 4.04Å; V35-L37 HydrophobicContact CG1-CG 4.25Å; V35-L42 HydrophobicContact CB-CB 4.2Å; V35-L42 HydrophobicContact CG2-CD2 4.49Å; V35-L42 PolarHBondContact N-O 2.88Å; V35-L42 PolarHBondContact O-N 3.2Å; V35-I44 HydrophobicContact CG2-CD1 4.41Å; V35-Q240 HydrophobicContact CG1-CB 3.94Å; V35-I241 HydrophobicContact CG1-CG1 4.22Å; V35-A244 HydrophobicContact CG2-CB 3.31Å
36	D	92.2	Very high	82	Confident	112 Å²	112	75.3 Å²	75.3	60%	0.599	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	116.5	172.4	-167.1	-24.1	0	0	0	108.8	G38 Q240	D36-G38 PolarHBondContact OD1-N 3.46Å; D36-Q240 PolarHBondContact O-OE1 2.91Å
37	L	87.4	Confident	84.2	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.047	36%	0.357	C	S	.	.			trans	-113.5	40.8	178	-62.9	175.3	0	0	0	110.3	V35 K40 L42 N189 H237 Q240 I241	V35-L37 HydrophobicContact CG1-CD2 4.04Å; V35-L37 HydrophobicContact CG1-CG 4.25Å; L37-K40 PolarHBondContact N-O 3.45Å; L37-L42 HydrophobicContact CD1-CB 4.12Å; L37-L42 HydrophobicContact CD1-CD2 4.49Å; L37-N189 WeakPolarHBondContact CD1-ND2 3.49Å; L37-H237 HydrophobicContact CD2-CB 4.37Å; L37-Q240 HydrophobicContact CD2-CB 4.35Å; L37-I241 HydrophobicContact CD1-CD1 4.08Å; L37-I241 HydrophobicContact CD1-CG1 4.33Å; L37-I241 HydrophobicContact CD2-CD1 4.4Å; L37-I241 HydrophobicContact CD2-CG1 4.08Å
38	G	81.4	Confident	86.2	Confident	58 Å²	58	64.8 Å²	64.8	60%	0.598	36%	0.36	S	S	*	.	S	Bend	trans	95.4	-113	-178.1	0	0	0	0	0	110.7	D36 K40	D36-G38 PolarHBondContact OD1-N 3.46Å; G38-K40 VanDerWaalsContact C-N 3.27Å
39	E	78.5	Confident	88.4	Confident	205 Å²	205	63.9 Å²	63.9	96%	0.958	35%	0.347	S	S	*	.	S	Bend	trans	-83	-9.5	176.2	-61.1	-170.8	163.2	0	0	112.7
40	K	87.9	Confident	90.1	Very high	40 Å²	40	61.1 Å²	61.1	17%	0.174	34%	0.338	C	S	.	.			trans	-110.4	133.5	-174.7	-59.6	-169.6	-177.9	-169.7	0	111.1	L37 G38 L61 N189 T191	L37-K40 PolarHBondContact N-O 3.45Å; G38-K40 VanDerWaalsContact C-N 3.27Å; K40-L61 HydrophobicContact CB-CD1 3.98Å; K40-N189 PolarHBondContact NZ-O 3.35Å; K40-T191 VanDerWaalsContact NZ-CG2 3.31Å
41	K	92.6	Very high	91.3	Very high	124 Å²	124	66 Å²	66	54%	0.539	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.2	176.9	-167.4	-174.7	-179	-151.4	0	110.4	E43 L61	K41-E43 WeakPolarHBondContact CE-OE1 3.49Å; K41-E43 IonicContact NZ-OE1 3.42Å; K41-E43 PolarHBondContact NZ-OE1 3.32Å; K41-L61 WeakPolarHBondContact O-CD1 3.36Å
42	L	95.9	Very high	91.9	Very high	1 Å²	1	69 Å²	69	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.9	173.8	-171.7	82.1	0	0	0	108.9	G34 V35 L37 I44 V59 L61 L154 I241	G34-L42 CarbonylContact C-O 3.57Å; G34-L42 WeakPolarHBondContact CA-O 2.82Å; V35-L42 HydrophobicContact CB-CB 4.2Å; V35-L42 HydrophobicContact CG2-CD2 4.49Å; V35-L42 PolarHBondContact N-O 2.88Å; V35-L42 PolarHBondContact O-N 3.2Å; L37-L42 HydrophobicContact CD1-CB 4.12Å; L37-L42 HydrophobicContact CD1-CD2 4.49Å; L42-I44 HydrophobicContact CD2-CD1 4.31Å; L42-I44 HydrophobicContact CD2-CG1 4.3Å; L42-V59 HydrophobicContact CD1-CG1 3.53Å; L42-V59 HydrophobicContact CD2-CG1 4.23Å; L42-V59 HydrophobicContact CG-CG1 3.89Å; L42-L61 HydrophobicContact CB-CD1 4.42Å; L42-L61 HydrophobicContact CD1-CB 4.13Å; L42-L61 HydrophobicContact CD1-CD1 4.24Å; L42-L154 HydrophobicContact CD1-CD1 4.44Å; L42-L154 HydrophobicContact CD1-CG 4.34Å; L42-I241 HydrophobicContact CD2-CD1 4.11Å; L42-I241 HydrophobicContact CD2-CG1 4.11Å; L42-I241 HydrophobicContact CD2-CG2 4.27Å
43	E	96.9	Very high	92.2	Very high	51 Å²	51	62.4 Å²	62.4	24%	0.238	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	176.1	-61.6	-163.1	164.8	0	0	110.5	K41 V59 Q60	K41-E43 WeakPolarHBondContact CE-OE1 3.49Å; K41-E43 IonicContact NZ-OE1 3.42Å; K41-E43 PolarHBondContact NZ-OE1 3.32Å; E43-V59 CarbonylContact O-C 3.55Å; E43-V59 WeakPolarHBondContact O-CA 3.47Å; E43-Q60 HydrophobicContact CB-CB 4.48Å; E43-Q60 PolarHBondContact N-O 3.26Å; E43-Q60 PolarHBondContact O-N 2.82Å
44	I	97.3	Very high	92.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.7	177.5	-49.2	178.7	0	0	0	107.8	R32 V33 V35 L42 V59 A161 I241 I245 L248	R32-I44 CarbonylContact C-O 3.57Å; R32-I44 VanDerWaalsContact CA-O 3.29Å; R32-I44 WeakPolarHBondContact CA-O 3.39Å; V33-I44 HydrophobicContact CG1-CB 3.89Å; V33-I44 HydrophobicContact CG1-CG1 4.42Å; V33-I44 PolarHBondContact N-O 3.03Å; V33-I44 PolarHBondContact O-N 3.19Å; V35-I44 HydrophobicContact CG2-CD1 4.41Å; L42-I44 HydrophobicContact CD2-CD1 4.31Å; L42-I44 HydrophobicContact CD2-CG1 4.3Å; I44-V59 HydrophobicContact CB-CG2 4.42Å; I44-V59 HydrophobicContact CG1-CG1 4.49Å; I44-V59 HydrophobicContact CG1-CG2 4.09Å; I44-V59 HydrophobicContact CG2-CG2 4.07Å; I44-A161 HydrophobicContact CG2-CB 3.82Å; I44-I241 HydrophobicContact CD1-CG2 4.24Å; I44-I245 HydrophobicContact CD1-CD1 4.31Å; I44-I245 HydrophobicContact CD1-CG1 3.72Å; I44-L248 HydrophobicContact CB-CD1 4Å; I44-L248 HydrophobicContact CG2-CD1 3.61Å
45	S	95.6	Very high	92.5	Very high	23 Å²	23	62.3 Å²	62.3	16%	0.161	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155	-178.7	64.8	0	0	0	0	113.5	R31 A57 V58	R31-S45 WeakPolarHBondContact O-CA 3.28Å; R31-S45 WeakPolarHBondContact O-CB 3.28Å; S45-A57 CarbonylContact O-C 3.48Å; S45-A57 WeakPolarHBondContact O-CA 3.43Å; S45-V58 PolarHBondContact N-O 3.13Å; S45-V58 PolarHBondContact O-N 3.09Å; S45-V58 PolarHBondContact OG-O 3.21Å
46	S	94.4	Very high	92.7	Very high	15 Å²	15	62.5 Å²	62.5	11%	0.105	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	164.3	179.3	-177.5	0	0	0	0	111.3	R31 S56	R31-S46 PolarHBondContact N-O 3.17Å; R31-S46 PolarHBondContact O-N 2.69Å; R31-S46 VanDerWaalsContact O-N 3.1Å; S46-S56 WeakPolarHBondContact CB-O 2.96Å; S46-S56 PolarHBondContact OG-O 3.34Å
47	G	88.2	Confident	92.9	Very high	23 Å²	23	57.1 Å²	57.1	24%	0.237	31%	0.306	C	S	.	.	S	Bend	trans	99.4	-13.1	175.8	0	0	0	0	0	115.6	R51	G47-R51 VanDerWaalsContact O-CD 3.3Å; G47-R51 WeakPolarHBondContact O-CD 3.43Å
48	S	90.2	Very high	93.5	Very high	73 Å²	73	57.6 Å²	57.6	51%	0.51	31%	0.309	S	S	.	.	S	Bend	trans	-94.2	-48.9	-179.7	-58.3	0	0	0	0	114	P30	P30-S48 WeakPolarHBondContact CB-OG 3.47Å
49	L	94.8	Very high	94.3	Very high	82 Å²	82	54.8 Å²	54.8	43%	0.429	28%	0.28	S	S	.	.	S	Bend	trans	-105.5	152.6	-171.7	-59.7	-179.4	0	0	0	111.5	R51 V58 M67 L143	L49-R51 PolarHBondContact O-N 3.07Å; L49-R51 VanDerWaalsContact O-N 3.09Å; L49-V58 HydrophobicContact CD1-CG2 3.99Å; L49-M67 HydrophobicContact CB-SD 3.69Å; L49-M67 HydrophobicContact CD1-SD 4Å; L49-L143 HydrophobicContact CD1-CD1 3.87Å
50	A	95.7	Very high	95.2	Very high	43 Å²	43	47.7 Å²	47.7	36%	0.355	25%	0.247	S	C	.	.			trans	47.9	39.4	174.2	0	0	0	0	0	115.4	F52 A53 M67 T69	A50-F52 PolarHBondContact O-N 2.81Å; A50-A53 WeakPolarHBondContact O-CB 3.29Å; A50-A53 PolarHBondContact O-N 3.47Å; A50-M67 HydrophobicContact CB-CE 4.36Å; A50-M67 HydrophobicContact CB-SD 4.14Å; A50-T69 HydrophobicContact CB-CG2 3.52Å
51	R	93.5	Very high	95.6	Very high	182 Å²	182	46.1 Å²	46.1	69%	0.687	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-10.7	-173.9	-61.5	176.1	-67.5	179.4	-1.4	115.8	Y24 G47 L49	Y24-R51 PolarHBondContact OH-O 3.38Å; G47-R51 VanDerWaalsContact O-CD 3.3Å; G47-R51 WeakPolarHBondContact O-CD 3.43Å; L49-R51 PolarHBondContact O-N 3.07Å; L49-R51 VanDerWaalsContact O-N 3.09Å
52	F	94.8	Very high	95.7	Very high	183 Å²	183	42.3 Å²	42.3	80%	0.803	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-19.4	173.5	-71.1	-68.9	0	0	0	113.8	Y24 A50	Y24-F52 HydrophobicContact CE1-CD1 4.1Å; Y24-F52 AromaticContact CE1-CE1 3.7Å; Y24-F52 HydrophobicContact CE1-CE1 3.7Å; Y24-F52 HydrophobicContact CE1-CZ 4.39Å; Y24-F52 AromaticContact CZ-CD1 3.66Å; Y24-F52 AromaticContact CZ-CE1 3.68Å; Y24-F52 WeakPolarHBondContact OH-CA 3.44Å; Y24-F52 WeakPolarHBondContact OH-CD1 3.38Å; Y24-F52 VanDerWaalsContact OH-CE1 3.29Å; Y24-F52 WeakPolarHBondContact OH-CE1 3.19Å; A50-F52 PolarHBondContact O-N 2.81Å
53	A	97.4	Very high	95.6	Very high	23 Å²	23	48 Å²	48	19%	0.19	27%	0.267	C	S	.	.	S	Bend	trans	-68.2	152.8	175.2	0	0	0	0	0	110.6	A50 G55 T69 V71	A50-A53 WeakPolarHBondContact O-CB 3.29Å; A50-A53 PolarHBondContact O-N 3.47Å; A53-G55 PolarHBondContact O-N 3.35Å; A53-T69 HydrophobicContact CB-CG2 4.15Å; A53-V71 HydrophobicContact CB-CG2 3.91Å
54	D	97.3	Very high	95.6	Very high	50 Å²	50	45.6 Å²	45.6	27%	0.267	26%	0.256	S	S	.	.	S	Bend	trans	-59.3	-36.9	176	-65.7	-38.6	0	0	0	110.8	A70 V71 S72 S166 I168 R257	D54-A70 PolarHBondContact N-O 3.15Å; D54-V71 WeakPolarHBondContact OD2-CA 3.22Å; D54-S72 PolarHBondContact OD2-N 3.1Å; D54-S166 VanDerWaalsContact O-CA 3.26Å; D54-S166 WeakPolarHBondContact O-CA 3.37Å; D54-S166 WeakPolarHBondContact O-CB 3.31Å; D54-I168 HydrophobicContact CB-CD1 4.04Å; D54-I168 HydrophobicContact CB-CG1 4.17Å; D54-R257 IonicContact OD1-NH2 2.77Å; D54-R257 PolarHBondContact OD1-NH2 3.41Å; D54-R257 IonicContact OD2-CZ 2.79Å; D54-R257 IonicContact OD2-NH1 3.41Å; D54-R257 IonicContact OD2-NH2 3.71Å; D54-R257 PolarHBondContact OD2-NH2 3.27Å
55	G	96.8	Very high	95.5	Very high	4 Å²	4	46.3 Å²	46.3	4%	0.041	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	146.6	166.4	0	0	0	0	0	112.3	A53 T69 A70 A162	A53-G55 PolarHBondContact O-N 3.35Å; G55-T69 WeakPolarHBondContact O-CA 3.31Å; G55-A70 PolarHBondContact N-O 2.88Å; G55-A70 VanDerWaalsContact N-O 3.14Å; G55-A70 PolarHBondContact O-N 3.16Å; G55-A162 WeakPolarHBondContact CA-O 3.47Å
56	S	97.6	Very high	95.6	Very high	11 Å²	11	45.2 Å²	45.2	8%	0.077	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139.4	173.7	-176.1	0	0	0	0	111	S46 V68	S46-S56 WeakPolarHBondContact CB-O 2.96Å; S46-S56 PolarHBondContact OG-O 3.34Å; S56-V68 VanDerWaalsContact CA-O 3.31Å; S56-V68 WeakPolarHBondContact CA-O 3.36Å; S56-V68 PolarHBondContact OG-O 3.37Å
57	A	97.8	Very high	95.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.3	174.8	0	0	0	0	0	110.9	S45 M67 V68 A161 A162	S45-A57 CarbonylContact O-C 3.48Å; S45-A57 WeakPolarHBondContact O-CA 3.43Å; A57-M67 WeakPolarHBondContact O-CA 3.33Å; A57-V68 PolarHBondContact N-O 3.03Å; A57-V68 PolarHBondContact O-N 3.1Å; A57-A161 HydrophobicContact CB-CB 3.57Å; A57-A162 HydrophobicContact CB-CB 4.26Å
58	V	98.2	Very high	96.3	Very high	18 Å²	18	44.6 Å²	44.6	11%	0.109	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.8	170	-178.3	0	0	0	0	107.9	S45 L49 V66 M67 L143	S45-V58 PolarHBondContact N-O 3.13Å; S45-V58 PolarHBondContact O-N 3.09Å; S45-V58 PolarHBondContact OG-O 3.21Å; L49-V58 HydrophobicContact CD1-CG2 3.99Å; V58-V66 WeakPolarHBondContact CA-O 3.45Å; V58-M67 HydrophobicContact CG2-CB 4.06Å; V58-M67 HydrophobicContact CG2-CG 4Å; V58-L143 HydrophobicContact CG1-CD1 4.12Å; V58-L143 HydrophobicContact CG2-CD1 4.31Å
59	V	98.1	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.7	173.3	179.6	0	0	0	0	108.9	L42 E43 I44 S65 V66 L154 N157 A158	L42-V59 HydrophobicContact CD1-CG1 3.53Å; L42-V59 HydrophobicContact CD2-CG1 4.23Å; L42-V59 HydrophobicContact CG-CG1 3.89Å; E43-V59 CarbonylContact O-C 3.55Å; E43-V59 WeakPolarHBondContact O-CA 3.47Å; I44-V59 HydrophobicContact CB-CG2 4.42Å; I44-V59 HydrophobicContact CG1-CG1 4.49Å; I44-V59 HydrophobicContact CG1-CG2 4.09Å; I44-V59 HydrophobicContact CG2-CG2 4.07Å; V59-S65 WeakPolarHBondContact O-CA 3.48Å; V59-V66 PolarHBondContact N-O 3.24Å; V59-V66 PolarHBondContact O-N 3.01Å; V59-L154 HydrophobicContact CG1-CB 4.22Å; V59-L154 HydrophobicContact CG1-CG 4.01Å; V59-N157 HydrophobicContact CG2-CB 4.45Å; V59-A158 HydrophobicContact CB-CB 4.01Å; V59-A158 VanDerWaalsContact CG2-CA 3.48Å; V59-A158 HydrophobicContact CG2-CB 3.54Å
60	Q	97.5	Very high	96.9	Very high	55 Å²	55	38.1 Å²	38.1	26%	0.257	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.6	-177.4	179.6	174.1	-2.7	0	0	110.7	E43 G62 T64 S65	E43-Q60 HydrophobicContact CB-CB 4.48Å; E43-Q60 PolarHBondContact N-O 3.26Å; E43-Q60 PolarHBondContact O-N 2.82Å; Q60-G62 WeakPolarHBondContact CG-O 3.38Å; Q60-G62 PolarHBondContact NE2-O 2.75Å; Q60-T64 VanDerWaalsContact CA-O 3.29Å; Q60-T64 WeakPolarHBondContact CA-O 3.37Å; Q60-S65 WeakPolarHBondContact CG-OG 3.36Å
61	L	96.3	Very high	97	Very high	7 Å²	7	39 Å²	39	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	116.4	171.4	-172.5	65.1	0	0	0	107.9	K40 K41 L42 D63 T64 N149 L154 N189	K40-L61 HydrophobicContact CB-CD1 3.98Å; K41-L61 WeakPolarHBondContact O-CD1 3.36Å; L42-L61 HydrophobicContact CB-CD1 4.42Å; L42-L61 HydrophobicContact CD1-CB 4.13Å; L42-L61 HydrophobicContact CD1-CD1 4.24Å; L61-D63 PolarHBondContact O-N 2.86Å; L61-T64 PolarHBondContact N-O 2.89Å; L61-T64 PolarHBondContact O-N 2.86Å; L61-T64 VanDerWaalsContact O-N 3.15Å; L61-N149 HydrophobicContact CD2-CB 4.33Å; L61-N149 PolarHBondContact O-ND2 2.84Å; L61-L154 HydrophobicContact CB-CD1 3.94Å; L61-L154 HydrophobicContact CB-CD2 3.82Å; L61-L154 HydrophobicContact CB-CG 4.19Å; L61-L154 HydrophobicContact CD2-CD1 4.02Å; L61-N189 HydrophobicContact CD2-CB 4.39Å
62	G	94.7	Very high	97.3	Very high	44 Å²	44	30.6 Å²	30.6	45%	0.454	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	-126.6	-166.8	0	0	0	0	0	110.4	Q60	Q60-G62 WeakPolarHBondContact CG-O 3.38Å; Q60-G62 PolarHBondContact NE2-O 2.75Å
63	D	94.9	Very high	97.4	Very high	122 Å²	122	28.2 Å²	28.2	65%	0.652	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	2	177.7	-67.1	-42.8	0	0	0	112.9	L61 D146	L61-D63 PolarHBondContact O-N 2.86Å; D63-D146 HydrophobicContact CB-CB 3.79Å; D63-D146 PolarHBondContact N-OD2 3.45Å
64	T	96.1	Very high	97.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.9	171.5	-67.1	0	0	0	0	110.8	Q60 L61 A144 V145 D146 N149 P151 L154	Q60-T64 VanDerWaalsContact CA-O 3.29Å; Q60-T64 WeakPolarHBondContact CA-O 3.37Å; L61-T64 PolarHBondContact N-O 2.89Å; L61-T64 PolarHBondContact O-N 2.86Å; L61-T64 VanDerWaalsContact O-N 3.15Å; T64-A144 CarbonylContact C-O 3.57Å; T64-A144 WeakPolarHBondContact CA-O 3.14Å; T64-V145 HydrophobicContact CG2-CG2 4.32Å; T64-D146 PolarHBondContact N-OD2 2.76Å; T64-D146 PolarHBondContact OG1-N 2.99Å; T64-D146 PolarHBondContact OG1-OD1 3.27Å; T64-D146 PolarHBondContact OG1-OD2 2.89Å; T64-N149 PolarHBondContact OG1-O 2.99Å; T64-P151 HydrophobicContact CG2-CB 4.06Å; T64-L154 HydrophobicContact CG2-CD2 3.86Å; T64-L154 WeakPolarHBondContact O-CD2 3.29Å
65	S	96.7	Very high	97.1	Very high	15 Å²	15	37 Å²	37	11%	0.105	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127	-177.3	-63.4	0	0	0	0	111.8	V59 Q60 L143 A144	V59-S65 WeakPolarHBondContact O-CA 3.48Å; Q60-S65 WeakPolarHBondContact CG-OG 3.36Å; S65-L143 WeakPolarHBondContact O-CB 3.47Å; S65-L143 PolarHBondContact O-N 3.19Å; S65-A144 PolarHBondContact N-O 3.38Å; S65-A144 PolarHBondContact O-N 2.99Å
66	V	97.8	Very high	96.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	125.8	179.5	-174.8	0	0	0	0	109.9	V58 V59 V68 L142 P151 L154 A155	V58-V66 WeakPolarHBondContact CA-O 3.45Å; V59-V66 PolarHBondContact N-O 3.24Å; V59-V66 PolarHBondContact O-N 3.01Å; V66-V68 HydrophobicContact CG1-CG2 4.21Å; V66-L142 HydrophobicContact CG1-CD1 4.29Å; V66-L142 HydrophobicContact CG2-CD1 4.38Å; V66-L142 HydrophobicContact CG2-CG 4.35Å; V66-P151 HydrophobicContact CG2-CB 3.71Å; V66-L154 HydrophobicContact CB-CB 4.37Å; V66-L154 HydrophobicContact CG2-CB 3.97Å; V66-L154 HydrophobicContact CG2-CD2 4.46Å; V66-A155 HydrophobicContact CG1-CB 4.02Å
67	M	98.1	Very high	96.6	Very high	25 Å²	25	39.7 Å²	39.7	12%	0.123	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.6	171.3	-175.6	-177.2	76.1	0	0	109.8	L49 A50 A57 V58 T69 N141 L143	L49-M67 HydrophobicContact CB-SD 3.69Å; L49-M67 HydrophobicContact CD1-SD 4Å; A50-M67 HydrophobicContact CB-CE 4.36Å; A50-M67 HydrophobicContact CB-SD 4.14Å; A57-M67 WeakPolarHBondContact O-CA 3.33Å; V58-M67 HydrophobicContact CG2-CB 4.06Å; V58-M67 HydrophobicContact CG2-CG 4Å; M67-T69 HydrophobicContact CE-CG2 4.4Å; M67-N141 HydrophobicContact CE-CB 4.22Å; M67-N141 PolarHBondContact N-O 2.85Å; M67-N141 PolarHBondContact O-N 2.93Å; M67-L143 HydrophobicContact CB-CD1 3.93Å; M67-L143 HydrophobicContact CB-CD2 4.04Å; M67-L143 HydrophobicContact CB-CG 3.89Å
68	V	98.7	Very high	96.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.5	172	-179.5	0	0	0	0	110.2	S56 A57 V66 V138 L139 C140 A158 A159 A162	S56-V68 VanDerWaalsContact CA-O 3.31Å; S56-V68 WeakPolarHBondContact CA-O 3.36Å; S56-V68 PolarHBondContact OG-O 3.37Å; A57-V68 PolarHBondContact N-O 3.03Å; A57-V68 PolarHBondContact O-N 3.1Å; V66-V68 HydrophobicContact CG1-CG2 4.21Å; V68-V138 HydrophobicContact CG1-CG1 3.51Å; V68-L139 VanDerWaalsContact CA-O 3.32Å; V68-L139 WeakPolarHBondContact CA-O 3.48Å; V68-C140 HydrophobicContact CG2-CB 3.9Å; V68-A158 HydrophobicContact CB-CB 3.77Å; V68-A158 HydrophobicContact CG2-CB 3.34Å; V68-A159 HydrophobicContact CG1-CB 3.95Å; V68-A162 HydrophobicContact CG1-CB 4.3Å
69	T	98.6	Very high	95.7	Very high	19 Å²	19	49.5 Å²	49.5	12%	0.117	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.2	173.7	56.6	0	0	0	0	109.9	A50 A53 G55 M67 V138 L139	A50-T69 HydrophobicContact CB-CG2 3.52Å; A53-T69 HydrophobicContact CB-CG2 4.15Å; G55-T69 WeakPolarHBondContact O-CA 3.31Å; M67-T69 HydrophobicContact CE-CG2 4.4Å; T69-V138 WeakPolarHBondContact O-CA 3.45Å; T69-L139 PolarHBondContact N-O 3.34Å; T69-L139 PolarHBondContact O-N 2.78Å
70	A	98.6	Very high	95.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.9	170.6	0	0	0	0	0	109.4	D54 G55 Q137 V138 A162 L163 I168	D54-A70 PolarHBondContact N-O 3.15Å; G55-A70 PolarHBondContact N-O 2.88Å; G55-A70 VanDerWaalsContact N-O 3.14Å; G55-A70 PolarHBondContact O-N 3.16Å; A70-Q137 WeakPolarHBondContact CA-O 3.41Å; A70-V138 HydrophobicContact CB-CG2 4.39Å; A70-A162 HydrophobicContact CB-CB 4.4Å; A70-L163 HydrophobicContact CB-CD2 3.7Å; A70-L163 HydrophobicContact CB-CG 4.13Å; A70-I168 HydrophobicContact CB-CD1 4.07Å
71	V	98.6	Very high	94.9	Very high	62 Å²	62	57.7 Å²	57.7	38%	0.376	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	129.6	176	-179.2	0	0	0	0	108.5	A53 D54 T136 Q137	A53-V71 HydrophobicContact CB-CG2 3.91Å; D54-V71 WeakPolarHBondContact OD2-CA 3.22Å; V71-T136 WeakPolarHBondContact O-CA 3.42Å; V71-Q137 PolarHBondContact N-O 2.59Å; V71-Q137 PolarHBondContact O-N 3.28Å
72	S	98.1	Very high	94.8	Very high	4 Å²	4	58.6 Å²	58.6	3%	0.028	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.3	177.6	-167.7	0	0	0	0	110.1	D54 Y132 D135 T136 R257	D54-S72 PolarHBondContact OD2-N 3.1Å; S72-Y132 PolarHBondContact OG-OH 3.01Å; S72-D135 WeakPolarHBondContact CA-O 3.26Å; S72-T136 PolarHBondContact OG-OG1 3.38Å; S72-R257 PolarHBondContact O-NH1 3.11Å
73	K	96.8	Very high	94.9	Very high	134 Å²	134	57.6 Å²	57.6	58%	0.583	30%	0.3	S	S	*	.			trans	-63.3	151.7	175.2	-65.7	-64.4	-175.9	-179.6	0	110.4	Y134 D135	K73-Y134 VanDerWaalsContact O-CD1 3.27Å; K73-Y134 WeakPolarHBondContact O-CD1 3.37Å; K73-D135 HydrophobicContact CB-CB 4.35Å; K73-D135 HydrophobicContact CG-CB 3.88Å; K73-D135 PolarHBondContact N-O 3.3Å
74	T	94.3	Very high	95	Very high	89 Å²	89	52.2 Å²	52.2	55%	0.546	27%	0.271	S	S	.	.	S	Bend	trans	-92.7	-12.6	176.1	52.1	0	0	0	0	113.1	Y134	T74-Y134 WeakPolarHBondContact O-CE1 3.4Å
75	K	94.6	Very high	95.1	Very high	167 Å²	167	55.3 Å²	55.3	73%	0.726	29%	0.289	S	S	*	.	S	Bend	trans	-94.9	138.8	173.8	-67	-174.2	179.4	-177.5	0	109.5	Y134	K75-Y134 VanDerWaalsContact O-CD1 3.31Å; K75-Y134 WeakPolarHBondContact O-CD1 3.25Å
76	P	92.7	Very high	95.2	Very high	51 Å²	51	54.7 Å²	54.7	33%	0.331	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-54.4	145.3	172	-27.7	36.4	0	0	0	112.4	Y134 F263	P76-Y134 HydrophobicContact CG-CE1 4.04Å; P76-F263 HydrophobicContact CB-CE2 3.82Å; P76-F263 HydrophobicContact CB-CZ 3.78Å; P76-F263 HydrophobicContact CG-CE2 4.37Å; P76-F263 HydrophobicContact CG-CZ 4.45Å
77	S	91.9	Very high	95.1	Very high	21 Å²	21	55.8 Å²	55.8	15%	0.147	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-71	154.9	169.4	-159.7	0	0	0	0	110.4	S79 F133 D135	S77-S79 PolarHBondContact OG-N 3.31Å; S77-F133 PolarHBondContact N-O 3.07Å; S77-D135 VanDerWaalsContact CB-OD1 3.27Å; S77-D135 WeakPolarHBondContact CB-OD1 3.18Å; S77-D135 PolarHBondContact OG-OD1 3Å
78	L	88.4	Confident	95	Very high	180 Å²	180	54.6 Å²	54.6	94%	0.942	29%	0.285	S	S	*	.	S	Bend	trans	-75.7	-21.2	169	-64.6	174.9	0	0	0	111.3
79	S	88.7	Confident	94.7	Very high	45 Å²	45	58 Å²	58	32%	0.315	30%	0.298	S	S	.	.	S	Bend	trans	-70.8	136.3	175.8	-63.3	0	0	0	0	111	S77 F81	S77-S79 PolarHBondContact OG-N 3.31Å; S79-F81 PolarHBondContact O-N 3.28Å
80	Q	87.2	Confident	94.1	Very high	102 Å²	102	57.6 Å²	57.6	48%	0.477	29%	0.294	S	S	.	.	S	Bend	trans	-80.4	29.1	176	-63.4	-179.1	-1.2	0	0	112.9	F320	Q80-F320 HydrophobicContact CB-CD2 4.02Å; Q80-F320 HydrophobicContact CB-CE2 4.48Å; Q80-F320 HydrophobicContact CG-CD2 4.1Å
81	F	90.6	Very high	93.6	Very high	125 Å²	125	61.5 Å²	61.5	55%	0.548	31%	0.312	S	S	.	.	S	Bend	trans	-147.1	163.7	177.7	66.3	-94.6	0	0	0	109.5	S79 P83 F133	S79-F81 PolarHBondContact O-N 3.28Å; F81-P83 HydrophobicContact CE2-CB 4.06Å; F81-P83 WeakPolarHBondContact O-CD 3.38Å; F81-F133 VanDerWaalsContact C-CD1 3.4Å
82	M	94.6	Very high	93	Very high	26 Å²	26	58.6 Å²	58.6	13%	0.128	29%	0.294	C	S	.	.			trans	-76.3	109.1	175.2	-178.6	180	69.4	0	0	111.1	L84 R125 F128 Y132 F133	M82-L84 VanDerWaalsContact C-N 3.32Å; M82-L84 HydrophobicContact CE-CB 4.01Å; M82-L84 HydrophobicContact CE-CD2 4.15Å; M82-L84 HydrophobicContact CG-CB 4.42Å; M82-L84 PolarHBondContact O-N 3.02Å; M82-R125 HydrophobicContact CE-CG 3.91Å; M82-F128 HydrophobicContact CE-CB 3.82Å; M82-F128 HydrophobicContact CE-CD2 3.8Å; M82-F128 HydrophobicContact CE-CG 3.9Å; M82-F128 HydrophobicContact SD-CB 3.37Å; M82-F128 WeakPolarHBondContact SD-CB 3.24Å; M82-F128 HydrophobicContact SD-CD1 3.86Å; M82-F128 HydrophobicContact SD-CD2 3.91Å; M82-F128 HydrophobicContact SD-CG 3.43Å; M82-F128 WeakPolarHBondContact SD-CG 3.47Å; M82-Y132 VanDerWaalsContact CG-O 3.29Å; M82-Y132 WeakPolarHBondContact CG-O 3.32Å; M82-Y132 HydrophobicContact SD-CD1 4.36Å; M82-F133 HydrophobicContact CB-CD1 4.25Å
83	P	96.1	Very high	92.4	Very high	23 Å²	23	62.1 Å²	62.1	15%	0.149	32%	0.324	C	S	.	.			trans	-83.5	81.5	177.8	20.3	-4	0	0	0	109.1	F81 D135 T136	F81-P83 HydrophobicContact CE2-CB 4.06Å; F81-P83 WeakPolarHBondContact O-CD 3.38Å; P83-D135 HydrophobicContact CG-CB 4.47Å; P83-D135 WeakPolarHBondContact CG-OD1 3.39Å; P83-T136 PolarHBondContact O-N 2.88Å
84	L	97.7	Very high	92	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.4	170.3	170.9	67.7	0	0	0	109.3	M82 I124 R125 F128 T136 V138	M82-L84 VanDerWaalsContact C-N 3.32Å; M82-L84 HydrophobicContact CE-CB 4.01Å; M82-L84 HydrophobicContact CE-CD2 4.15Å; M82-L84 HydrophobicContact CG-CB 4.42Å; M82-L84 PolarHBondContact O-N 3.02Å; L84-I124 HydrophobicContact CD1-CD1 4.27Å; L84-I124 HydrophobicContact CD2-CD1 4.15Å; L84-I124 HydrophobicContact CD2-CG1 4.04Å; L84-R125 HydrophobicContact CD2-CB 3.94Å; L84-R125 HydrophobicContact CD2-CG 4.39Å; L84-R125 PolarHBondContact O-NH2 3.27Å; L84-F128 HydrophobicContact CD1-CE2 4.26Å; L84-F128 HydrophobicContact CD1-CZ 4.33Å; L84-F128 HydrophobicContact CD2-CD2 4.27Å; L84-F128 HydrophobicContact CD2-CE2 3.83Å; L84-T136 WeakPolarHBondContact CA-O 3.45Å; L84-T136 HydrophobicContact CD1-CG2 3.95Å; L84-V138 HydrophobicContact CD1-CG2 4.3Å
85	V	97.8	Very high	91.7	Very high	64 Å²	64	53.5 Å²	53.5	39%	0.388	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.7	173.5	-178.8	0	0	0	0	109.4	T136 Q137 V138	V85-T136 PolarHBondContact N-O 2.88Å; V85-Q137 WeakPolarHBondContact O-CA 3.35Å; V85-V138 PolarHBondContact O-N 3.16Å
86	V	98.4	Very high	91.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.6	168.9	-172.2	0	0	0	0	109.1	S117 I120 D121 I124 V138 R431	V86-S117 WeakPolarHBondContact O-CB 3.48Å; V86-I120 HydrophobicContact CG1-CB 3.93Å; V86-I120 HydrophobicContact CG1-CD1 4.38Å; V86-I120 HydrophobicContact CG1-CG2 3.77Å; V86-I120 HydrophobicContact CG2-CG2 4.41Å; V86-D121 HydrophobicContact CB-CB 4.34Å; V86-D121 HydrophobicContact CG2-CB 3.82Å; V86-I124 HydrophobicContact CG2-CD1 3.9Å; V86-V138 WeakPolarHBondContact CA-O 3.43Å; V86-V138 HydrophobicContact CG1-CB 4.34Å; V86-V138 HydrophobicContact CG1-CG1 4.44Å; V86-V138 HydrophobicContact CG2-CB 4.22Å; V86-R431 PolarHBondContact O-NH1 2.91Å
87	D	97.1	Very high	91.1	Very high	23 Å²	23	52.8 Å²	52.8	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	112.3	170.4	-64.9	-67.7	0	0	0	109.7	R89 V138 L139 C140 R431	D87-R89 IonicContact OD1-NH2 3.41Å; D87-V138 PolarHBondContact N-O 3.5Å; D87-L139 HydrophobicContact CB-CD2 3.73Å; D87-L139 WeakPolarHBondContact O-CA 3.43Å; D87-C140 PolarHBondContact O-N 3.01Å; D87-R431 IonicContact OD1-CZ 3.32Å; D87-R431 IonicContact OD1-NH1 2.98Å; D87-R431 IonicContact OD1-NH2 3.53Å; D87-R431 PolarHBondContact OD1-NH2 2.84Å
88	Y	96.2	Very high	90.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.3	167.9	174.8	-84.3	0	0	0	109.1	Q90 E113 T116 S117 I120 C140 L142 P151 A155	Y88-Q90 HydrophobicContact CD1-CG 4.42Å; Y88-Q90 HydrophobicContact CE1-CG 3.62Å; Y88-E113 HydrophobicContact CD1-CB 4.4Å; Y88-E113 HydrophobicContact CD1-CG 4.2Å; Y88-E113 WeakPolarHBondContact O-CB 3.38Å; Y88-E113 WeakPolarHBondContact O-CG 3.21Å; Y88-T116 HydrophobicContact CD1-CG2 3.91Å; Y88-T116 HydrophobicContact CD2-CG2 3.56Å; Y88-T116 HydrophobicContact CE1-CG2 4.04Å; Y88-T116 HydrophobicContact CE2-CG2 3.75Å; Y88-T116 HydrophobicContact CG-CG2 3.64Å; Y88-S117 WeakPolarHBondContact CB-OG 3.46Å; Y88-S117 PolarHBondContact N-OG 3.19Å; Y88-I120 HydrophobicContact CD2-CD1 4.16Å; Y88-C140 HydrophobicContact CD2-CB 3.71Å; Y88-C140 HydrophobicContact CG-CB 4.32Å; Y88-L142 HydrophobicContact CD2-CD1 4.29Å; Y88-L142 HydrophobicContact CE1-CD1 4.36Å; Y88-L142 HydrophobicContact CE2-CD1 3.51Å; Y88-P151 VanDerWaalsContact OH-CG 3.24Å; Y88-P151 WeakPolarHBondContact OH-CG 3.39Å; Y88-A155 HydrophobicContact CD2-CB 3.8Å; Y88-A155 HydrophobicContact CE2-CB 3.78Å
89	R	91.1	Very high	90.7	Very high	73 Å²	73	49.4 Å²	49.4	28%	0.275	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.4	-177.4	-70.2	-71.2	174	-123.1	-13.4	111.8	D87 E113 C140	D87-R89 IonicContact OD1-NH2 3.41Å; R89-E113 WeakPolarHBondContact CA-OE1 3.32Å; R89-E113 IonicContact CZ-OE2 2.83Å; R89-E113 IonicContact NH1-OE2 3.71Å; R89-E113 PolarHBondContact NH1-OE2 3.22Å; R89-C140 PolarHBondContact N-O 2.99Å; R89-C140 VanDerWaalsContact N-O 3.08Å
90	Q	87.4	Confident	90.3	Very high	9 Å²	9	50.6 Å²	50.6	4%	0.042	28%	0.282	C	S	.	.			trans	-82.6	139.2	170.6	-65.1	-168.2	-53	0	0	109.4	Y88 N112 E113 L142 L401 S402	Y88-Q90 HydrophobicContact CD1-CG 4.42Å; Y88-Q90 HydrophobicContact CE1-CG 3.62Å; Q90-N112 PolarHBondContact NE2-ND2 3.32Å; Q90-E113 HydrophobicContact CB-CG 4.34Å; Q90-E113 HydrophobicContact CG-CG 3.99Å; Q90-E113 PolarHBondContact N-OE1 3.29Å; Q90-L142 HydrophobicContact CG-CD2 4.11Å; Q90-L401 HydrophobicContact CB-CD1 3.71Å; Q90-L401 HydrophobicContact CG-CD1 4.18Å; Q90-S402 PolarHBondContact NE2-OG 3.47Å
91	K	86.6	Confident	90.1	Very high	83 Å²	83	47.4 Å²	47.4	36%	0.361	27%	0.268	S	S	.	.			trans	-120.8	131	175.7	-71.5	-178.1	177.8	170.7	0	109	A93 A94 N141	K91-A93 PolarHBondContact O-N 2.87Å; K91-A94 HydrophobicContact CB-CB 4.31Å; K91-A94 VanDerWaalsContact O-CB 3.29Å; K91-A94 WeakPolarHBondContact O-CB 3.4Å; K91-A94 PolarHBondContact O-N 3.35Å; K91-N141 WeakPolarHBondContact CD-OD1 3.42Å; K91-N141 WeakPolarHBondContact CE-OD1 3.23Å; K91-N141 VanDerWaalsContact NZ-CG 3.3Å; K91-N141 PolarHBondContact NZ-ND2 2.92Å; K91-N141 VanDerWaalsContact NZ-ND2 3.2Å; K91-N141 PolarHBondContact NZ-OD1 3.33Å
92	A	85.9	Confident	89.8	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-62.4	-35.9	177.7	0	0	0	0	0	111.2	A94 A95 G96 R97 P99 E106 I397	A92-A94 PolarHBondContact O-N 2.78Å; A92-A95 PolarHBondContact O-N 2.83Å; A92-G96 PolarHBondContact O-N 3.46Å; A92-R97 CarbonylContact C-O 3.6Å; A92-R97 VanDerWaalsContact CB-O 3.25Å; A92-R97 WeakPolarHBondContact CB-O 3.3Å; A92-R97 PolarHBondContact O-N 2.9Å; A92-P99 HydrophobicContact CB-CG 3.72Å; A92-E106 PolarHBondContact N-OE1 3.05Å; A92-I397 HydrophobicContact CB-CD1 3.51Å; A92-I397 HydrophobicContact CB-CG1 3.91Å; A92-I397 HydrophobicContact CB-CG2 4.09Å
93	A	87.4	Confident	89.4	Confident	78 Å²	78	53.2 Å²	53.2	65%	0.645	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-58.9	-29.5	175.3	0	0	0	0	0	113.1	K91 A95 G96 R97	K91-A93 PolarHBondContact O-N 2.87Å; A93-A95 PolarHBondContact O-N 2.89Å; A93-G96 PolarHBondContact O-N 2.86Å; A93-R97 PolarHBondContact N-O 2.91Å
94	A	88.3	Confident	89	Confident	10 Å²	10	59.2 Å²	59.2	8%	0.083	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-65.6	-22.7	177.5	0	0	0	0	0	112.7	K91 A92 L142 A144 V145	K91-A94 HydrophobicContact CB-CB 4.31Å; K91-A94 VanDerWaalsContact O-CB 3.29Å; K91-A94 WeakPolarHBondContact O-CB 3.4Å; K91-A94 PolarHBondContact O-N 3.35Å; A92-A94 PolarHBondContact O-N 2.78Å; A94-L142 HydrophobicContact CB-CB 3.95Å; A94-L142 WeakPolarHBondContact CB-O 3.32Å; A94-A144 CarbonylContact O-C 3.54Å; A94-A144 WeakPolarHBondContact O-CA 3.48Å; A94-V145 HydrophobicContact CB-CG2 4.34Å; A94-V145 PolarHBondContact O-N 3.03Å
95	A	87.6	Confident	88.4	Confident	32 Å²	32	67.6 Å²	67.6	26%	0.264	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-104.1	12.9	171.3	0	0	0	0	0	113.1	A92 A93 R97 L401	A92-A95 PolarHBondContact O-N 2.83Å; A93-A95 PolarHBondContact O-N 2.89Å; A95-R97 VanDerWaalsContact C-N 3.26Å; A95-R97 PolarHBondContact O-N 3.17Å; A95-L401 HydrophobicContact CB-CD2 3.56Å; A95-L401 HydrophobicContact CB-CG 4.26Å
96	G	86.4	Confident	87.7	Confident	75 Å²	75	69.3 Å²	69.3	77%	0.773	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	27.1	-177.6	0	0	0	0	0	114.1	A92 A93	A92-G96 PolarHBondContact O-N 3.46Å; A93-G96 PolarHBondContact O-N 2.86Å
97	R	86.9	Confident	86.8	Confident	128 Å²	128	73.4 Å²	73.4	48%	0.483	37%	0.367	S	S	.	.			trans	-115.9	154.9	-178.2	-64.5	-169.4	179.1	-156.4	-2.6	112.2	A92 A93 A95 I396	A92-R97 CarbonylContact C-O 3.6Å; A92-R97 VanDerWaalsContact CB-O 3.25Å; A92-R97 WeakPolarHBondContact CB-O 3.3Å; A92-R97 PolarHBondContact O-N 2.9Å; A93-R97 PolarHBondContact N-O 2.91Å; A95-R97 VanDerWaalsContact C-N 3.26Å; A95-R97 PolarHBondContact O-N 3.17Å; R97-I396 VanDerWaalsContact NH1-CG2 3.34Å
98	I	87	Confident	85.9	Confident	123 Å²	123	75.5 Å²	75.5	63%	0.631	39%	0.394	S	S	*	.			trans	-99.9	135.3	170.8	-58	177.6	0	0	0	108.3	T100 R104	I98-T100 PolarHBondContact O-N 2.92Å; I98-R104 HydrophobicContact CG2-CB 4.1Å; I98-R104 HydrophobicContact CG2-CG 4.49Å
99	P	85.6	Confident	85.4	Confident	7 Å²	7	77.4 Å²	77.4	5%	0.045	41%	0.406	C	S	.	.			trans	-53.5	138.4	172.8	-23.8	33.2	0	0	0	113.4	A92 R104 I397	A92-P99 HydrophobicContact CB-CG 3.72Å; P99-R104 WeakPolarHBondContact O-CD 3.32Å; P99-R104 PolarHBondContact O-NH1 2.8Å; P99-I397 VanDerWaalsContact CA-CD1 3.5Å; P99-I397 HydrophobicContact CB-CD1 3.73Å; P99-I397 HydrophobicContact CG-CD1 3.87Å
100	T	80.7	Confident	85.4	Confident	70 Å²	70	75.9 Å²	75.9	43%	0.429	41%	0.405	S	S	.	.			trans	-84.6	-14	-174.1	52.3	0	0	0	0	113.2	I98 D395 I396	I98-T100 PolarHBondContact O-N 2.92Å; T100-D395 PolarHBondContact OG1-OD1 3.19Å; T100-I396 HydrophobicContact CG2-CD1 3.88Å
101	N	82.1	Confident	85.5	Confident	35 Å²	35	79.9 Å²	79.9	19%	0.187	43%	0.426	C	S	.	.	S	Bend	trans	-65.6	164.5	175.6	65.1	43.9	0	0	0	112.8	L103 R104 R105 L107	N101-L103 PolarHBondContact O-N 3.39Å; N101-L103 VanDerWaalsContact O-N 3.16Å; N101-L103 PolarHBondContact OD1-N 3.34Å; N101-R104 WeakPolarHBondContact O-CD 3.38Å; N101-R104 PolarHBondContact O-N 3.21Å; N101-R104 VanDerWaalsContact O-N 3.1Å; N101-R104 PolarHBondContact OD1-N 2.84Å; N101-R105 PolarHBondContact ND2-O 2.8Å; N101-R105 PolarHBondContact OD1-N 2.83Å; N101-R105 PolarHBondContact OD1-O 3.08Å; N101-L107 HydrophobicContact CB-CD1 3.69Å; N101-L107 VanDerWaalsContact CG-CD1 3.48Å; N101-L107 VanDerWaalsContact ND2-CD1 3.29Å; N101-L107 WeakPolarHBondContact ND2-CD1 3.32Å; N101-L107 VanDerWaalsContact ND2-CG 3.34Å; N101-L107 WeakPolarHBondContact ND2-CG 3.45Å
102	Y	84.6	Confident	85.7	Confident	194 Å²	194	77.2 Å²	77.2	76%	0.761	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26	-176.5	72	-80.5	0	0	0	114.1	L107	Y102-L107 HydrophobicContact CE1-CD1 4.31Å
103	L	87	Confident	86.1	Confident	78 Å²	78	77.6 Å²	77.6	41%	0.408	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-12.2	-179.8	-68.6	173.4	0	0	0	113.7	N101 R105 L107	N101-L103 PolarHBondContact O-N 3.39Å; N101-L103 VanDerWaalsContact O-N 3.16Å; N101-L103 PolarHBondContact OD1-N 3.34Å; L103-R105 HydrophobicContact CB-CB 4.42Å; L103-R105 WeakPolarHBondContact O-CG 3.45Å; L103-R105 PolarHBondContact O-N 3.47Å; L103-R105 VanDerWaalsContact O-N 3.16Å; L103-L107 HydrophobicContact CD1-CD2 3.51Å; L103-L107 HydrophobicContact CD1-CG 4.44Å
104	R	86.9	Confident	86.5	Confident	150 Å²	150	74 Å²	74	57%	0.566	39%	0.387	S	S	*	.	S	Bend	trans	51.5	33.9	-174	-54.4	-59.9	-175.1	-180	-2.1	112.7	I98 P99 N101	I98-R104 HydrophobicContact CG2-CB 4.1Å; I98-R104 HydrophobicContact CG2-CG 4.49Å; P99-R104 WeakPolarHBondContact O-CD 3.32Å; P99-R104 PolarHBondContact O-NH1 2.8Å; N101-R104 WeakPolarHBondContact O-CD 3.38Å; N101-R104 PolarHBondContact O-N 3.21Å; N101-R104 VanDerWaalsContact O-N 3.1Å; N101-R104 PolarHBondContact OD1-N 2.84Å
105	R	84.9	Confident	86.8	Confident	185 Å²	185	75.8 Å²	75.8	70%	0.698	40%	0.395	S	S	*	.	S	Bend	trans	-137.6	155.6	-179.2	-70.7	178.6	-176.2	-172.8	1	109.8	N101 L103 L107	N101-R105 PolarHBondContact ND2-O 2.8Å; N101-R105 PolarHBondContact OD1-N 2.83Å; N101-R105 PolarHBondContact OD1-O 3.08Å; L103-R105 HydrophobicContact CB-CB 4.42Å; L103-R105 WeakPolarHBondContact O-CG 3.45Å; L103-R105 PolarHBondContact O-N 3.47Å; L103-R105 VanDerWaalsContact O-N 3.16Å; R105-L107 PolarHBondContact O-N 2.68Å
106	E	83.3	Confident	87.3	Confident	100 Å²	100	74.4 Å²	74.4	47%	0.467	38%	0.384	S	S	.	.			trans	-58.1	123.7	172	-68.2	76.2	-171.4	0	0	109.9	A92	A92-E106 PolarHBondContact N-OE1 3.05Å
107	L	79.6	Confident	87.8	Confident	87 Å²	87	71 Å²	71	46%	0.455	35%	0.348	S	S	.	.			trans	-107.7	127.8	-179.2	-78.9	176.8	0	0	0	111	N101 Y102 L103 R105	N101-L107 HydrophobicContact CB-CD1 3.69Å; N101-L107 VanDerWaalsContact CG-CD1 3.48Å; N101-L107 VanDerWaalsContact ND2-CD1 3.29Å; N101-L107 WeakPolarHBondContact ND2-CD1 3.32Å; N101-L107 VanDerWaalsContact ND2-CG 3.34Å; N101-L107 WeakPolarHBondContact ND2-CG 3.45Å; Y102-L107 HydrophobicContact CE1-CD1 4.31Å; L103-L107 HydrophobicContact CD1-CD2 3.51Å; L103-L107 HydrophobicContact CD1-CG 4.44Å; R105-L107 PolarHBondContact O-N 2.68Å
108	G	78.6	Confident	88.3	Confident	67 Å²	67	67.3 Å²	67.3	69%	0.691	33%	0.334	S	S	*	.	S	Bend	trans	58.4	-155.2	172.9	0	0	0	0	0	113
109	T	86.4	Confident	88.8	Confident	41 Å²	41	61.8 Å²	61.8	25%	0.252	31%	0.306	S	S	.	.			trans	-124.7	126.1	179	66.2	0	0	0	0	108.8	E113 L429	T109-E113 VanDerWaalsContact CA-OE2 3.26Å; T109-E113 WeakPolarHBondContact CA-OE2 3.26Å; T109-L429 WeakPolarHBondContact OG1-CD2 3.37Å
110	T	89.2	Confident	89.4	Confident	41 Å²	41	61.5 Å²	61.5	25%	0.252	30%	0.304	S	S	.	.			trans	-80.5	160	-178.4	72.4	0	0	0	0	111.7	N112 E113 I114	T110-N112 PolarHBondContact O-N 2.83Å; T110-E113 PolarHBondContact N-OE2 3.29Å; T110-E113 WeakPolarHBondContact O-CB 3.36Å; T110-E113 PolarHBondContact O-N 3.12Å; T110-E113 VanDerWaalsContact O-N 3.12Å; T110-E113 WeakPolarHBondContact OG1-CG 3.17Å; T110-E113 PolarHBondContact OG1-N 2.83Å; T110-I114 WeakPolarHBondContact O-CD1 3.46Å; T110-I114 WeakPolarHBondContact O-CG1 3.42Å; T110-I114 PolarHBondContact O-N 3.29Å
111	D	90.1	Very high	90.2	Very high	92 Å²	92	59.5 Å²	59.5	49%	0.492	29%	0.291	S	S	.	.	H	α-helix	trans	-52.9	-44.3	173.6	-69.7	15.4	0	0	0	111.5	E113 I114 L115 L434	D111-E113 VanDerWaalsContact C-N 3.34Å; D111-E113 PolarHBondContact O-N 3.05Å; D111-I114 PolarHBondContact O-N 2.63Å; D111-L115 WeakPolarHBondContact O-CB 3.48Å; D111-L115 WeakPolarHBondContact O-CG 3.36Å; D111-L115 PolarHBondContact O-N 3.42Å; D111-L434 HydrophobicContact CB-CD1 4.27Å; D111-L434 HydrophobicContact CB-CD2 4.24Å; D111-L434 WeakPolarHBondContact OD1-CD1 3.15Å
112	N	90.9	Very high	90.9	Very high	27 Å²	27	58.7 Å²	58.7	14%	0.144	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-40.3	179.9	-169.3	50.7	0	0	0	112.1	Q90 T110 T116 T398 S402 I404	Q90-N112 PolarHBondContact NE2-ND2 3.32Å; T110-N112 PolarHBondContact O-N 2.83Å; N112-T116 VanDerWaalsContact O-CB 3.29Å; N112-T116 WeakPolarHBondContact O-CB 3.44Å; N112-T116 PolarHBondContact O-N 3.43Å; N112-T116 PolarHBondContact O-OG1 2.91Å; N112-T398 HydrophobicContact CB-CG2 4.37Å; N112-S402 PolarHBondContact ND2-OG 2.89Å; N112-S402 VanDerWaalsContact ND2-OG 3.09Å; N112-I404 HydrophobicContact CB-CD1 3.91Å
113	E	93.7	Very high	91.5	Very high	9 Å²	9	49.5 Å²	49.5	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-42.5	175.8	-74.3	179.5	149.5	0	0	112.4	Y88 R89 Q90 T109 T110 D111 S117	Y88-E113 HydrophobicContact CD1-CB 4.4Å; Y88-E113 HydrophobicContact CD1-CG 4.2Å; Y88-E113 WeakPolarHBondContact O-CB 3.38Å; Y88-E113 WeakPolarHBondContact O-CG 3.21Å; R89-E113 WeakPolarHBondContact CA-OE1 3.32Å; R89-E113 IonicContact CZ-OE2 2.83Å; R89-E113 IonicContact NH1-OE2 3.71Å; R89-E113 PolarHBondContact NH1-OE2 3.22Å; Q90-E113 HydrophobicContact CB-CG 4.34Å; Q90-E113 HydrophobicContact CG-CG 3.99Å; Q90-E113 PolarHBondContact N-OE1 3.29Å; T109-E113 VanDerWaalsContact CA-OE2 3.26Å; T109-E113 WeakPolarHBondContact CA-OE2 3.26Å; T110-E113 PolarHBondContact N-OE2 3.29Å; T110-E113 WeakPolarHBondContact O-CB 3.36Å; T110-E113 PolarHBondContact O-N 3.12Å; T110-E113 VanDerWaalsContact O-N 3.12Å; T110-E113 WeakPolarHBondContact OG1-CG 3.17Å; T110-E113 PolarHBondContact OG1-N 2.83Å; D111-E113 VanDerWaalsContact C-N 3.34Å; D111-E113 PolarHBondContact O-N 3.05Å; E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.26Å; E113-S117 PolarHBondContact O-N 3.33Å; E113-S117 PolarHBondContact O-OG 2.99Å
114	I	95.6	Very high	92	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.1	-46.3	179.2	-65.1	158	0	0	0	110.6	T110 D111 S117 R118 L429 R431 L434	T110-I114 WeakPolarHBondContact O-CD1 3.46Å; T110-I114 WeakPolarHBondContact O-CG1 3.42Å; T110-I114 PolarHBondContact O-N 3.29Å; D111-I114 PolarHBondContact O-N 2.63Å; I114-S117 PolarHBondContact O-N 2.84Å; I114-R118 WeakPolarHBondContact O-CG 3.49Å; I114-R118 PolarHBondContact O-N 2.88Å; I114-L429 HydrophobicContact CD1-CD1 3.62Å; I114-L429 HydrophobicContact CD1-CD2 3.56Å; I114-L429 HydrophobicContact CD1-CG 3.84Å; I114-L429 HydrophobicContact CG1-CD2 4.29Å; I114-R431 HydrophobicContact CG2-CB 3.78Å; I114-R431 HydrophobicContact CG2-CG 3.73Å; I114-L434 HydrophobicContact CB-CD2 4.47Å; I114-L434 HydrophobicContact CD1-CD1 3.71Å; I114-L434 HydrophobicContact CG2-CD1 4.48Å; I114-L434 HydrophobicContact CG2-CD2 4.25Å
115	L	95.8	Very high	92.6	Very high	48 Å²	48	42.8 Å²	42.8	25%	0.251	22%	0.218	S	C	.	.	H	α-helix	trans	-62.3	-44.2	178.8	-70.5	173.6	0	0	0	111.3	D111 R118 L119 L434 A438	D111-L115 WeakPolarHBondContact O-CB 3.48Å; D111-L115 WeakPolarHBondContact O-CG 3.36Å; D111-L115 PolarHBondContact O-N 3.42Å; L115-R118 PolarHBondContact O-N 2.87Å; L115-L119 WeakPolarHBondContact O-CB 3.24Å; L115-L119 PolarHBondContact O-N 2.75Å; L115-L434 HydrophobicContact CD1-CD2 4.1Å; L115-L434 HydrophobicContact CD2-CD2 3.59Å; L115-L434 HydrophobicContact CG-CD2 3.56Å; L115-A438 HydrophobicContact CD1-CB 3.92Å; L115-A438 HydrophobicContact CD2-CB 3.68Å; L115-A438 HydrophobicContact CG-CB 4.45Å
116	T	96.9	Very high	93.1	Very high	4 Å²	4	35 Å²	35	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-66.5	-40.6	177.1	-53.3	0	0	0	0	111.4	Y88 N112 R118 L119 I120 D152	Y88-T116 HydrophobicContact CD1-CG2 3.91Å; Y88-T116 HydrophobicContact CD2-CG2 3.56Å; Y88-T116 HydrophobicContact CE1-CG2 4.04Å; Y88-T116 HydrophobicContact CE2-CG2 3.75Å; Y88-T116 HydrophobicContact CG-CG2 3.64Å; N112-T116 VanDerWaalsContact O-CB 3.29Å; N112-T116 WeakPolarHBondContact O-CB 3.44Å; N112-T116 PolarHBondContact O-N 3.43Å; N112-T116 PolarHBondContact O-OG1 2.91Å; T116-R118 VanDerWaalsContact C-N 3.32Å; T116-R118 PolarHBondContact O-N 2.83Å; T116-L119 WeakPolarHBondContact O-CB 3.34Å; T116-L119 PolarHBondContact O-N 2.77Å; T116-I120 HydrophobicContact CG2-CD1 4.08Å; T116-I120 WeakPolarHBondContact O-CG1 3.49Å; T116-I120 PolarHBondContact O-N 3.49Å; T116-D152 HydrophobicContact CG2-CB 3.84Å
117	S	97.8	Very high	93.7	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-43.8	174.6	-59.4	0	0	0	0	111.7	V86 Y88 E113 I114 I120 D121	V86-S117 WeakPolarHBondContact O-CB 3.48Å; Y88-S117 WeakPolarHBondContact CB-OG 3.46Å; Y88-S117 PolarHBondContact N-OG 3.19Å; E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.26Å; E113-S117 PolarHBondContact O-N 3.33Å; E113-S117 PolarHBondContact O-OG 2.99Å; I114-S117 PolarHBondContact O-N 2.84Å; S117-I120 PolarHBondContact O-N 2.89Å; S117-D121 WeakPolarHBondContact O-CB 3.15Å; S117-D121 PolarHBondContact O-N 3.22Å
118	R	97.4	Very high	94.5	Very high	50 Å²	50	26.8 Å²	26.8	19%	0.189	15%	0.151	C	C	.	.	H	α-helix	trans	-66.3	-37.9	176.5	-72.5	172.7	59.1	72.6	1.8	112.6	I114 L115 T116 D121 R122 R431	I114-R118 WeakPolarHBondContact O-CG 3.49Å; I114-R118 PolarHBondContact O-N 2.88Å; L115-R118 PolarHBondContact O-N 2.87Å; T116-R118 VanDerWaalsContact C-N 3.32Å; T116-R118 PolarHBondContact O-N 2.83Å; R118-D121 PolarHBondContact O-N 3.25Å; R118-R122 WeakPolarHBondContact O-CG 3.45Å; R118-R122 PolarHBondContact O-N 3.24Å; R118-R122 VanDerWaalsContact O-N 3.09Å; R118-R122 PolarHBondContact O-NE 3.26Å; R118-R431 WeakPolarHBondContact CD-O 3.17Å; R118-R431 PolarHBondContact NE-O 3.01Å
119	L	97	Very high	95.2	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-47.7	176.3	-172.7	72.6	0	0	0	110.8	L115 T116 S123 I156 I203 M214 E216	L115-L119 WeakPolarHBondContact O-CB 3.24Å; L115-L119 PolarHBondContact O-N 2.75Å; T116-L119 WeakPolarHBondContact O-CB 3.34Å; T116-L119 PolarHBondContact O-N 2.77Å; L119-S123 PolarHBondContact O-N 2.93Å; L119-S123 PolarHBondContact O-OG 2.76Å; L119-I156 HydrophobicContact CD2-CD1 3.82Å; L119-I156 HydrophobicContact CG-CD1 4.03Å; L119-I203 HydrophobicContact CD2-CD1 3.54Å; L119-I203 HydrophobicContact CD2-CG2 4.44Å; L119-M214 HydrophobicContact CD1-CE 3.22Å; L119-M214 HydrophobicContact CD1-SD 3.61Å; L119-M214 HydrophobicContact CG-CE 3.69Å; L119-E216 HydrophobicContact CD1-CB 3.61Å; L119-E216 HydrophobicContact CD1-CG 4.07Å
120	I	98.4	Very high	95.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-45.3	177	-61.8	162.5	0	0	0	110.7	V86 Y88 T116 S117 R122 S123 I124 A155 I156 A159	V86-I120 HydrophobicContact CG1-CB 3.93Å; V86-I120 HydrophobicContact CG1-CD1 4.38Å; V86-I120 HydrophobicContact CG1-CG2 3.77Å; V86-I120 HydrophobicContact CG2-CG2 4.41Å; Y88-I120 HydrophobicContact CD2-CD1 4.16Å; T116-I120 HydrophobicContact CG2-CD1 4.08Å; T116-I120 WeakPolarHBondContact O-CG1 3.49Å; T116-I120 PolarHBondContact O-N 3.49Å; S117-I120 PolarHBondContact O-N 2.89Å; I120-R122 PolarHBondContact O-N 2.76Å; I120-S123 WeakPolarHBondContact O-CA 3.35Å; I120-S123 VanDerWaalsContact O-CB 3.26Å; I120-S123 WeakPolarHBondContact O-CB 3.14Å; I120-S123 PolarHBondContact O-N 2.89Å; I120-I124 HydrophobicContact CG2-CD1 4.44Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 2.69Å; I120-A155 HydrophobicContact CD1-CB 3.78Å; I120-I156 HydrophobicContact CG1-CG1 3.64Å; I120-A159 HydrophobicContact CG2-CB 3.87Å
121	D	98.1	Very high	95.6	Very high	29 Å²	29	26.7 Å²	26.7	16%	0.155	14%	0.141	C	C	.	.	H	α-helix	trans	-54.5	-52.5	179.5	-174.6	-76.8	0	0	0	112.3	V86 S117 R118 S123 I124 R125	V86-D121 HydrophobicContact CB-CB 4.34Å; V86-D121 HydrophobicContact CG2-CB 3.82Å; S117-D121 WeakPolarHBondContact O-CB 3.15Å; S117-D121 PolarHBondContact O-N 3.22Å; R118-D121 PolarHBondContact O-N 3.25Å; D121-S123 PolarHBondContact O-N 2.72Å; D121-I124 WeakPolarHBondContact O-CG1 3.34Å; D121-I124 PolarHBondContact O-N 2.84Å; D121-I124 VanDerWaalsContact O-N 3.13Å; D121-R125 WeakPolarHBondContact O-CB 3.43Å; D121-R125 PolarHBondContact O-N 3.27Å; D121-R125 IonicContact OD1-CZ 2.63Å; D121-R125 IonicContact OD1-NE 3.75Å; D121-R125 PolarHBondContact OD1-NE 2.78Å; D121-R125 IonicContact OD1-NH2 2.65Å; D121-R125 PolarHBondContact OD1-NH2 3.49Å; D121-R125 IonicContact OD2-CZ 3.7Å; D121-R125 IonicContact OD2-NE 3.21Å; D121-R125 IonicContact OD2-NH2 2.73Å; D121-R125 PolarHBondContact OD2-NH2 2.87Å
122	R	96.4	Very high	95.9	Very high	18 Å²	18	22.4 Å²	22.4	7%	0.068	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-28.8	176.9	-69.7	-178.5	-60.1	-154.3	7.2	113.2	R118 I120 P126 M214 E216 D547	R118-R122 WeakPolarHBondContact O-CG 3.45Å; R118-R122 PolarHBondContact O-N 3.24Å; R118-R122 VanDerWaalsContact O-N 3.09Å; R118-R122 PolarHBondContact O-NE 3.26Å; I120-R122 PolarHBondContact O-N 2.76Å; R122-P126 WeakPolarHBondContact O-CD 3.48Å; R122-M214 HydrophobicContact CB-CG 4.08Å; R122-E216 IonicContact CZ-OE2 2.67Å; R122-E216 IonicContact NH1-OE2 3.73Å; R122-E216 IonicContact NH2-OE2 3.13Å; R122-E216 PolarHBondContact NH2-OE2 2.82Å; R122-D547 WeakPolarHBondContact CD-OD2 3.44Å; R122-D547 WeakPolarHBondContact CG-OD2 3.42Å
123	S	97.9	Very high	96.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-72.3	-30.1	179.4	-57.1	0	0	0	0	112.8	L119 I120 D121 I174 V213 M214	L119-S123 PolarHBondContact O-N 2.93Å; L119-S123 PolarHBondContact O-OG 2.76Å; I120-S123 WeakPolarHBondContact O-CA 3.35Å; I120-S123 VanDerWaalsContact O-CB 3.26Å; I120-S123 WeakPolarHBondContact O-CB 3.14Å; I120-S123 PolarHBondContact O-N 2.89Å; D121-S123 PolarHBondContact O-N 2.72Å; S123-I174 WeakPolarHBondContact O-CD1 3.33Å; S123-V213 WeakPolarHBondContact O-CG1 3.42Å; S123-M214 WeakPolarHBondContact OG-CE 3.44Å
124	I	98.1	Very high	96.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-110	-28.3	-172.1	65.1	176.4	0	0	0	113.7	L84 V86 I120 D121 P126 L127 F128 V138 L163 W170 I174	L84-I124 HydrophobicContact CD1-CD1 4.27Å; L84-I124 HydrophobicContact CD2-CD1 4.15Å; L84-I124 HydrophobicContact CD2-CG1 4.04Å; V86-I124 HydrophobicContact CG2-CD1 3.9Å; I120-I124 HydrophobicContact CG2-CD1 4.44Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 2.69Å; D121-I124 WeakPolarHBondContact O-CG1 3.34Å; D121-I124 PolarHBondContact O-N 2.84Å; D121-I124 VanDerWaalsContact O-N 3.13Å; I124-P126 VanDerWaalsContact C-CD 3.47Å; I124-L127 PolarHBondContact O-N 3.25Å; I124-F128 HydrophobicContact CG1-CE2 4.47Å; I124-F128 WeakPolarHBondContact O-CD2 3.33Å; I124-V138 HydrophobicContact CD1-CG2 3.93Å; I124-L163 HydrophobicContact CB-CD1 4.04Å; I124-L163 HydrophobicContact CD1-CD1 3.99Å; I124-L163 HydrophobicContact CG2-CD1 4.05Å; I124-W170 HydrophobicContact CB-CZ2 4.27Å; I124-W170 HydrophobicContact CG2-CZ2 4.1Å; I124-W170 PolarHBondContact O-NE1 3.34Å; I124-I174 HydrophobicContact CG2-CD1 3.81Å
125	R	97.6	Very high	96.3	Very high	87 Å²	87	25.6 Å²	25.6	33%	0.328	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-56.7	-44.8	-174.3	179.1	175.4	-64.4	-82.5	-3	114.2	M82 L84 D121 L127 F128	M82-R125 HydrophobicContact CE-CG 3.91Å; L84-R125 HydrophobicContact CD2-CB 3.94Å; L84-R125 HydrophobicContact CD2-CG 4.39Å; L84-R125 PolarHBondContact O-NH2 3.27Å; D121-R125 WeakPolarHBondContact O-CB 3.43Å; D121-R125 PolarHBondContact O-N 3.27Å; D121-R125 IonicContact OD1-CZ 2.63Å; D121-R125 IonicContact OD1-NE 3.75Å; D121-R125 PolarHBondContact OD1-NE 2.78Å; D121-R125 IonicContact OD1-NH2 2.65Å; D121-R125 PolarHBondContact OD1-NH2 3.49Å; D121-R125 IonicContact OD2-CZ 3.7Å; D121-R125 IonicContact OD2-NE 3.21Å; D121-R125 IonicContact OD2-NH2 2.73Å; D121-R125 PolarHBondContact OD2-NH2 2.87Å; R125-L127 PolarHBondContact O-N 3.36Å; R125-L127 VanDerWaalsContact O-N 3.1Å; R125-F128 PolarHBondContact O-N 2.88Å
126	P	95.6	Very high	96.4	Very high	21 Å²	21	23.4 Å²	23.4	14%	0.136	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-67.9	-12.5	-175.4	-20.6	34.8	0	0	0	114.2	R122 I124 V213 V548	R122-P126 WeakPolarHBondContact O-CD 3.48Å; I124-P126 VanDerWaalsContact C-CD 3.47Å; P126-V213 HydrophobicContact CG-CG1 4.15Å; P126-V548 WeakPolarHBondContact CB-O 3.46Å; P126-V548 WeakPolarHBondContact CG-O 3.47Å
127	L	96.3	Very high	96.5	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-99.4	-1.7	-175	-60.6	173.4	0	0	0	112.5	I124 R125 W170 H171 I174 P551	I124-L127 PolarHBondContact O-N 3.25Å; R125-L127 PolarHBondContact O-N 3.36Å; R125-L127 VanDerWaalsContact O-N 3.1Å; L127-W170 HydrophobicContact CB-CZ2 4.33Å; L127-W170 HydrophobicContact CD1-CH2 4.47Å; L127-W170 HydrophobicContact CD1-CZ2 3.67Å; L127-H171 WeakPolarHBondContact O-CB 3.49Å; L127-H171 PolarHBondContact O-CD2 3.37Å; L127-H171 PolarHBondContact O-N 2.96Å; L127-I174 HydrophobicContact CD1-CG2 3.19Å; L127-P551 HydrophobicContact CD2-CB 3.61Å
128	F	96.7	Very high	96.6	Very high	13 Å²	13	27.2 Å²	27.2	6%	0.057	14%	0.14	C	C	.	.	S	Bend	trans	-74.8	141.4	167	-75.9	-87.9	0	0	0	110.2	M82 L84 I124 R125 Y132 T136 L163 I168 W170	M82-F128 HydrophobicContact CE-CB 3.82Å; M82-F128 HydrophobicContact CE-CD2 3.8Å; M82-F128 HydrophobicContact CE-CG 3.9Å; M82-F128 HydrophobicContact SD-CB 3.37Å; M82-F128 WeakPolarHBondContact SD-CB 3.24Å; M82-F128 HydrophobicContact SD-CD1 3.86Å; M82-F128 HydrophobicContact SD-CD2 3.91Å; M82-F128 HydrophobicContact SD-CG 3.43Å; M82-F128 WeakPolarHBondContact SD-CG 3.47Å; L84-F128 HydrophobicContact CD1-CE2 4.26Å; L84-F128 HydrophobicContact CD1-CZ 4.33Å; L84-F128 HydrophobicContact CD2-CD2 4.27Å; L84-F128 HydrophobicContact CD2-CE2 3.83Å; I124-F128 HydrophobicContact CG1-CE2 4.47Å; I124-F128 WeakPolarHBondContact O-CD2 3.33Å; R125-F128 PolarHBondContact O-N 2.88Å; F128-Y132 AromaticContact CD1-CD1 3.93Å; F128-Y132 HydrophobicContact CD1-CD1 3.93Å; F128-Y132 HydrophobicContact CD1-CE1 4.27Å; F128-Y132 HydrophobicContact CE1-CE1 4.43Å; F128-T136 HydrophobicContact CE1-CG2 4.3Å; F128-T136 HydrophobicContact CZ-CG2 4.17Å; F128-L163 HydrophobicContact CZ-CD1 4.31Å; F128-L163 HydrophobicContact CZ-CD2 3.95Å; F128-I168 HydrophobicContact CE1-CG2 3.95Å; F128-W170 AromaticContact CD2-CD1 3.73Å; F128-W170 AromaticContact CE2-CD1 3.69Å; F128-W170 AromaticContact CE2-NE1 3.98Å; F128-W170 AromaticContact CG-CD1 3.97Å; F128-W170 AromaticContact CZ-CD1 3.9Å
129	P	94.1	Very high	96.6	Very high	16 Å²	16	28 Å²	28	10%	0.104	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-63.6	143.9	179.2	19	-23.8	0	0	0	111.2	G131 Y132 P169 M262	P129-G131 PolarHBondContact O-N 3.08Å; P129-Y132 HydrophobicContact CG-CD2 4.49Å; P129-Y132 HydrophobicContact CG-CG 4.38Å; P129-Y132 VanDerWaalsContact O-CB 3.26Å; P129-Y132 WeakPolarHBondContact O-CB 3.14Å; P129-Y132 PolarHBondContact O-N 3.03Å; P129-P169 VanDerWaalsContact CD-O 3.31Å; P129-P169 WeakPolarHBondContact CD-O 3.43Å; P129-P169 HydrophobicContact CG-CB 3.88Å; P129-M262 HydrophobicContact CB-CE 3.86Å; P129-M262 HydrophobicContact CG-CE 4.1Å
130	P	91.3	Very high	96.7	Very high	122 Å²	122	27.7 Å²	27.7	79%	0.792	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	139.9	175.2	26	-33.8	0	0	0	110	Y132 M262	P130-Y132 VanDerWaalsContact C-N 3.34Å; P130-M262 WeakPolarHBondContact O-CE 3.39Å
131	G	92.2	Very high	96.5	Very high	10 Å²	10	29.3 Å²	29.3	10%	0.103	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	7.6	-177.6	0	0	0	0	0	115.6	P129 F133 F263	P129-G131 PolarHBondContact O-N 3.08Å; G131-F133 PolarHBondContact O-N 3.48Å; G131-F133 VanDerWaalsContact O-N 3.09Å; G131-F263 WeakPolarHBondContact CA-O 3.36Å; G131-F263 WeakPolarHBondContact O-CD2 3.34Å; G131-F263 PolarHBondContact O-N 2.99Å
132	Y	95.6	Very high	96.4	Very high	2 Å²	2	28 Å²	28	1%	0.008	15%	0.148	C	C	.	.			trans	-81.3	75.5	174.5	-169.8	-100.9	0	0	0	111.9	S72 M82 F128 P129 P130 Y134 I168 P169 P259 M262	S72-Y132 PolarHBondContact OG-OH 3.01Å; M82-Y132 VanDerWaalsContact CG-O 3.29Å; M82-Y132 WeakPolarHBondContact CG-O 3.32Å; M82-Y132 HydrophobicContact SD-CD1 4.36Å; F128-Y132 AromaticContact CD1-CD1 3.93Å; F128-Y132 HydrophobicContact CD1-CD1 3.93Å; F128-Y132 HydrophobicContact CD1-CE1 4.27Å; F128-Y132 HydrophobicContact CE1-CE1 4.43Å; P129-Y132 HydrophobicContact CG-CD2 4.49Å; P129-Y132 HydrophobicContact CG-CG 4.38Å; P129-Y132 VanDerWaalsContact O-CB 3.26Å; P129-Y132 WeakPolarHBondContact O-CB 3.14Å; P129-Y132 PolarHBondContact O-N 3.03Å; P130-Y132 VanDerWaalsContact C-N 3.34Å; Y132-Y134 HydrophobicContact CD1-CD2 4.13Å; Y132-Y134 AromaticContact CD2-CD2 3.52Å; Y132-Y134 HydrophobicContact CD2-CD2 3.52Å; Y132-Y134 AromaticContact CD2-CE2 3.86Å; Y132-Y134 HydrophobicContact CD2-CE2 3.86Å; Y132-Y134 HydrophobicContact CE1-CD2 4.05Å; Y132-Y134 HydrophobicContact CE1-CG 4.27Å; Y132-Y134 AromaticContact CE2-CD2 3.43Å; Y132-Y134 HydrophobicContact CE2-CD2 3.43Å; Y132-Y134 VanDerWaalsContact CE2-CD2 3.43Å; Y132-Y134 AromaticContact CE2-CE2 3.9Å; Y132-Y134 HydrophobicContact CE2-CE2 3.9Å; Y132-Y134 HydrophobicContact CE2-CG 4.05Å; Y132-Y134 AromaticContact CG-CD2 3.86Å; Y132-Y134 HydrophobicContact CG-CD2 3.86Å; Y132-Y134 AromaticContact CZ-CD2 3.7Å; Y132-Y134 AromaticContact CZ-CG 3.91Å; Y132-Y134 PolarHBondContact O-N 2.81Å; Y132-Y134 VanDerWaalsContact O-N 3.17Å; Y132-I168 HydrophobicContact CE1-CG2 4.15Å; Y132-P169 HydrophobicContact CD2-CG 4.27Å; Y132-P169 HydrophobicContact CE2-CB 4.49Å; Y132-P169 HydrophobicContact CE2-CG 3.81Å; Y132-P259 HydrophobicContact CD2-CB 4.5Å; Y132-P259 HydrophobicContact CD2-CG 4Å; Y132-P259 HydrophobicContact CE2-CB 4.35Å; Y132-P259 HydrophobicContact CE2-CG 3.84Å; Y132-M262 HydrophobicContact CD2-SD 4.18Å
133	F	95.4	Very high	96.3	Very high	24 Å²	24	30.5 Å²	30.5	11%	0.105	16%	0.163	C	C	.	.			trans	-91	72.5	-178.2	-56.6	-18.9	0	0	0	112.2	S77 F81 M82 G131 F263 F320	S77-F133 PolarHBondContact N-O 3.07Å; F81-F133 VanDerWaalsContact C-CD1 3.4Å; M82-F133 HydrophobicContact CB-CD1 4.25Å; G131-F133 PolarHBondContact O-N 3.48Å; G131-F133 VanDerWaalsContact O-N 3.09Å; F133-F263 HydrophobicContact CB-CD2 3.86Å; F133-F263 HydrophobicContact CB-CE2 3.87Å; F133-F263 HydrophobicContact CD2-CB 3.8Å; F133-F263 HydrophobicContact CD2-CD1 4.03Å; F133-F263 AromaticContact CD2-CD2 3.59Å; F133-F263 HydrophobicContact CD2-CD2 3.59Å; F133-F263 HydrophobicContact CD2-CE2 4.11Å; F133-F263 AromaticContact CD2-CG 3.54Å; F133-F263 HydrophobicContact CD2-CG 3.54Å; F133-F263 HydrophobicContact CE2-CB 3.73Å; F133-F263 HydrophobicContact CE2-CD1 4.38Å; F133-F263 HydrophobicContact CE2-CD2 4.39Å; F133-F263 AromaticContact CE2-CG 3.94Å; F133-F263 HydrophobicContact CE2-CG 3.94Å; F133-F263 AromaticContact CG-CD2 3.94Å; F133-F263 HydrophobicContact CG-CD2 3.94Å; F133-F263 HydrophobicContact CG-CE2 4.39Å; F133-F263 HydrophobicContact CG-CG 4.31Å; F133-F263 HydrophobicContact CZ-CB 4.43Å; F133-F320 HydrophobicContact CE2-CD2 4.14Å; F133-F320 HydrophobicContact CE2-CE1 4.37Å; F133-F320 AromaticContact CE2-CE2 3.43Å; F133-F320 HydrophobicContact CE2-CE2 3.43Å; F133-F320 VanDerWaalsContact CE2-CE2 3.43Å; F133-F320 AromaticContact CE2-CZ 3.56Å; F133-F320 HydrophobicContact CE2-CZ 3.56Å; F133-F320 AromaticContact CZ-CE2 3.88Å; F133-F320 HydrophobicContact CZ-CE2 3.88Å; F133-F320 AromaticContact CZ-CZ 3.88Å; F133-F320 HydrophobicContact CZ-CZ 3.88Å
134	Y	96.5	Very high	96.2	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.008	18%	0.177	C	C	.	.			trans	-128.3	128.7	178.6	-63.4	-97.7	0	0	0	109.7	K73 T74 K75 P76 Y132 T136 P259 V260 K261	K73-Y134 VanDerWaalsContact O-CD1 3.27Å; K73-Y134 WeakPolarHBondContact O-CD1 3.37Å; T74-Y134 WeakPolarHBondContact O-CE1 3.4Å; K75-Y134 VanDerWaalsContact O-CD1 3.31Å; K75-Y134 WeakPolarHBondContact O-CD1 3.25Å; P76-Y134 HydrophobicContact CG-CE1 4.04Å; Y132-Y134 HydrophobicContact CD1-CD2 4.13Å; Y132-Y134 AromaticContact CD2-CD2 3.52Å; Y132-Y134 HydrophobicContact CD2-CD2 3.52Å; Y132-Y134 AromaticContact CD2-CE2 3.86Å; Y132-Y134 HydrophobicContact CD2-CE2 3.86Å; Y132-Y134 HydrophobicContact CE1-CD2 4.05Å; Y132-Y134 HydrophobicContact CE1-CG 4.27Å; Y132-Y134 AromaticContact CE2-CD2 3.43Å; Y132-Y134 HydrophobicContact CE2-CD2 3.43Å; Y132-Y134 VanDerWaalsContact CE2-CD2 3.43Å; Y132-Y134 AromaticContact CE2-CE2 3.9Å; Y132-Y134 HydrophobicContact CE2-CE2 3.9Å; Y132-Y134 HydrophobicContact CE2-CG 4.05Å; Y132-Y134 AromaticContact CG-CD2 3.86Å; Y132-Y134 HydrophobicContact CG-CD2 3.86Å; Y132-Y134 AromaticContact CZ-CD2 3.7Å; Y132-Y134 AromaticContact CZ-CG 3.91Å; Y132-Y134 PolarHBondContact O-N 2.81Å; Y132-Y134 VanDerWaalsContact O-N 3.17Å; Y134-T136 PolarHBondContact O-N 2.93Å; Y134-T136 PolarHBondContact O-OG1 2.93Å; Y134-P259 HydrophobicContact CE2-CB 3.88Å; Y134-P259 WeakPolarHBondContact OH-CB 3.46Å; Y134-V260 PolarHBondContact OH-N 2.82Å; Y134-K261 WeakPolarHBondContact CE2-O 3.29Å; Y134-K261 PolarHBondContact OH-N 3.15Å; Y134-K261 PolarHBondContact OH-O 3.25Å
135	D	97.8	Very high	96	Very high	78 Å²	78	33.1 Å²	33.1	42%	0.417	18%	0.182	S	C	.	.			trans	-52.1	113.1	175.1	-72.6	22.9	0	0	0	109.7	S72 K73 S77 P83	S72-D135 WeakPolarHBondContact CA-O 3.26Å; K73-D135 HydrophobicContact CB-CB 4.35Å; K73-D135 HydrophobicContact CG-CB 3.88Å; K73-D135 PolarHBondContact N-O 3.3Å; S77-D135 VanDerWaalsContact CB-OD1 3.27Å; S77-D135 WeakPolarHBondContact CB-OD1 3.18Å; S77-D135 PolarHBondContact OG-OD1 3Å; P83-D135 HydrophobicContact CG-CB 4.47Å; P83-D135 WeakPolarHBondContact CG-OD1 3.39Å
136	T	98.4	Very high	95.7	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.7	-173.4	-58.3	0	0	0	0	109.4	V71 S72 P83 L84 V85 F128 Y134	V71-T136 WeakPolarHBondContact O-CA 3.42Å; S72-T136 PolarHBondContact OG-OG1 3.38Å; P83-T136 PolarHBondContact O-N 2.88Å; L84-T136 WeakPolarHBondContact CA-O 3.45Å; L84-T136 HydrophobicContact CD1-CG2 3.95Å; V85-T136 PolarHBondContact N-O 2.88Å; F128-T136 HydrophobicContact CE1-CG2 4.3Å; F128-T136 HydrophobicContact CZ-CG2 4.17Å; Y134-T136 PolarHBondContact O-N 2.93Å; Y134-T136 PolarHBondContact O-OG1 2.93Å
137	Q	98.6	Very high	95.4	Very high	86 Å²	86	31.5 Å²	31.5	40%	0.402	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.1	179.9	-168.2	177.4	40.6	0	0	110.6	A70 V71 V85 L139	A70-Q137 WeakPolarHBondContact CA-O 3.41Å; V71-Q137 PolarHBondContact N-O 2.59Å; V71-Q137 PolarHBondContact O-N 3.28Å; V85-Q137 WeakPolarHBondContact O-CA 3.35Å; Q137-L139 HydrophobicContact CG-CD2 3.87Å; Q137-L139 HydrophobicContact CG-CG 4.01Å
138	V	98.7	Very high	95.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.6	171	-179.2	0	0	0	0	108.5	V68 T69 A70 L84 V85 V86 D87 I124 A159	V68-V138 HydrophobicContact CG1-CG1 3.51Å; T69-V138 WeakPolarHBondContact O-CA 3.45Å; A70-V138 HydrophobicContact CB-CG2 4.39Å; L84-V138 HydrophobicContact CD1-CG2 4.3Å; V85-V138 PolarHBondContact O-N 3.16Å; V86-V138 WeakPolarHBondContact CA-O 3.43Å; V86-V138 HydrophobicContact CG1-CB 4.34Å; V86-V138 HydrophobicContact CG1-CG1 4.44Å; V86-V138 HydrophobicContact CG2-CB 4.22Å; D87-V138 PolarHBondContact N-O 3.5Å; I124-V138 HydrophobicContact CD1-CG2 3.93Å; V138-A159 HydrophobicContact CG1-CB 4.02Å
139	L	98.3	Very high	95	Very high	66 Å²	66	35 Å²	35	35%	0.346	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.8	179.8	-63.1	-179.5	0	0	0	110.1	V68 T69 D87 Q137	V68-L139 VanDerWaalsContact CA-O 3.32Å; V68-L139 WeakPolarHBondContact CA-O 3.48Å; T69-L139 PolarHBondContact N-O 3.34Å; T69-L139 PolarHBondContact O-N 2.78Å; D87-L139 HydrophobicContact CB-CD2 3.73Å; D87-L139 WeakPolarHBondContact O-CA 3.43Å; Q137-L139 HydrophobicContact CG-CD2 3.87Å; Q137-L139 HydrophobicContact CG-CG 4.01Å
140	C	97.8	Very high	94.8	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.02	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.7	176.2	-42.5	0	0	0	0	109.9	V68 D87 Y88 R89 A155	V68-C140 HydrophobicContact CG2-CB 3.9Å; D87-C140 PolarHBondContact O-N 3.01Å; Y88-C140 HydrophobicContact CD2-CB 3.71Å; Y88-C140 HydrophobicContact CG-CB 4.32Å; R89-C140 PolarHBondContact N-O 2.99Å; R89-C140 VanDerWaalsContact N-O 3.08Å; C140-A155 HydrophobicContact CB-CB 4.34Å
141	N	95.5	Very high	95	Very high	34 Å²	34	30.5 Å²	30.5	18%	0.182	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.8	-176.3	179.5	14.5	0	0	0	109.5	M67 K91 L143	M67-N141 HydrophobicContact CE-CB 4.22Å; M67-N141 PolarHBondContact N-O 2.85Å; M67-N141 PolarHBondContact O-N 2.93Å; K91-N141 WeakPolarHBondContact CD-OD1 3.42Å; K91-N141 WeakPolarHBondContact CE-OD1 3.23Å; K91-N141 VanDerWaalsContact NZ-CG 3.3Å; K91-N141 PolarHBondContact NZ-ND2 2.92Å; K91-N141 VanDerWaalsContact NZ-ND2 3.2Å; K91-N141 PolarHBondContact NZ-OD1 3.33Å; N141-L143 PolarHBondContact O-N 2.66Å
142	L	95.1	Very high	95.1	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	115.3	173.7	-82.3	57.8	0	0	0	108.6	V66 Y88 Q90 A94 V145 P151	V66-L142 HydrophobicContact CG1-CD1 4.29Å; V66-L142 HydrophobicContact CG2-CD1 4.38Å; V66-L142 HydrophobicContact CG2-CG 4.35Å; Y88-L142 HydrophobicContact CD2-CD1 4.29Å; Y88-L142 HydrophobicContact CE1-CD1 4.36Å; Y88-L142 HydrophobicContact CE2-CD1 3.51Å; Q90-L142 HydrophobicContact CG-CD2 4.11Å; A94-L142 HydrophobicContact CB-CB 3.95Å; A94-L142 WeakPolarHBondContact CB-O 3.32Å; L142-V145 HydrophobicContact CB-CG2 4.26Å; L142-V145 HydrophobicContact CD2-CG2 3.73Å; L142-V145 HydrophobicContact CG-CG2 4.1Å; L142-P151 HydrophobicContact CD1-CB 4.4Å; L142-P151 HydrophobicContact CD2-CB 4.05Å; L142-P151 HydrophobicContact CD2-CG 3.84Å; L142-P151 HydrophobicContact CG-CB 4.05Å; L142-P151 HydrophobicContact CG-CG 4.4Å
143	L	95	Very high	95.2	Very high	70 Å²	70	30.6 Å²	30.6	37%	0.366	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-47.1	177.4	-62	-177.5	0	0	0	110.6	L49 V58 S65 M67 N141	L49-L143 HydrophobicContact CD1-CD1 3.87Å; V58-L143 HydrophobicContact CG1-CD1 4.12Å; V58-L143 HydrophobicContact CG2-CD1 4.31Å; S65-L143 WeakPolarHBondContact O-CB 3.47Å; S65-L143 PolarHBondContact O-N 3.19Å; M67-L143 HydrophobicContact CB-CD1 3.93Å; M67-L143 HydrophobicContact CB-CD2 4.04Å; M67-L143 HydrophobicContact CB-CG 3.89Å; N141-L143 PolarHBondContact O-N 2.66Å
144	A	95.1	Very high	95.3	Very high	37 Å²	37	29.6 Å²	29.6	31%	0.306	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	144.8	179.3	0	0	0	0	0	109.5	T64 S65 A94	T64-A144 CarbonylContact C-O 3.57Å; T64-A144 WeakPolarHBondContact CA-O 3.14Å; S65-A144 PolarHBondContact N-O 3.38Å; S65-A144 PolarHBondContact O-N 2.99Å; A94-A144 CarbonylContact O-C 3.54Å; A94-A144 WeakPolarHBondContact O-CA 3.48Å
145	V	94.3	Very high	95.4	Very high	17 Å²	17	29.5 Å²	29.5	10%	0.103	17%	0.169	C	C	.	.			trans	-135.5	127	174.9	179.9	0	0	0	0	109.2	T64 A94 L142 P151 L401	T64-V145 HydrophobicContact CG2-CG2 4.32Å; A94-V145 HydrophobicContact CB-CG2 4.34Å; A94-V145 PolarHBondContact O-N 3.03Å; L142-V145 HydrophobicContact CB-CG2 4.26Å; L142-V145 HydrophobicContact CD2-CG2 3.73Å; L142-V145 HydrophobicContact CG-CG2 4.1Å; V145-P151 HydrophobicContact CG2-CG 4.41Å; V145-L401 HydrophobicContact CB-CD2 3.63Å; V145-L401 HydrophobicContact CG1-CD2 3.91Å; V145-L401 HydrophobicContact CG2-CD2 3.69Å
146	D	92.4	Very high	95.4	Very high	47 Å²	47	25.8 Å²	25.8	25%	0.251	15%	0.149	S	C	.	.			trans	-86.2	-9.7	-175.9	63.2	15.1	0	0	0	113.9	D63 T64 V148 N149	D63-D146 HydrophobicContact CB-CB 3.79Å; D63-D146 PolarHBondContact N-OD2 3.45Å; T64-D146 PolarHBondContact N-OD2 2.76Å; T64-D146 PolarHBondContact OG1-N 2.99Å; T64-D146 PolarHBondContact OG1-OD1 3.27Å; T64-D146 PolarHBondContact OG1-OD2 2.89Å; D146-V148 PolarHBondContact O-N 2.82Å; D146-V148 WeakPolarHBondContact OD1-CA 3.37Å; D146-V148 PolarHBondContact OD1-N 3.18Å; D146-N149 PolarHBondContact OD1-N 2.84Å; D146-N149 PolarHBondContact OD2-ND2 2.84Å
147	G	87.6	Confident	95.4	Very high	27 Å²	27	25.6 Å²	25.6	28%	0.278	15%	0.148	S	C	.	.	S	Bend	trans	76.4	2.9	-177.4	0	0	0	0	0	114.3	R192	G147-R192 WeakPolarHBondContact O-CD 3.4Å
148	V	91.4	Very high	95.4	Very high	70 Å²	70	21.5 Å²	21.5	42%	0.424	13%	0.129	S	C	.	.	S	Bend	trans	-109	-47.7	-179.9	179.3	0	0	0	0	110.6	D146 T191 R192	D146-V148 PolarHBondContact O-N 2.82Å; D146-V148 WeakPolarHBondContact OD1-CA 3.37Å; D146-V148 PolarHBondContact OD1-N 3.18Å; V148-T191 HydrophobicContact CG1-CG2 3.62Å; V148-T191 CarbonylContact O-C 3.6Å; V148-T191 WeakPolarHBondContact O-CA 3.08Å; V148-R192 PolarHBondContact O-N 3.23Å
149	N	93	Very high	95.4	Very high	18 Å²	18	21.5 Å²	21.5	10%	0.096	13%	0.129	C	C	.	.	S	Bend	trans	-99.9	130.5	-178.5	-62.6	-67.6	0	0	0	110.5	L61 T64 D146 P151	L61-N149 HydrophobicContact CD2-CB 4.33Å; L61-N149 PolarHBondContact O-ND2 2.84Å; T64-N149 PolarHBondContact OG1-O 2.99Å; D146-N149 PolarHBondContact OD1-N 2.84Å; D146-N149 PolarHBondContact OD2-ND2 2.84Å; N149-P151 WeakPolarHBondContact O-CD 3.34Å
150	D	91.3	Very high	95.4	Very high	44 Å²	44	18.4 Å²	18.4	24%	0.235	11%	0.113	C	C	.	.			trans	-77.5	125.9	-178.3	-164	-23.6	0	0	0	111.2	D152 R178	D150-D152 VanDerWaalsContact C-N 3.29Å; D150-D152 VanDerWaalsContact CG-OD1 3.28Å; D150-D152 PolarHBondContact O-N 2.85Å; D150-D152 PolarHBondContact OD1-N 3.15Å; D150-R178 IonicContact OD2-CZ 2.78Å; D150-R178 IonicContact OD2-NH1 3.4Å; D150-R178 PolarHBondContact OD2-NH1 2.78Å; D150-R178 IonicContact OD2-NH2 3.85Å
151	P	95	Very high	95.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.9	-14	-177.8	24.7	-35.8	0	0	0	115.7	T64 V66 Y88 L142 V145 N149 L154 A155	T64-P151 HydrophobicContact CG2-CB 4.06Å; V66-P151 HydrophobicContact CG2-CB 3.71Å; Y88-P151 VanDerWaalsContact OH-CG 3.24Å; Y88-P151 WeakPolarHBondContact OH-CG 3.39Å; L142-P151 HydrophobicContact CD1-CB 4.4Å; L142-P151 HydrophobicContact CD2-CB 4.05Å; L142-P151 HydrophobicContact CD2-CG 3.84Å; L142-P151 HydrophobicContact CG-CB 4.05Å; L142-P151 HydrophobicContact CG-CG 4.4Å; V145-P151 HydrophobicContact CG2-CG 4.41Å; N149-P151 WeakPolarHBondContact O-CD 3.34Å; P151-L154 WeakPolarHBondContact O-CB 3.49Å; P151-L154 PolarHBondContact O-N 2.97Å; P151-A155 WeakPolarHBondContact O-CB 3.19Å; P151-A155 PolarHBondContact O-N 3.35Å
152	D	95.1	Very high	95.6	Very high	11 Å²	11	16.6 Å²	16.6	6%	0.059	10%	0.103	C	C	.	.	H	α-helix	trans	-65.3	-46.4	-172.2	64.6	-8.2	0	0	0	114.3	T116 D150 L154 A155 I156 R178	T116-D152 HydrophobicContact CG2-CB 3.84Å; D150-D152 VanDerWaalsContact C-N 3.29Å; D150-D152 VanDerWaalsContact CG-OD1 3.28Å; D150-D152 PolarHBondContact O-N 2.85Å; D150-D152 PolarHBondContact OD1-N 3.15Å; D152-L154 VanDerWaalsContact C-N 3.31Å; D152-L154 PolarHBondContact O-N 2.81Å; D152-A155 WeakPolarHBondContact O-CB 3.29Å; D152-A155 PolarHBondContact O-N 3.25Å; D152-I156 PolarHBondContact O-N 2.83Å; D152-R178 IonicContact OD1-CZ 3.51Å; D152-R178 IonicContact OD1-NH1 2.74Å; D152-R178 PolarHBondContact OD1-NH1 3.32Å; D152-R178 IonicContact OD1-NH2 2.82Å; D152-R178 IonicContact OD2-CZ 3.32Å; D152-R178 IonicContact OD2-NH1 3.48Å; D152-R178 PolarHBondContact OD2-NH1 3.48Å; D152-R178 IonicContact OD2-NH2 3.58Å; D152-R178 PolarHBondContact OD2-NH2 3.15Å
153	V	96.9	Very high	95.7	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.024	10%	0.103	C	C	.	.	H	α-helix	trans	-64.1	-38.5	175.1	171.8	0	0	0	0	110.9	A155 I156 N157 A176 R178	V153-A155 VanDerWaalsContact C-N 3.3Å; V153-A155 PolarHBondContact O-N 3.32Å; V153-I156 PolarHBondContact O-N 3.46Å; V153-N157 PolarHBondContact O-N 2.8Å; V153-N157 VanDerWaalsContact O-N 3.16Å; V153-N157 PolarHBondContact O-ND2 3.37Å; V153-A176 HydrophobicContact CG1-CB 4.34Å; V153-A176 VanDerWaalsContact CG1-O 3.25Å; V153-A176 WeakPolarHBondContact CG1-O 3.33Å; V153-R178 HydrophobicContact CG2-CB 3.8Å
154	L	97.8	Very high	95.8	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-40.2	176	-82.1	61.5	0	0	0	110.7	L42 V59 L61 T64 V66 P151 D152 I156 N157 A158	L42-L154 HydrophobicContact CD1-CD1 4.44Å; L42-L154 HydrophobicContact CD1-CG 4.34Å; V59-L154 HydrophobicContact CG1-CB 4.22Å; V59-L154 HydrophobicContact CG1-CG 4.01Å; L61-L154 HydrophobicContact CB-CD1 3.94Å; L61-L154 HydrophobicContact CB-CD2 3.82Å; L61-L154 HydrophobicContact CB-CG 4.19Å; L61-L154 HydrophobicContact CD2-CD1 4.02Å; T64-L154 HydrophobicContact CG2-CD2 3.86Å; T64-L154 WeakPolarHBondContact O-CD2 3.29Å; V66-L154 HydrophobicContact CB-CB 4.37Å; V66-L154 HydrophobicContact CG2-CB 3.97Å; V66-L154 HydrophobicContact CG2-CD2 4.46Å; P151-L154 WeakPolarHBondContact O-CB 3.49Å; P151-L154 PolarHBondContact O-N 2.97Å; D152-L154 VanDerWaalsContact C-N 3.31Å; D152-L154 PolarHBondContact O-N 2.81Å; L154-I156 PolarHBondContact O-N 3.32Å; L154-N157 PolarHBondContact O-N 2.8Å; L154-A158 VanDerWaalsContact O-CB 3.24Å; L154-A158 WeakPolarHBondContact O-CB 3.29Å; L154-A158 PolarHBondContact O-N 3.09Å
155	A	98.4	Very high	95.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.4	-40.1	177.7	0	0	0	0	0	112.5	V66 Y88 I120 C140 P151 D152 V153 A158 A159	V66-A155 HydrophobicContact CG1-CB 4.02Å; Y88-A155 HydrophobicContact CD2-CB 3.8Å; Y88-A155 HydrophobicContact CE2-CB 3.78Å; I120-A155 HydrophobicContact CD1-CB 3.78Å; C140-A155 HydrophobicContact CB-CB 4.34Å; P151-A155 WeakPolarHBondContact O-CB 3.19Å; P151-A155 PolarHBondContact O-N 3.35Å; D152-A155 WeakPolarHBondContact O-CB 3.29Å; D152-A155 PolarHBondContact O-N 3.25Å; V153-A155 VanDerWaalsContact C-N 3.3Å; V153-A155 PolarHBondContact O-N 3.32Å; A155-A158 PolarHBondContact O-N 3.03Å; A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 3.09Å
156	I	98.6	Very high	96	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.5	-47.9	175.4	-58.9	165.6	0	0	0	110.4	L119 I120 D152 V153 L154 A158 A159 S160 I174 A176 I203 V205	L119-I156 HydrophobicContact CD2-CD1 3.82Å; L119-I156 HydrophobicContact CG-CD1 4.03Å; I120-I156 HydrophobicContact CG1-CG1 3.64Å; D152-I156 PolarHBondContact O-N 2.83Å; V153-I156 PolarHBondContact O-N 3.46Å; L154-I156 PolarHBondContact O-N 3.32Å; I156-A158 VanDerWaalsContact C-N 3.33Å; I156-A158 PolarHBondContact O-N 3.31Å; I156-A159 PolarHBondContact O-N 3.12Å; I156-S160 PolarHBondContact O-N 3Å; I156-I174 HydrophobicContact CG2-CD1 3.84Å; I156-A176 HydrophobicContact CB-CB 3.77Å; I156-A176 HydrophobicContact CD1-CB 4.05Å; I156-A176 HydrophobicContact CG2-CB 3.56Å; I156-I203 HydrophobicContact CD1-CG2 4.19Å; I156-V205 HydrophobicContact CD1-CG2 4.32Å; I156-V205 HydrophobicContact CG2-CG2 4.17Å
157	N	98.6	Very high	96.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-64.9	-37.2	179.2	-70.4	-53.1	0	0	0	112	V59 V153 L154 S160 A161 A176 I241	V59-N157 HydrophobicContact CG2-CB 4.45Å; V153-N157 PolarHBondContact O-N 2.8Å; V153-N157 VanDerWaalsContact O-N 3.16Å; V153-N157 PolarHBondContact O-ND2 3.37Å; L154-N157 PolarHBondContact O-N 2.8Å; N157-S160 WeakPolarHBondContact O-CB 3.35Å; N157-S160 PolarHBondContact O-N 3Å; N157-A161 WeakPolarHBondContact O-CB 3.49Å; N157-A161 PolarHBondContact O-N 3.35Å; N157-A176 PolarHBondContact ND2-O 3.44Å; N157-A176 PolarHBondContact OD1-N 2.83Å; N157-I241 WeakPolarHBondContact OD1-CG2 3.27Å
158	A	98.4	Very high	96.7	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-68.3	-38	175.5	0	0	0	0	0	112	V59 V68 L154 A155 I156 A161 A162	V59-A158 HydrophobicContact CB-CB 4.01Å; V59-A158 VanDerWaalsContact CG2-CA 3.48Å; V59-A158 HydrophobicContact CG2-CB 3.54Å; V68-A158 HydrophobicContact CB-CB 3.77Å; V68-A158 HydrophobicContact CG2-CB 3.34Å; L154-A158 VanDerWaalsContact O-CB 3.24Å; L154-A158 WeakPolarHBondContact O-CB 3.29Å; L154-A158 PolarHBondContact O-N 3.09Å; A155-A158 PolarHBondContact O-N 3.03Å; I156-A158 VanDerWaalsContact C-N 3.33Å; I156-A158 PolarHBondContact O-N 3.31Å; A158-A161 PolarHBondContact O-N 2.89Å; A158-A162 VanDerWaalsContact O-CB 3.28Å; A158-A162 WeakPolarHBondContact O-CB 3.11Å; A158-A162 PolarHBondContact O-N 2.94Å
159	A	98.7	Very high	96.9	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.9	-44.2	172.7	0	0	0	0	0	111.8	V68 I120 V138 A155 I156 A162 L163	V68-A159 HydrophobicContact CG1-CB 3.95Å; I120-A159 HydrophobicContact CG2-CB 3.87Å; V138-A159 HydrophobicContact CG1-CB 4.02Å; A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 3.09Å; I156-A159 PolarHBondContact O-N 3.12Å; A159-A162 PolarHBondContact O-N 3.07Å; A159-L163 WeakPolarHBondContact O-CB 3.24Å; A159-L163 WeakPolarHBondContact O-CG 3.26Å; A159-L163 PolarHBondContact O-N 3.46Å
160	S	98.6	Very high	97.1	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-56.8	-50.6	173.4	-175.8	0	0	0	0	111.7	I156 N157 L163 A164 I174	I156-S160 PolarHBondContact O-N 3Å; N157-S160 WeakPolarHBondContact O-CB 3.35Å; N157-S160 PolarHBondContact O-N 3Å; S160-L163 PolarHBondContact O-N 2.84Å; S160-A164 WeakPolarHBondContact O-CB 3.49Å; S160-A164 PolarHBondContact O-N 2.79Å; S160-I174 VanDerWaalsContact CB-CG1 3.46Å; S160-I174 WeakPolarHBondContact CB-O 3.31Å; S160-I174 WeakPolarHBondContact OG-CG1 3.5Å; S160-I174 PolarHBondContact OG-N 3.04Å; S160-I174 PolarHBondContact OG-O 3.32Å
161	A	98	Very high	97.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.8	-42.4	178.8	0	0	0	0	0	112.1	I44 A57 N157 A158 A164 L165 I245	I44-A161 HydrophobicContact CG2-CB 3.82Å; A57-A161 HydrophobicContact CB-CB 3.57Å; N157-A161 WeakPolarHBondContact O-CB 3.49Å; N157-A161 PolarHBondContact O-N 3.35Å; A158-A161 PolarHBondContact O-N 2.89Å; A161-A164 PolarHBondContact O-N 2.89Å; A161-L165 WeakPolarHBondContact O-CB 3.47Å; A161-L165 WeakPolarHBondContact O-CG 3.44Å; A161-L165 PolarHBondContact O-N 3.46Å; A161-I245 HydrophobicContact CB-CD1 4.34Å; A161-I245 HydrophobicContact CB-CG1 4.34Å; A161-I245 HydrophobicContact CB-CG2 4.46Å
162	A	98.2	Very high	97.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-44.3	178.3	0	0	0	0	0	112.2	G55 A57 V68 A70 A158 A159 L165 S166	G55-A162 WeakPolarHBondContact CA-O 3.47Å; A57-A162 HydrophobicContact CB-CB 4.26Å; V68-A162 HydrophobicContact CG1-CB 4.3Å; A70-A162 HydrophobicContact CB-CB 4.4Å; A158-A162 VanDerWaalsContact O-CB 3.28Å; A158-A162 WeakPolarHBondContact O-CB 3.11Å; A158-A162 PolarHBondContact O-N 2.94Å; A159-A162 PolarHBondContact O-N 3.07Å; A162-L165 CarbonylContact O-C 3.48Å; A162-S166 WeakPolarHBondContact O-CB 3.49Å; A162-S166 PolarHBondContact O-N 3.48Å
163	L	98.4	Very high	97.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-67.7	-42.5	176	-73.9	167.4	0	0	0	111.7	A70 I124 F128 A159 S160 L165 S166 I168 W170 K256	A70-L163 HydrophobicContact CB-CD2 3.7Å; A70-L163 HydrophobicContact CB-CG 4.13Å; I124-L163 HydrophobicContact CB-CD1 4.04Å; I124-L163 HydrophobicContact CD1-CD1 3.99Å; I124-L163 HydrophobicContact CG2-CD1 4.05Å; F128-L163 HydrophobicContact CZ-CD1 4.31Å; F128-L163 HydrophobicContact CZ-CD2 3.95Å; A159-L163 WeakPolarHBondContact O-CB 3.24Å; A159-L163 WeakPolarHBondContact O-CG 3.26Å; A159-L163 PolarHBondContact O-N 3.46Å; S160-L163 PolarHBondContact O-N 2.84Å; L163-L165 VanDerWaalsContact C-N 3.3Å; L163-L165 PolarHBondContact O-N 3.45Å; L163-S166 PolarHBondContact O-N 3.22Å; L163-S166 VanDerWaalsContact O-N 3.12Å; L163-S166 PolarHBondContact O-OG 2.78Å; L163-I168 HydrophobicContact CD2-CD1 4.23Å; L163-W170 HydrophobicContact CB-CD2 3.85Å; L163-W170 HydrophobicContact CB-CE3 3.6Å; L163-W170 HydrophobicContact CB-CG 4.31Å; L163-W170 HydrophobicContact CB-CZ3 3.97Å; L163-W170 HydrophobicContact CD1-CD2 4.08Å; L163-W170 HydrophobicContact CD1-CG 4.39Å; L163-W170 HydrophobicContact CD1-CZ2 4.24Å; L163-K256 PolarHBondContact O-NZ 3.5Å; L163-K256 VanDerWaalsContact O-NZ 3.07Å
164	A	97.1	Very high	97.3	Very high	7 Å²	7	11.3 Å²	11.3	6%	0.058	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-40	178.3	0	0	0	0	0	111.7	S160 A161 S166 W170 P173 I245 V249 K256	S160-A164 WeakPolarHBondContact O-CB 3.49Å; S160-A164 PolarHBondContact O-N 2.79Å; A161-A164 PolarHBondContact O-N 2.89Å; A164-S166 VanDerWaalsContact C-N 3.3Å; A164-S166 PolarHBondContact O-N 3.15Å; A164-W170 HydrophobicContact CB-CZ3 4.26Å; A164-P173 HydrophobicContact CB-CB 4.29Å; A164-I245 HydrophobicContact CB-CG2 3.74Å; A164-V249 HydrophobicContact CB-CG2 3.65Å; A164-K256 PolarHBondContact O-NZ 2.9Å
165	L	95.9	Very high	97.3	Very high	7 Å²	7	11.2 Å²	11.2	4%	0.037	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.9	176.2	-64.2	172.5	0	0	0	114	A161 A162 L163 L248 V249 Q252 I254	A161-L165 WeakPolarHBondContact O-CB 3.47Å; A161-L165 WeakPolarHBondContact O-CG 3.44Å; A161-L165 PolarHBondContact O-N 3.46Å; A162-L165 CarbonylContact O-C 3.48Å; L163-L165 VanDerWaalsContact C-N 3.3Å; L163-L165 PolarHBondContact O-N 3.45Å; L165-L248 HydrophobicContact CD2-CB 4.31Å; L165-V249 HydrophobicContact CD2-CG2 4.03Å; L165-Q252 HydrophobicContact CD2-CB 4.35Å; L165-Q252 HydrophobicContact CD2-CG 4.16Å; L165-I254 HydrophobicContact CB-CD1 4.13Å; L165-I254 HydrophobicContact CD2-CD1 4.19Å; L165-I254 WeakPolarHBondContact O-CD1 3.33Å
166	S	96.9	Very high	97.3	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	-92.2	167.6	171	73.9	0	0	0	0	110.9	D54 A162 L163 A164 I168 K256	D54-S166 VanDerWaalsContact O-CA 3.26Å; D54-S166 WeakPolarHBondContact O-CA 3.37Å; D54-S166 WeakPolarHBondContact O-CB 3.31Å; A162-S166 WeakPolarHBondContact O-CB 3.49Å; A162-S166 PolarHBondContact O-N 3.48Å; L163-S166 PolarHBondContact O-N 3.22Å; L163-S166 VanDerWaalsContact O-N 3.12Å; L163-S166 PolarHBondContact O-OG 2.78Å; A164-S166 VanDerWaalsContact C-N 3.3Å; A164-S166 PolarHBondContact O-N 3.15Å; S166-I168 WeakPolarHBondContact OG-CB 3.48Å; S166-I168 WeakPolarHBondContact OG-CG1 3.38Å; S166-I168 PolarHBondContact OG-N 2.8Å; S166-I168 VanDerWaalsContact OG-N 3.09Å; S166-K256 PolarHBondContact O-NZ 3.16Å
167	D	96	Very high	97.3	Very high	33 Å²	33	11.2 Å²	11.2	18%	0.176	6%	0.063	C	C	.	.	S	Bend	trans	-78.4	-4.5	165.5	67.3	-21.7	0	0	0	112.4	T255 K256 R257	D167-T255 WeakPolarHBondContact CB-O 3.16Å; D167-K256 CarbonylContact O-C 3.6Å; D167-K256 WeakPolarHBondContact O-CA 3.32Å; D167-R257 HydrophobicContact CB-CB 4.27Å; D167-R257 WeakPolarHBondContact O-CG 3.49Å; D167-R257 PolarHBondContact O-N 3.02Å; D167-R257 IonicContact OD1-CZ 2.72Å; D167-R257 VanDerWaalsContact OD1-CZ 3.28Å; D167-R257 IonicContact OD1-NE 3.69Å; D167-R257 PolarHBondContact OD1-NE 2.79Å; D167-R257 IonicContact OD1-NH2 2.92Å; D167-R257 PolarHBondContact OD1-NH2 3.41Å; D167-R257 IonicContact OD2-CZ 3.99Å; D167-R257 VanDerWaalsContact OD2-CZ 3.28Å; D167-R257 IonicContact OD2-NE 2.84Å; D167-R257 PolarHBondContact OD2-NE 3.35Å; D167-R257 IonicContact OD2-NH2 2.69Å; D167-R257 PolarHBondContact OD2-NH2 3.37Å
168	I	97.7	Very high	97.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.065	C	C	.	.	S	Bend	trans	-63.9	132.2	-178.7	-54.4	165.5	0	0	0	110.5	D54 A70 F128 Y132 L163 S166 W170 K256	D54-I168 HydrophobicContact CB-CD1 4.04Å; D54-I168 HydrophobicContact CB-CG1 4.17Å; A70-I168 HydrophobicContact CB-CD1 4.07Å; F128-I168 HydrophobicContact CE1-CG2 3.95Å; Y132-I168 HydrophobicContact CE1-CG2 4.15Å; L163-I168 HydrophobicContact CD2-CD1 4.23Å; S166-I168 WeakPolarHBondContact OG-CB 3.48Å; S166-I168 WeakPolarHBondContact OG-CG1 3.38Å; S166-I168 PolarHBondContact OG-N 2.8Å; S166-I168 VanDerWaalsContact OG-N 3.09Å; I168-W170 PolarHBondContact O-N 3.43Å; I168-K256 WeakPolarHBondContact O-CD 3.25Å; I168-K256 PolarHBondContact O-NZ 2.99Å
169	P	96.3	Very high	97.2	Very high	19 Å²	19	11.9 Å²	11.9	12%	0.123	7%	0.065	C	C	.	.			trans	-65	115.7	174.2	-19.5	33.3	0	0	0	111	P129 Y132 R257 P259	P129-P169 VanDerWaalsContact CD-O 3.31Å; P129-P169 WeakPolarHBondContact CD-O 3.43Å; P129-P169 HydrophobicContact CG-CB 3.88Å; Y132-P169 HydrophobicContact CD2-CG 4.27Å; Y132-P169 HydrophobicContact CE2-CB 4.49Å; Y132-P169 HydrophobicContact CE2-CG 3.81Å; P169-R257 HydrophobicContact CG-CG 4.32Å; P169-P259 HydrophobicContact CG-CG 3.79Å
170	W	97.1	Very high	97.2	Very high	17 Å²	17	11.9 Å²	11.9	6%	0.064	7%	0.065	C	C	.	.			trans	-157.3	128.6	-178.6	-177.4	72	0	0	0	110.1	I124 L127 F128 L163 A164 I168 G172 P173 I174	I124-W170 HydrophobicContact CB-CZ2 4.27Å; I124-W170 HydrophobicContact CG2-CZ2 4.1Å; I124-W170 PolarHBondContact O-NE1 3.34Å; L127-W170 HydrophobicContact CB-CZ2 4.33Å; L127-W170 HydrophobicContact CD1-CH2 4.47Å; L127-W170 HydrophobicContact CD1-CZ2 3.67Å; F128-W170 AromaticContact CD2-CD1 3.73Å; F128-W170 AromaticContact CE2-CD1 3.69Å; F128-W170 AromaticContact CE2-NE1 3.98Å; F128-W170 AromaticContact CG-CD1 3.97Å; F128-W170 AromaticContact CZ-CD1 3.9Å; L163-W170 HydrophobicContact CB-CD2 3.85Å; L163-W170 HydrophobicContact CB-CE3 3.6Å; L163-W170 HydrophobicContact CB-CG 4.31Å; L163-W170 HydrophobicContact CB-CZ3 3.97Å; L163-W170 HydrophobicContact CD1-CD2 4.08Å; L163-W170 HydrophobicContact CD1-CG 4.39Å; L163-W170 HydrophobicContact CD1-CZ2 4.24Å; A164-W170 HydrophobicContact CB-CZ3 4.26Å; I168-W170 PolarHBondContact O-N 3.43Å; W170-G172 VanDerWaalsContact C-N 3.28Å; W170-G172 PolarHBondContact O-N 3.25Å; W170-P173 HydrophobicContact CZ3-CB 4.33Å; W170-I174 HydrophobicContact CH2-CG1 4.09Å; W170-I174 HydrophobicContact CH2-CG2 4.31Å; W170-I174 HydrophobicContact CZ2-CG1 4.38Å; W170-I174 HydrophobicContact CZ2-CG2 4.22Å
171	H	94	Very high	97.1	Very high	118 Å²	118	12.8 Å²	12.8	55%	0.546	7%	0.07	S	C	.	.			trans	-88.9	38.4	-171.3	-61.5	-67	0	0	0	113.7	L127	L127-H171 WeakPolarHBondContact O-CB 3.49Å; L127-H171 PolarHBondContact O-CD2 3.37Å; L127-H171 PolarHBondContact O-N 2.96Å
172	G	93.3	Very high	97	Very high	24 Å²	24	13.9 Å²	13.9	25%	0.247	8%	0.077	C	C	.	.			trans	-90.3	-153.2	170.9	0	0	0	0	0	113.3	W170	W170-G172 VanDerWaalsContact C-N 3.28Å; W170-G172 PolarHBondContact O-N 3.25Å
173	P	96.9	Very high	96.7	Very high	10 Å²	10	21.9 Å²	21.9	7%	0.065	12%	0.119	C	C	.	.			cis	-81	160.2	3.9	31.8	-32.1	0	0	0	113.4	A164 W170 P208 I242 I245 Q246	A164-P173 HydrophobicContact CB-CB 4.29Å; W170-P173 HydrophobicContact CZ3-CB 4.33Å; P173-P208 WeakPolarHBondContact O-CD 3.14Å; P173-I242 HydrophobicContact CG-CG2 4.17Å; P173-I245 HydrophobicContact CB-CB 3.95Å; P173-I245 HydrophobicContact CB-CD1 4.33Å; P173-I245 HydrophobicContact CB-CG2 3.5Å; P173-I245 VanDerWaalsContact CB-CG2 3.5Å; P173-I245 HydrophobicContact CG-CB 4.05Å; P173-I245 HydrophobicContact CG-CG2 3.87Å; P173-Q246 HydrophobicContact CG-CG 3.67Å
174	I	98.3	Very high	96.4	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.			trans	-101.8	159.3	167.7	63.3	177.7	0	0	0	110.7	S123 I124 L127 I156 S160 W170 V205 G206 V213	S123-I174 WeakPolarHBondContact O-CD1 3.33Å; I124-I174 HydrophobicContact CG2-CD1 3.81Å; L127-I174 HydrophobicContact CD1-CG2 3.19Å; I156-I174 HydrophobicContact CG2-CD1 3.84Å; S160-I174 VanDerWaalsContact CB-CG1 3.46Å; S160-I174 WeakPolarHBondContact CB-O 3.31Å; S160-I174 WeakPolarHBondContact OG-CG1 3.5Å; S160-I174 PolarHBondContact OG-N 3.04Å; S160-I174 PolarHBondContact OG-O 3.32Å; W170-I174 HydrophobicContact CH2-CG1 4.09Å; W170-I174 HydrophobicContact CH2-CG2 4.31Å; W170-I174 HydrophobicContact CZ2-CG1 4.38Å; W170-I174 HydrophobicContact CZ2-CG2 4.22Å; I174-V205 HydrophobicContact CB-CG1 3.84Å; I174-V205 HydrophobicContact CD1-CG1 3.73Å; I174-V205 HydrophobicContact CG1-CG1 4.2Å; I174-V205 HydrophobicContact CG2-CG1 4.27Å; I174-G206 CarbonylContact C-O 3.45Å; I174-G206 WeakPolarHBondContact CA-O 3.32Å; I174-G206 VanDerWaalsContact CB-O 3.31Å; I174-G206 WeakPolarHBondContact CB-O 3.1Å; I174-V213 HydrophobicContact CG2-CG2 4.43Å
175	G	98.2	Very high	96.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.7	167.4	0	0	0	0	0	109.8	V205 G206 T238 I242	G175-V205 CarbonylContact O-C 3.49Å; G175-V205 WeakPolarHBondContact O-CA 3.45Å; G175-G206 PolarHBondContact N-O 3.33Å; G175-G206 PolarHBondContact O-N 2.84Å; G175-T238 VanDerWaalsContact O-CB 3.32Å; G175-T238 WeakPolarHBondContact O-CB 3.18Å; G175-T238 WeakPolarHBondContact O-CG2 3.44Å; G175-I242 VanDerWaalsContact N-CG1 3.33Å
176	A	98.3	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.1	-178.8	0	0	0	0	0	110.9	V153 I156 N157 V204 V205 I241	V153-A176 HydrophobicContact CG1-CB 4.34Å; V153-A176 VanDerWaalsContact CG1-O 3.25Å; V153-A176 WeakPolarHBondContact CG1-O 3.33Å; I156-A176 HydrophobicContact CB-CB 3.77Å; I156-A176 HydrophobicContact CD1-CB 4.05Å; I156-A176 HydrophobicContact CG2-CB 3.56Å; N157-A176 PolarHBondContact ND2-O 3.44Å; N157-A176 PolarHBondContact OD1-N 2.83Å; A176-V204 WeakPolarHBondContact CA-O 3.29Å; A176-V205 HydrophobicContact CB-CG2 3.79Å; A176-I241 WeakPolarHBondContact O-CD1 3.16Å
177	V	97.9	Very high	96.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.7	170.7	-62.4	0	0	0	0	110.3	V179 V188 N189 I203 V204 G234 H237 T238 I241	V177-V179 HydrophobicContact CG2-CG2 4.27Å; V177-V188 HydrophobicContact CB-CG1 4.07Å; V177-V188 HydrophobicContact CG1-CG1 4.13Å; V177-N189 WeakPolarHBondContact CA-OD1 3.44Å; V177-I203 WeakPolarHBondContact O-CA 3.49Å; V177-V204 PolarHBondContact N-O 2.74Å; V177-V204 VanDerWaalsContact N-O 3.11Å; V177-V204 PolarHBondContact O-N 2.65Å; V177-G234 WeakPolarHBondContact CG2-O 3.08Å; V177-H237 HydrophobicContact CG1-CB 4.01Å; V177-H237 HydrophobicContact CG2-CB 4.4Å; V177-T238 HydrophobicContact CG1-CG2 4.41Å; V177-T238 HydrophobicContact CG2-CG2 3.93Å; V177-I241 HydrophobicContact CG1-CD1 3.81Å
178	R	98.1	Very high	96.2	Very high	14 Å²	14	35 Å²	35	5%	0.053	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.5	163.7	174.5	174.1	-82.7	134.4	-4.7	109	D150 D152 V153 V188 N189 P190 M195 N201 L202 I203	D150-R178 IonicContact OD2-CZ 2.78Å; D150-R178 IonicContact OD2-NH1 3.4Å; D150-R178 PolarHBondContact OD2-NH1 2.78Å; D150-R178 IonicContact OD2-NH2 3.85Å; D152-R178 IonicContact OD1-CZ 3.51Å; D152-R178 IonicContact OD1-NH1 2.74Å; D152-R178 PolarHBondContact OD1-NH1 3.32Å; D152-R178 IonicContact OD1-NH2 2.82Å; D152-R178 IonicContact OD2-CZ 3.32Å; D152-R178 IonicContact OD2-NH1 3.48Å; D152-R178 PolarHBondContact OD2-NH1 3.48Å; D152-R178 IonicContact OD2-NH2 3.58Å; D152-R178 PolarHBondContact OD2-NH2 3.15Å; V153-R178 HydrophobicContact CG2-CB 3.8Å; R178-V188 CarbonylContact O-C 3.55Å; R178-N189 PolarHBondContact N-OD1 3Å; R178-N189 WeakPolarHBondContact O-CA 3.44Å; R178-N189 PolarHBondContact O-N 3.47Å; R178-P190 HydrophobicContact CG-CG 4.09Å; R178-M195 HydrophobicContact CG-SD 4.41Å; R178-N201 PolarHBondContact NE-OD1 2.88Å; R178-L202 CarbonylContact C-O 3.53Å; R178-L202 VanDerWaalsContact CA-O 3.27Å; R178-L202 WeakPolarHBondContact CA-O 3.47Å; R178-I203 HydrophobicContact CB-CG1 4.44Å
179	V	98.1	Very high	96.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.7	174.8	-174.9	0	0	0	0	108	V177 L186 L187 L200 L202 A230	V177-V179 HydrophobicContact CG2-CG2 4.27Å; V179-L186 HydrophobicContact CG1-CB 4.42Å; V179-L186 HydrophobicContact CG1-CD2 3.85Å; V179-L187 CarbonylContact C-O 3.56Å; V179-L187 WeakPolarHBondContact CA-O 3.24Å; V179-L200 HydrophobicContact CG1-CD2 4.45Å; V179-L202 HydrophobicContact CB-CB 4.32Å; V179-L202 HydrophobicContact CB-CD2 4.31Å; V179-L202 HydrophobicContact CB-CG 4.5Å; V179-L202 PolarHBondContact N-O 3.23Å; V179-L202 PolarHBondContact O-N 3.1Å; V179-A230 HydrophobicContact CG1-CB 4.12Å
180	G	97.5	Very high	96.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	168.1	171.7	0	0	0	0	0	111.5	L186 L187 S198 L200	G180-L186 WeakPolarHBondContact O-CA 3.49Å; G180-L187 PolarHBondContact N-O 3.34Å; G180-L187 PolarHBondContact O-N 2.89Å; G180-S198 WeakPolarHBondContact CA-OG 3.2Å; G180-L200 WeakPolarHBondContact CA-O 3.29Å
181	M	96.9	Very high	95.9	Very high	19 Å²	19	34.9 Å²	34.9	9%	0.094	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	110.1	175.4	-177.6	73.3	88.4	0	0	108.3	E185 L186 S198 S199 L200 D226	M181-E185 WeakPolarHBondContact CA-O 3.47Å; M181-L186 HydrophobicContact CB-CD2 4.33Å; M181-L186 HydrophobicContact CE-CD2 3.35Å; M181-L186 HydrophobicContact CE-CG 3.79Å; M181-L186 HydrophobicContact SD-CD2 3.75Å; M181-L186 HydrophobicContact SD-CG 4.03Å; M181-S198 PolarHBondContact N-OG 3.14Å; M181-S198 CarbonylContact O-C 3.54Å; M181-S198 VanDerWaalsContact O-CA 3.25Å; M181-S198 WeakPolarHBondContact O-CA 3.4Å; M181-S198 PolarHBondContact O-OG 2.88Å; M181-S199 PolarHBondContact O-N 2.74Å; M181-L200 HydrophobicContact CB-CB 3.81Å; M181-D226 HydrophobicContact CE-CB 4.32Å
182	V	95.6	Very high	95.8	Very high	24 Å²	24	33.5 Å²	33.5	15%	0.145	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.3	-180	-179.4	0	0	0	0	107.5	G184 E185 L187 E194	V182-G184 PolarHBondContact O-N 3.23Å; V182-E185 PolarHBondContact N-O 3.23Å; V182-E185 PolarHBondContact O-N 3.48Å; V182-L187 HydrophobicContact CB-CD1 4.02Å; V182-L187 HydrophobicContact CG2-CD1 3.87Å; V182-E194 HydrophobicContact CG2-CB 4.41Å
183	D	92.2	Very high	95.7	Very high	167 Å²	167	35.8 Å²	35.8	89%	0.893	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	29.6	-179.3	-58.5	-34.6	0	0	0	114.9	E185	D183-E185 VanDerWaalsContact C-N 3.33Å
184	G	91.3	Very high	95.6	Very high	65 Å²	65	38.4 Å²	38.4	67%	0.67	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.1	1.2	-178.9	0	0	0	0	0	114.9	V182	V182-G184 PolarHBondContact O-N 3.23Å
185	E	95	Very high	95.4	Very high	141 Å²	141	40.2 Å²	40.2	66%	0.659	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.7	177.2	-61.6	-166.5	167	0	0	112.4	M181 V182 D183	M181-E185 WeakPolarHBondContact CA-O 3.47Å; V182-E185 PolarHBondContact N-O 3.23Å; V182-E185 PolarHBondContact O-N 3.48Å; D183-E185 VanDerWaalsContact C-N 3.33Å
186	L	96.3	Very high	95.1	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.209	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.3	177.2	-70.9	175.2	0	0	0	110.9	V179 G180 M181 L200 H229 A230 V233	V179-L186 HydrophobicContact CG1-CB 4.42Å; V179-L186 HydrophobicContact CG1-CD2 3.85Å; G180-L186 WeakPolarHBondContact O-CA 3.49Å; M181-L186 HydrophobicContact CB-CD2 4.33Å; M181-L186 HydrophobicContact CE-CD2 3.35Å; M181-L186 HydrophobicContact CE-CG 3.79Å; M181-L186 HydrophobicContact SD-CD2 3.75Å; M181-L186 HydrophobicContact SD-CG 4.03Å; L186-L200 HydrophobicContact CD2-CD2 4.36Å; L186-H229 WeakPolarHBondContact CD1-CD2 3.4Å; L186-A230 HydrophobicContact CD1-CB 4.23Å; L186-A230 HydrophobicContact CD2-CB 3.7Å; L186-V233 HydrophobicContact CD1-CB 4.21Å; L186-V233 HydrophobicContact CD1-CG2 3.81Å
187	L	95.9	Very high	94.8	Very high	51 Å²	51	48.7 Å²	48.7	27%	0.267	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.6	177.1	-59	-178.5	0	0	0	110.5	V179 G180 V182 P190 E194	V179-L187 CarbonylContact C-O 3.56Å; V179-L187 WeakPolarHBondContact CA-O 3.24Å; G180-L187 PolarHBondContact N-O 3.34Å; G180-L187 PolarHBondContact O-N 2.89Å; V182-L187 HydrophobicContact CB-CD1 4.02Å; V182-L187 HydrophobicContact CG2-CD1 3.87Å; L187-P190 HydrophobicContact CB-CB 4.19Å; L187-E194 HydrophobicContact CD1-CB 4.22Å; L187-E194 HydrophobicContact CD1-CG 3.98Å
188	V	96.2	Very high	94.8	Very high	25 Å²	25	49.5 Å²	49.5	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.6	176.3	-179.2	0	0	0	0	109.9	V177 R178 V233 H237	V177-V188 HydrophobicContact CB-CG1 4.07Å; V177-V188 HydrophobicContact CG1-CG1 4.13Å; R178-V188 CarbonylContact O-C 3.55Å; V188-V233 HydrophobicContact CG2-CG1 4.16Å; V188-H237 HydrophobicContact CG1-CB 4.18Å
189	N	95.7	Very high	94.7	Very high	11 Å²	11	51 Å²	51	6%	0.059	31%	0.31	C	S	.	.	S	Bend	trans	46.1	54.3	-170.6	-64.8	-24	0	0	0	112.3	L37 K40 L61 V177 R178	L37-N189 WeakPolarHBondContact CD1-ND2 3.49Å; K40-N189 PolarHBondContact NZ-O 3.35Å; L61-N189 HydrophobicContact CD2-CB 4.39Å; V177-N189 WeakPolarHBondContact CA-OD1 3.44Å; R178-N189 PolarHBondContact N-OD1 3Å; R178-N189 WeakPolarHBondContact O-CA 3.44Å; R178-N189 PolarHBondContact O-N 3.47Å
190	P	95.3	Very high	94.7	Very high	5 Å²	5	51.2 Å²	51.2	3%	0.032	31%	0.311	C	S	.	.			trans	-54.5	146.9	-178.5	25	-37.3	0	0	0	112.3	R178 L187 E194 M195	R178-P190 HydrophobicContact CG-CG 4.09Å; L187-P190 HydrophobicContact CB-CB 4.19Å; P190-E194 WeakPolarHBondContact CA-OE2 3.39Å; P190-E194 HydrophobicContact CB-CB 3.88Å; P190-M195 HydrophobicContact CB-CG 3.98Å; P190-M195 HydrophobicContact CB-SD 3.92Å; P190-M195 HydrophobicContact CG-CG 3.68Å; P190-M195 HydrophobicContact CG-SD 3.18Å; P190-M195 WeakPolarHBondContact CG-SD 3.33Å
191	T	93.7	Very high	94.7	Very high	19 Å²	19	53.4 Å²	53.4	12%	0.117	32%	0.323	C	S	.	.			trans	-66	164	174.2	66.5	0	0	0	0	111	K40 V148 A193 E194 M195	K40-T191 VanDerWaalsContact NZ-CG2 3.31Å; V148-T191 HydrophobicContact CG1-CG2 3.62Å; V148-T191 CarbonylContact O-C 3.6Å; V148-T191 WeakPolarHBondContact O-CA 3.08Å; T191-A193 PolarHBondContact O-N 3.33Å; T191-E194 WeakPolarHBondContact CG2-OE1 3.02Å; T191-E194 PolarHBondContact N-OE2 2.84Å; T191-E194 PolarHBondContact O-N 3.06Å; T191-E194 WeakPolarHBondContact OG1-CG 3.25Å; T191-E194 PolarHBondContact OG1-N 3.29Å; T191-E194 PolarHBondContact OG1-OE1 3.45Å; T191-E194 PolarHBondContact OG1-OE2 3.34Å; T191-M195 WeakPolarHBondContact O-CB 3.18Å; T191-M195 WeakPolarHBondContact O-CG 3.35Å; T191-M195 PolarHBondContact O-N 2.71Å
192	R	90.6	Very high	94.8	Very high	88 Å²	88	52.5 Å²	52.5	33%	0.332	32%	0.318	S	S	.	.	H	α-helix	trans	-55.4	-36.3	173.8	179.8	-177.2	161.7	173.2	0.7	112.7	G147 V148 A196 T399 A400	G147-R192 WeakPolarHBondContact O-CD 3.4Å; V148-R192 PolarHBondContact O-N 3.23Å; R192-A196 PolarHBondContact O-N 2.99Å; R192-T399 PolarHBondContact NH1-O 3.13Å; R192-T399 PolarHBondContact NH2-O 3.16Å; R192-T399 VanDerWaalsContact NH2-O 3.09Å; R192-A400 PolarHBondContact NH1-O 3.37Å; R192-A400 VanDerWaalsContact NH1-O 3.09Å
193	A	91.9	Very high	94.9	Very high	73 Å²	73	51.7 Å²	51.7	60%	0.603	31%	0.314	S	S	*	.	H	α-helix	trans	-70.8	-44.8	178.5	0	0	0	0	0	111.6	T191 M195 A196	T191-A193 PolarHBondContact O-N 3.33Å; A193-M195 VanDerWaalsContact C-N 3.34Å; A193-M195 PolarHBondContact O-N 2.81Å; A193-A196 WeakPolarHBondContact O-CB 3.41Å; A193-A196 PolarHBondContact O-N 3.43Å
194	E	94.7	Very high	95.2	Very high	64 Å²	64	43.8 Å²	43.8	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-43.8	173.2	-73.8	146.6	-138.4	0	0	111.2	V182 L187 P190 T191 A196 S197 S198	V182-E194 HydrophobicContact CG2-CB 4.41Å; L187-E194 HydrophobicContact CD1-CB 4.22Å; L187-E194 HydrophobicContact CD1-CG 3.98Å; P190-E194 WeakPolarHBondContact CA-OE2 3.39Å; P190-E194 HydrophobicContact CB-CB 3.88Å; T191-E194 WeakPolarHBondContact CG2-OE1 3.02Å; T191-E194 PolarHBondContact N-OE2 2.84Å; T191-E194 PolarHBondContact O-N 3.06Å; T191-E194 WeakPolarHBondContact OG1-CG 3.25Å; T191-E194 PolarHBondContact OG1-N 3.29Å; T191-E194 PolarHBondContact OG1-OE1 3.45Å; T191-E194 PolarHBondContact OG1-OE2 3.34Å; E194-A196 PolarHBondContact O-N 2.79Å; E194-S197 CarbonylContact O-C 3.56Å; E194-S197 PolarHBondContact O-N 3.48Å; E194-S198 PolarHBondContact O-N 3.17Å
195	M	93.8	Very high	95.5	Very high	38 Å²	38	40.7 Å²	40.7	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-29.9	178.3	-79.9	-53.9	-53.5	0	0	113.7	R178 P190 T191 A193 S197 S198 N201	R178-M195 HydrophobicContact CG-SD 4.41Å; P190-M195 HydrophobicContact CB-CG 3.98Å; P190-M195 HydrophobicContact CB-SD 3.92Å; P190-M195 HydrophobicContact CG-CG 3.68Å; P190-M195 HydrophobicContact CG-SD 3.18Å; P190-M195 WeakPolarHBondContact CG-SD 3.33Å; T191-M195 WeakPolarHBondContact O-CB 3.18Å; T191-M195 WeakPolarHBondContact O-CG 3.35Å; T191-M195 PolarHBondContact O-N 2.71Å; A193-M195 VanDerWaalsContact C-N 3.34Å; A193-M195 PolarHBondContact O-N 2.81Å; M195-S197 PolarHBondContact O-N 3.25Å; M195-S198 PolarHBondContact O-N 2.89Å; M195-N201 HydrophobicContact CE-CB 3.42Å; M195-N201 VanDerWaalsContact CE-CB 3.42Å; M195-N201 VanDerWaalsContact CE-CG 3.43Å
196	A	91.3	Very high	95.6	Very high	86 Å²	86	34 Å²	34	71%	0.711	21%	0.208	S	C	*	.	H	α-helix	trans	-67.7	-23.8	176.2	0	0	0	0	0	112.9	R192 A193 E194	R192-A196 PolarHBondContact O-N 2.99Å; A193-A196 WeakPolarHBondContact O-CB 3.41Å; A193-A196 PolarHBondContact O-N 3.43Å; E194-A196 PolarHBondContact O-N 2.79Å
197	S	93.3	Very high	95.6	Very high	93 Å²	93	32.2 Å²	32.2	65%	0.65	20%	0.199	S	C	*	.	H	α-helix	trans	-104.3	-3.5	177.6	-51.4	0	0	0	0	112.7	E194 M195	E194-S197 CarbonylContact O-C 3.56Å; E194-S197 PolarHBondContact O-N 3.48Å; M195-S197 PolarHBondContact O-N 3.25Å
198	S	96.6	Very high	95.5	Very high	17 Å²	17	31.8 Å²	31.8	12%	0.119	20%	0.199	C	C	.	.			trans	-77.4	135.7	-174.5	-176.9	0	0	0	0	112.2	G180 M181 E194 M195 L200	G180-S198 WeakPolarHBondContact CA-OG 3.2Å; M181-S198 PolarHBondContact N-OG 3.14Å; M181-S198 CarbonylContact O-C 3.54Å; M181-S198 VanDerWaalsContact O-CA 3.25Å; M181-S198 WeakPolarHBondContact O-CA 3.4Å; M181-S198 PolarHBondContact O-OG 2.88Å; E194-S198 PolarHBondContact O-N 3.17Å; M195-S198 PolarHBondContact O-N 2.89Å; S198-L200 PolarHBondContact O-N 2.72Å; S198-L200 PolarHBondContact OG-N 3.02Å; S198-L200 VanDerWaalsContact OG-N 3.16Å; S198-L200 PolarHBondContact OG-O 2.93Å
199	S	96.8	Very high	95.3	Very high	46 Å²	46	35.3 Å²	35.3	32%	0.322	23%	0.225	S	C	.	.	S	Bend	trans	-81.2	-4.9	170.7	68.6	0	0	0	0	113.1	M181 A219 E220	M181-S199 PolarHBondContact O-N 2.74Å; S199-A219 CarbonylContact O-C 3.54Å; S199-A219 VanDerWaalsContact O-CA 3.31Å; S199-A219 WeakPolarHBondContact O-CA 3.44Å; S199-E220 PolarHBondContact O-N 3.28Å
200	L	98.1	Very high	95.1	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135.5	-178.5	-178.7	60.9	0	0	0	111.4	V179 G180 M181 L186 S198 L202 A219 M222 F227 A230	V179-L200 HydrophobicContact CG1-CD2 4.45Å; G180-L200 WeakPolarHBondContact CA-O 3.29Å; M181-L200 HydrophobicContact CB-CB 3.81Å; L186-L200 HydrophobicContact CD2-CD2 4.36Å; S198-L200 PolarHBondContact O-N 2.72Å; S198-L200 PolarHBondContact OG-N 3.02Å; S198-L200 VanDerWaalsContact OG-N 3.16Å; S198-L200 PolarHBondContact OG-O 2.93Å; L200-L202 HydrophobicContact CD1-CB 3.82Å; L200-L202 HydrophobicContact CD2-CB 3.96Å; L200-L202 HydrophobicContact CD2-CD2 4.32Å; L200-L202 HydrophobicContact CG-CB 3.8Å; L200-A219 HydrophobicContact CD1-CB 3.84Å; L200-M222 HydrophobicContact CB-CE 4.35Å; L200-M222 HydrophobicContact CB-SD 4.22Å; L200-M222 HydrophobicContact CD1-CE 3.44Å; L200-M222 VanDerWaalsContact CD1-CE 3.44Å; L200-M222 HydrophobicContact CD1-SD 4.37Å; L200-M222 HydrophobicContact CD2-CE 3.77Å; L200-M222 HydrophobicContact CD2-SD 4.2Å; L200-M222 HydrophobicContact CG-CE 4.03Å; L200-M222 HydrophobicContact CG-SD 4.49Å; L200-F227 HydrophobicContact CD1-CD2 4.31Å; L200-F227 HydrophobicContact CD1-CE2 4.11Å; L200-A230 HydrophobicContact CD2-CB 3.47Å; L200-A230 VanDerWaalsContact CD2-CB 3.47Å
201	N	97.8	Very high	95.1	Very high	46 Å²	46	38.7 Å²	38.7	25%	0.246	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	96.1	162.4	-173.2	-9.7	0	0	0	107.2	R178 M195 A217 S218	R178-N201 PolarHBondContact NE-OD1 2.88Å; M195-N201 HydrophobicContact CE-CB 3.42Å; M195-N201 VanDerWaalsContact CE-CB 3.42Å; M195-N201 VanDerWaalsContact CE-CG 3.43Å; N201-A217 CarbonylContact O-C 3.56Å; N201-A217 WeakPolarHBondContact O-CA 3.4Å; N201-S218 WeakPolarHBondContact CB-OG 3.49Å; N201-S218 PolarHBondContact N-O 3.42Å; N201-S218 PolarHBondContact O-N 2.81Å
202	L	98.3	Very high	95.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.5	-177.2	167.6	65.5	0	0	0	109.3	R178 V179 L200 V204 I215 A217 F227 A230 V231	R178-L202 CarbonylContact C-O 3.53Å; R178-L202 VanDerWaalsContact CA-O 3.27Å; R178-L202 WeakPolarHBondContact CA-O 3.47Å; V179-L202 HydrophobicContact CB-CB 4.32Å; V179-L202 HydrophobicContact CB-CD2 4.31Å; V179-L202 HydrophobicContact CB-CG 4.5Å; V179-L202 PolarHBondContact N-O 3.23Å; V179-L202 PolarHBondContact O-N 3.1Å; L200-L202 HydrophobicContact CD1-CB 3.82Å; L200-L202 HydrophobicContact CD2-CB 3.96Å; L200-L202 HydrophobicContact CD2-CD2 4.32Å; L200-L202 HydrophobicContact CG-CB 3.8Å; L202-V204 HydrophobicContact CD1-CG2 3.79Å; L202-V204 HydrophobicContact CD2-CG2 3.88Å; L202-V204 HydrophobicContact CG-CG2 3.66Å; L202-I215 HydrophobicContact CD1-CG2 3.44Å; L202-I215 VanDerWaalsContact CD1-CG2 3.44Å; L202-A217 HydrophobicContact CB-CB 4.31Å; L202-A217 HydrophobicContact CD1-CB 3.69Å; L202-F227 HydrophobicContact CD1-CZ 4.14Å; L202-A230 HydrophobicContact CD2-CB 3.7Å; L202-V231 HydrophobicContact CD1-CG2 4.35Å; L202-V231 HydrophobicContact CD2-CG2 3.83Å
203	I	98.5	Very high	95.5	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124	168.6	-57.1	175.3	0	0	0	107.9	L119 I156 V177 R178 M214 I215 E216	L119-I203 HydrophobicContact CD2-CD1 3.54Å; L119-I203 HydrophobicContact CD2-CG2 4.44Å; I156-I203 HydrophobicContact CD1-CG2 4.19Å; V177-I203 WeakPolarHBondContact O-CA 3.49Å; R178-I203 HydrophobicContact CB-CG1 4.44Å; I203-M214 HydrophobicContact CG2-CE 4.39Å; I203-I215 WeakPolarHBondContact O-CA 3.45Å; I203-E216 PolarHBondContact N-O 3.07Å; I203-E216 PolarHBondContact O-N 2.98Å
204	V	97.9	Very high	95.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.1	176.2	-176.5	0	0	0	0	109.1	A176 V177 L202 V235	A176-V204 WeakPolarHBondContact CA-O 3.29Å; V177-V204 PolarHBondContact N-O 2.74Å; V177-V204 VanDerWaalsContact N-O 3.11Å; V177-V204 PolarHBondContact O-N 2.65Å; L202-V204 HydrophobicContact CD1-CG2 3.79Å; L202-V204 HydrophobicContact CD2-CG2 3.88Å; L202-V204 HydrophobicContact CG-CG2 3.66Å; V204-V235 HydrophobicContact CG1-CG2 3.68Å
205	V	98.4	Very high	95.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.1	171.8	179.2	0	0	0	0	109.3	I156 I174 G175 A176 V213 M214	I156-V205 HydrophobicContact CD1-CG2 4.32Å; I156-V205 HydrophobicContact CG2-CG2 4.17Å; I174-V205 HydrophobicContact CB-CG1 3.84Å; I174-V205 HydrophobicContact CD1-CG1 3.73Å; I174-V205 HydrophobicContact CG1-CG1 4.2Å; I174-V205 HydrophobicContact CG2-CG1 4.27Å; G175-V205 CarbonylContact O-C 3.49Å; G175-V205 WeakPolarHBondContact O-CA 3.45Å; A176-V205 HydrophobicContact CB-CG2 3.79Å; V205-V213 HydrophobicContact CG1-CB 4.36Å; V205-V213 PolarHBondContact O-N 2.87Å; V205-M214 HydrophobicContact CB-CB 4.19Å; V205-M214 HydrophobicContact CB-CE 4.3Å; V205-M214 HydrophobicContact CG2-CE 3.44Å; V205-M214 VanDerWaalsContact CG2-CE 3.44Å; V205-M214 PolarHBondContact N-O 2.85Å; V205-M214 PolarHBondContact O-N 2.89Å
206	G	96.9	Very high	96.1	Very high	0 Å²	0	26 Å²	26	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	156.4	176	0	0	0	0	0	112.3	I174 G175 Q211	I174-G206 CarbonylContact C-O 3.45Å; I174-G206 WeakPolarHBondContact CA-O 3.32Å; I174-G206 VanDerWaalsContact CB-O 3.31Å; I174-G206 WeakPolarHBondContact CB-O 3.1Å; G175-G206 PolarHBondContact N-O 3.33Å; G175-G206 PolarHBondContact O-N 2.84Å; G206-Q211 CarbonylContact C-O 3.58Å; G206-Q211 WeakPolarHBondContact CA-O 3.4Å
207	A	95.6	Very high	96.4	Very high	4 Å²	4	22 Å²	22	3%	0.033	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	175.2	165	0	0	0	0	0	109.1	Q211 V213 Q239	A207-Q211 HydrophobicContact CB-CB 4.19Å; A207-Q211 PolarHBondContact N-O 3.32Å; A207-V213 HydrophobicContact CB-CG2 3.6Å; A207-Q239 PolarHBondContact O-NE2 3.48Å; A207-Q239 PolarHBondContact O-OE1 3.48Å
208	P	94.3	Very high	96.6	Very high	41 Å²	41	19.3 Å²	19.3	27%	0.266	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	158.8	179.2	-25.7	36.5	0	0	0	112.3	P173 S210 Q211 I242	P173-P208 WeakPolarHBondContact O-CD 3.14Å; P208-S210 PolarHBondContact O-N 2.89Å; P208-Q211 WeakPolarHBondContact O-CG 3.48Å; P208-Q211 PolarHBondContact O-N 3.13Å; P208-I242 HydrophobicContact CG-CG2 4.02Å
209	S	91	Very high	96.6	Very high	100 Å²	100	18.7 Å²	18.7	70%	0.699	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	33.2	-178.5	-51.7	0	0	0	0	113.5	Q211	S209-Q211 PolarHBondContact O-N 3.09Å; S209-Q211 VanDerWaalsContact O-N 3.14Å
210	S	92.9	Very high	96.6	Very high	54 Å²	54	21.5 Å²	21.5	38%	0.378	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	28.6	177.6	-57.6	0	0	0	0	114.5	P208	P208-S210 PolarHBondContact O-N 2.89Å
211	Q	94.1	Very high	96.5	Very high	32 Å²	32	23.5 Å²	23.5	15%	0.15	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	145.5	173.6	-59.6	-64.4	-47.8	0	0	110.2	G206 A207 P208 S209 L553 P554	G206-Q211 CarbonylContact C-O 3.58Å; G206-Q211 WeakPolarHBondContact CA-O 3.4Å; A207-Q211 HydrophobicContact CB-CB 4.19Å; A207-Q211 PolarHBondContact N-O 3.32Å; P208-Q211 WeakPolarHBondContact O-CG 3.48Å; P208-Q211 PolarHBondContact O-N 3.13Å; S209-Q211 PolarHBondContact O-N 3.09Å; S209-Q211 VanDerWaalsContact O-N 3.14Å; Q211-L553 CarbonylContact C-O 3.54Å; Q211-L553 WeakPolarHBondContact CA-O 3.43Å; Q211-L553 PolarHBondContact OE1-O 3.23Å; Q211-P554 VanDerWaalsContact OE1-CD 3.3Å
212	V	96.4	Very high	96.4	Very high	1 Å²	1	22 Å²	22	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.8	179	-179.9	0	0	0	0	109.8	I215 V235 G552 L553 L555 V558	V212-I215 HydrophobicContact CG1-CD1 3.81Å; V212-I215 HydrophobicContact CG1-CG1 3.67Å; V212-V235 HydrophobicContact CG2-CG2 3.66Å; V212-G552 CarbonylContact O-C 3.53Å; V212-G552 VanDerWaalsContact O-CA 3.31Å; V212-G552 WeakPolarHBondContact O-CA 3.32Å; V212-L553 PolarHBondContact N-O 3.01Å; V212-L553 PolarHBondContact O-N 2.93Å; V212-L555 HydrophobicContact CG2-CD1 4.15Å; V212-V558 HydrophobicContact CB-CG2 4.17Å; V212-V558 HydrophobicContact CG1-CG2 4.47Å; V212-V558 HydrophobicContact CG2-CG2 4.29Å
213	V	96.1	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-37.2	179.6	-179.4	0	0	0	0	111.5	S123 P126 I174 V205 A207 V548	S123-V213 WeakPolarHBondContact O-CG1 3.42Å; P126-V213 HydrophobicContact CG-CG1 4.15Å; I174-V213 HydrophobicContact CG2-CG2 4.43Å; V205-V213 HydrophobicContact CG1-CB 4.36Å; V205-V213 PolarHBondContact O-N 2.87Å; A207-V213 HydrophobicContact CB-CG2 3.6Å; V213-V548 WeakPolarHBondContact O-CB 3.45Å; V213-V548 VanDerWaalsContact O-CG2 3.23Å; V213-V548 WeakPolarHBondContact O-CG2 3.44Å
214	M	97.1	Very high	96.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	141.1	-177.3	-176.5	-78.6	-68	0	0	110.1	L119 R122 S123 I203 V205 E216	L119-M214 HydrophobicContact CD1-CE 3.22Å; L119-M214 HydrophobicContact CD1-SD 3.61Å; L119-M214 HydrophobicContact CG-CE 3.69Å; R122-M214 HydrophobicContact CB-CG 4.08Å; S123-M214 WeakPolarHBondContact OG-CE 3.44Å; I203-M214 HydrophobicContact CG2-CE 4.39Å; V205-M214 HydrophobicContact CB-CB 4.19Å; V205-M214 HydrophobicContact CB-CE 4.3Å; V205-M214 HydrophobicContact CG2-CE 3.44Å; V205-M214 VanDerWaalsContact CG2-CE 3.44Å; V205-M214 PolarHBondContact N-O 2.85Å; V205-M214 PolarHBondContact O-N 2.89Å; M214-E216 HydrophobicContact SD-CB 3.98Å
215	I	97.9	Very high	96.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	133.9	169	-61	173.7	0	0	0	108.7	L202 I203 V212 V231 L544 Q545 A546 V558	L202-I215 HydrophobicContact CD1-CG2 3.44Å; L202-I215 VanDerWaalsContact CD1-CG2 3.44Å; I203-I215 WeakPolarHBondContact O-CA 3.45Å; V212-I215 HydrophobicContact CG1-CD1 3.81Å; V212-I215 HydrophobicContact CG1-CG1 3.67Å; I215-V231 HydrophobicContact CD1-CG1 3.95Å; I215-V231 HydrophobicContact CD1-CG2 4.34Å; I215-L544 HydrophobicContact CB-CD2 4.4Å; I215-L544 HydrophobicContact CD1-CD2 4.48Å; I215-L544 HydrophobicContact CG2-CD2 3.73Å; I215-L544 HydrophobicContact CG2-CG 4.35Å; I215-Q545 CarbonylContact O-C 3.58Å; I215-Q545 WeakPolarHBondContact O-CA 3.29Å; I215-A546 HydrophobicContact CB-CB 4.02Å; I215-A546 PolarHBondContact N-O 3.23Å; I215-A546 PolarHBondContact O-N 3.07Å; I215-V558 HydrophobicContact CD1-CG1 3.88Å
216	E	98.1	Very high	96.2	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.065	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.3	168.4	-171.5	76.5	-145.5	0	0	108.5	L119 R122 I203 M214 K442 L544 Q545	L119-E216 HydrophobicContact CD1-CB 3.61Å; L119-E216 HydrophobicContact CD1-CG 4.07Å; R122-E216 IonicContact CZ-OE2 2.67Å; R122-E216 IonicContact NH1-OE2 3.73Å; R122-E216 IonicContact NH2-OE2 3.13Å; R122-E216 PolarHBondContact NH2-OE2 2.82Å; I203-E216 PolarHBondContact N-O 3.07Å; I203-E216 PolarHBondContact O-N 2.98Å; M214-E216 HydrophobicContact SD-CB 3.98Å; E216-K442 IonicContact OE1-NZ 2.83Å; E216-K442 PolarHBondContact OE1-NZ 2.97Å; E216-L544 CarbonylContact C-O 3.58Å; E216-L544 WeakPolarHBondContact CA-O 3.49Å; E216-Q545 PolarHBondContact OE1-NE2 3.35Å; E216-Q545 WeakPolarHBondContact OE2-CG 3.25Å; E216-Q545 PolarHBondContact OE2-NE2 2.91Å
217	A	97.9	Very high	96.3	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.4	-176.5	0	0	0	0	0	113.9	N201 L202 F227 A543 L544	N201-A217 CarbonylContact O-C 3.56Å; N201-A217 WeakPolarHBondContact O-CA 3.4Å; L202-A217 HydrophobicContact CB-CB 4.31Å; L202-A217 HydrophobicContact CD1-CB 3.69Å; A217-F227 HydrophobicContact CB-CE2 3.82Å; A217-F227 HydrophobicContact CB-CZ 3.59Å; A217-A543 VanDerWaalsContact O-CA 3.31Å; A217-A543 WeakPolarHBondContact O-CA 3.5Å; A217-L544 HydrophobicContact CB-CB 4.07Å; A217-L544 PolarHBondContact N-O 2.67Å; A217-L544 PolarHBondContact O-N 2.85Å
218	S	97.4	Very high	96.4	Very high	37 Å²	37	40 Å²	40	26%	0.259	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140	159.2	61.1	0	0	0	0	109	N201 T542	N201-S218 WeakPolarHBondContact CB-OG 3.49Å; N201-S218 PolarHBondContact N-O 3.42Å; N201-S218 PolarHBondContact O-N 2.81Å; S218-T542 CarbonylContact C-O 3.55Å; S218-T542 WeakPolarHBondContact CA-O 3.09Å
219	A	97.5	Very high	96.5	Very high	3 Å²	3	43.1 Å²	43.1	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.3	-177.1	0	0	0	0	0	111.2	S199 L200 N221 M222 P446 T542	S199-A219 CarbonylContact O-C 3.54Å; S199-A219 VanDerWaalsContact O-CA 3.31Å; S199-A219 WeakPolarHBondContact O-CA 3.44Å; L200-A219 HydrophobicContact CD1-CB 3.84Å; A219-N221 PolarHBondContact O-N 3.3Å; A219-M222 HydrophobicContact CB-CB 3.95Å; A219-M222 HydrophobicContact CB-CE 4.34Å; A219-P446 WeakPolarHBondContact O-CG 3.33Å; A219-T542 PolarHBondContact N-O 3.19Å; A219-T542 WeakPolarHBondContact O-CA 3.38Å
220	E	96.4	Very high	96.9	Very high	106 Å²	106	38.3 Å²	38.3	50%	0.495	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	66.1	177.5	-67.1	-60.6	140.9	0	0	110.6	S199 M222	S199-E220 PolarHBondContact O-N 3.28Å; E220-M222 VanDerWaalsContact C-N 3.33Å; E220-M222 PolarHBondContact O-N 3.35Å
221	N	96.2	Very high	97.1	Very high	45 Å²	45	35.8 Å²	35.8	24%	0.241	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.1	45.2	-180	-164	31.5	0	0	0	113.7	A219 T537 G540 I541 T542	A219-N221 PolarHBondContact O-N 3.3Å; N221-T537 VanDerWaalsContact CG-OG1 3.24Å; N221-T537 PolarHBondContact ND2-OG1 2.81Å; N221-T537 VanDerWaalsContact ND2-OG1 3.1Å; N221-T537 WeakPolarHBondContact OD1-CG2 3.44Å; N221-T537 PolarHBondContact OD1-OG1 3.28Å; N221-G540 VanDerWaalsContact OD1-CA 3.24Å; N221-G540 WeakPolarHBondContact OD1-CA 3.22Å; N221-G540 PolarHBondContact OD1-N 3.46Å; N221-G540 PolarHBondContact OD1-O 2.81Å; N221-I541 CarbonylContact C-O 3.54Å; N221-I541 VanDerWaalsContact CA-O 3.31Å; N221-I541 WeakPolarHBondContact CA-O 3.37Å; N221-I541 PolarHBondContact N-O 2.98Å; N221-T542 HydrophobicContact CB-CG2 4.34Å
222	M	96.6	Very high	97.3	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.069	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	148.1	-171.7	-171.2	170.9	61.2	0	0	112.6	L200 A219 E220 D226 F227 G540 I541	L200-M222 HydrophobicContact CB-CE 4.35Å; L200-M222 HydrophobicContact CB-SD 4.22Å; L200-M222 HydrophobicContact CD1-CE 3.44Å; L200-M222 VanDerWaalsContact CD1-CE 3.44Å; L200-M222 HydrophobicContact CD1-SD 4.37Å; L200-M222 HydrophobicContact CD2-CE 3.77Å; L200-M222 HydrophobicContact CD2-SD 4.2Å; L200-M222 HydrophobicContact CG-CE 4.03Å; L200-M222 HydrophobicContact CG-SD 4.49Å; A219-M222 HydrophobicContact CB-CB 3.95Å; A219-M222 HydrophobicContact CB-CE 4.34Å; E220-M222 VanDerWaalsContact C-N 3.33Å; E220-M222 PolarHBondContact O-N 3.35Å; M222-D226 HydrophobicContact CG-CB 4.01Å; M222-D226 HydrophobicContact SD-CB 4.09Å; M222-F227 HydrophobicContact CE-CB 3.56Å; M222-F227 HydrophobicContact CE-CD2 3.3Å; M222-F227 HydrophobicContact CE-CE2 4.25Å; M222-F227 HydrophobicContact CE-CG 3.78Å; M222-G540 CarbonylContact O-C 3.6Å; M222-G540 WeakPolarHBondContact O-CA 3.37Å; M222-I541 PolarHBondContact N-O 3.16Å; M222-I541 PolarHBondContact O-N 2.81Å
223	L	97.3	Very high	97.3	Very high	101 Å²	101	40.5 Å²	40.5	53%	0.529	20%	0.202	S	C	.	.			trans	-63.4	147.2	176.4	-63.2	176.5	0	0	0	111.4	Q225 D226 F227	L223-Q225 VanDerWaalsContact C-N 3.3Å; L223-Q225 PolarHBondContact O-N 3.37Å; L223-D226 PolarHBondContact O-N 2.8Å; L223-F227 PolarHBondContact O-N 3.2Å
224	Q	97.2	Very high	97.4	Very high	48 Å²	48	40.5 Å²	40.5	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-40.6	-178	-174.3	-170.7	-33.1	0	0	112.4	F227 C228 I541 I562 T566	Q224-F227 PolarHBondContact O-N 3.1Å; Q224-C228 WeakPolarHBondContact O-CB 3.09Å; Q224-C228 PolarHBondContact O-N 3.49Å; Q224-C228 PolarHBondContact O-SG 2.94Å; Q224-I541 HydrophobicContact CG-CD1 4.45Å; Q224-I562 HydrophobicContact CG-CG2 3.7Å; Q224-T566 PolarHBondContact OE1-OG1 3.4Å
225	Q	96.8	Very high	97.4	Very high	162 Å²	162	40.7 Å²	40.7	76%	0.757	20%	0.203	S	C	*	.	H	α-helix	trans	-63	-45.7	-178.4	-179.3	174.5	-13.5	0	0	111.8	L223 F227 C228 H229	L223-Q225 VanDerWaalsContact C-N 3.3Å; L223-Q225 PolarHBondContact O-N 3.37Å; Q225-F227 VanDerWaalsContact C-N 3.34Å; Q225-C228 PolarHBondContact O-N 2.83Å; Q225-H229 WeakPolarHBondContact O-CB 3.24Å; Q225-H229 PolarHBondContact O-N 2.84Å
226	D	97.3	Very high	97.3	Very high	63 Å²	63	47.5 Å²	47.5	34%	0.337	23%	0.233	S	C	.	.	H	α-helix	trans	-66.4	-39.9	179.2	-55.8	-26.5	0	0	0	110.7	M181 M222 L223 H229 A230	M181-D226 HydrophobicContact CE-CB 4.32Å; M222-D226 HydrophobicContact CG-CB 4.01Å; M222-D226 HydrophobicContact SD-CB 4.09Å; L223-D226 PolarHBondContact O-N 2.8Å; D226-H229 PolarHBondContact O-N 3.33Å; D226-A230 WeakPolarHBondContact O-CB 3.41Å; D226-A230 PolarHBondContact O-N 3.26Å
227	F	97.8	Very high	97.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-50.2	173.5	-163	-77.4	0	0	0	111.7	L200 L202 A217 M222 L223 Q224 Q225 H229 A230 V231 I541 L544 I562	L200-F227 HydrophobicContact CD1-CD2 4.31Å; L200-F227 HydrophobicContact CD1-CE2 4.11Å; L202-F227 HydrophobicContact CD1-CZ 4.14Å; A217-F227 HydrophobicContact CB-CE2 3.82Å; A217-F227 HydrophobicContact CB-CZ 3.59Å; M222-F227 HydrophobicContact CE-CB 3.56Å; M222-F227 HydrophobicContact CE-CD2 3.3Å; M222-F227 HydrophobicContact CE-CE2 4.25Å; M222-F227 HydrophobicContact CE-CG 3.78Å; L223-F227 PolarHBondContact O-N 3.2Å; Q224-F227 PolarHBondContact O-N 3.1Å; Q225-F227 VanDerWaalsContact C-N 3.34Å; F227-H229 VanDerWaalsContact C-N 3.28Å; F227-H229 PolarHBondContact O-N 3.27Å; F227-A230 WeakPolarHBondContact O-CB 3.45Å; F227-A230 PolarHBondContact O-N 2.86Å; F227-V231 HydrophobicContact CD1-CG2 4Å; F227-V231 HydrophobicContact CE1-CG2 3.74Å; F227-V231 WeakPolarHBondContact O-CG2 3.32Å; F227-V231 PolarHBondContact O-N 2.9Å; F227-I541 HydrophobicContact CB-CD1 3.93Å; F227-I541 HydrophobicContact CD1-CD1 4.21Å; F227-I541 HydrophobicContact CD2-CB 4.22Å; F227-I541 HydrophobicContact CD2-CD1 4.17Å; F227-I541 HydrophobicContact CD2-CG2 4.03Å; F227-I541 HydrophobicContact CE2-CG2 4.01Å; F227-I541 HydrophobicContact CG-CD1 3.83Å; F227-L544 HydrophobicContact CE1-CB 4.39Å; F227-L544 HydrophobicContact CE1-CD2 3.43Å; F227-L544 VanDerWaalsContact CE1-CD2 3.43Å; F227-L544 HydrophobicContact CZ-CB 3.77Å; F227-L544 HydrophobicContact CZ-CD2 3.62Å; F227-L544 HydrophobicContact CZ-CG 4.34Å; F227-I562 HydrophobicContact CD1-CD1 4.28Å; F227-I562 HydrophobicContact CE1-CD1 4.48Å
228	C	97.7	Very high	97.2	Very high	15 Å²	15	48.2 Å²	48.2	10%	0.101	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-37.9	177.7	-73.5	0	0	0	0	111.9	Q224 Q225 V231 K232 M559	Q224-C228 WeakPolarHBondContact O-CB 3.09Å; Q224-C228 PolarHBondContact O-N 3.49Å; Q224-C228 PolarHBondContact O-SG 2.94Å; Q225-C228 PolarHBondContact O-N 2.83Å; C228-V231 PolarHBondContact O-N 2.91Å; C228-K232 WeakPolarHBondContact O-CG 3.31Å; C228-K232 PolarHBondContact O-N 2.95Å; C228-M559 HydrophobicContact CB-CE 4.42Å; C228-M559 HydrophobicContact CB-SD 3.51Å; C228-M559 VanDerWaalsContact CB-SD 3.51Å
229	H	97.8	Very high	97.2	Very high	107 Å²	107	48 Å²	48	50%	0.495	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-44.7	175.4	-172.9	57.3	0	0	0	111.6	L186 Q225 D226 F227 V231 K232 V233	L186-H229 WeakPolarHBondContact CD1-CD2 3.4Å; Q225-H229 WeakPolarHBondContact O-CB 3.24Å; Q225-H229 PolarHBondContact O-N 2.84Å; D226-H229 PolarHBondContact O-N 3.33Å; F227-H229 VanDerWaalsContact C-N 3.28Å; F227-H229 PolarHBondContact O-N 3.27Å; H229-V231 VanDerWaalsContact C-N 3.33Å; H229-V231 PolarHBondContact O-N 2.91Å; H229-K232 WeakPolarHBondContact O-CB 3.44Å; H229-K232 PolarHBondContact O-N 3.49Å; H229-K232 VanDerWaalsContact O-N 3.13Å; H229-V233 WeakPolarHBondContact O-CG2 3.18Å; H229-V233 PolarHBondContact O-N 3.31Å
230	A	98.1	Very high	97.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-41.3	176.5	0	0	0	0	0	112.6	V179 L186 L200 L202 D226 F227 K232 V233 G234	V179-A230 HydrophobicContact CG1-CB 4.12Å; L186-A230 HydrophobicContact CD1-CB 4.23Å; L186-A230 HydrophobicContact CD2-CB 3.7Å; L200-A230 HydrophobicContact CD2-CB 3.47Å; L200-A230 VanDerWaalsContact CD2-CB 3.47Å; L202-A230 HydrophobicContact CD2-CB 3.7Å; D226-A230 WeakPolarHBondContact O-CB 3.41Å; D226-A230 PolarHBondContact O-N 3.26Å; F227-A230 WeakPolarHBondContact O-CB 3.45Å; F227-A230 PolarHBondContact O-N 2.86Å; A230-K232 PolarHBondContact O-N 3.21Å; A230-V233 PolarHBondContact O-N 3.31Å; A230-G234 PolarHBondContact O-N 3.33Å
231	V	97.9	Very high	97.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-44.9	175.1	175.9	0	0	0	0	111.1	L202 I215 F227 C228 H229 V233 G234 V235 L555 M559	L202-V231 HydrophobicContact CD1-CG2 4.35Å; L202-V231 HydrophobicContact CD2-CG2 3.83Å; I215-V231 HydrophobicContact CD1-CG1 3.95Å; I215-V231 HydrophobicContact CD1-CG2 4.34Å; F227-V231 HydrophobicContact CD1-CG2 4Å; F227-V231 HydrophobicContact CE1-CG2 3.74Å; F227-V231 WeakPolarHBondContact O-CG2 3.32Å; F227-V231 PolarHBondContact O-N 2.9Å; C228-V231 PolarHBondContact O-N 2.91Å; H229-V231 VanDerWaalsContact C-N 3.33Å; H229-V231 PolarHBondContact O-N 2.91Å; V231-V233 PolarHBondContact O-N 2.87Å; V231-G234 PolarHBondContact O-N 2.91Å; V231-V235 WeakPolarHBondContact O-CG2 3.2Å; V231-V235 PolarHBondContact O-N 3.14Å; V231-L555 HydrophobicContact CG1-CD1 3.88Å; V231-M559 HydrophobicContact CB-CE 4.04Å; V231-M559 HydrophobicContact CG1-CE 3.89Å
232	K	97.6	Very high	97.3	Very high	105 Å²	105	44.2 Å²	44.2	46%	0.457	21%	0.211	S	C	.	.	H	α-helix	trans	-60.5	-44.9	177.7	-66.9	174.3	-179	-177.6	0	111.8	C228 H229 A230 V235 K236 L555 M559	C228-K232 WeakPolarHBondContact O-CG 3.31Å; C228-K232 PolarHBondContact O-N 2.95Å; H229-K232 WeakPolarHBondContact O-CB 3.44Å; H229-K232 PolarHBondContact O-N 3.49Å; H229-K232 VanDerWaalsContact O-N 3.13Å; A230-K232 PolarHBondContact O-N 3.21Å; K232-V235 PolarHBondContact O-N 2.83Å; K232-K236 PolarHBondContact O-N 2.97Å; K232-L555 HydrophobicContact CB-CD2 4.37Å; K232-L555 HydrophobicContact CG-CD2 3.71Å; K232-L555 HydrophobicContact CG-CG 4.45Å; K232-M559 HydrophobicContact CG-CE 4.28Å
233	V	97.3	Very high	97.4	Very high	28 Å²	28	48.4 Å²	48.4	17%	0.17	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-42.9	177.4	173	0	0	0	0	110.9	L186 V188 H229 A230 V231 K236 H237	L186-V233 HydrophobicContact CD1-CB 4.21Å; L186-V233 HydrophobicContact CD1-CG2 3.81Å; V188-V233 HydrophobicContact CG2-CG1 4.16Å; H229-V233 WeakPolarHBondContact O-CG2 3.18Å; H229-V233 PolarHBondContact O-N 3.31Å; A230-V233 PolarHBondContact O-N 3.31Å; V231-V233 PolarHBondContact O-N 2.87Å; V233-K236 WeakPolarHBondContact O-CB 3.39Å; V233-K236 PolarHBondContact O-N 3.35Å; V233-H237 PolarHBondContact O-N 3.33Å; V233-H237 PolarHBondContact O-ND1 3.08Å
234	G	97.3	Very high	97.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-54.9	175.2	0	0	0	0	0	111.9	V177 A230 V231 K236 H237 T238	V177-G234 WeakPolarHBondContact CG2-O 3.08Å; A230-G234 PolarHBondContact O-N 3.33Å; V231-G234 PolarHBondContact O-N 2.91Å; G234-K236 VanDerWaalsContact C-N 3.26Å; G234-K236 PolarHBondContact O-N 3.06Å; G234-H237 PolarHBondContact O-N 3.03Å; G234-T238 WeakPolarHBondContact O-CG2 3.41Å; G234-T238 PolarHBondContact O-N 3.37Å
235	V	97.1	Very high	97.3	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-37.3	179.4	176.4	0	0	0	0	112.2	V204 V212 V231 K232 H237 T238 Q239 L555	V204-V235 HydrophobicContact CG1-CG2 3.68Å; V212-V235 HydrophobicContact CG2-CG2 3.66Å; V231-V235 WeakPolarHBondContact O-CG2 3.2Å; V231-V235 PolarHBondContact O-N 3.14Å; K232-V235 PolarHBondContact O-N 2.83Å; V235-H237 VanDerWaalsContact C-N 3.33Å; V235-H237 PolarHBondContact O-N 2.91Å; V235-T238 PolarHBondContact O-N 3.21Å; V235-T238 PolarHBondContact O-OG1 3.29Å; V235-Q239 WeakPolarHBondContact O-CG 3.44Å; V235-Q239 PolarHBondContact O-N 3.37Å; V235-L555 HydrophobicContact CG2-CD1 4.23Å
236	K	96.6	Very high	97.2	Very high	143 Å²	143	36.2 Å²	36.2	62%	0.622	18%	0.175	S	C	*	.	H	α-helix	trans	-58.3	-45.4	176.1	-178.4	-174.5	174.5	-172	0	111.7	K232 V233 G234 Q239	K232-K236 PolarHBondContact O-N 2.97Å; V233-K236 WeakPolarHBondContact O-CB 3.39Å; V233-K236 PolarHBondContact O-N 3.35Å; G234-K236 VanDerWaalsContact C-N 3.26Å; G234-K236 PolarHBondContact O-N 3.06Å; K236-Q239 PolarHBondContact O-N 3.23Å
237	H	96.8	Very high	97	Very high	31 Å²	31	37.4 Å²	37.4	14%	0.144	18%	0.178	C	C	.	.	H	α-helix	trans	-74.9	-30.3	-178.6	-69.2	86.2	0	0	0	112.6	L37 V177 V188 V233 G234 V235 Q239 Q240	L37-H237 HydrophobicContact CD2-CB 4.37Å; V177-H237 HydrophobicContact CG1-CB 4.01Å; V177-H237 HydrophobicContact CG2-CB 4.4Å; V188-H237 HydrophobicContact CG1-CB 4.18Å; V233-H237 PolarHBondContact O-N 3.33Å; V233-H237 PolarHBondContact O-ND1 3.08Å; G234-H237 PolarHBondContact O-N 3.03Å; V235-H237 VanDerWaalsContact C-N 3.33Å; V235-H237 PolarHBondContact O-N 2.91Å; H237-Q239 PolarHBondContact O-N 3.31Å; H237-Q240 WeakPolarHBondContact O-CB 3.42Å; H237-Q240 PolarHBondContact O-N 3.38Å
238	T	97.8	Very high	96.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-32.5	174.3	65.7	0	0	0	0	112.3	G175 V177 G234 V235 Q240 I241 I242	G175-T238 VanDerWaalsContact O-CB 3.32Å; G175-T238 WeakPolarHBondContact O-CB 3.18Å; G175-T238 WeakPolarHBondContact O-CG2 3.44Å; V177-T238 HydrophobicContact CG1-CG2 4.41Å; V177-T238 HydrophobicContact CG2-CG2 3.93Å; G234-T238 WeakPolarHBondContact O-CG2 3.41Å; G234-T238 PolarHBondContact O-N 3.37Å; V235-T238 PolarHBondContact O-N 3.21Å; V235-T238 PolarHBondContact O-OG1 3.29Å; T238-Q240 VanDerWaalsContact C-N 3.3Å; T238-Q240 PolarHBondContact O-N 3.04Å; T238-I241 PolarHBondContact O-N 3.32Å; T238-I242 WeakPolarHBondContact O-CD1 3.3Å; T238-I242 VanDerWaalsContact O-CG1 3.29Å; T238-I242 WeakPolarHBondContact O-CG1 3.37Å; T238-I242 PolarHBondContact O-N 3.36Å
239	Q	97.2	Very high	96.5	Very high	33 Å²	33	38.6 Å²	38.6	15%	0.154	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-34.6	177.8	-59	-50.4	-71.6	0	0	112.8	A207 V235 K236 H237 I241 I242 L243	A207-Q239 PolarHBondContact O-NE2 3.48Å; A207-Q239 PolarHBondContact O-OE1 3.48Å; V235-Q239 WeakPolarHBondContact O-CG 3.44Å; V235-Q239 PolarHBondContact O-N 3.37Å; K236-Q239 PolarHBondContact O-N 3.23Å; H237-Q239 PolarHBondContact O-N 3.31Å; Q239-I241 VanDerWaalsContact C-N 3.33Å; Q239-I241 PolarHBondContact O-N 2.89Å; Q239-I242 PolarHBondContact O-N 3.38Å; Q239-L243 VanDerWaalsContact O-CG 3.27Å; Q239-L243 WeakPolarHBondContact O-CG 3.46Å; Q239-L243 PolarHBondContact O-N 2.9Å
240	Q	96.7	Very high	96.1	Very high	71 Å²	71	41.4 Å²	41.4	33%	0.332	19%	0.191	S	C	.	.	H	α-helix	trans	-63.9	-41.6	177.4	-64.6	170.1	-19.7	0	0	111	V35 D36 L37 H237 T238 L243 A244	V35-Q240 HydrophobicContact CG1-CB 3.94Å; D36-Q240 PolarHBondContact O-OE1 2.91Å; L37-Q240 HydrophobicContact CD2-CB 4.35Å; H237-Q240 WeakPolarHBondContact O-CB 3.42Å; H237-Q240 PolarHBondContact O-N 3.38Å; T238-Q240 VanDerWaalsContact C-N 3.3Å; T238-Q240 PolarHBondContact O-N 3.04Å; Q240-L243 PolarHBondContact O-N 3.35Å; Q240-A244 PolarHBondContact O-N 3.2Å
241	I	97.8	Very high	95.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.8	-44.3	176.5	-57.4	172.9	0	0	0	111	V35 L37 L42 I44 N157 A176 V177 T238 Q239 L243 A244 I245	V35-I241 HydrophobicContact CG1-CG1 4.22Å; L37-I241 HydrophobicContact CD1-CD1 4.08Å; L37-I241 HydrophobicContact CD1-CG1 4.33Å; L37-I241 HydrophobicContact CD2-CD1 4.4Å; L37-I241 HydrophobicContact CD2-CG1 4.08Å; L42-I241 HydrophobicContact CD2-CD1 4.11Å; L42-I241 HydrophobicContact CD2-CG1 4.11Å; L42-I241 HydrophobicContact CD2-CG2 4.27Å; I44-I241 HydrophobicContact CD1-CG2 4.24Å; N157-I241 WeakPolarHBondContact OD1-CG2 3.27Å; A176-I241 WeakPolarHBondContact O-CD1 3.16Å; V177-I241 HydrophobicContact CG1-CD1 3.81Å; T238-I241 PolarHBondContact O-N 3.32Å; Q239-I241 VanDerWaalsContact C-N 3.33Å; Q239-I241 PolarHBondContact O-N 2.89Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.21Å; I241-A244 PolarHBondContact O-N 3.32Å; I241-A244 VanDerWaalsContact O-N 3.17Å; I241-I245 HydrophobicContact CG2-CD1 4.01Å; I241-I245 HydrophobicContact CG2-CG1 4.45Å; I241-I245 WeakPolarHBondContact O-CG1 3.4Å; I241-I245 PolarHBondContact O-N 3.38Å
242	I	97.8	Very high	94.9	Very high	3 Å²	3	47 Å²	47	2%	0.015	22%	0.217	C	C	.	.	H	α-helix	trans	-56.3	-46.8	177.4	-72	162.6	0	0	0	110.7	P173 G175 P208 T238 Q239 A244 I245 Q246	P173-I242 HydrophobicContact CG-CG2 4.17Å; G175-I242 VanDerWaalsContact N-CG1 3.33Å; P208-I242 HydrophobicContact CG-CG2 4.02Å; T238-I242 WeakPolarHBondContact O-CD1 3.3Å; T238-I242 VanDerWaalsContact O-CG1 3.29Å; T238-I242 WeakPolarHBondContact O-CG1 3.37Å; T238-I242 PolarHBondContact O-N 3.36Å; Q239-I242 PolarHBondContact O-N 3.38Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.08Å; I242-I245 PolarHBondContact O-N 2.83Å; I242-Q246 HydrophobicContact CG2-CG 4.44Å; I242-Q246 WeakPolarHBondContact O-CB 3.36Å; I242-Q246 VanDerWaalsContact O-CG 3.3Å; I242-Q246 WeakPolarHBondContact O-CG 3.17Å; I242-Q246 PolarHBondContact O-N 3.39Å
243	L	96.8	Very high	94.2	Very high	103 Å²	103	50.5 Å²	50.5	54%	0.539	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-40.4	179	-72.3	170.6	0	0	0	112	Q239 Q240 I241 Q246 Q247	Q239-L243 VanDerWaalsContact O-CG 3.27Å; Q239-L243 WeakPolarHBondContact O-CG 3.46Å; Q239-L243 PolarHBondContact O-N 2.9Å; Q240-L243 PolarHBondContact O-N 3.35Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.21Å; L243-Q246 PolarHBondContact O-N 3.49Å; L243-Q247 PolarHBondContact O-N 3.33Å
244	A	96	Very high	93.4	Very high	7 Å²	7	51.3 Å²	51.3	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-40.8	177.5	0	0	0	0	0	112.8	V33 V35 Q240 I241 I242 Q246 Q247 L248	V33-A244 HydrophobicContact CG1-CB 3.93Å; V33-A244 HydrophobicContact CG2-CB 3.96Å; V35-A244 HydrophobicContact CG2-CB 3.31Å; Q240-A244 PolarHBondContact O-N 3.2Å; I241-A244 PolarHBondContact O-N 3.32Å; I241-A244 VanDerWaalsContact O-N 3.17Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.08Å; A244-Q246 VanDerWaalsContact C-N 3.35Å; A244-Q247 WeakPolarHBondContact O-CB 3.46Å; A244-Q247 PolarHBondContact O-N 3.48Å; A244-L248 PolarHBondContact O-N 2.92Å
245	I	96.5	Very high	93.1	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-42.2	174.3	-62.9	171.7	0	0	0	110.1	I44 A161 A164 P173 I241 I242 Q247 L248 V249	I44-I245 HydrophobicContact CD1-CD1 4.31Å; I44-I245 HydrophobicContact CD1-CG1 3.72Å; A161-I245 HydrophobicContact CB-CD1 4.34Å; A161-I245 HydrophobicContact CB-CG1 4.34Å; A161-I245 HydrophobicContact CB-CG2 4.46Å; A164-I245 HydrophobicContact CB-CG2 3.74Å; P173-I245 HydrophobicContact CB-CB 3.95Å; P173-I245 HydrophobicContact CB-CD1 4.33Å; P173-I245 HydrophobicContact CB-CG2 3.5Å; P173-I245 VanDerWaalsContact CB-CG2 3.5Å; P173-I245 HydrophobicContact CG-CB 4.05Å; P173-I245 HydrophobicContact CG-CG2 3.87Å; I241-I245 HydrophobicContact CG2-CD1 4.01Å; I241-I245 HydrophobicContact CG2-CG1 4.45Å; I241-I245 WeakPolarHBondContact O-CG1 3.4Å; I241-I245 PolarHBondContact O-N 3.38Å; I242-I245 PolarHBondContact O-N 2.83Å; I245-Q247 VanDerWaalsContact C-N 3.29Å; I245-Q247 PolarHBondContact O-N 2.61Å; I245-L248 PolarHBondContact O-N 3.06Å; I245-V249 HydrophobicContact CG2-CG2 4.43Å; I245-V249 VanDerWaalsContact O-CG2 3.32Å; I245-V249 WeakPolarHBondContact O-CG2 3.48Å; I245-V249 PolarHBondContact O-N 3.27Å
246	Q	95.3	Very high	93	Very high	47 Å²	47	60.4 Å²	60.4	22%	0.22	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-39.3	174.8	-72.9	178.3	-2.2	0	0	112.1	P173 I242 L243 A244 V249 R250	P173-Q246 HydrophobicContact CG-CG 3.67Å; I242-Q246 HydrophobicContact CG2-CG 4.44Å; I242-Q246 WeakPolarHBondContact O-CB 3.36Å; I242-Q246 VanDerWaalsContact O-CG 3.3Å; I242-Q246 WeakPolarHBondContact O-CG 3.17Å; I242-Q246 PolarHBondContact O-N 3.39Å; L243-Q246 PolarHBondContact O-N 3.49Å; A244-Q246 VanDerWaalsContact C-N 3.35Å; Q246-V249 PolarHBondContact O-N 2.82Å; Q246-R250 VanDerWaalsContact O-CG 3.3Å; Q246-R250 WeakPolarHBondContact O-CG 3.49Å; Q246-R250 PolarHBondContact O-N 3.23Å
247	Q	93.8	Very high	92.8	Very high	89 Å²	89	55.4 Å²	55.4	42%	0.416	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-49.9	174.2	-179.9	-177.6	-16.3	0	0	111	L243 A244 I245 V249 R250 E251	L243-Q247 PolarHBondContact O-N 3.33Å; A244-Q247 WeakPolarHBondContact O-CB 3.46Å; A244-Q247 PolarHBondContact O-N 3.48Å; I245-Q247 VanDerWaalsContact C-N 3.29Å; I245-Q247 PolarHBondContact O-N 2.61Å; Q247-V249 VanDerWaalsContact C-N 3.31Å; Q247-V249 PolarHBondContact O-N 3.1Å; Q247-R250 PolarHBondContact O-N 3.36Å; Q247-E251 WeakPolarHBondContact CG-OE1 3.27Å; Q247-E251 PolarHBondContact NE2-OE1 3.07Å; Q247-E251 WeakPolarHBondContact O-CG 3.47Å; Q247-E251 PolarHBondContact O-N 2.98Å
248	L	91.6	Very high	92.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57	-43.1	176.9	-78.9	174.7	0	0	0	112.6	R31 V33 I44 L165 A244 I245 E251 Q252	R31-L248 HydrophobicContact CB-CD2 4.16Å; V33-L248 HydrophobicContact CB-CD1 4.3Å; V33-L248 HydrophobicContact CB-CD2 4.13Å; V33-L248 HydrophobicContact CB-CG 3.96Å; V33-L248 HydrophobicContact CG1-CD1 3.44Å; V33-L248 VanDerWaalsContact CG1-CD1 3.44Å; V33-L248 HydrophobicContact CG1-CD2 4.17Å; V33-L248 HydrophobicContact CG1-CG 3.57Å; I44-L248 HydrophobicContact CB-CD1 4Å; I44-L248 HydrophobicContact CG2-CD1 3.61Å; L165-L248 HydrophobicContact CD2-CB 4.31Å; A244-L248 PolarHBondContact O-N 2.92Å; I245-L248 PolarHBondContact O-N 3.06Å; L248-E251 PolarHBondContact O-N 3.28Å; L248-Q252 WeakPolarHBondContact O-CG 3.3Å; L248-Q252 PolarHBondContact O-N 3.48Å
249	V	92.1	Very high	92.3	Very high	40 Å²	40	61.7 Å²	61.7	24%	0.242	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-45	178.7	173.7	0	0	0	0	111.3	A164 L165 I245 Q246 Q247 E251 Q252 K253	A164-V249 HydrophobicContact CB-CG2 3.65Å; L165-V249 HydrophobicContact CD2-CG2 4.03Å; I245-V249 HydrophobicContact CG2-CG2 4.43Å; I245-V249 VanDerWaalsContact O-CG2 3.32Å; I245-V249 WeakPolarHBondContact O-CG2 3.48Å; I245-V249 PolarHBondContact O-N 3.27Å; Q246-V249 PolarHBondContact O-N 2.82Å; Q247-V249 VanDerWaalsContact C-N 3.31Å; Q247-V249 PolarHBondContact O-N 3.1Å; V249-E251 VanDerWaalsContact C-N 3.29Å; V249-E251 PolarHBondContact O-N 3.49Å; V249-Q252 PolarHBondContact O-N 3.07Å; V249-K253 PolarHBondContact O-N 3.04Å; V249-K253 VanDerWaalsContact O-N 3.13Å
250	R	90.4	Very high	91.9	Very high	165 Å²	165	65.9 Å²	65.9	62%	0.623	33%	0.331	S	S	*	.	H	α-helix	trans	-62	-38.5	177.5	-70.5	177.4	-144	163.5	6.1	111.8	Q246 Q247 K253	Q246-R250 VanDerWaalsContact O-CG 3.3Å; Q246-R250 WeakPolarHBondContact O-CG 3.49Å; Q246-R250 PolarHBondContact O-N 3.23Å; Q247-R250 PolarHBondContact O-N 3.36Å; R250-K253 WeakPolarHBondContact O-CG 3.29Å
251	E	87.8	Confident	91.5	Very high	87 Å²	87	66.1 Å²	66.1	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-67.8	-38.9	178.5	-73.4	177	-166.2	0	0	112.5	Q247 L248 V249	Q247-E251 WeakPolarHBondContact CG-OE1 3.27Å; Q247-E251 PolarHBondContact NE2-OE1 3.07Å; Q247-E251 WeakPolarHBondContact O-CG 3.47Å; Q247-E251 PolarHBondContact O-N 2.98Å; L248-E251 PolarHBondContact O-N 3.28Å; V249-E251 VanDerWaalsContact C-N 3.29Å; V249-E251 PolarHBondContact O-N 3.49Å
252	Q	82.1	Confident	91.2	Very high	30 Å²	30	69.4 Å²	69.4	14%	0.14	35%	0.347	C	S	.	.	H	α-helix	trans	-81.8	-15.4	-178.7	-66.3	-155.3	17.3	0	0	114.4	L165 L248 V249 I254	L165-Q252 HydrophobicContact CD2-CB 4.35Å; L165-Q252 HydrophobicContact CD2-CG 4.16Å; L248-Q252 WeakPolarHBondContact O-CG 3.3Å; L248-Q252 PolarHBondContact O-N 3.48Å; V249-Q252 PolarHBondContact O-N 3.07Å; Q252-I254 VanDerWaalsContact C-N 3.27Å; Q252-I254 HydrophobicContact CB-CD1 3.92Å; Q252-I254 HydrophobicContact CB-CG1 3.73Å; Q252-I254 PolarHBondContact O-N 2.89Å
253	K	83.5	Confident	90.7	Very high	179 Å²	179	71 Å²	71	78%	0.778	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	43.9	176.9	-60.9	-176.4	178.4	-179.1	0	113.3	V249 R250 T255	V249-K253 PolarHBondContact O-N 3.04Å; V249-K253 VanDerWaalsContact O-N 3.13Å; R250-K253 WeakPolarHBondContact O-CG 3.29Å; K253-T255 PolarHBondContact O-N 2.91Å
254	I	80.9	Confident	90.4	Very high	45 Å²	45	70 Å²	70	23%	0.231	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-76.6	125.2	-176.5	-57.1	-177.8	0	0	0	109.5	L165 Q252	L165-I254 HydrophobicContact CB-CD1 4.13Å; L165-I254 HydrophobicContact CD2-CD1 4.19Å; L165-I254 WeakPolarHBondContact O-CD1 3.33Å; Q252-I254 VanDerWaalsContact C-N 3.27Å; Q252-I254 HydrophobicContact CB-CD1 3.92Å; Q252-I254 HydrophobicContact CB-CG1 3.73Å; Q252-I254 PolarHBondContact O-N 2.89Å
255	T	91.3	Very high	90.1	Very high	120 Å²	120	70.8 Å²	70.8	74%	0.736	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-82.3	126.7	173.8	-53.4	0	0	0	0	109.3	D167 K253	D167-T255 WeakPolarHBondContact CB-O 3.16Å; K253-T255 PolarHBondContact O-N 2.91Å
256	K	94.2	Very high	89.9	Confident	76 Å²	76	73.2 Å²	73.2	33%	0.33	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-67.8	137.6	172.6	-63.1	-59.2	-170.5	174	0	110.3	L163 A164 S166 D167 I168	L163-K256 PolarHBondContact O-NZ 3.5Å; L163-K256 VanDerWaalsContact O-NZ 3.07Å; A164-K256 PolarHBondContact O-NZ 2.9Å; S166-K256 PolarHBondContact O-NZ 3.16Å; D167-K256 CarbonylContact O-C 3.6Å; D167-K256 WeakPolarHBondContact O-CA 3.32Å; I168-K256 WeakPolarHBondContact O-CD 3.25Å; I168-K256 PolarHBondContact O-NZ 2.99Å
257	R	93	Very high	89.7	Confident	38 Å²	38	76.8 Å²	76.8	14%	0.143	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-65.4	144.2	175.8	70.8	178.6	62.4	169.5	-2.3	109.6	D54 S72 D167 P169 P259	D54-R257 IonicContact OD1-NH2 2.77Å; D54-R257 PolarHBondContact OD1-NH2 3.41Å; D54-R257 IonicContact OD2-CZ 2.79Å; D54-R257 IonicContact OD2-NH1 3.41Å; D54-R257 IonicContact OD2-NH2 3.71Å; D54-R257 PolarHBondContact OD2-NH2 3.27Å; S72-R257 PolarHBondContact O-NH1 3.11Å; D167-R257 HydrophobicContact CB-CB 4.27Å; D167-R257 WeakPolarHBondContact O-CG 3.49Å; D167-R257 PolarHBondContact O-N 3.02Å; D167-R257 IonicContact OD1-CZ 2.72Å; D167-R257 VanDerWaalsContact OD1-CZ 3.28Å; D167-R257 IonicContact OD1-NE 3.69Å; D167-R257 PolarHBondContact OD1-NE 2.79Å; D167-R257 IonicContact OD1-NH2 2.92Å; D167-R257 PolarHBondContact OD1-NH2 3.41Å; D167-R257 IonicContact OD2-CZ 3.99Å; D167-R257 VanDerWaalsContact OD2-CZ 3.28Å; D167-R257 IonicContact OD2-NE 2.84Å; D167-R257 PolarHBondContact OD2-NE 3.35Å; D167-R257 IonicContact OD2-NH2 2.69Å; D167-R257 PolarHBondContact OD2-NH2 3.37Å; P169-R257 HydrophobicContact CG-CG 4.32Å; R257-P259 WeakPolarHBondContact O-CD 3.39Å
258	T	93.3	Very high	89.7	Confident	134 Å²	134	78.9 Å²	78.9	82%	0.822	40%	0.403	S	S	*	.			trans	-87.4	116	166.5	-49.7	0	0	0	0	107.8
259	P	91	Very high	89.8	Confident	28 Å²	28	79.5 Å²	79.5	18%	0.182	41%	0.406	C	S	.	.			trans	-60.2	146.1	177.8	-24.7	37.7	0	0	0	111.1	Y132 Y134 P169 R257 K261 M262	Y132-P259 HydrophobicContact CD2-CB 4.5Å; Y132-P259 HydrophobicContact CD2-CG 4Å; Y132-P259 HydrophobicContact CE2-CB 4.35Å; Y132-P259 HydrophobicContact CE2-CG 3.84Å; Y134-P259 HydrophobicContact CE2-CB 3.88Å; Y134-P259 WeakPolarHBondContact OH-CB 3.46Å; P169-P259 HydrophobicContact CG-CG 3.79Å; R257-P259 WeakPolarHBondContact O-CD 3.39Å; P259-K261 VanDerWaalsContact C-N 3.26Å; P259-K261 PolarHBondContact O-N 3.04Å; P259-M262 HydrophobicContact CB-CG 4.36Å; P259-M262 HydrophobicContact CB-SD 3.87Å; P259-M262 HydrophobicContact CG-CG 4.44Å; P259-M262 HydrophobicContact CG-SD 3.7Å
260	V	88.5	Confident	89.9	Confident	121 Å²	121	78.1 Å²	78.1	73%	0.733	40%	0.398	S	S	*	.	S	Bend	trans	-61.1	-40.5	-179.9	177.8	0	0	0	0	111.1	Y134	Y134-V260 PolarHBondContact OH-N 2.82Å
261	K	88.4	Confident	90.1	Very high	77 Å²	77	73.8 Å²	73.8	34%	0.335	39%	0.387	S	S	.	.			trans	-140.5	131.6	174.5	-177	172.1	-179	172.5	0	108.5	Y134 P259 F263	Y134-K261 WeakPolarHBondContact CE2-O 3.29Å; Y134-K261 PolarHBondContact OH-N 3.15Å; Y134-K261 PolarHBondContact OH-O 3.25Å; P259-K261 VanDerWaalsContact C-N 3.26Å; P259-K261 PolarHBondContact O-N 3.04Å; K261-F263 HydrophobicContact CD-CD1 4.41Å; K261-F263 HydrophobicContact CD-CE1 4.14Å; K261-F263 HydrophobicContact CD-CZ 4.24Å
262	M	90.2	Very high	90.4	Very high	69 Å²	69	71.7 Å²	71.7	34%	0.34	38%	0.377	S	S	.	.			trans	-96	126.9	159.3	-71.2	-60.9	-69.1	0	0	106.7	P129 P130 Y132 P259 S264	P129-M262 HydrophobicContact CB-CE 3.86Å; P129-M262 HydrophobicContact CG-CE 4.1Å; P130-M262 WeakPolarHBondContact O-CE 3.39Å; Y132-M262 HydrophobicContact CD2-SD 4.18Å; P259-M262 HydrophobicContact CB-CG 4.36Å; P259-M262 HydrophobicContact CB-SD 3.87Å; P259-M262 HydrophobicContact CG-CG 4.44Å; P259-M262 HydrophobicContact CG-SD 3.7Å; M262-S264 PolarHBondContact O-N 2.9Å
263	F	89.1	Confident	91	Very high	36 Å²	36	70.3 Å²	70.3	16%	0.158	37%	0.371	C	S	.	.			trans	-79.2	102.6	179.1	-69.9	-96.8	0	0	0	108.6	P76 G131 F133 K261 F320	P76-F263 HydrophobicContact CB-CE2 3.82Å; P76-F263 HydrophobicContact CB-CZ 3.78Å; P76-F263 HydrophobicContact CG-CE2 4.37Å; P76-F263 HydrophobicContact CG-CZ 4.45Å; G131-F263 WeakPolarHBondContact CA-O 3.36Å; G131-F263 WeakPolarHBondContact O-CD2 3.34Å; G131-F263 PolarHBondContact O-N 2.99Å; F133-F263 HydrophobicContact CB-CD2 3.86Å; F133-F263 HydrophobicContact CB-CE2 3.87Å; F133-F263 HydrophobicContact CD2-CB 3.8Å; F133-F263 HydrophobicContact CD2-CD1 4.03Å; F133-F263 AromaticContact CD2-CD2 3.59Å; F133-F263 HydrophobicContact CD2-CD2 3.59Å; F133-F263 HydrophobicContact CD2-CE2 4.11Å; F133-F263 AromaticContact CD2-CG 3.54Å; F133-F263 HydrophobicContact CD2-CG 3.54Å; F133-F263 HydrophobicContact CE2-CB 3.73Å; F133-F263 HydrophobicContact CE2-CD1 4.38Å; F133-F263 HydrophobicContact CE2-CD2 4.39Å; F133-F263 AromaticContact CE2-CG 3.94Å; F133-F263 HydrophobicContact CE2-CG 3.94Å; F133-F263 AromaticContact CG-CD2 3.94Å; F133-F263 HydrophobicContact CG-CD2 3.94Å; F133-F263 HydrophobicContact CG-CE2 4.39Å; F133-F263 HydrophobicContact CG-CG 4.31Å; F133-F263 HydrophobicContact CZ-CB 4.43Å; K261-F263 HydrophobicContact CD-CD1 4.41Å; K261-F263 HydrophobicContact CD-CE1 4.14Å; K261-F263 HydrophobicContact CD-CZ 4.24Å; F263-F320 HydrophobicContact CB-CD1 4.25Å; F263-F320 HydrophobicContact CB-CE1 3.67Å; F263-F320 HydrophobicContact CB-CZ 4.06Å; F263-F320 HydrophobicContact CD1-CD1 4.03Å; F263-F320 HydrophobicContact CD1-CE1 4.3Å; F263-F320 HydrophobicContact CD1-CG 4.43Å; F263-F320 HydrophobicContact CG-CE1 4.48Å
264	S	89.8	Confident	91.6	Very high	81 Å²	81	65.2 Å²	65.2	57%	0.566	35%	0.347	S	S	*	.			trans	-136	149.4	178.9	58.1	0	0	0	0	109.5	M262	M262-S264 PolarHBondContact O-N 2.9Å
265	V	89.9	Confident	92.3	Very high	25 Å²	25	70.7 Å²	70.7	15%	0.152	37%	0.371	C	S	.	.			trans	-85.8	136	176.9	-175.6	0	0	0	0	109.8	M267 M269 V270 E324	V265-M267 PolarHBondContact O-N 3.04Å; V265-M269 HydrophobicContact CG1-CB 4.25Å; V265-V270 HydrophobicContact CB-CG2 4.11Å; V265-V270 HydrophobicContact CG1-CG2 3.61Å; V265-E324 HydrophobicContact CG2-CB 3.44Å; V265-E324 VanDerWaalsContact CG2-CB 3.44Å; V265-E324 HydrophobicContact CG2-CG 3.43Å; V265-E324 VanDerWaalsContact CG2-CG 3.43Å
266	P	91.2	Very high	92.3	Very high	50 Å²	50	68.7 Å²	68.7	33%	0.325	36%	0.355	S	S	.	.			trans	-59.7	131.5	170.4	-23.1	34.4	0	0	0	111.9	E268 M269 V270	P266-E268 PolarHBondContact O-N 2.82Å; P266-M269 HydrophobicContact CB-CG 4.33Å; P266-M269 HydrophobicContact CG-CE 3.94Å; P266-M269 HydrophobicContact CG-SD 4.09Å; P266-M269 WeakPolarHBondContact O-CB 3.49Å; P266-M269 PolarHBondContact O-N 3.09Å; P266-V270 PolarHBondContact O-N 2.85Å
267	M	91.9	Very high	92.4	Very high	122 Å²	122	65.7 Å²	65.7	60%	0.601	34%	0.342	S	S	*	.	H	α-helix	trans	-57.2	-34.7	-179.7	-77.1	-63.2	-64	0	0	112.9	V265 M269 V270 D271	V265-M267 PolarHBondContact O-N 3.04Å; M267-M269 VanDerWaalsContact C-N 3.27Å; M267-M269 PolarHBondContact O-N 3Å; M267-V270 PolarHBondContact O-N 3.39Å; M267-V270 VanDerWaalsContact O-N 3.12Å; M267-D271 WeakPolarHBondContact O-CB 3.12Å; M267-D271 PolarHBondContact O-N 2.89Å
268	E	93.8	Very high	92.5	Very high	134 Å²	134	64.8 Å²	64.8	63%	0.626	34%	0.343	S	S	*	.	H	α-helix	trans	-57.5	-39.1	176.3	-171.9	-177	175.7	0	0	112.5	P266 H272 F314	P266-E268 PolarHBondContact O-N 2.82Å; E268-H272 WeakPolarHBondContact O-CB 3.36Å; E268-H272 PolarHBondContact O-N 3.4Å; E268-F314 HydrophobicContact CG-CE1 4.09Å; E268-F314 HydrophobicContact CG-CZ 4.07Å
269	M	92.9	Very high	92.7	Very high	13 Å²	13	66.3 Å²	66.3	6%	0.064	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-42.9	176.2	-65.3	-179.3	-169.4	0	0	111	V265 P266 M267 D271 H272 V273 F314 A317 E321	V265-M269 HydrophobicContact CG1-CB 4.25Å; P266-M269 HydrophobicContact CB-CG 4.33Å; P266-M269 HydrophobicContact CG-CE 3.94Å; P266-M269 HydrophobicContact CG-SD 4.09Å; P266-M269 WeakPolarHBondContact O-CB 3.49Å; P266-M269 PolarHBondContact O-N 3.09Å; M267-M269 VanDerWaalsContact C-N 3.27Å; M267-M269 PolarHBondContact O-N 3Å; M269-D271 VanDerWaalsContact C-N 3.33Å; M269-D271 PolarHBondContact O-N 3.29Å; M269-H272 PolarHBondContact O-N 3.36Å; M269-V273 VanDerWaalsContact O-CG2 3.29Å; M269-V273 WeakPolarHBondContact O-CG2 3.49Å; M269-V273 PolarHBondContact O-N 3Å; M269-F314 HydrophobicContact CE-CB 3.97Å; M269-F314 HydrophobicContact CE-CD1 4.23Å; M269-F314 HydrophobicContact CE-CG 4.1Å; M269-F314 HydrophobicContact CG-CD1 4.27Å; M269-F314 HydrophobicContact CG-CD2 3.99Å; M269-F314 HydrophobicContact CG-CE1 4.3Å; M269-F314 HydrophobicContact CG-CE2 4.02Å; M269-F314 HydrophobicContact CG-CG 4.12Å; M269-F314 HydrophobicContact CG-CZ 4.17Å; M269-A317 HydrophobicContact CE-CB 3.49Å; M269-A317 VanDerWaalsContact CE-CB 3.49Å; M269-A317 HydrophobicContact SD-CB 4.13Å; M269-E321 HydrophobicContact SD-CB 4.22Å
270	V	94.3	Very high	92.9	Very high	11 Å²	11	69.4 Å²	69.4	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-60.7	-44.4	177.3	-178.6	0	0	0	0	110.5	V265 P266 M267 V273 R274 V329	V265-V270 HydrophobicContact CB-CG2 4.11Å; V265-V270 HydrophobicContact CG1-CG2 3.61Å; P266-V270 PolarHBondContact O-N 2.85Å; M267-V270 PolarHBondContact O-N 3.39Å; M267-V270 VanDerWaalsContact O-N 3.12Å; V270-V273 PolarHBondContact O-N 3.23Å; V270-R274 VanDerWaalsContact O-CB 3.31Å; V270-R274 WeakPolarHBondContact O-CB 3.47Å; V270-R274 PolarHBondContact O-N 3.37Å; V270-V329 HydrophobicContact CG1-CG2 3.79Å; V270-V329 WeakPolarHBondContact O-CG2 3.45Å
271	D	95.2	Very high	93.3	Very high	73 Å²	73	63.7 Å²	63.7	39%	0.39	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-41.2	179.3	-65.6	-18.9	0	0	0	111.7	M267 M269 R274 H275	M267-D271 WeakPolarHBondContact O-CB 3.12Å; M267-D271 PolarHBondContact O-N 2.89Å; M269-D271 VanDerWaalsContact C-N 3.33Å; M269-D271 PolarHBondContact O-N 3.29Å; D271-R274 PolarHBondContact O-N 3.11Å; D271-R274 IonicContact OD1-CZ 3.2Å; D271-R274 IonicContact OD1-NH1 2.79Å; D271-R274 PolarHBondContact OD1-NH1 2.87Å; D271-H275 WeakPolarHBondContact O-CB 3.48Å; D271-H275 PolarHBondContact O-N 2.81Å
272	H	94.3	Very high	93.8	Very high	44 Å²	44	64.3 Å²	64.3	20%	0.204	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-46.9	174.8	-178.8	77.3	0	0	0	111.9	E268 M269 H275 L276 N309 F314	E268-H272 WeakPolarHBondContact O-CB 3.36Å; E268-H272 PolarHBondContact O-N 3.4Å; M269-H272 PolarHBondContact O-N 3.36Å; H272-H275 PolarHBondContact O-N 2.99Å; H272-L276 VanDerWaalsContact CE1-CD1 3.44Å; H272-L276 WeakPolarHBondContact CE1-CD1 3.42Å; H272-L276 WeakPolarHBondContact NE2-CD1 3.5Å; H272-L276 PolarHBondContact O-N 2.79Å; H272-N309 PolarHBondContact NE2-OD1 3.48Å; H272-F314 HydrophobicContact CB-CE2 4.16Å; H272-F314 HydrophobicContact CB-CZ 4.38Å
273	V	94.3	Very high	94.1	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-43.4	175.8	174.9	0	0	0	0	111.1	M269 V270 H275 L276 F277 T306 I310 V329	M269-V273 VanDerWaalsContact O-CG2 3.29Å; M269-V273 WeakPolarHBondContact O-CG2 3.49Å; M269-V273 PolarHBondContact O-N 3Å; V270-V273 PolarHBondContact O-N 3.23Å; V273-H275 VanDerWaalsContact C-N 3.28Å; V273-H275 PolarHBondContact O-N 2.79Å; V273-L276 PolarHBondContact O-N 2.91Å; V273-F277 HydrophobicContact CG1-CB 4.43Å; V273-F277 HydrophobicContact CG1-CD2 4.49Å; V273-F277 PolarHBondContact O-N 3.39Å; V273-T306 HydrophobicContact CB-CG2 4.46Å; V273-T306 HydrophobicContact CG1-CG2 3.85Å; V273-T306 HydrophobicContact CG2-CG2 3.79Å; V273-I310 HydrophobicContact CG2-CD1 3.48Å; V273-I310 VanDerWaalsContact CG2-CD1 3.48Å; V273-I310 HydrophobicContact CG2-CG1 3.91Å; V273-V329 HydrophobicContact CB-CG2 3.96Å; V273-V329 HydrophobicContact CG1-CB 3.91Å; V273-V329 HydrophobicContact CG1-CG1 4.18Å; V273-V329 HydrophobicContact CG1-CG2 3.75Å
274	R	95.7	Very high	94.6	Very high	72 Å²	72	62.7 Å²	62.7	27%	0.272	32%	0.317	S	S	.	.	H	α-helix	trans	-58.1	-44	177.7	-169.7	-174.3	-62.6	101.4	2.8	110.6	V270 D271 A278 V329 E332	V270-R274 VanDerWaalsContact O-CB 3.31Å; V270-R274 WeakPolarHBondContact O-CB 3.47Å; V270-R274 PolarHBondContact O-N 3.37Å; D271-R274 PolarHBondContact O-N 3.11Å; D271-R274 IonicContact OD1-CZ 3.2Å; D271-R274 IonicContact OD1-NH1 2.79Å; D271-R274 PolarHBondContact OD1-NH1 2.87Å; R274-A278 HydrophobicContact CG-CB 4.19Å; R274-A278 WeakPolarHBondContact O-CB 3.3Å; R274-A278 PolarHBondContact O-N 3.39Å; R274-V329 HydrophobicContact CB-CG1 4.35Å; R274-V329 HydrophobicContact CB-CG2 4.19Å; R274-E332 IonicContact CZ-OE1 2.68Å; R274-E332 IonicContact CZ-OE2 2.64Å; R274-E332 IonicContact NE-OE1 2.65Å; R274-E332 PolarHBondContact NE-OE1 3.11Å; R274-E332 IonicContact NE-OE2 3.9Å; R274-E332 PolarHBondContact NE-OE2 3.34Å; R274-E332 VanDerWaalsContact NE-OE2 3.12Å; R274-E332 IonicContact NH2-OE1 3.09Å; R274-E332 IonicContact NH2-OE2 3.57Å; R274-E332 PolarHBondContact NH2-OE2 3.29Å
275	H	95.2	Very high	94.9	Very high	161 Å²	161	58.9 Å²	58.9	75%	0.745	29%	0.29	S	S	*	.	H	α-helix	trans	-66.3	-40.5	-178.4	-173.2	55	0	0	0	113.3	D271 H272 V273	D271-H275 WeakPolarHBondContact O-CB 3.48Å; D271-H275 PolarHBondContact O-N 2.81Å; H272-H275 PolarHBondContact O-N 2.99Å; V273-H275 VanDerWaalsContact C-N 3.28Å; V273-H275 PolarHBondContact O-N 2.79Å
276	L	93.2	Very high	95.3	Very high	78 Å²	78	59.4 Å²	59.4	41%	0.408	29%	0.294	S	S	.	.	H	α-helix	trans	-92.3	-31.5	-172.8	-66.8	-177	0	0	0	114.7	H272 V273	H272-L276 VanDerWaalsContact CE1-CD1 3.44Å; H272-L276 WeakPolarHBondContact CE1-CD1 3.42Å; H272-L276 WeakPolarHBondContact NE2-CD1 3.5Å; H272-L276 PolarHBondContact O-N 2.79Å; V273-L276 PolarHBondContact O-N 2.91Å
277	F	94.9	Very high	95.6	Very high	13 Å²	13	60 Å²	60	6%	0.057	29%	0.294	C	S	.	.	H	α-helix	trans	-120.6	-12.5	-167.4	-63.6	-82.8	0	0	0	114.3	V273 E279 R280 I281 V302 E305 T306 N309	V273-F277 HydrophobicContact CG1-CB 4.43Å; V273-F277 HydrophobicContact CG1-CD2 4.49Å; V273-F277 PolarHBondContact O-N 3.39Å; F277-E279 VanDerWaalsContact C-N 3.35Å; F277-E279 PolarHBondContact O-N 3.05Å; F277-R280 PolarHBondContact O-N 3.26Å; F277-R280 VanDerWaalsContact O-N 3.14Å; F277-I281 HydrophobicContact CB-CD1 4.47Å; F277-I281 WeakPolarHBondContact O-CG1 3.33Å; F277-I281 PolarHBondContact O-N 3.46Å; F277-V302 HydrophobicContact CB-CG1 4.35Å; F277-V302 HydrophobicContact CD1-CG1 3.95Å; F277-E305 HydrophobicContact CE1-CB 4.32Å; F277-T306 VanDerWaalsContact CD1-OG1 3.29Å; F277-T306 WeakPolarHBondContact CD1-OG1 3.42Å; F277-T306 HydrophobicContact CD2-CG2 3.89Å; F277-T306 HydrophobicContact CE2-CG2 4.04Å; F277-T306 HydrophobicContact CG-CG2 4.39Å; F277-T306 VanDerWaalsContact CG-OG1 3.27Å; F277-T306 WeakPolarHBondContact CG-OG1 3.47Å; F277-N309 HydrophobicContact CE2-CB 4.13Å; F277-N309 HydrophobicContact CZ-CB 3.99Å
278	A	95.4	Very high	95.8	Very high	18 Å²	18	59 Å²	59	15%	0.149	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-41	-177.6	0	0	0	0	0	113	R274 R280 I281 Y282 V329 V333	R274-A278 HydrophobicContact CG-CB 4.19Å; R274-A278 WeakPolarHBondContact O-CB 3.3Å; R274-A278 PolarHBondContact O-N 3.39Å; A278-R280 VanDerWaalsContact C-N 3.31Å; A278-R280 PolarHBondContact O-N 2.98Å; A278-I281 PolarHBondContact O-N 2.62Å; A278-Y282 VanDerWaalsContact O-CB 3.24Å; A278-Y282 WeakPolarHBondContact O-CB 3.34Å; A278-Y282 PolarHBondContact O-N 2.78Å; A278-V329 HydrophobicContact CB-CG1 4.31Å; A278-V333 HydrophobicContact CB-CG2 3.9Å
279	E	96.6	Very high	95.9	Very high	167 Å²	167	58.4 Å²	58.4	78%	0.78	29%	0.29	S	S	*	.	H	α-helix	trans	-63.3	-37.4	177.5	-69.2	-171.1	167.2	0	0	112.3	F277 Y282 A283	F277-E279 VanDerWaalsContact C-N 3.35Å; F277-E279 PolarHBondContact O-N 3.05Å; E279-Y282 PolarHBondContact O-N 3.17Å; E279-A283 WeakPolarHBondContact O-CB 3.46Å; E279-A283 PolarHBondContact O-N 2.9Å
280	R	96.9	Very high	96.1	Very high	93 Å²	93	59.6 Å²	59.6	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-70.5	-41.5	178	-64.7	178.5	61.2	-168.6	-0.7	111.6	F277 A278 Y282 A283 V284 V302 E305	F277-R280 PolarHBondContact O-N 3.26Å; F277-R280 VanDerWaalsContact O-N 3.14Å; A278-R280 VanDerWaalsContact C-N 3.31Å; A278-R280 PolarHBondContact O-N 2.98Å; R280-Y282 VanDerWaalsContact C-N 3.33Å; R280-A283 PolarHBondContact O-N 2.99Å; R280-V284 WeakPolarHBondContact O-CG2 3.15Å; R280-V284 PolarHBondContact O-N 3Å; R280-V302 HydrophobicContact CB-CG1 4.35Å; R280-V302 HydrophobicContact CB-CG2 4.45Å; R280-E305 IonicContact CZ-OE2 3.28Å; R280-E305 IonicContact NH1-OE2 2.68Å; R280-E305 PolarHBondContact NH1-OE2 3.16Å; R280-E305 IonicContact NH2-OE1 2.96Å; R280-E305 PolarHBondContact NH2-OE1 3.34Å; R280-E305 IonicContact NH2-OE2 3.91Å; R280-E305 PolarHBondContact NH2-OE2 3.34Å
281	I	97.1	Very high	96.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-45.8	173.5	-66.6	168.6	0	0	0	109.8	F277 A278 A283 V284 F285 I299 V302 F326 V329 V333	F277-I281 HydrophobicContact CB-CD1 4.47Å; F277-I281 WeakPolarHBondContact O-CG1 3.33Å; F277-I281 PolarHBondContact O-N 3.46Å; A278-I281 PolarHBondContact O-N 2.62Å; I281-A283 PolarHBondContact O-N 2.72Å; I281-V284 PolarHBondContact O-N 2.86Å; I281-F285 HydrophobicContact CG2-CD2 3.63Å; I281-F285 HydrophobicContact CG2-CE2 3.28Å; I281-F285 HydrophobicContact CG2-CZ 4.08Å; I281-F285 PolarHBondContact O-N 2.88Å; I281-I299 HydrophobicContact CG2-CD1 4.24Å; I281-V302 HydrophobicContact CG1-CG1 4.03Å; I281-F326 HydrophobicContact CD1-CD2 4.29Å; I281-F326 HydrophobicContact CD1-CE2 3.73Å; I281-F326 HydrophobicContact CD1-CZ 4.31Å; I281-F326 HydrophobicContact CG1-CE2 4.14Å; I281-F326 HydrophobicContact CG1-CZ 4.49Å; I281-V329 HydrophobicContact CD1-CG1 4.14Å; I281-V333 HydrophobicContact CB-CG1 4.43Å; I281-V333 HydrophobicContact CG2-CB 3.97Å; I281-V333 HydrophobicContact CG2-CG1 3.88Å; I281-V333 HydrophobicContact CG2-CG2 4.39Å
282	Y	97.7	Very high	96.1	Very high	90 Å²	90	60.9 Å²	60.9	35%	0.353	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-48	177.6	176.4	-91.1	0	0	0	111	A278 E279 R280 V284 F285 T286 V333 L337 E341	A278-Y282 VanDerWaalsContact O-CB 3.24Å; A278-Y282 WeakPolarHBondContact O-CB 3.34Å; A278-Y282 PolarHBondContact O-N 2.78Å; E279-Y282 PolarHBondContact O-N 3.17Å; R280-Y282 VanDerWaalsContact C-N 3.33Å; Y282-V284 VanDerWaalsContact C-N 3.29Å; Y282-V284 PolarHBondContact O-N 2.98Å; Y282-F285 CarbonylContact O-C 3.6Å; Y282-F285 PolarHBondContact O-N 3.15Å; Y282-T286 HydrophobicContact CD1-CG2 4.07Å; Y282-T286 HydrophobicContact CD2-CG2 4.2Å; Y282-T286 HydrophobicContact CE1-CG2 3.61Å; Y282-T286 HydrophobicContact CE2-CG2 3.78Å; Y282-T286 HydrophobicContact CG-CG2 4.34Å; Y282-T286 VanDerWaalsContact CZ-CG2 3.46Å; Y282-T286 WeakPolarHBondContact O-CG2 3.47Å; Y282-T286 PolarHBondContact O-N 3.34Å; Y282-T286 PolarHBondContact O-OG1 3.42Å; Y282-V333 HydrophobicContact CD2-CG1 4.29Å; Y282-L337 HydrophobicContact CE2-CD1 4.06Å; Y282-E341 WeakPolarHBondContact CE2-OE1 3.15Å; Y282-E341 PolarHBondContact OH-OE1 3.47Å; Y282-E341 PolarHBondContact OH-OE2 3.36Å
283	A	97.6	Very high	96.2	Very high	53 Å²	53	62.8 Å²	62.8	44%	0.438	31%	0.311	S	S	.	.	H	α-helix	trans	-54.1	-44.9	177.2	0	0	0	0	0	112.1	E279 R280 I281 T286 D287	E279-A283 WeakPolarHBondContact O-CB 3.46Å; E279-A283 PolarHBondContact O-N 2.9Å; R280-A283 PolarHBondContact O-N 2.99Å; I281-A283 PolarHBondContact O-N 2.72Å; A283-T286 WeakPolarHBondContact CA-OG1 3.38Å; A283-T286 PolarHBondContact O-N 3.26Å; A283-T286 PolarHBondContact O-OG1 3.34Å; A283-T286 VanDerWaalsContact O-OG1 3.1Å; A283-D287 PolarHBondContact O-N 3Å
284	V	97.8	Very high	96.3	Very high	18 Å²	18	64.6 Å²	64.6	11%	0.109	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-42.5	176.1	175.9	0	0	0	0	111.7	R280 I281 Y282 T286 D287 H290 R295 A298 I299	R280-V284 WeakPolarHBondContact O-CG2 3.15Å; R280-V284 PolarHBondContact O-N 3Å; I281-V284 PolarHBondContact O-N 2.86Å; Y282-V284 VanDerWaalsContact C-N 3.29Å; Y282-V284 PolarHBondContact O-N 2.98Å; V284-T286 VanDerWaalsContact C-N 3.31Å; V284-T286 PolarHBondContact O-N 3.1Å; V284-D287 PolarHBondContact O-N 3.06Å; V284-H290 PolarHBondContact O-CD2 3.32Å; V284-R295 HydrophobicContact CG1-CG 4.08Å; V284-A298 HydrophobicContact CG1-CB 3.81Å; V284-A298 HydrophobicContact CG2-CB 4.01Å; V284-I299 HydrophobicContact CB-CD1 3.88Å; V284-I299 HydrophobicContact CG1-CD1 3.63Å; V284-I299 HydrophobicContact CG1-CG1 3.76Å; V284-I299 HydrophobicContact CG2-CD1 4.45Å
285	F	97.6	Very high	96.4	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-73.4	-21.1	178.8	-66.8	-34.7	0	0	0	114	I281 Y282 I299 V333 F334 L337 C345 I523	I281-F285 HydrophobicContact CG2-CD2 3.63Å; I281-F285 HydrophobicContact CG2-CE2 3.28Å; I281-F285 HydrophobicContact CG2-CZ 4.08Å; I281-F285 PolarHBondContact O-N 2.88Å; Y282-F285 CarbonylContact O-C 3.6Å; Y282-F285 PolarHBondContact O-N 3.15Å; F285-I299 HydrophobicContact CD1-CD1 4.2Å; F285-I299 HydrophobicContact CE1-CD1 3.61Å; F285-I299 HydrophobicContact CE1-CG1 3.76Å; F285-I299 HydrophobicContact CE2-CD1 4.31Å; F285-I299 HydrophobicContact CZ-CD1 3.67Å; F285-I299 HydrophobicContact CZ-CG1 4.12Å; F285-V333 HydrophobicContact CD2-CG1 4.16Å; F285-F334 HydrophobicContact CD1-CD2 4.01Å; F285-F334 HydrophobicContact CD2-CB 4.04Å; F285-F334 HydrophobicContact CD2-CD2 4.02Å; F285-F334 HydrophobicContact CE1-CD2 4.01Å; F285-F334 HydrophobicContact CE2-CB 3.75Å; F285-F334 HydrophobicContact CE2-CD2 4.02Å; F285-F334 HydrophobicContact CE2-CG 4.41Å; F285-F334 HydrophobicContact CG-CD2 4.02Å; F285-F334 HydrophobicContact CZ-CB 4.32Å; F285-F334 HydrophobicContact CZ-CD2 4.02Å; F285-L337 HydrophobicContact CB-CD2 3.91Å; F285-C345 HydrophobicContact CB-CB 4.44Å; F285-C345 WeakPolarHBondContact O-CA 3.43Å; F285-C345 WeakPolarHBondContact O-CB 3.41Å; F285-I523 HydrophobicContact CE1-CD1 3.73Å; F285-I523 HydrophobicContact CZ-CD1 4.25Å
286	T	97.4	Very high	96.4	Very high	36 Å²	36	57.3 Å²	57.3	22%	0.221	30%	0.295	C	S	.	.	H	α-helix	trans	-93.6	-7.8	174.7	55.8	0	0	0	0	114.3	Y282 A283 V284 Y288 L337	Y282-T286 HydrophobicContact CD1-CG2 4.07Å; Y282-T286 HydrophobicContact CD2-CG2 4.2Å; Y282-T286 HydrophobicContact CE1-CG2 3.61Å; Y282-T286 HydrophobicContact CE2-CG2 3.78Å; Y282-T286 HydrophobicContact CG-CG2 4.34Å; Y282-T286 VanDerWaalsContact CZ-CG2 3.46Å; Y282-T286 WeakPolarHBondContact O-CG2 3.47Å; Y282-T286 PolarHBondContact O-N 3.34Å; Y282-T286 PolarHBondContact O-OG1 3.42Å; A283-T286 WeakPolarHBondContact CA-OG1 3.38Å; A283-T286 PolarHBondContact O-N 3.26Å; A283-T286 PolarHBondContact O-OG1 3.34Å; A283-T286 VanDerWaalsContact O-OG1 3.1Å; V284-T286 VanDerWaalsContact C-N 3.31Å; V284-T286 PolarHBondContact O-N 3.1Å; T286-Y288 WeakPolarHBondContact O-CD1 3.24Å; T286-Y288 WeakPolarHBondContact O-CE1 3.43Å; T286-Y288 PolarHBondContact O-N 3.18Å; T286-L337 HydrophobicContact CG2-CD1 3.75Å; T286-L337 HydrophobicContact CG2-CD2 4.36Å
287	D	97.4	Very high	96.6	Very high	61 Å²	61	59.7 Å²	59.7	33%	0.326	30%	0.304	S	S	.	.			trans	-81.6	99.1	173.4	-174.6	-7.6	0	0	0	110.3	A283 V284 T289 H290	A283-D287 PolarHBondContact O-N 3Å; V284-D287 PolarHBondContact O-N 3.06Å; D287-T289 VanDerWaalsContact CG-OG1 3.28Å; D287-T289 PolarHBondContact O-N 3.23Å; D287-T289 VanDerWaalsContact OD1-CB 3.29Å; D287-T289 WeakPolarHBondContact OD1-CB 3.47Å; D287-T289 WeakPolarHBondContact OD1-CG2 3.47Å; D287-T289 PolarHBondContact OD1-N 2.82Å; D287-T289 PolarHBondContact OD1-OG1 2.94Å; D287-T289 PolarHBondContact OD2-OG1 3.41Å; D287-H290 WeakPolarHBondContact O-CB 3.5Å; D287-H290 PolarHBondContact O-N 3.35Å
288	Y	96.6	Very high	96.7	Very high	103 Å²	103	60.2 Å²	60.2	40%	0.404	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-3.9	-178.8	-48	-37.9	0	0	0	113.8	T286 R344 G347	T286-Y288 WeakPolarHBondContact O-CD1 3.24Å; T286-Y288 WeakPolarHBondContact O-CE1 3.43Å; T286-Y288 PolarHBondContact O-N 3.18Å; Y288-R344 WeakPolarHBondContact CE1-O 3.5Å; Y288-G347 VanDerWaalsContact CD1-CA 3.41Å
289	T	95.8	Very high	96.8	Very high	121 Å²	121	60.4 Å²	60.4	74%	0.742	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.2	172.7	71.2	0	0	0	0	112.2	D287	D287-T289 VanDerWaalsContact CG-OG1 3.28Å; D287-T289 PolarHBondContact O-N 3.23Å; D287-T289 VanDerWaalsContact OD1-CB 3.29Å; D287-T289 WeakPolarHBondContact OD1-CB 3.47Å; D287-T289 WeakPolarHBondContact OD1-CG2 3.47Å; D287-T289 PolarHBondContact OD1-N 2.82Å; D287-T289 PolarHBondContact OD1-OG1 2.94Å; D287-T289 PolarHBondContact OD2-OG1 3.41Å
290	H	96.3	Very high	96.8	Very high	37 Å²	37	55.4 Å²	55.4	17%	0.171	29%	0.287	C	S	.	.			trans	-70.4	130	178.1	-80.4	-53.5	0	0	0	113.9	V284 D287 S294 R295	V284-H290 PolarHBondContact O-CD2 3.32Å; D287-H290 WeakPolarHBondContact O-CB 3.5Å; D287-H290 PolarHBondContact O-N 3.35Å; H290-S294 WeakPolarHBondContact ND1-CB 3.35Å; H290-S294 PolarHBondContact ND1-OG 3.21Å; H290-S294 VanDerWaalsContact ND1-OG 3.14Å; H290-R295 HydrophobicContact CB-CB 4Å; H290-R295 PolarHBondContact O-NH2 3.45Å
291	D	95.4	Very high	96.8	Very high	70 Å²	70	57.3 Å²	57.3	37%	0.374	30%	0.298	S	S	.	.			trans	-85.1	-173	160.4	71	10.1	0	0	0	111.5	I293 S294 R295	D291-I293 PolarHBondContact OD1-N 3.4Å; D291-I293 VanDerWaalsContact OD1-N 3.12Å; D291-S294 PolarHBondContact N-OG 2.93Å; D291-S294 VanDerWaalsContact OD1-CB 3.31Å; D291-S294 WeakPolarHBondContact OD1-CB 3.19Å; D291-S294 PolarHBondContact OD1-N 3.5Å; D291-S294 PolarHBondContact OD1-OG 3.46Å; D291-R295 WeakPolarHBondContact O-CB 3.33Å; D291-R295 PolarHBondContact O-N 3.33Å; D291-R295 PolarHBondContact O-NH1 3.19Å; D291-R295 VanDerWaalsContact O-NH1 3.11Å
292	K	95	Very high	96.8	Very high	42 Å²	42	57.6 Å²	57.6	18%	0.183	30%	0.3	C	S	.	.	H	α-helix	trans	-55	-56	175.9	-175	-172.7	173.4	-169.5	0	112.6	R295 D296 Q376 S465 N466	K292-R295 PolarHBondContact O-N 3.34Å; K292-D296 WeakPolarHBondContact O-CB 3.42Å; K292-D296 PolarHBondContact O-N 2.88Å; K292-Q376 VanDerWaalsContact CB-OE1 3.3Å; K292-S465 PolarHBondContact NZ-O 3.44Å; K292-N466 HydrophobicContact CD-CB 4Å
293	I	95.7	Very high	96.7	Very high	84 Å²	84	56.7 Å²	56.7	43%	0.431	30%	0.296	S	S	.	.	H	α-helix	trans	-69.8	-48.7	-168	-63.5	175.1	0	0	0	110.1	D291 R295 D296 E297	D291-I293 PolarHBondContact OD1-N 3.4Å; D291-I293 VanDerWaalsContact OD1-N 3.12Å; I293-R295 VanDerWaalsContact C-N 3.28Å; I293-R295 PolarHBondContact O-N 2.97Å; I293-D296 PolarHBondContact O-N 2.81Å; I293-D296 VanDerWaalsContact O-N 3.17Å; I293-E297 HydrophobicContact CG2-CG 4.32Å; I293-E297 WeakPolarHBondContact CG2-OE1 3.34Å; I293-E297 WeakPolarHBondContact O-CB 3.23Å; I293-E297 WeakPolarHBondContact O-CG 3.24Å; I293-E297 PolarHBondContact O-N 3.2Å
294	S	97.3	Very high	96.6	Very high	37 Å²	37	57.8 Å²	57.8	26%	0.259	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-35.5	178.8	59.6	0	0	0	0	112.5	H290 D291 A298	H290-S294 WeakPolarHBondContact ND1-CB 3.35Å; H290-S294 PolarHBondContact ND1-OG 3.21Å; H290-S294 VanDerWaalsContact ND1-OG 3.14Å; D291-S294 PolarHBondContact N-OG 2.93Å; D291-S294 VanDerWaalsContact OD1-CB 3.31Å; D291-S294 WeakPolarHBondContact OD1-CB 3.19Å; D291-S294 PolarHBondContact OD1-N 3.5Å; D291-S294 PolarHBondContact OD1-OG 3.46Å; S294-A298 VanDerWaalsContact O-CB 3.26Å; S294-A298 WeakPolarHBondContact O-CB 3.26Å; S294-A298 PolarHBondContact O-N 3Å
295	R	97.6	Very high	96.5	Very high	5 Å²	5	60 Å²	60	2%	0.019	30%	0.303	C	S	.	.	H	α-helix	trans	-65.7	-48	173.2	-166.1	-176.1	-64.6	95.7	4	111.3	V284 H290 D291 K292 I293 E297 A298 I299 C345	V284-R295 HydrophobicContact CG1-CG 4.08Å; H290-R295 HydrophobicContact CB-CB 4Å; H290-R295 PolarHBondContact O-NH2 3.45Å; D291-R295 WeakPolarHBondContact O-CB 3.33Å; D291-R295 PolarHBondContact O-N 3.33Å; D291-R295 PolarHBondContact O-NH1 3.19Å; D291-R295 VanDerWaalsContact O-NH1 3.11Å; K292-R295 PolarHBondContact O-N 3.34Å; I293-R295 VanDerWaalsContact C-N 3.28Å; I293-R295 PolarHBondContact O-N 2.97Å; R295-E297 VanDerWaalsContact C-N 3.32Å; R295-E297 PolarHBondContact O-N 3.18Å; R295-A298 PolarHBondContact O-N 3.21Å; R295-I299 WeakPolarHBondContact O-CB 3.25Å; R295-I299 WeakPolarHBondContact O-CG1 3.22Å; R295-I299 PolarHBondContact O-N 3.13Å; R295-C345 PolarHBondContact NH2-O 2.68Å
296	D	96	Very high	96.3	Very high	75 Å²	75	59.9 Å²	59.9	40%	0.401	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-40.7	-178.6	-68.9	-12.7	0	0	0	110.6	K292 I293 N300	K292-D296 WeakPolarHBondContact O-CB 3.42Å; K292-D296 PolarHBondContact O-N 2.88Å; I293-D296 PolarHBondContact O-N 2.81Å; I293-D296 VanDerWaalsContact O-N 3.17Å; D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.33Å
297	E	97	Very high	96	Very high	128 Å²	128	59.1 Å²	59.1	60%	0.598	30%	0.297	S	S	*	.	H	α-helix	trans	-64.6	-44.6	174	-73.1	176.3	177.7	0	0	112.5	I293 R295 N300 K301	I293-E297 HydrophobicContact CG2-CG 4.32Å; I293-E297 WeakPolarHBondContact CG2-OE1 3.34Å; I293-E297 WeakPolarHBondContact O-CB 3.23Å; I293-E297 WeakPolarHBondContact O-CG 3.24Å; I293-E297 PolarHBondContact O-N 3.2Å; R295-E297 VanDerWaalsContact C-N 3.32Å; R295-E297 PolarHBondContact O-N 3.18Å; E297-N300 PolarHBondContact O-N 2.85Å; E297-K301 PolarHBondContact O-N 3.46Å
298	A	97.5	Very high	95.9	Very high	24 Å²	24	62.3 Å²	62.3	20%	0.198	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-46.2	178.3	0	0	0	0	0	111.7	V284 S294 R295 N300 K301 V302	V284-A298 HydrophobicContact CG1-CB 3.81Å; V284-A298 HydrophobicContact CG2-CB 4.01Å; S294-A298 VanDerWaalsContact O-CB 3.26Å; S294-A298 WeakPolarHBondContact O-CB 3.26Å; S294-A298 PolarHBondContact O-N 3Å; R295-A298 PolarHBondContact O-N 3.21Å; A298-N300 VanDerWaalsContact C-N 3.33Å; A298-N300 PolarHBondContact O-N 2.79Å; A298-K301 WeakPolarHBondContact O-CB 3.42Å; A298-K301 PolarHBondContact O-N 3.4Å; A298-V302 WeakPolarHBondContact O-CG2 3.38Å; A298-V302 PolarHBondContact O-N 3.24Å; A298-V302 VanDerWaalsContact O-N 3.16Å
299	I	96.8	Very high	95.7	Very high	23 Å²	23	59.6 Å²	59.6	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-41.5	174	-70.5	-59.7	0	0	0	110.8	I281 V284 F285 R295 K301 V302 R303 F326	I281-I299 HydrophobicContact CG2-CD1 4.24Å; V284-I299 HydrophobicContact CB-CD1 3.88Å; V284-I299 HydrophobicContact CG1-CD1 3.63Å; V284-I299 HydrophobicContact CG1-CG1 3.76Å; V284-I299 HydrophobicContact CG2-CD1 4.45Å; F285-I299 HydrophobicContact CD1-CD1 4.2Å; F285-I299 HydrophobicContact CE1-CD1 3.61Å; F285-I299 HydrophobicContact CE1-CG1 3.76Å; F285-I299 HydrophobicContact CE2-CD1 4.31Å; F285-I299 HydrophobicContact CZ-CD1 3.67Å; F285-I299 HydrophobicContact CZ-CG1 4.12Å; R295-I299 WeakPolarHBondContact O-CB 3.25Å; R295-I299 WeakPolarHBondContact O-CG1 3.22Å; R295-I299 PolarHBondContact O-N 3.13Å; I299-K301 VanDerWaalsContact C-N 3.31Å; I299-K301 PolarHBondContact O-N 3.14Å; I299-V302 PolarHBondContact O-N 2.64Å; I299-R303 WeakPolarHBondContact O-CB 3.21Å; I299-R303 PolarHBondContact O-N 2.82Å; I299-F326 HydrophobicContact CG2-CE1 4Å; I299-F326 HydrophobicContact CG2-CZ 3.92Å
300	N	96.6	Very high	95.6	Very high	61 Å²	61	53.8 Å²	53.8	33%	0.326	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-36.8	178.2	-174.9	57.4	0	0	0	112.4	D296 E297 A298 R303 L304	D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.33Å; E297-N300 PolarHBondContact O-N 2.85Å; A298-N300 VanDerWaalsContact C-N 3.33Å; A298-N300 PolarHBondContact O-N 2.79Å; N300-R303 WeakPolarHBondContact O-CB 3.35Å; N300-R303 PolarHBondContact O-N 2.9Å; N300-R303 VanDerWaalsContact OD1-CZ 3.26Å; N300-R303 PolarHBondContact OD1-NE 3.5Å; N300-R303 PolarHBondContact OD1-NH2 2.91Å; N300-L304 WeakPolarHBondContact O-CG 3.43Å; N300-L304 PolarHBondContact O-N 2.86Å
301	K	97.1	Very high	95.3	Very high	133 Å²	133	57.5 Å²	57.5	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-61.8	-48.1	173.4	-176.1	-179.9	177.6	-177.6	0	111.2	E297 A298 I299 R303 L304 E305	E297-K301 PolarHBondContact O-N 3.46Å; A298-K301 WeakPolarHBondContact O-CB 3.42Å; A298-K301 PolarHBondContact O-N 3.4Å; I299-K301 VanDerWaalsContact C-N 3.31Å; I299-K301 PolarHBondContact O-N 3.14Å; K301-R303 VanDerWaalsContact C-N 3.26Å; K301-R303 PolarHBondContact O-N 3Å; K301-L304 PolarHBondContact O-N 3.09Å; K301-E305 WeakPolarHBondContact CE-OE1 3.48Å; K301-E305 WeakPolarHBondContact O-CG 3.3Å; K301-E305 PolarHBondContact O-N 3.2Å
302	V	96.4	Very high	95.2	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-37.9	176.2	-176.2	0	0	0	0	110.8	F277 R280 I281 A298 I299 T306 F326	F277-V302 HydrophobicContact CB-CG1 4.35Å; F277-V302 HydrophobicContact CD1-CG1 3.95Å; R280-V302 HydrophobicContact CB-CG1 4.35Å; R280-V302 HydrophobicContact CB-CG2 4.45Å; I281-V302 HydrophobicContact CG1-CG1 4.03Å; A298-V302 WeakPolarHBondContact O-CG2 3.38Å; A298-V302 PolarHBondContact O-N 3.24Å; A298-V302 VanDerWaalsContact O-N 3.16Å; I299-V302 PolarHBondContact O-N 2.64Å; V302-T306 WeakPolarHBondContact O-CB 3.19Å; V302-T306 PolarHBondContact O-N 2.68Å; V302-T306 PolarHBondContact O-OG1 2.89Å; V302-F326 HydrophobicContact CB-CE2 4.4Å; V302-F326 HydrophobicContact CG1-CE2 4.04Å
303	R	95.8	Very high	95.1	Very high	70 Å²	70	65.7 Å²	65.7	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-59.1	-52.5	175.8	-175.8	178.8	67.6	100.5	-7	111.8	I299 N300 K301 E305 T306 E307 F326	I299-R303 WeakPolarHBondContact O-CB 3.21Å; I299-R303 PolarHBondContact O-N 2.82Å; N300-R303 WeakPolarHBondContact O-CB 3.35Å; N300-R303 PolarHBondContact O-N 2.9Å; N300-R303 VanDerWaalsContact OD1-CZ 3.26Å; N300-R303 PolarHBondContact OD1-NE 3.5Å; N300-R303 PolarHBondContact OD1-NH2 2.91Å; K301-R303 VanDerWaalsContact C-N 3.26Å; K301-R303 PolarHBondContact O-N 3Å; R303-E305 VanDerWaalsContact C-N 3.33Å; R303-E305 PolarHBondContact O-N 3.34Å; R303-T306 CarbonylContact O-C 3.57Å; R303-T306 WeakPolarHBondContact O-CA 3.28Å; R303-T306 WeakPolarHBondContact O-CB 3.36Å; R303-T306 PolarHBondContact O-N 3.42Å; R303-T306 VanDerWaalsContact O-N 3.1Å; R303-E307 HydrophobicContact CG-CG 4.31Å; R303-E307 WeakPolarHBondContact CG-OE1 3.37Å; R303-E307 IonicContact CZ-OE1 2.67Å; R303-E307 IonicContact NE-OE1 3.28Å; R303-E307 IonicContact NH1-OE1 3.38Å; R303-E307 PolarHBondContact NH1-OE1 2.76Å; R303-E307 WeakPolarHBondContact O-CG 3.43Å; R303-E307 PolarHBondContact O-N 3.02Å; R303-F326 HydrophobicContact CB-CD1 3.86Å; R303-F326 HydrophobicContact CB-CD2 4.37Å; R303-F326 HydrophobicContact CB-CE1 3.52Å; R303-F326 HydrophobicContact CB-CE2 4.06Å; R303-F326 HydrophobicContact CB-CG 4.26Å; R303-F326 HydrophobicContact CB-CZ 3.62Å; R303-F326 HydrophobicContact CG-CD1 3.58Å; R303-F326 HydrophobicContact CG-CE1 3.76Å; R303-F326 HydrophobicContact CG-CG 3.99Å; R303-F326 HydrophobicContact CG-CZ 4.3Å
304	L	96.1	Very high	95	Very high	77 Å²	77	63 Å²	63	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-44.2	-178.2	-69.6	172.8	0	0	0	111.7	N300 K301 T306 E307 E308	N300-L304 WeakPolarHBondContact O-CG 3.43Å; N300-L304 PolarHBondContact O-N 2.86Å; K301-L304 PolarHBondContact O-N 3.09Å; L304-T306 VanDerWaalsContact C-N 3.31Å; L304-T306 PolarHBondContact O-N 2.95Å; L304-E307 PolarHBondContact O-N 3.3Å; L304-E308 WeakPolarHBondContact O-CG 3.34Å; L304-E308 PolarHBondContact O-N 2.82Å
305	E	94.8	Very high	94.6	Very high	63 Å²	63	66 Å²	66	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-37.1	175.7	-65.3	175.4	-152.5	0	0	112.2	F277 R280 K301 R303 N309	F277-E305 HydrophobicContact CE1-CB 4.32Å; R280-E305 IonicContact CZ-OE2 3.28Å; R280-E305 IonicContact NH1-OE2 2.68Å; R280-E305 PolarHBondContact NH1-OE2 3.16Å; R280-E305 IonicContact NH2-OE1 2.96Å; R280-E305 PolarHBondContact NH2-OE1 3.34Å; R280-E305 IonicContact NH2-OE2 3.91Å; R280-E305 PolarHBondContact NH2-OE2 3.34Å; K301-E305 WeakPolarHBondContact CE-OE1 3.48Å; K301-E305 WeakPolarHBondContact O-CG 3.3Å; K301-E305 PolarHBondContact O-N 3.2Å; R303-E305 VanDerWaalsContact C-N 3.33Å; R303-E305 PolarHBondContact O-N 3.34Å; E305-N309 WeakPolarHBondContact O-CB 3.29Å; E305-N309 PolarHBondContact O-N 2.76Å; E305-N309 VanDerWaalsContact O-N 3.09Å
306	T	93.1	Very high	94.3	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.4	-45.4	174.7	-57.4	0	0	0	0	111.1	V273 F277 V302 R303 L304 E308 N309 I310 F326	V273-T306 HydrophobicContact CB-CG2 4.46Å; V273-T306 HydrophobicContact CG1-CG2 3.85Å; V273-T306 HydrophobicContact CG2-CG2 3.79Å; F277-T306 VanDerWaalsContact CD1-OG1 3.29Å; F277-T306 WeakPolarHBondContact CD1-OG1 3.42Å; F277-T306 HydrophobicContact CD2-CG2 3.89Å; F277-T306 HydrophobicContact CE2-CG2 4.04Å; F277-T306 HydrophobicContact CG-CG2 4.39Å; F277-T306 VanDerWaalsContact CG-OG1 3.27Å; F277-T306 WeakPolarHBondContact CG-OG1 3.47Å; V302-T306 WeakPolarHBondContact O-CB 3.19Å; V302-T306 PolarHBondContact O-N 2.68Å; V302-T306 PolarHBondContact O-OG1 2.89Å; R303-T306 CarbonylContact O-C 3.57Å; R303-T306 WeakPolarHBondContact O-CA 3.28Å; R303-T306 WeakPolarHBondContact O-CB 3.36Å; R303-T306 PolarHBondContact O-N 3.42Å; R303-T306 VanDerWaalsContact O-N 3.1Å; L304-T306 VanDerWaalsContact C-N 3.31Å; L304-T306 PolarHBondContact O-N 2.95Å; T306-E308 VanDerWaalsContact C-N 3.33Å; T306-E308 PolarHBondContact O-N 3.35Å; T306-N309 PolarHBondContact O-N 2.98Å; T306-I310 HydrophobicContact CG2-CD1 3.72Å; T306-I310 HydrophobicContact CG2-CG1 4.22Å; T306-I310 VanDerWaalsContact O-CG1 3.27Å; T306-I310 WeakPolarHBondContact O-CG1 3.34Å; T306-I310 PolarHBondContact O-N 2.94Å; T306-F326 HydrophobicContact CG2-CB 4.3Å; T306-F326 HydrophobicContact CG2-CD2 3.94Å
307	E	92.9	Very high	93.9	Very high	20 Å²	20	71.5 Å²	71.5	9%	0.093	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-40.5	179.8	-71.1	-179.9	-167.1	0	0	111.9	R303 L304 K311 V322	R303-E307 HydrophobicContact CG-CG 4.31Å; R303-E307 WeakPolarHBondContact CG-OE1 3.37Å; R303-E307 IonicContact CZ-OE1 2.67Å; R303-E307 IonicContact NE-OE1 3.28Å; R303-E307 IonicContact NH1-OE1 3.38Å; R303-E307 PolarHBondContact NH1-OE1 2.76Å; R303-E307 WeakPolarHBondContact O-CG 3.43Å; R303-E307 PolarHBondContact O-N 3.02Å; L304-E307 PolarHBondContact O-N 3.3Å; E307-K311 WeakPolarHBondContact O-CB 3.06Å; E307-K311 WeakPolarHBondContact O-CD 3.28Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 3.16Å; E307-K311 VanDerWaalsContact O-N 3.11Å; E307-V322 HydrophobicContact CB-CG1 3.95Å; E307-V322 HydrophobicContact CG-CG1 3.91Å
308	E	93.8	Very high	93.5	Very high	128 Å²	128	70.5 Å²	70.5	60%	0.598	34%	0.343	S	S	*	.	H	α-helix	trans	-62.8	-48.1	173.9	-72.5	178	175.7	0	0	111.1	L304 T306 I310 K311 E312	L304-E308 WeakPolarHBondContact O-CG 3.34Å; L304-E308 PolarHBondContact O-N 2.82Å; T306-E308 VanDerWaalsContact C-N 3.33Å; T306-E308 PolarHBondContact O-N 3.35Å; E308-I310 PolarHBondContact O-N 3.21Å; E308-K311 PolarHBondContact O-N 3.41Å; E308-E312 PolarHBondContact O-N 3.21Å; E308-E312 VanDerWaalsContact O-N 3.09Å
309	N	93.9	Very high	93	Very high	46 Å²	46	73.2 Å²	73.2	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-62	-41.6	179.9	-173.6	-97.5	0	0	0	113.1	H272 F277 E305 T306 E312 K313	H272-N309 PolarHBondContact NE2-OD1 3.48Å; F277-N309 HydrophobicContact CE2-CB 4.13Å; F277-N309 HydrophobicContact CZ-CB 3.99Å; E305-N309 WeakPolarHBondContact O-CB 3.29Å; E305-N309 PolarHBondContact O-N 2.76Å; E305-N309 VanDerWaalsContact O-N 3.09Å; T306-N309 PolarHBondContact O-N 2.98Å; N309-E312 PolarHBondContact O-N 3.26Å; N309-K313 WeakPolarHBondContact O-CB 3.47Å; N309-K313 PolarHBondContact O-N 3.43Å
310	I	91.9	Very high	92.6	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-42	177.1	-66	167.9	0	0	0	110.5	V273 T306 E308 E312 K313 F314 V322 S325	V273-I310 HydrophobicContact CG2-CD1 3.48Å; V273-I310 VanDerWaalsContact CG2-CD1 3.48Å; V273-I310 HydrophobicContact CG2-CG1 3.91Å; T306-I310 HydrophobicContact CG2-CD1 3.72Å; T306-I310 HydrophobicContact CG2-CG1 4.22Å; T306-I310 VanDerWaalsContact O-CG1 3.27Å; T306-I310 WeakPolarHBondContact O-CG1 3.34Å; T306-I310 PolarHBondContact O-N 2.94Å; E308-I310 PolarHBondContact O-N 3.21Å; I310-E312 VanDerWaalsContact C-N 3.26Å; I310-E312 PolarHBondContact O-N 3.16Å; I310-K313 PolarHBondContact O-N 3.1Å; I310-F314 HydrophobicContact CG2-CB 4.44Å; I310-F314 HydrophobicContact CG2-CD2 4.05Å; I310-F314 WeakPolarHBondContact O-CA 3.5Å; I310-F314 WeakPolarHBondContact O-CB 3.5Å; I310-F314 PolarHBondContact O-N 3.44Å; I310-V322 HydrophobicContact CB-CG1 4.03Å; I310-V322 HydrophobicContact CD1-CG1 4.06Å; I310-V322 HydrophobicContact CG2-CB 4.29Å; I310-V322 HydrophobicContact CG2-CG1 4.01Å; I310-V322 HydrophobicContact CG2-CG2 3.85Å; I310-S325 WeakPolarHBondContact CD1-OG 3.09Å
311	K	91	Very high	92.3	Very high	114 Å²	114	71.7 Å²	71.7	50%	0.496	35%	0.348	S	S	.	.	H	α-helix	trans	-61.9	-35.4	178.4	-74.5	167.1	-172.5	164.6	0	111.9	E307 E308 P315	E307-K311 WeakPolarHBondContact O-CB 3.06Å; E307-K311 WeakPolarHBondContact O-CD 3.28Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 3.16Å; E307-K311 VanDerWaalsContact O-N 3.11Å; E308-K311 PolarHBondContact O-N 3.41Å; K311-P315 WeakPolarHBondContact O-CA 3.39Å
312	E	92.6	Very high	91.9	Very high	156 Å²	156	65.5 Å²	65.5	73%	0.729	32%	0.322	S	S	*	.	H	α-helix	trans	-69.6	-45.8	174.2	-70.3	-177.9	170.7	0	0	112.4	E308 N309 I310	E308-E312 PolarHBondContact O-N 3.21Å; E308-E312 VanDerWaalsContact O-N 3.09Å; N309-E312 PolarHBondContact O-N 3.26Å; I310-E312 VanDerWaalsContact C-N 3.26Å; I310-E312 PolarHBondContact O-N 3.16Å
313	K	92.6	Very high	91.7	Very high	128 Å²	128	67.4 Å²	67.4	56%	0.557	33%	0.331	S	S	*	.	H	α-helix	trans	-75.5	-36.6	-176.1	-176.1	62	175.2	-177.9	0	113.1	N309 I310 P315	N309-K313 WeakPolarHBondContact O-CB 3.47Å; N309-K313 PolarHBondContact O-N 3.43Å; I310-K313 PolarHBondContact O-N 3.1Å; K313-P315 WeakPolarHBondContact O-CD 3.16Å
314	F	93.4	Very high	91.6	Very high	29 Å²	29	67.3 Å²	67.3	13%	0.127	33%	0.334	C	S	.	.			trans	-125.1	73	-176.7	-56.7	-82.3	0	0	0	110.1	E268 M269 H272 I310 Q316 A317	E268-F314 HydrophobicContact CG-CE1 4.09Å; E268-F314 HydrophobicContact CG-CZ 4.07Å; M269-F314 HydrophobicContact CE-CB 3.97Å; M269-F314 HydrophobicContact CE-CD1 4.23Å; M269-F314 HydrophobicContact CE-CG 4.1Å; M269-F314 HydrophobicContact CG-CD1 4.27Å; M269-F314 HydrophobicContact CG-CD2 3.99Å; M269-F314 HydrophobicContact CG-CE1 4.3Å; M269-F314 HydrophobicContact CG-CE2 4.02Å; M269-F314 HydrophobicContact CG-CG 4.12Å; M269-F314 HydrophobicContact CG-CZ 4.17Å; H272-F314 HydrophobicContact CB-CE2 4.16Å; H272-F314 HydrophobicContact CB-CZ 4.38Å; I310-F314 HydrophobicContact CG2-CB 4.44Å; I310-F314 HydrophobicContact CG2-CD2 4.05Å; I310-F314 WeakPolarHBondContact O-CA 3.5Å; I310-F314 WeakPolarHBondContact O-CB 3.5Å; I310-F314 PolarHBondContact O-N 3.44Å; F314-Q316 PolarHBondContact O-N 3.04Å; F314-A317 HydrophobicContact CB-CB 3.97Å; F314-A317 WeakPolarHBondContact O-CB 3.33Å; F314-A317 PolarHBondContact O-N 3.27Å
315	P	89.9	Confident	91.5	Very high	99 Å²	99	63.6 Å²	63.6	64%	0.643	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.1	-175.5	26.3	-35.7	0	0	0	114.2	K311 K313	K311-P315 WeakPolarHBondContact O-CA 3.39Å; K313-P315 WeakPolarHBondContact O-CD 3.16Å
316	Q	90.7	Very high	91.5	Very high	175 Å²	175	60.8 Å²	60.8	82%	0.818	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	1.3	175.7	-56.3	-59.8	-40	0	0	113	F314	F314-Q316 PolarHBondContact O-N 3.04Å
317	A	88.5	Confident	91.6	Very high	20 Å²	20	62.8 Å²	62.8	17%	0.165	31%	0.312	C	S	.	.			trans	-68.5	133.4	179.9	0	0	0	0	0	111	M269 F314 V322	M269-A317 HydrophobicContact CE-CB 3.49Å; M269-A317 VanDerWaalsContact CE-CB 3.49Å; M269-A317 HydrophobicContact SD-CB 4.13Å; F314-A317 HydrophobicContact CB-CB 3.97Å; F314-A317 WeakPolarHBondContact O-CB 3.33Å; F314-A317 PolarHBondContact O-N 3.27Å; A317-V322 HydrophobicContact CB-CG2 3.78Å
318	E	88.3	Confident	91.6	Very high	107 Å²	107	63.6 Å²	63.6	50%	0.5	32%	0.322	S	S	.	.			trans	-70.7	146.8	173.6	-70.1	-69.4	148.8	0	0	110.2	F320 E321 V322	E318-F320 PolarHBondContact O-N 2.79Å; E318-E321 HydrophobicContact CB-CG 4.22Å; E318-E321 PolarHBondContact N-OE2 3.02Å; E318-E321 WeakPolarHBondContact O-CB 3.48Å; E318-E321 PolarHBondContact O-N 3.09Å; E318-V322 PolarHBondContact O-N 3.14Å
319	P	86.2	Confident	91.8	Very high	81 Å²	81	57.5 Å²	57.5	53%	0.526	29%	0.293	S	S	.	.	H	α-helix	trans	-53.1	-34.1	-178.7	-28.6	34.8	0	0	0	114.4	I323	P319-I323 WeakPolarHBondContact O-CG1 3.26Å; P319-I323 PolarHBondContact O-N 2.92Å
320	F	88.4	Confident	91.9	Very high	22 Å²	22	55.8 Å²	55.8	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-64.3	-44.4	174.5	172.4	-96.8	0	0	0	112.5	Q80 F133 F263 E318 V322 I323 E324	Q80-F320 HydrophobicContact CB-CD2 4.02Å; Q80-F320 HydrophobicContact CB-CE2 4.48Å; Q80-F320 HydrophobicContact CG-CD2 4.1Å; F133-F320 HydrophobicContact CE2-CD2 4.14Å; F133-F320 HydrophobicContact CE2-CE1 4.37Å; F133-F320 AromaticContact CE2-CE2 3.43Å; F133-F320 HydrophobicContact CE2-CE2 3.43Å; F133-F320 VanDerWaalsContact CE2-CE2 3.43Å; F133-F320 AromaticContact CE2-CZ 3.56Å; F133-F320 HydrophobicContact CE2-CZ 3.56Å; F133-F320 AromaticContact CZ-CE2 3.88Å; F133-F320 HydrophobicContact CZ-CE2 3.88Å; F133-F320 AromaticContact CZ-CZ 3.88Å; F133-F320 HydrophobicContact CZ-CZ 3.88Å; F263-F320 HydrophobicContact CB-CD1 4.25Å; F263-F320 HydrophobicContact CB-CE1 3.67Å; F263-F320 HydrophobicContact CB-CZ 4.06Å; F263-F320 HydrophobicContact CD1-CD1 4.03Å; F263-F320 HydrophobicContact CD1-CE1 4.3Å; F263-F320 HydrophobicContact CD1-CG 4.43Å; F263-F320 HydrophobicContact CG-CE1 4.48Å; E318-F320 PolarHBondContact O-N 2.79Å; F320-V322 VanDerWaalsContact C-N 3.29Å; F320-V322 PolarHBondContact O-N 2.8Å; F320-I323 PolarHBondContact O-N 2.79Å; F320-E324 HydrophobicContact CE1-CB 4.12Å; F320-E324 HydrophobicContact CE1-CG 4.28Å; F320-E324 HydrophobicContact CE2-CB 4.15Å; F320-E324 HydrophobicContact CE2-CG 4.41Å; F320-E324 HydrophobicContact CZ-CB 3.88Å; F320-E324 HydrophobicContact CZ-CG 3.84Å; F320-E324 VanDerWaalsContact O-CB 3.23Å; F320-E324 WeakPolarHBondContact O-CB 3.43Å; F320-E324 PolarHBondContact O-N 3.27Å
321	E	90.6	Very high	92.1	Very high	30 Å²	30	59.7 Å²	59.7	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-37.9	-178	-67.3	168.4	-177.6	0	0	110.8	M269 E318 S325	M269-E321 HydrophobicContact SD-CB 4.22Å; E318-E321 HydrophobicContact CB-CG 4.22Å; E318-E321 PolarHBondContact N-OE2 3.02Å; E318-E321 WeakPolarHBondContact O-CB 3.48Å; E318-E321 PolarHBondContact O-N 3.09Å; E321-S325 VanDerWaalsContact O-CB 3.28Å; E321-S325 WeakPolarHBondContact O-CB 3.45Å; E321-S325 PolarHBondContact O-N 2.97Å; E321-S325 PolarHBondContact O-OG 2.87Å
322	V	89.9	Confident	92.3	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-55.8	174.6	-177.3	0	0	0	0	110.7	E307 I310 A317 E318 F320 E324 S325	E307-V322 HydrophobicContact CB-CG1 3.95Å; E307-V322 HydrophobicContact CG-CG1 3.91Å; I310-V322 HydrophobicContact CB-CG1 4.03Å; I310-V322 HydrophobicContact CD1-CG1 4.06Å; I310-V322 HydrophobicContact CG2-CB 4.29Å; I310-V322 HydrophobicContact CG2-CG1 4.01Å; I310-V322 HydrophobicContact CG2-CG2 3.85Å; A317-V322 HydrophobicContact CB-CG2 3.78Å; E318-V322 PolarHBondContact O-N 3.14Å; F320-V322 VanDerWaalsContact C-N 3.29Å; F320-V322 PolarHBondContact O-N 2.8Å; V322-E324 PolarHBondContact O-N 3.4Å; V322-S325 PolarHBondContact O-N 3.04Å; V322-S325 PolarHBondContact O-OG 3.42Å
323	I	91.4	Very high	92.5	Very high	46 Å²	46	50.6 Å²	50.6	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-45.6	-177.3	-66.4	167.6	0	0	0	110.7	P319 F320 S325 F326 N327	P319-I323 WeakPolarHBondContact O-CG1 3.26Å; P319-I323 PolarHBondContact O-N 2.92Å; F320-I323 PolarHBondContact O-N 2.79Å; I323-S325 VanDerWaalsContact C-N 3.32Å; I323-S325 PolarHBondContact O-N 3.21Å; I323-F326 PolarHBondContact O-N 3.21Å; I323-N327 PolarHBondContact O-N 3.11Å; I323-N327 VanDerWaalsContact O-N 3.07Å; I323-N327 PolarHBondContact O-ND2 3.16Å
324	E	92.6	Very high	92.8	Very high	68 Å²	68	44.5 Å²	44.5	32%	0.318	24%	0.236	S	C	.	.	H	α-helix	trans	-71.8	-27.6	-174.6	-171.3	63.2	-172.8	0	0	112.3	V265 F320 V322 F326 N327 A328	V265-E324 HydrophobicContact CG2-CB 3.44Å; V265-E324 VanDerWaalsContact CG2-CB 3.44Å; V265-E324 HydrophobicContact CG2-CG 3.43Å; V265-E324 VanDerWaalsContact CG2-CG 3.43Å; F320-E324 HydrophobicContact CE1-CB 4.12Å; F320-E324 HydrophobicContact CE1-CG 4.28Å; F320-E324 HydrophobicContact CE2-CB 4.15Å; F320-E324 HydrophobicContact CE2-CG 4.41Å; F320-E324 HydrophobicContact CZ-CB 3.88Å; F320-E324 HydrophobicContact CZ-CG 3.84Å; F320-E324 VanDerWaalsContact O-CB 3.23Å; F320-E324 WeakPolarHBondContact O-CB 3.43Å; F320-E324 PolarHBondContact O-N 3.27Å; V322-E324 PolarHBondContact O-N 3.4Å; E324-F326 PolarHBondContact O-N 2.96Å; E324-N327 PolarHBondContact O-N 2.73Å; E324-N327 PolarHBondContact OE2-ND2 3.4Å; E324-N327 VanDerWaalsContact OE2-ND2 3.09Å; E324-A328 WeakPolarHBondContact O-CB 3.18Å; E324-A328 PolarHBondContact O-N 3.46Å
325	S	94.3	Very high	93	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-43.2	172.9	72.3	0	0	0	0	112.1	I310 E321 V322 I323 A328 V329	I310-S325 WeakPolarHBondContact CD1-OG 3.09Å; E321-S325 VanDerWaalsContact O-CB 3.28Å; E321-S325 WeakPolarHBondContact O-CB 3.45Å; E321-S325 PolarHBondContact O-N 2.97Å; E321-S325 PolarHBondContact O-OG 2.87Å; V322-S325 PolarHBondContact O-N 3.04Å; V322-S325 PolarHBondContact O-OG 3.42Å; I323-S325 VanDerWaalsContact C-N 3.32Å; I323-S325 PolarHBondContact O-N 3.21Å; S325-A328 PolarHBondContact O-N 2.94Å; S325-V329 WeakPolarHBondContact O-CG2 3.36Å; S325-V329 PolarHBondContact O-N 3.33Å
326	F	95.3	Very high	93.3	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.013	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-45.2	174.1	176.6	-93.9	0	0	0	111.1	I281 I299 V302 R303 T306 I323 E324 A328 V329 S330	I281-F326 HydrophobicContact CD1-CD2 4.29Å; I281-F326 HydrophobicContact CD1-CE2 3.73Å; I281-F326 HydrophobicContact CD1-CZ 4.31Å; I281-F326 HydrophobicContact CG1-CE2 4.14Å; I281-F326 HydrophobicContact CG1-CZ 4.49Å; I299-F326 HydrophobicContact CG2-CE1 4Å; I299-F326 HydrophobicContact CG2-CZ 3.92Å; V302-F326 HydrophobicContact CB-CE2 4.4Å; V302-F326 HydrophobicContact CG1-CE2 4.04Å; R303-F326 HydrophobicContact CB-CD1 3.86Å; R303-F326 HydrophobicContact CB-CD2 4.37Å; R303-F326 HydrophobicContact CB-CE1 3.52Å; R303-F326 HydrophobicContact CB-CE2 4.06Å; R303-F326 HydrophobicContact CB-CG 4.26Å; R303-F326 HydrophobicContact CB-CZ 3.62Å; R303-F326 HydrophobicContact CG-CD1 3.58Å; R303-F326 HydrophobicContact CG-CE1 3.76Å; R303-F326 HydrophobicContact CG-CG 3.99Å; R303-F326 HydrophobicContact CG-CZ 4.3Å; T306-F326 HydrophobicContact CG2-CB 4.3Å; T306-F326 HydrophobicContact CG2-CD2 3.94Å; I323-F326 PolarHBondContact O-N 3.21Å; E324-F326 PolarHBondContact O-N 2.96Å; F326-A328 VanDerWaalsContact C-N 3.3Å; F326-A328 PolarHBondContact O-N 3.45Å; F326-V329 PolarHBondContact O-N 2.8Å; F326-S330 VanDerWaalsContact O-CB 3.23Å; F326-S330 WeakPolarHBondContact O-CB 3.49Å; F326-S330 PolarHBondContact O-N 3.44Å
327	N	94.8	Very high	93.5	Very high	43 Å²	43	34.6 Å²	34.6	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-41.8	178.3	-68.6	-23.2	0	0	0	112	I323 E324 S330 K331	I323-N327 PolarHBondContact O-N 3.11Å; I323-N327 VanDerWaalsContact O-N 3.07Å; I323-N327 PolarHBondContact O-ND2 3.16Å; E324-N327 PolarHBondContact O-N 2.73Å; E324-N327 PolarHBondContact OE2-ND2 3.4Å; E324-N327 VanDerWaalsContact OE2-ND2 3.09Å; N327-S330 PolarHBondContact O-N 3.42Å; N327-K331 VanDerWaalsContact O-CB 3.22Å; N327-K331 WeakPolarHBondContact O-CB 3.36Å; N327-K331 PolarHBondContact O-N 3.35Å
328	A	94.4	Very high	93.9	Very high	36 Å²	36	33.7 Å²	33.7	30%	0.298	17%	0.174	S	C	.	.	H	α-helix	trans	-62.3	-49.2	178.9	0	0	0	0	0	111.4	E324 S325 F326 K331 E332	E324-A328 WeakPolarHBondContact O-CB 3.18Å; E324-A328 PolarHBondContact O-N 3.46Å; S325-A328 PolarHBondContact O-N 2.94Å; F326-A328 VanDerWaalsContact C-N 3.3Å; F326-A328 PolarHBondContact O-N 3.45Å; A328-K331 PolarHBondContact O-N 3.46Å; A328-E332 WeakPolarHBondContact O-CB 3.46Å; A328-E332 PolarHBondContact O-N 2.91Å
329	V	96.4	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-42.7	177.8	176.3	0	0	0	0	111.3	V270 V273 R274 A278 I281 S325 F326 K331 E332 V333	V270-V329 HydrophobicContact CG1-CG2 3.79Å; V270-V329 WeakPolarHBondContact O-CG2 3.45Å; V273-V329 HydrophobicContact CB-CG2 3.96Å; V273-V329 HydrophobicContact CG1-CB 3.91Å; V273-V329 HydrophobicContact CG1-CG1 4.18Å; V273-V329 HydrophobicContact CG1-CG2 3.75Å; R274-V329 HydrophobicContact CB-CG1 4.35Å; R274-V329 HydrophobicContact CB-CG2 4.19Å; A278-V329 HydrophobicContact CB-CG1 4.31Å; I281-V329 HydrophobicContact CD1-CG1 4.14Å; S325-V329 WeakPolarHBondContact O-CG2 3.36Å; S325-V329 PolarHBondContact O-N 3.33Å; F326-V329 PolarHBondContact O-N 2.8Å; V329-K331 VanDerWaalsContact C-N 3.33Å; V329-K331 PolarHBondContact O-N 2.91Å; V329-E332 WeakPolarHBondContact O-CB 3.4Å; V329-E332 PolarHBondContact O-N 2.75Å; V329-V333 HydrophobicContact CG1-CG2 4.16Å; V329-V333 VanDerWaalsContact O-CG2 3.31Å; V329-V333 WeakPolarHBondContact O-CG2 3.16Å; V329-V333 PolarHBondContact O-N 3.16Å
330	S	96.8	Very high	94.8	Very high	10 Å²	10	30.5 Å²	30.5	7%	0.07	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-44.4	177.3	-176.3	0	0	0	0	111.8	F326 N327 F334	F326-S330 VanDerWaalsContact O-CB 3.23Å; F326-S330 WeakPolarHBondContact O-CB 3.49Å; F326-S330 PolarHBondContact O-N 3.44Å; N327-S330 PolarHBondContact O-N 3.42Å; S330-F334 WeakPolarHBondContact O-CB 3.41Å; S330-F334 PolarHBondContact O-N 2.89Å
331	K	96.2	Very high	95.2	Very high	82 Å²	82	33.4 Å²	33.4	36%	0.357	17%	0.17	S	C	.	.	H	α-helix	trans	-61.5	-44.9	173.5	-177.2	171.2	180	175.1	0	111.8	N327 A328 V329 R335 L527	N327-K331 VanDerWaalsContact O-CB 3.22Å; N327-K331 WeakPolarHBondContact O-CB 3.36Å; N327-K331 PolarHBondContact O-N 3.35Å; A328-K331 PolarHBondContact O-N 3.46Å; V329-K331 VanDerWaalsContact C-N 3.33Å; V329-K331 PolarHBondContact O-N 2.91Å; K331-R335 HydrophobicContact CG-CG 4.41Å; K331-R335 WeakPolarHBondContact O-CB 3.36Å; K331-R335 VanDerWaalsContact O-CD 3.26Å; K331-R335 WeakPolarHBondContact O-CD 3.45Å; K331-R335 WeakPolarHBondContact O-CG 3.4Å; K331-R335 PolarHBondContact O-N 2.95Å; K331-L527 HydrophobicContact CB-CD2 3.9Å; K331-L527 HydrophobicContact CD-CD2 4.47Å; K331-L527 WeakPolarHBondContact CE-O 3.31Å; K331-L527 HydrophobicContact CG-CB 4.48Å; K331-L527 HydrophobicContact CG-CD2 4.05Å
332	E	95.6	Very high	95.5	Very high	64 Å²	64	37.6 Å²	37.6	30%	0.299	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-51.8	178.3	-174.4	-170.8	146.2	0	0	111.4	R274 A328 V329 F334 R335 N336	R274-E332 IonicContact CZ-OE1 2.68Å; R274-E332 IonicContact CZ-OE2 2.64Å; R274-E332 IonicContact NE-OE1 2.65Å; R274-E332 PolarHBondContact NE-OE1 3.11Å; R274-E332 IonicContact NE-OE2 3.9Å; R274-E332 PolarHBondContact NE-OE2 3.34Å; R274-E332 VanDerWaalsContact NE-OE2 3.12Å; R274-E332 IonicContact NH2-OE1 3.09Å; R274-E332 IonicContact NH2-OE2 3.57Å; R274-E332 PolarHBondContact NH2-OE2 3.29Å; A328-E332 WeakPolarHBondContact O-CB 3.46Å; A328-E332 PolarHBondContact O-N 2.91Å; V329-E332 WeakPolarHBondContact O-CB 3.4Å; V329-E332 PolarHBondContact O-N 2.75Å; E332-F334 PolarHBondContact O-N 2.83Å; E332-R335 PolarHBondContact O-N 3.02Å; E332-N336 WeakPolarHBondContact O-CB 3.23Å; E332-N336 VanDerWaalsContact O-CG 3.24Å; E332-N336 PolarHBondContact O-N 2.94Å; E332-N336 PolarHBondContact O-ND2 2.87Å
333	V	97.2	Very high	95.8	Very high	15 Å²	15	40.3 Å²	40.3	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-47.3	-179.9	174.5	0	0	0	0	111	A278 I281 Y282 F285 V329 R335 N336 L337	A278-V333 HydrophobicContact CB-CG2 3.9Å; I281-V333 HydrophobicContact CB-CG1 4.43Å; I281-V333 HydrophobicContact CG2-CB 3.97Å; I281-V333 HydrophobicContact CG2-CG1 3.88Å; I281-V333 HydrophobicContact CG2-CG2 4.39Å; Y282-V333 HydrophobicContact CD2-CG1 4.29Å; F285-V333 HydrophobicContact CD2-CG1 4.16Å; V329-V333 HydrophobicContact CG1-CG2 4.16Å; V329-V333 VanDerWaalsContact O-CG2 3.31Å; V329-V333 WeakPolarHBondContact O-CG2 3.16Å; V329-V333 PolarHBondContact O-N 3.16Å; V333-R335 VanDerWaalsContact C-N 3.33Å; V333-R335 PolarHBondContact O-N 3.19Å; V333-N336 PolarHBondContact O-N 3.24Å; V333-L337 PolarHBondContact O-N 3.02Å
334	F	97.6	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.8	-43.8	178.4	-174.2	-90.6	0	0	0	112.5	F285 S330 E332 L337 V338 C345 I500 I523 E524 L527	F285-F334 HydrophobicContact CD1-CD2 4.01Å; F285-F334 HydrophobicContact CD2-CB 4.04Å; F285-F334 HydrophobicContact CD2-CD2 4.02Å; F285-F334 HydrophobicContact CE1-CD2 4.01Å; F285-F334 HydrophobicContact CE2-CB 3.75Å; F285-F334 HydrophobicContact CE2-CD2 4.02Å; F285-F334 HydrophobicContact CE2-CG 4.41Å; F285-F334 HydrophobicContact CG-CD2 4.02Å; F285-F334 HydrophobicContact CZ-CB 4.32Å; F285-F334 HydrophobicContact CZ-CD2 4.02Å; S330-F334 WeakPolarHBondContact O-CB 3.41Å; S330-F334 PolarHBondContact O-N 2.89Å; E332-F334 PolarHBondContact O-N 2.83Å; F334-L337 WeakPolarHBondContact O-CB 3Å; F334-V338 HydrophobicContact CE1-CG2 4.47Å; F334-V338 PolarHBondContact O-N 2.58Å; F334-C345 HydrophobicContact CD2-CB 4.49Å; F334-C345 HydrophobicContact CE2-CB 3.72Å; F334-C345 HydrophobicContact CZ-CB 4.49Å; F334-I500 HydrophobicContact CD1-CD1 4.15Å; F334-I500 HydrophobicContact CE1-CD1 3.91Å; F334-I523 HydrophobicContact CD2-CD1 4.22Å; F334-I523 HydrophobicContact CE2-CD1 4.01Å; F334-I523 HydrophobicContact CE2-CG1 4.14Å; F334-I523 HydrophobicContact CE2-CG2 4.2Å; F334-I523 HydrophobicContact CZ-CG1 4.44Å; F334-I523 HydrophobicContact CZ-CG2 4.21Å; F334-E524 HydrophobicContact CE1-CG 4.05Å; F334-E524 HydrophobicContact CZ-CG 3.61Å; F334-L527 HydrophobicContact CB-CD1 3.7Å; F334-L527 HydrophobicContact CD1-CB 3.98Å; F334-L527 HydrophobicContact CD1-CD1 3.8Å; F334-L527 HydrophobicContact CD2-CD1 3.95Å; F334-L527 HydrophobicContact CE1-CB 4.39Å; F334-L527 HydrophobicContact CE1-CD1 4.44Å; F334-L527 HydrophobicContact CG-CD1 3.53Å
335	R	97.3	Very high	96.3	Very high	32 Å²	32	34.9 Å²	34.9	12%	0.121	17%	0.171	C	C	.	.	H	α-helix	trans	-71.9	-40	-178	-68.2	166.6	71	94.1	-5.1	111.7	K331 E332 V333 L337 V338 L339 I500 S501 L527 D529	K331-R335 HydrophobicContact CG-CG 4.41Å; K331-R335 WeakPolarHBondContact O-CB 3.36Å; K331-R335 VanDerWaalsContact O-CD 3.26Å; K331-R335 WeakPolarHBondContact O-CD 3.45Å; K331-R335 WeakPolarHBondContact O-CG 3.4Å; K331-R335 PolarHBondContact O-N 2.95Å; E332-R335 PolarHBondContact O-N 3.02Å; V333-R335 VanDerWaalsContact C-N 3.33Å; V333-R335 PolarHBondContact O-N 3.19Å; R335-L337 VanDerWaalsContact C-N 3.32Å; R335-L337 PolarHBondContact O-N 2.65Å; R335-V338 PolarHBondContact O-N 3.03Å; R335-L339 WeakPolarHBondContact O-CB 3.2Å; R335-L339 WeakPolarHBondContact O-CG 3.31Å; R335-L339 PolarHBondContact O-N 3.01Å; R335-I500 HydrophobicContact CB-CG2 3.74Å; R335-I500 HydrophobicContact CG-CD1 4.39Å; R335-I500 HydrophobicContact CG-CG2 3.84Å; R335-S501 PolarHBondContact NH2-O 2.97Å; R335-L527 PolarHBondContact NH1-O 3.45Å; R335-D529 IonicContact CZ-OD1 3.24Å; R335-D529 IonicContact CZ-OD2 3.34Å; R335-D529 VanDerWaalsContact NH1-CG 3.31Å; R335-D529 IonicContact NH1-OD1 3.65Å; R335-D529 PolarHBondContact NH1-OD1 2.93Å; R335-D529 IonicContact NH1-OD2 2.73Å; R335-D529 PolarHBondContact NH1-OD2 2.83Å; R335-D529 VanDerWaalsContact NH2-CG 3.31Å; R335-D529 IonicContact NH2-OD1 2.74Å; R335-D529 PolarHBondContact NH2-OD1 2.92Å; R335-D529 VanDerWaalsContact NH2-OD1 3.09Å; R335-D529 IonicContact NH2-OD2 3.66Å; R335-D529 PolarHBondContact NH2-OD2 2.76Å
336	N	96.1	Very high	96.4	Very high	61 Å²	61	36.8 Å²	36.8	33%	0.326	18%	0.181	S	C	.	.	H	α-helix	trans	-63.6	-38.7	177.4	-74	-15.2	0	0	0	111.7	E332 V333 V338 L339 N340	E332-N336 WeakPolarHBondContact O-CB 3.23Å; E332-N336 VanDerWaalsContact O-CG 3.24Å; E332-N336 PolarHBondContact O-N 2.94Å; E332-N336 PolarHBondContact O-ND2 2.87Å; V333-N336 PolarHBondContact O-N 3.24Å; N336-V338 PolarHBondContact O-N 2.97Å; N336-L339 PolarHBondContact O-N 3.26Å; N336-N340 WeakPolarHBondContact O-CB 3.43Å; N336-N340 PolarHBondContact O-N 2.9Å; N336-N340 PolarHBondContact O-ND2 3.05Å
337	L	96.3	Very high	96.4	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-53.2	-53.5	172.4	174.1	65.2	0	0	0	110.9	Y282 F285 T286 V333 F334 R335 L339 E341	Y282-L337 HydrophobicContact CE2-CD1 4.06Å; F285-L337 HydrophobicContact CB-CD2 3.91Å; T286-L337 HydrophobicContact CG2-CD1 3.75Å; T286-L337 HydrophobicContact CG2-CD2 4.36Å; V333-L337 PolarHBondContact O-N 3.02Å; F334-L337 WeakPolarHBondContact O-CB 3Å; R335-L337 VanDerWaalsContact C-N 3.32Å; R335-L337 PolarHBondContact O-N 2.65Å; L337-L339 PolarHBondContact O-N 2.81Å; L337-E341 HydrophobicContact CD1-CB 4.35Å; L337-E341 HydrophobicContact CD1-CG 4.47Å; L337-E341 WeakPolarHBondContact O-CB 3.35Å; L337-E341 PolarHBondContact O-N 2.86Å
338	V	97.4	Very high	96.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-40.3	-177.7	178	0	0	0	0	112.4	F334 R335 N336 Y342 K343 L350 I500 R515 L517	F334-V338 HydrophobicContact CE1-CG2 4.47Å; F334-V338 PolarHBondContact O-N 2.58Å; R335-V338 PolarHBondContact O-N 3.03Å; N336-V338 PolarHBondContact O-N 2.97Å; V338-Y342 WeakPolarHBondContact O-CA 3.35Å; V338-Y342 PolarHBondContact O-N 3.47Å; V338-K343 WeakPolarHBondContact CA-O 2.78Å; V338-L350 HydrophobicContact CG1-CD2 3.85Å; V338-I500 HydrophobicContact CB-CD1 3.78Å; V338-I500 HydrophobicContact CG1-CD1 3.95Å; V338-I500 HydrophobicContact CG2-CD1 3.74Å; V338-R515 HydrophobicContact CG1-CB 4.02Å; V338-R515 HydrophobicContact CG1-CG 4.2Å; V338-L517 HydrophobicContact CG1-CD1 4.48Å; V338-L517 HydrophobicContact CG1-CD2 3.86Å
339	L	96.8	Very high	96.7	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-68.4	-43.5	-179	-74.3	163.6	0	0	0	112.2	R335 N336 L337 I500 K502 R515	R335-L339 WeakPolarHBondContact O-CB 3.2Å; R335-L339 WeakPolarHBondContact O-CG 3.31Å; R335-L339 PolarHBondContact O-N 3.01Å; N336-L339 PolarHBondContact O-N 3.26Å; L337-L339 PolarHBondContact O-N 2.81Å; L339-I500 HydrophobicContact CD1-CG2 4.03Å; L339-I500 HydrophobicContact CD2-CG2 4.33Å; L339-I500 HydrophobicContact CG-CG2 3.91Å; L339-K502 HydrophobicContact CD1-CB 4.2Å; L339-R515 HydrophobicContact CD2-CG 4.11Å; L339-R515 PolarHBondContact O-NE 2.84Å; L339-R515 PolarHBondContact O-NH2 2.98Å
340	N	96.4	Very high	96.8	Very high	115 Å²	115	40.8 Å²	40.8	62%	0.615	20%	0.196	S	C	*	.	H	α-helix	trans	-88.2	-42.2	-170.9	-62	-23.8	0	0	0	112.5	N336 Y342	N336-N340 WeakPolarHBondContact O-CB 3.43Å; N336-N340 PolarHBondContact O-N 2.9Å; N336-N340 PolarHBondContact O-ND2 3.05Å; N340-Y342 WeakPolarHBondContact O-CD2 3.21Å
341	E	95.8	Very high	96.9	Very high	82 Å²	82	44.6 Å²	44.6	38%	0.383	22%	0.219	S	C	.	.	H	α-helix	trans	-100.8	-8.3	-172.3	-66.7	173.7	-130.9	0	0	113.3	Y282 L337 K343	Y282-E341 WeakPolarHBondContact CE2-OE1 3.15Å; Y282-E341 PolarHBondContact OH-OE1 3.47Å; Y282-E341 PolarHBondContact OH-OE2 3.36Å; L337-E341 HydrophobicContact CD1-CB 4.35Å; L337-E341 HydrophobicContact CD1-CG 4.47Å; L337-E341 WeakPolarHBondContact O-CB 3.35Å; L337-E341 PolarHBondContact O-N 2.86Å; E341-K343 HydrophobicContact CB-CB 4.38Å; E341-K343 PolarHBondContact O-N 3.09Å
342	Y	96.4	Very high	97	Very high	119 Å²	119	42.1 Å²	42.1	47%	0.467	21%	0.214	S	C	.	.			trans	57.9	18.9	-178	-59.8	-107.1	0	0	0	113.1	V338 N340 L350 R515	V338-Y342 WeakPolarHBondContact O-CA 3.35Å; V338-Y342 PolarHBondContact O-N 3.47Å; N340-Y342 WeakPolarHBondContact O-CD2 3.21Å; Y342-L350 HydrophobicContact CD1-CD1 3.88Å; Y342-R515 VanDerWaalsContact CE1-CZ 3.47Å; Y342-R515 VanDerWaalsContact CZ-NH2 3.28Å; Y342-R515 PolarHBondContact OH-NH2 3.01Å
343	K	96.5	Very high	97.1	Very high	61 Å²	61	40.4 Å²	40.4	27%	0.265	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-113.5	150	179	-79.9	-65.6	-162.5	178.1	0	110.9	V338 E341 G347 E349	V338-K343 WeakPolarHBondContact CA-O 2.78Å; E341-K343 HydrophobicContact CB-CB 4.38Å; E341-K343 PolarHBondContact O-N 3.09Å; K343-G347 PolarHBondContact NZ-O 3.39Å; K343-E349 WeakPolarHBondContact CE-OE1 3.3Å; K343-E349 IonicContact NZ-OE1 3.12Å; K343-E349 PolarHBondContact NZ-OE1 3.26Å
344	R	97.7	Very high	97.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.			trans	-104.7	164.2	179.8	-62.1	162	66.5	171.9	11	110.6	Y288 D346 G347 R348 E349 A352 L517 T518 D519 E524	Y288-R344 WeakPolarHBondContact CE1-O 3.5Å; R344-D346 PolarHBondContact O-N 2.99Å; R344-G347 PolarHBondContact O-N 2.92Å; R344-R348 WeakPolarHBondContact CB-O 3.36Å; R344-R348 WeakPolarHBondContact CG-O 3.46Å; R344-R348 PolarHBondContact N-O 3Å; R344-R348 VanDerWaalsContact N-O 3.11Å; R344-R348 VanDerWaalsContact NH1-CZ 3.25Å; R344-E349 WeakPolarHBondContact CD-O 3.41Å; R344-E349 PolarHBondContact NH1-O 2.87Å; R344-A352 PolarHBondContact NH1-O 3.42Å; R344-L517 HydrophobicContact CG-CD2 4.13Å; R344-T518 PolarHBondContact NH1-O 3.07Å; R344-T518 PolarHBondContact NH2-O 3.38Å; R344-D519 PolarHBondContact NH2-O 2.79Å; R344-E524 IonicContact CZ-OE1 3.01Å; R344-E524 IonicContact CZ-OE2 2.77Å; R344-E524 IonicContact NE-OE1 3.74Å; R344-E524 PolarHBondContact NE-OE1 2.96Å; R344-E524 IonicContact NE-OE2 3.44Å; R344-E524 IonicContact NH2-OE1 3.82Å; R344-E524 PolarHBondContact NH2-OE1 3.26Å; R344-E524 IonicContact NH2-OE2 3.75Å; R344-E524 PolarHBondContact NH2-OE2 3.22Å
345	C	96.6	Very high	97.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-2.7	-175.9	70.6	0	0	0	0	115.5	F285 R295 F334	F285-C345 HydrophobicContact CB-CB 4.44Å; F285-C345 WeakPolarHBondContact O-CA 3.43Å; F285-C345 WeakPolarHBondContact O-CB 3.41Å; R295-C345 PolarHBondContact NH2-O 2.68Å; F334-C345 HydrophobicContact CD2-CB 4.49Å; F334-C345 HydrophobicContact CE2-CB 3.72Å; F334-C345 HydrophobicContact CZ-CB 4.49Å
346	D	96.6	Very high	97.3	Very high	40 Å²	40	48.8 Å²	48.8	21%	0.214	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	13.8	172.2	65.6	0.2	0	0	0	112	R344 R348 L521	R344-D346 PolarHBondContact O-N 2.99Å; D346-R348 VanDerWaalsContact C-N 3.26Å; D346-R348 PolarHBondContact O-N 2.7Å; D346-R348 WeakPolarHBondContact OD1-CB 3.29Å; D346-R348 PolarHBondContact OD1-N 3.45Å; D346-R348 IonicContact OD1-NE 3.93Å; D346-R348 PolarHBondContact OD1-NE 2.92Å; D346-R348 IonicContact OD2-CZ 3.96Å; D346-R348 IonicContact OD2-NE 2.64Å; D346-R348 PolarHBondContact OD2-NE 3.32Å; D346-R348 IonicContact OD2-NH2 3.94Å; D346-R348 PolarHBondContact OD2-NH2 3.27Å; D346-L521 HydrophobicContact CB-CD1 4.28Å
347	G	96.2	Very high	97.4	Very high	18 Å²	18	48.6 Å²	48.6	19%	0.186	25%	0.247	C	C	.	.	S	Bend	trans	81.5	-6.2	177	0	0	0	0	0	115.3	Y288 K343 R344	Y288-G347 VanDerWaalsContact CD1-CA 3.41Å; K343-G347 PolarHBondContact NZ-O 3.39Å; R344-G347 PolarHBondContact O-N 2.92Å
348	R	97.8	Very high	97.5	Very high	29 Å²	29	49.5 Å²	49.5	11%	0.109	25%	0.253	C	S	.	.			trans	-68.8	153.5	179	-74.4	-171.3	-69.2	153.3	-6.5	112.6	R344 D346 A352 T518 D519	R344-R348 WeakPolarHBondContact CB-O 3.36Å; R344-R348 WeakPolarHBondContact CG-O 3.46Å; R344-R348 PolarHBondContact N-O 3Å; R344-R348 VanDerWaalsContact N-O 3.11Å; R344-R348 VanDerWaalsContact NH1-CZ 3.25Å; D346-R348 VanDerWaalsContact C-N 3.26Å; D346-R348 PolarHBondContact O-N 2.7Å; D346-R348 WeakPolarHBondContact OD1-CB 3.29Å; D346-R348 PolarHBondContact OD1-N 3.45Å; D346-R348 IonicContact OD1-NE 3.93Å; D346-R348 PolarHBondContact OD1-NE 2.92Å; D346-R348 IonicContact OD2-CZ 3.96Å; D346-R348 IonicContact OD2-NE 2.64Å; D346-R348 PolarHBondContact OD2-NE 3.32Å; D346-R348 IonicContact OD2-NH2 3.94Å; D346-R348 PolarHBondContact OD2-NH2 3.27Å; R348-A352 HydrophobicContact CB-CB 4.21Å; R348-A352 HydrophobicContact CG-CB 4.35Å; R348-A352 PolarHBondContact NH1-O 2.87Å; R348-T518 PolarHBondContact NH1-O 2.83Å; R348-D519 PolarHBondContact NH1-O 2.87Å; R348-D519 IonicContact NH1-OD2 2.75Å; R348-D519 PolarHBondContact NH2-O 3.38Å
349	E	97.8	Very high	97.5	Very high	92 Å²	92	54.6 Å²	54.6	43%	0.43	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-70.3	164.3	161.9	-57.5	-56.7	139.5	0	0	110.9	K343 R344 T351 A352	K343-E349 WeakPolarHBondContact CE-OE1 3.3Å; K343-E349 IonicContact NZ-OE1 3.12Å; K343-E349 PolarHBondContact NZ-OE1 3.26Å; R344-E349 WeakPolarHBondContact CD-O 3.41Å; R344-E349 PolarHBondContact NH1-O 2.87Å; E349-T351 VanDerWaalsContact C-N 3.26Å; E349-T351 PolarHBondContact O-N 3.3Å; E349-A352 HydrophobicContact CB-CB 4.3Å; E349-A352 PolarHBondContact O-N 3.33Å
350	L	98.3	Very high	97.6	Very high	27 Å²	27	56.1 Å²	56.1	14%	0.141	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-35.5	-178.8	-53.6	178.7	0	0	0	113.4	V338 Y342 R515 L517 T518	V338-L350 HydrophobicContact CG1-CD2 3.85Å; Y342-L350 HydrophobicContact CD1-CD1 3.88Å; L350-R515 HydrophobicContact CD1-CB 4.23Å; L350-R515 HydrophobicContact CD1-CG 4.28Å; L350-R515 HydrophobicContact CD2-CB 4.32Å; L350-L517 HydrophobicContact CB-CD2 4.36Å; L350-L517 HydrophobicContact CD2-CD2 3.48Å; L350-L517 VanDerWaalsContact CD2-CD2 3.48Å; L350-L517 CarbonylContact O-C 3.53Å; L350-L517 WeakPolarHBondContact O-CA 3.32Å; L350-T518 PolarHBondContact O-N 3.21Å
351	T	98.3	Very high	97.6	Very high	89 Å²	89	53.8 Å²	53.8	55%	0.546	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-7.5	-174.9	55.7	0	0	0	0	114.2	E349 T518	E349-T351 VanDerWaalsContact C-N 3.26Å; E349-T351 PolarHBondContact O-N 3.3Å; T351-T518 WeakPolarHBondContact O-CB 3.39Å; T351-T518 PolarHBondContact O-OG1 3.13Å
352	A	98.1	Very high	97.7	Very high	31 Å²	31	52.3 Å²	52.3	26%	0.256	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-77.6	135.1	-170.9	0	0	0	0	0	113.2	R344 R348 E349	R344-A352 PolarHBondContact NH1-O 3.42Å; R348-A352 HydrophobicContact CB-CB 4.21Å; R348-A352 HydrophobicContact CG-CB 4.35Å; R348-A352 PolarHBondContact NH1-O 2.87Å; E349-A352 HydrophobicContact CB-CB 4.3Å; E349-A352 PolarHBondContact O-N 3.33Å
353	L	98.4	Very high	97.6	Very high	28 Å²	28	52 Å²	52	15%	0.147	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-75.2	151.9	170	-69.8	173.5	0	0	0	111.7	V495 T518 D519 A568 E571 I572	L353-V495 HydrophobicContact CD2-CG2 4.32Å; L353-T518 HydrophobicContact CD2-CG2 3.82Å; L353-T518 HydrophobicContact CG-CG2 4.45Å; L353-D519 HydrophobicContact CD2-CB 3.64Å; L353-A568 HydrophobicContact CD2-CB 4.17Å; L353-E571 HydrophobicContact CD1-CB 3.69Å; L353-I572 HydrophobicContact CD1-CD1 4.41Å; L353-I572 HydrophobicContact CD1-CG1 3.66Å; L353-I572 HydrophobicContact CD2-CD1 4.02Å; L353-I572 HydrophobicContact CD2-CG1 4.1Å
354	R	98.5	Very high	97.4	Very high	18 Å²	18	57.8 Å²	57.8	7%	0.068	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-68.6	163.4	163.6	-65.8	170.1	-70.3	-178.7	-2.3	110.1	I356 R374 N466 G467 D519 I520	R354-I356 PolarHBondContact O-N 3.4Å; R354-R374 HydrophobicContact CB-CG 4.06Å; R354-N466 PolarHBondContact NH1-O 3.36Å; R354-G467 PolarHBondContact NH2-O 2.84Å; R354-D519 VanDerWaalsContact CB-OD2 3.31Å; R354-D519 WeakPolarHBondContact CB-OD2 3.47Å; R354-D519 VanDerWaalsContact CG-OD2 3.3Å; R354-D519 WeakPolarHBondContact CG-OD2 3.27Å; R354-D519 IonicContact CZ-OD1 3.38Å; R354-D519 IonicContact CZ-OD2 3.18Å; R354-D519 PolarHBondContact N-OD2 3.3Å; R354-D519 VanDerWaalsContact NE-CG 3.3Å; R354-D519 IonicContact NE-OD1 2.75Å; R354-D519 PolarHBondContact NE-OD1 2.78Å; R354-D519 IonicContact NE-OD2 2.73Å; R354-D519 PolarHBondContact NE-OD2 2.77Å; R354-D519 IonicContact NH2-OD1 3.09Å; R354-D519 PolarHBondContact NH2-OD1 3.3Å; R354-D519 IonicContact NH2-OD2 2.74Å; R354-I520 PolarHBondContact NH2-O 3.24Å
355	K	98.3	Very high	97.1	Very high	186 Å²	186	63 Å²	63	81%	0.809	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-59.4	132.3	172.1	-172.4	178.2	179.3	-176.7	0	110.1	R374 G375	K355-R374 WeakPolarHBondContact O-CA 3.36Å; K355-G375 PolarHBondContact O-N 3.42Å
356	I	98.8	Very high	97	Very high	19 Å²	19	65.3 Å²	65.3	10%	0.097	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.9	179.4	-63.5	171.3	0	0	0	109.4	R354 F372 Q373 R374 I572 I575	R354-I356 PolarHBondContact O-N 3.4Å; I356-F372 HydrophobicContact CD1-CZ 4.35Å; I356-F372 HydrophobicContact CG2-CD2 4.48Å; I356-F372 HydrophobicContact CG2-CE2 3.67Å; I356-F372 HydrophobicContact CG2-CZ 3.75Å; I356-Q373 CarbonylContact C-O 3.58Å; I356-Q373 WeakPolarHBondContact CA-O 3.38Å; I356-Q373 WeakPolarHBondContact CG2-O 3.43Å; I356-R374 HydrophobicContact CD1-CG 4.21Å; I356-R374 HydrophobicContact CG1-CB 3.97Å; I356-R374 HydrophobicContact CG1-CG 3.73Å; I356-I572 HydrophobicContact CD1-CB 4.29Å; I356-I572 HydrophobicContact CD1-CG1 3.7Å; I356-I572 HydrophobicContact CD1-CG2 4.11Å; I356-I575 HydrophobicContact CB-CD1 4.17Å; I356-I575 HydrophobicContact CB-CG2 4.09Å; I356-I575 HydrophobicContact CD1-CD1 4.12Å; I356-I575 HydrophobicContact CG2-CG2 3.84Å
357	S	98.6	Very high	97	Very high	57 Å²	57	64.4 Å²	64.4	40%	0.399	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.3	165.4	59.4	0	0	0	0	110	Q373	S357-Q373 PolarHBondContact N-O 2.88Å; S357-Q373 PolarHBondContact O-N 3.45Å; S357-Q373 WeakPolarHBondContact OG-CB 3.41Å
358	C	98.3	Very high	97	Very high	22 Å²	22	63.5 Å²	63.5	15%	0.149	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.8	-177.7	-54.4	0	0	0	0	108.2	L371 F372 L479 C579	C358-L371 WeakPolarHBondContact CA-O 3.38Å; C358-F372 VanDerWaalsContact SG-CD2 3.58Å; C358-L479 HydrophobicContact CB-CD1 3.83Å; C358-C579 HydrophobicContact CB-CB 3.84Å; C358-C579 PolarHBondContact O-SG 2.98Å
359	E	98.4	Very high	97	Very high	106 Å²	106	62.1 Å²	62.1	50%	0.495	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.4	172.5	-64.6	174	-155.3	0	0	108.4	L362 A370 L371	E359-L362 HydrophobicContact CB-CD2 3.89Å; E359-A370 CarbonylContact O-C 3.52Å; E359-A370 WeakPolarHBondContact O-CA 3.2Å; E359-L371 HydrophobicContact CB-CB 4.34Å; E359-L371 PolarHBondContact N-O 2.95Å; E359-L371 PolarHBondContact O-N 2.98Å
360	I	98.4	Very high	97.1	Very high	39 Å²	39	57.8 Å²	57.8	20%	0.2	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	168.3	176.8	59.3	165.6	0	0	0	109.6	L362 S369 A370 L479 D483 I580	I360-L362 VanDerWaalsContact C-N 3.3Å; I360-L362 PolarHBondContact O-N 3.28Å; I360-S369 CarbonylContact C-O 3.51Å; I360-S369 VanDerWaalsContact CA-O 3.28Å; I360-S369 WeakPolarHBondContact CA-O 3.37Å; I360-A370 HydrophobicContact CG2-CB 4.05Å; I360-L479 HydrophobicContact CG2-CB 4.1Å; I360-D483 HydrophobicContact CB-CB 4.18Å; I360-D483 HydrophobicContact CD1-CB 4.49Å; I360-D483 HydrophobicContact CG2-CB 4.43Å; I360-I580 HydrophobicContact CD1-CB 3.98Å; I360-I580 HydrophobicContact CD1-CD1 3.79Å; I360-I580 HydrophobicContact CD1-CG1 4.42Å; I360-I580 HydrophobicContact CD1-CG2 4.31Å; I360-I580 HydrophobicContact CG2-CG2 4.28Å
361	D	97.1	Very high	97.1	Very high	66 Å²	66	58 Å²	58	35%	0.353	30%	0.3	S	S	.	.			trans	58.5	39.5	175.1	-152.2	8.8	0	0	0	114	S369 D483 R584 K588	D361-S369 WeakPolarHBondContact CA-OG 3.25Å; D361-S369 PolarHBondContact N-O 2.88Å; D361-S369 PolarHBondContact N-OG 2.9Å; D361-D483 PolarHBondContact N-OD2 3.34Å; D361-R584 VanDerWaalsContact CG-NH2 3.33Å; D361-R584 IonicContact OD2-CZ 3.5Å; D361-R584 IonicContact OD2-NH1 3.75Å; D361-R584 IonicContact OD2-NH2 2.78Å; D361-R584 PolarHBondContact OD2-NH2 3.27Å; D361-K588 WeakPolarHBondContact OD1-CE 3.49Å; D361-K588 IonicContact OD1-NZ 2.65Å; D361-K588 PolarHBondContact OD1-NZ 2.88Å
362	L	96.5	Very high	97.1	Very high	52 Å²	52	53.8 Å²	53.8	27%	0.272	27%	0.274	S	S	.	.			trans	-64.8	-41	-175	-59.2	167.9	0	0	0	112.4	E359 I360 S369 L371 L380	E359-L362 HydrophobicContact CB-CD2 3.89Å; I360-L362 VanDerWaalsContact C-N 3.3Å; I360-L362 PolarHBondContact O-N 3.28Å; L362-S369 PolarHBondContact N-OG 3.26Å; L362-L371 HydrophobicContact CD1-CB 3.76Å; L362-L371 HydrophobicContact CD2-CB 4.22Å; L362-L380 HydrophobicContact CD1-CD1 3.35Å
363	F	95.6	Very high	97.2	Very high	111 Å²	111	53.4 Å²	53.4	49%	0.487	27%	0.267	S	S	.	.			trans	-131	118.4	-174	-55.3	-72.6	0	0	0	110.4	P365 L366 L380	F363-P365 VanDerWaalsContact C-CD 3.46Å; F363-P365 VanDerWaalsContact C-N 3.34Å; F363-L366 HydrophobicContact CB-CD1 3.87Å; F363-L366 HydrophobicContact CB-CG 3.97Å; F363-L366 HydrophobicContact CD2-CD1 3.77Å; F363-L366 HydrophobicContact CG-CD1 4.27Å; F363-L366 PolarHBondContact O-N 2.75Å; F363-L366 VanDerWaalsContact O-N 3.07Å; F363-L380 HydrophobicContact CE2-CD1 4.42Å; F363-L380 HydrophobicContact CE2-CD2 4.43Å
364	K	91.1	Very high	97.2	Very high	184 Å²	184	52.1 Å²	52.1	80%	0.8	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-39.2	-177.5	-60.9	-175.5	178.8	-176.6	0	114.5	L366 N590	K364-L366 VanDerWaalsContact C-N 3.26Å; K364-L366 PolarHBondContact O-N 3.4Å; K364-N590 PolarHBondContact O-ND2 3.07Å
365	P	91.3	Very high	97.1	Very high	108 Å²	108	52.5 Å²	52.5	70%	0.701	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.7	-179.8	-21.3	35.4	0	0	0	115.2	F363 N590	F363-P365 VanDerWaalsContact C-CD 3.46Å; F363-P365 VanDerWaalsContact C-N 3.34Å; P365-N590 WeakPolarHBondContact CA-ND2 3.46Å; P365-N590 PolarHBondContact O-ND2 3.37Å
366	L	94.6	Very high	97.1	Very high	50 Å²	50	46.7 Å²	46.7	26%	0.262	25%	0.246	S	C	.	.	S	Bend	trans	-84.8	139.3	178.2	-59.9	-179.4	0	0	0	110.8	F363 K364 G368 N590	F363-L366 HydrophobicContact CB-CD1 3.87Å; F363-L366 HydrophobicContact CB-CG 3.97Å; F363-L366 HydrophobicContact CD2-CD1 3.77Å; F363-L366 HydrophobicContact CG-CD1 4.27Å; F363-L366 PolarHBondContact O-N 2.75Å; F363-L366 VanDerWaalsContact O-N 3.07Å; K364-L366 VanDerWaalsContact C-N 3.26Å; K364-L366 PolarHBondContact O-N 3.4Å; L366-G368 VanDerWaalsContact C-N 3.28Å; L366-G368 PolarHBondContact O-N 2.92Å; L366-N590 PolarHBondContact O-ND2 3.31Å
367	H	95.9	Very high	97.1	Very high	20 Å²	20	45.8 Å²	45.8	9%	0.093	24%	0.241	C	C	.	.	S	Bend	trans	-64.7	-36.2	177.6	-54.1	134.7	0	0	0	111.8	V383 F385 S484 K588 N590	H367-V383 WeakPolarHBondContact CB-O 3.4Å; H367-F385 HydrophobicContact CB-CD2 3.75Å; H367-F385 HydrophobicContact CB-CE2 3.91Å; H367-F385 AromaticContact CG-CD2 3.83Å; H367-F385 AromaticContact ND1-CD2 3.88Å; H367-F385 PolarHBondContact ND1-N 2.84Å; H367-S484 VanDerWaalsContact O-CA 3.23Å; H367-S484 WeakPolarHBondContact O-CA 3.29Å; H367-S484 WeakPolarHBondContact O-CB 2.8Å; H367-K588 VanDerWaalsContact O-CD 3.23Å; H367-K588 WeakPolarHBondContact O-CD 3.19Å; H367-K588 WeakPolarHBondContact O-CE 3.17Å; H367-N590 PolarHBondContact CD2-O 3Å; H367-N590 PolarHBondContact NE2-O 3.47Å
368	G	97.3	Very high	97.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	149.8	167.3	0	0	0	0	0	110.9	L366 S382 V383 D483	L366-G368 VanDerWaalsContact C-N 3.28Å; L366-G368 PolarHBondContact O-N 2.92Å; G368-S382 CarbonylContact O-C 3.15Å; G368-S382 WeakPolarHBondContact O-CA 3.2Å; G368-V383 PolarHBondContact N-O 2.66Å; G368-V383 PolarHBondContact O-N 2.88Å; G368-D483 WeakPolarHBondContact CA-OD2 3.42Å
369	S	98.3	Very high	97.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	145.4	179.5	57.7	0	0	0	0	111.1	I360 D361 L362 S381 D483	I360-S369 CarbonylContact C-O 3.51Å; I360-S369 VanDerWaalsContact CA-O 3.28Å; I360-S369 WeakPolarHBondContact CA-O 3.37Å; D361-S369 WeakPolarHBondContact CA-OG 3.25Å; D361-S369 PolarHBondContact N-O 2.88Å; D361-S369 PolarHBondContact N-OG 2.9Å; L362-S369 PolarHBondContact N-OG 3.26Å; S369-S381 CarbonylContact C-O 3.41Å; S369-S381 VanDerWaalsContact CA-O 3.26Å; S369-S381 WeakPolarHBondContact CA-O 3.29Å; S369-D483 PolarHBondContact N-OD2 3.39Å
370	A	98.8	Very high	97.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	141.9	173.1	0	0	0	0	0	111.6	E359 I360 S381 L479 A480	E359-A370 CarbonylContact O-C 3.52Å; E359-A370 WeakPolarHBondContact O-CA 3.2Å; I360-A370 HydrophobicContact CG2-CB 4.05Å; A370-S381 PolarHBondContact N-O 2.9Å; A370-S381 PolarHBondContact O-N 2.85Å; A370-L479 HydrophobicContact CB-CB 3.5Å; A370-L479 HydrophobicContact CB-CD1 4.38Å; A370-A480 HydrophobicContact CB-CB 3.98Å
371	L	98.8	Very high	97.2	Very high	33 Å²	33	38.3 Å²	38.3	17%	0.173	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.2	167.9	-169.9	67.4	0	0	0	107.3	C358 E359 L362 Q378 L380 L463	C358-L371 WeakPolarHBondContact CA-O 3.38Å; E359-L371 HydrophobicContact CB-CB 4.34Å; E359-L371 PolarHBondContact N-O 2.95Å; E359-L371 PolarHBondContact O-N 2.98Å; L362-L371 HydrophobicContact CD1-CB 3.76Å; L362-L371 HydrophobicContact CD2-CB 4.22Å; L371-Q378 HydrophobicContact CD1-CG 3.62Å; L371-Q378 HydrophobicContact CG-CG 4.24Å; L371-L380 HydrophobicContact CD1-CB 4.23Å; L371-L463 HydrophobicContact CD1-CD1 4.13Å
372	F	98.8	Very high	97.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.9	176.3	-176.8	-87.6	0	0	0	109.2	I356 C358 R374 V379 A472 C475 L479 I572 M576	I356-F372 HydrophobicContact CD1-CZ 4.35Å; I356-F372 HydrophobicContact CG2-CD2 4.48Å; I356-F372 HydrophobicContact CG2-CE2 3.67Å; I356-F372 HydrophobicContact CG2-CZ 3.75Å; C358-F372 VanDerWaalsContact SG-CD2 3.58Å; F372-R374 HydrophobicContact CE1-CB 3.81Å; F372-R374 HydrophobicContact CZ-CB 4.42Å; F372-V379 PolarHBondContact N-O 3.05Å; F372-V379 PolarHBondContact O-N 3.44Å; F372-A472 HydrophobicContact CD1-CB 3.78Å; F372-A472 HydrophobicContact CE1-CB 4.09Å; F372-C475 HydrophobicContact CD1-CB 4.07Å; F372-C475 HydrophobicContact CD2-CB 3.6Å; F372-C475 HydrophobicContact CE1-CB 3.98Å; F372-C475 HydrophobicContact CE2-CB 3.5Å; F372-C475 HydrophobicContact CG-CB 3.89Å; F372-C475 HydrophobicContact CZ-CB 3.7Å; F372-L479 HydrophobicContact CD2-CD1 3.97Å; F372-I572 HydrophobicContact CE2-CG2 4.33Å; F372-I572 HydrophobicContact CZ-CG2 4.1Å; F372-M576 HydrophobicContact CE2-CG 4.02Å; F372-M576 HydrophobicContact CE2-SD 4.28Å
373	Q	98.8	Very high	97.3	Very high	23 Å²	23	33.3 Å²	33.3	11%	0.107	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.6	174.2	-168.9	71.5	22	0	0	109.9	I356 S357 G375 T377 E464	I356-Q373 CarbonylContact C-O 3.58Å; I356-Q373 WeakPolarHBondContact CA-O 3.38Å; I356-Q373 WeakPolarHBondContact CG2-O 3.43Å; S357-Q373 PolarHBondContact N-O 2.88Å; S357-Q373 PolarHBondContact O-N 3.45Å; S357-Q373 WeakPolarHBondContact OG-CB 3.41Å; Q373-G375 WeakPolarHBondContact CG-O 3.28Å; Q373-G375 PolarHBondContact NE2-O 3.12Å; Q373-T377 WeakPolarHBondContact CA-O 3.4Å; Q373-E464 PolarHBondContact NE2-OE2 3.24Å
374	R	98.5	Very high	97.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	106.2	165.9	-179.7	164.8	63.4	-171.5	-2.8	110	R354 K355 I356 F372 Q376 T377 G494 D519	R354-R374 HydrophobicContact CB-CG 4.06Å; K355-R374 WeakPolarHBondContact O-CA 3.36Å; I356-R374 HydrophobicContact CD1-CG 4.21Å; I356-R374 HydrophobicContact CG1-CB 3.97Å; I356-R374 HydrophobicContact CG1-CG 3.73Å; F372-R374 HydrophobicContact CE1-CB 3.81Å; F372-R374 HydrophobicContact CZ-CB 4.42Å; R374-Q376 PolarHBondContact O-N 3.29Å; R374-T377 PolarHBondContact N-O 3Å; R374-T377 WeakPolarHBondContact O-CB 3.45Å; R374-T377 PolarHBondContact O-N 3.25Å; R374-G494 PolarHBondContact NH1-O 3.47Å; R374-D519 VanDerWaalsContact CD-OD1 3.28Å; R374-D519 WeakPolarHBondContact CD-OD1 3.48Å; R374-D519 WeakPolarHBondContact CD-OD2 3.26Å; R374-D519 IonicContact CZ-OD1 2.84Å; R374-D519 IonicContact NE-OD1 3.76Å; R374-D519 PolarHBondContact NE-OD1 3.1Å; R374-D519 IonicContact NH1-OD1 2.85Å; R374-D519 IonicContact NH2-OD1 3.93Å
375	G	97.9	Very high	97.6	Very high	27 Å²	27	22.1 Å²	22.1	28%	0.278	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	-120.8	-169.7	0	0	0	0	0	111	K355 Q373	K355-G375 PolarHBondContact O-N 3.42Å; Q373-G375 WeakPolarHBondContact CG-O 3.28Å; Q373-G375 PolarHBondContact NE2-O 3.12Å
376	Q	98.1	Very high	97.6	Very high	64 Å²	64	20 Å²	20	30%	0.299	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	36.7	174.4	-61.6	-179.7	-75.7	0	0	111.9	K292 R374 S465 N466	K292-Q376 VanDerWaalsContact CB-OE1 3.3Å; R374-Q376 PolarHBondContact O-N 3.29Å; Q376-S465 CarbonylContact O-C 3.43Å; Q376-N466 HydrophobicContact CB-CB 3.77Å; Q376-N466 VanDerWaalsContact O-CB 3.31Å; Q376-N466 WeakPolarHBondContact O-CB 3.49Å; Q376-N466 PolarHBondContact O-N 3.09Å; Q376-N466 PolarHBondContact OE1-ND2 2.94Å
377	T	98.6	Very high	97.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.7	171	-58.7	0	0	0	0	108.2	Q373 R374 E464 N466 G467 A472	Q373-T377 WeakPolarHBondContact CA-O 3.4Å; R374-T377 PolarHBondContact N-O 3Å; R374-T377 WeakPolarHBondContact O-CB 3.45Å; R374-T377 PolarHBondContact O-N 3.25Å; T377-E464 WeakPolarHBondContact CA-O 3.49Å; T377-N466 VanDerWaalsContact OG1-C 3.31Å; T377-N466 PolarHBondContact OG1-N 2.89Å; T377-G467 PolarHBondContact OG1-N 3.44Å; T377-G467 PolarHBondContact OG1-O 3.21Å; T377-G467 VanDerWaalsContact OG1-O 3.07Å; T377-A472 HydrophobicContact CG2-CB 4.11Å
378	Q	98.8	Very high	96.8	Very high	42 Å²	42	20.9 Å²	20.9	20%	0.196	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.5	-174	-169	166.5	88.4	0	0	109.6	L371 L463 E464	L371-Q378 HydrophobicContact CD1-CG 3.62Å; L371-Q378 HydrophobicContact CG-CG 4.24Å; Q378-L463 HydrophobicContact CB-CB 4.14Å; Q378-L463 HydrophobicContact CG-CB 4.09Å; Q378-L463 HydrophobicContact CG-CD1 4.36Å; Q378-L463 PolarHBondContact O-N 3.02Å; Q378-E464 HydrophobicContact CB-CB 3.72Å; Q378-E464 HydrophobicContact CB-CG 3.86Å; Q378-E464 PolarHBondContact N-O 2.88Å; Q378-E464 PolarHBondContact O-N 3.32Å
379	V	98.8	Very high	96.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.8	174	-177.5	0	0	0	0	109.9	F372 A460 E461 V462 A472	F372-V379 PolarHBondContact N-O 3.05Å; F372-V379 PolarHBondContact O-N 3.44Å; V379-A460 HydrophobicContact CG1-CB 4.03Å; V379-E461 WeakPolarHBondContact CA-O 3.35Å; V379-V462 HydrophobicContact CG2-CG2 4.18Å; V379-A472 HydrophobicContact CB-CB 4.27Å; V379-A472 HydrophobicContact CG2-CB 3.54Å
380	L	98.8	Very high	95.6	Very high	25 Å²	25	28 Å²	28	13%	0.131	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.6	166.2	175.5	62.8	0	0	0	108.1	L362 F363 L371 A460 E461 L463	L362-L380 HydrophobicContact CD1-CD1 3.35Å; F363-L380 HydrophobicContact CE2-CD1 4.42Å; F363-L380 HydrophobicContact CE2-CD2 4.43Å; L371-L380 HydrophobicContact CD1-CB 4.23Å; L380-A460 WeakPolarHBondContact O-CA 3.49Å; L380-E461 PolarHBondContact N-O 3.08Å; L380-E461 PolarHBondContact O-N 3.21Å; L380-L463 HydrophobicContact CB-CD1 3.91Å; L380-L463 HydrophobicContact CB-CG 4.22Å
381	S	98.7	Very high	95	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.5	175.8	-60	0	0	0	0	109.9	S369 A370 T459 G476 G477	S369-S381 CarbonylContact C-O 3.41Å; S369-S381 VanDerWaalsContact CA-O 3.26Å; S369-S381 WeakPolarHBondContact CA-O 3.29Å; A370-S381 PolarHBondContact N-O 2.9Å; A370-S381 PolarHBondContact O-N 2.85Å; S381-T459 CarbonylContact C-O 3.53Å; S381-T459 VanDerWaalsContact CA-O 3.27Å; S381-T459 WeakPolarHBondContact CA-O 3.29Å; S381-G476 WeakPolarHBondContact CB-O 3.49Å; S381-G476 VanDerWaalsContact OG-C 3.26Å; S381-G476 WeakPolarHBondContact OG-CA 3.32Å; S381-G477 PolarHBondContact OG-N 3.09Å
382	S	98.4	Very high	94.3	Very high	13 Å²	13	29.4 Å²	29.4	9%	0.091	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.4	173.8	60.7	0	0	0	0	110.8	G368 V458 T459	G368-S382 CarbonylContact O-C 3.15Å; G368-S382 WeakPolarHBondContact O-CA 3.2Å; S382-V458 CarbonylContact O-C 3.59Å; S382-V458 WeakPolarHBondContact O-CA 3.23Å; S382-T459 PolarHBondContact N-O 3.33Å; S382-T459 PolarHBondContact O-N 2.96Å
383	V	98.3	Very high	93.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.7	172.5	176.3	0	0	0	0	109	H367 G368 F385 I456 R457 V458 A480 L481	H367-V383 WeakPolarHBondContact CB-O 3.4Å; G368-V383 PolarHBondContact N-O 2.66Å; G368-V383 PolarHBondContact O-N 2.88Å; V383-F385 HydrophobicContact CG1-CD1 4.38Å; V383-F385 HydrophobicContact CG1-CE1 3.93Å; V383-F385 HydrophobicContact CG1-CZ 4.19Å; V383-I456 HydrophobicContact CG1-CG2 4.05Å; V383-R457 CarbonylContact C-O 3.26Å; V383-R457 WeakPolarHBondContact CA-O 3.19Å; V383-V458 HydrophobicContact CG2-CG2 4.22Å; V383-A480 HydrophobicContact CG2-CB 3.73Å; V383-L481 HydrophobicContact CG1-CD2 4.47Å; V383-L481 HydrophobicContact CG2-CD2 4.04Å; V383-L481 HydrophobicContact CG2-CG 4.17Å
384	T	96.4	Very high	92.5	Very high	55 Å²	55	35.5 Å²	35.5	34%	0.337	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.3	173.5	-52.4	0	0	0	0	109.2	R457	T384-R457 PolarHBondContact N-O 2.84Å; T384-R457 PolarHBondContact O-N 2.88Å
385	F	94.8	Very high	91.5	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.022	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	141.3	173.5	-62.7	-50.4	0	0	0	108.7	H367 V383 F452 F454 T455 I456 V486 R587 P592	H367-F385 HydrophobicContact CB-CD2 3.75Å; H367-F385 HydrophobicContact CB-CE2 3.91Å; H367-F385 AromaticContact CG-CD2 3.83Å; H367-F385 AromaticContact ND1-CD2 3.88Å; H367-F385 PolarHBondContact ND1-N 2.84Å; V383-F385 HydrophobicContact CG1-CD1 4.38Å; V383-F385 HydrophobicContact CG1-CE1 3.93Å; V383-F385 HydrophobicContact CG1-CZ 4.19Å; F385-F452 AromaticContact CD1-CE1 3.77Å; F385-F452 HydrophobicContact CD1-CE1 3.77Å; F385-F452 HydrophobicContact CD1-CZ 4.44Å; F385-F452 AromaticContact CE1-CE1 3.46Å; F385-F452 HydrophobicContact CE1-CE1 3.46Å; F385-F452 VanDerWaalsContact CE1-CE1 3.46Å; F385-F452 AromaticContact CE1-CZ 3.79Å; F385-F452 HydrophobicContact CE1-CZ 3.79Å; F385-F452 HydrophobicContact CZ-CE1 4.11Å; F385-F452 AromaticContact CZ-CZ 3.98Å; F385-F452 HydrophobicContact CZ-CZ 3.98Å; F385-F454 HydrophobicContact CB-CB 4.16Å; F385-F454 HydrophobicContact CB-CD2 4.32Å; F385-F454 HydrophobicContact CB-CG 4.32Å; F385-F454 HydrophobicContact CD1-CB 4.27Å; F385-F454 HydrophobicContact CD1-CD2 4.45Å; F385-F454 HydrophobicContact CG-CB 4.47Å; F385-F454 HydrophobicContact CG-CD2 4.24Å; F385-T455 WeakPolarHBondContact CA-O 3.4Å; F385-I456 HydrophobicContact CD1-CG1 4.15Å; F385-I456 HydrophobicContact CE1-CG1 4.07Å; F385-V486 HydrophobicContact CE1-CG2 3.51Å; F385-V486 HydrophobicContact CZ-CG2 3.58Å; F385-R587 HydrophobicContact CE2-CG 4.41Å; F385-P592 HydrophobicContact CB-CG 3.51Å; F385-P592 HydrophobicContact CD2-CG 4.23Å; F385-P592 HydrophobicContact CG-CG 4.27Å
386	D	91.6	Very high	90.5	Very high	62 Å²	62	41.5 Å²	41.5	33%	0.332	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	172.7	175.1	-154.6	-12.9	0	0	0	110.2	S390 T455	D386-S390 VanDerWaalsContact CG-CB 3.44Å; D386-S390 PolarHBondContact OD1-OG 2.89Å; D386-S390 WeakPolarHBondContact OD2-CB 3.47Å; D386-S390 PolarHBondContact OD2-OG 3.46Å; D386-T455 PolarHBondContact N-O 3.25Å; D386-T455 PolarHBondContact O-N 2.97Å
387	S	87.3	Confident	89.6	Confident	5 Å²	5	39.2 Å²	39.2	4%	0.035	21%	0.208	C	C	.	.			trans	-57.7	157.4	176.4	78.6	0	0	0	0	111.5	E389 S390 T455 F637	S387-E389 PolarHBondContact O-N 3.03Å; S387-E389 PolarHBondContact OG-N 3.2Å; S387-S390 WeakPolarHBondContact O-CB 3.48Å; S387-S390 PolarHBondContact O-N 2.96Å; S387-S390 PolarHBondContact OG-N 3.34Å; S387-S390 PolarHBondContact OG-OG 3.22Å; S387-S390 VanDerWaalsContact OG-OG 3.13Å; S387-T455 WeakPolarHBondContact O-CB 3.29Å; S387-T455 PolarHBondContact O-OG1 3.18Å; S387-F637 VanDerWaalsContact N-CZ 3.3Å
388	L	86.4	Confident	88.7	Confident	84 Å²	84	39.7 Å²	39.7	44%	0.44	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-65.5	-21.2	172.9	-65	176.5	0	0	0	112.3	S390 S391	L388-S390 VanDerWaalsContact C-N 3.33Å; L388-S391 VanDerWaalsContact O-CB 3.25Å; L388-S391 WeakPolarHBondContact O-CB 2.89Å; L388-S391 PolarHBondContact O-N 3.01Å; L388-S391 PolarHBondContact O-OG 3.47Å
389	E	84.7	Confident	87.8	Confident	102 Å²	102	39.6 Å²	39.6	48%	0.477	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-70.6	-31.8	175.2	-62.8	-177.4	179.9	0	0	111.7	S387 S391 T625 S627	S387-E389 PolarHBondContact O-N 3.03Å; S387-E389 PolarHBondContact OG-N 3.2Å; E389-S391 PolarHBondContact O-N 2.95Å; E389-T625 HydrophobicContact CB-CG2 4.35Å; E389-T625 HydrophobicContact CG-CG2 4.26Å; E389-T625 WeakPolarHBondContact OE2-CG2 3.14Å; E389-S627 VanDerWaalsContact OE1-CB 3.32Å; E389-S627 WeakPolarHBondContact OE1-CB 3.5Å
390	S	86.5	Confident	86.6	Confident	48 Å²	48	40.4 Å²	40.4	34%	0.336	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-73.5	4.8	173.3	-55.2	0	0	0	0	114	D386 S387 L388	D386-S390 VanDerWaalsContact CG-CB 3.44Å; D386-S390 PolarHBondContact OD1-OG 2.89Å; D386-S390 WeakPolarHBondContact OD2-CB 3.47Å; D386-S390 PolarHBondContact OD2-OG 3.46Å; S387-S390 WeakPolarHBondContact O-CB 3.48Å; S387-S390 PolarHBondContact O-N 2.96Å; S387-S390 PolarHBondContact OG-N 3.34Å; S387-S390 PolarHBondContact OG-OG 3.22Å; S387-S390 VanDerWaalsContact OG-OG 3.13Å; L388-S390 VanDerWaalsContact C-N 3.33Å
391	S	86.4	Confident	85.6	Confident	7 Å²	7	39.4 Å²	39.4	5%	0.049	22%	0.215	C	C	.	.	S	Bend	trans	-58.7	148.2	173.4	53.1	0	0	0	0	111.2	L388 E389 K393 K407 N408	L388-S391 VanDerWaalsContact O-CB 3.25Å; L388-S391 WeakPolarHBondContact O-CB 2.89Å; L388-S391 PolarHBondContact O-N 3.01Å; L388-S391 PolarHBondContact O-OG 3.47Å; E389-S391 PolarHBondContact O-N 2.95Å; S391-K393 PolarHBondContact O-N 3.13Å; S391-K393 WeakPolarHBondContact OG-CE 3.31Å; S391-K393 PolarHBondContact OG-NZ 3.44Å; S391-K407 WeakPolarHBondContact CB-O 3.39Å; S391-N408 WeakPolarHBondContact CB-OD1 3.44Å
392	V	83.6	Confident	84.2	Confident	55 Å²	55	40.3 Å²	40.3	33%	0.333	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-67.3	108.5	177.7	178.8	0	0	0	0	108.3	D406 K407 M410	V392-D406 WeakPolarHBondContact O-CA 3.45Å; V392-K407 HydrophobicContact CB-CB 4.28Å; V392-K407 PolarHBondContact N-O 3.19Å; V392-K407 PolarHBondContact O-N 3.03Å; V392-M410 HydrophobicContact CG2-CB 4.06Å; V392-M410 HydrophobicContact CG2-CG 4.04Å; V392-M410 HydrophobicContact CG2-SD 4.42Å
393	K	82.6	Confident	82.8	Confident	125 Å²	125	40.5 Å²	40.5	54%	0.543	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-80.3	120.6	176.8	-60.6	-51.1	-173.3	-168.9	0	110	S391 D406	S391-K393 PolarHBondContact O-N 3.13Å; S391-K393 WeakPolarHBondContact OG-CE 3.31Å; S391-K393 PolarHBondContact OG-NZ 3.44Å; K393-D406 WeakPolarHBondContact CA-OD1 3.37Å; K393-D406 HydrophobicContact CD-CB 4.45Å; K393-D406 WeakPolarHBondContact CD-OD2 3.46Å; K393-D406 IonicContact NZ-OD2 3.63Å; K393-D406 PolarHBondContact NZ-OD2 2.99Å
394	T	77.4	Confident	81.6	Confident	27 Å²	27	42.9 Å²	42.9	17%	0.166	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-83.3	137.5	175.9	-57.8	0	0	0	0	109.1	T398 T399 I404 K405 D406	T394-T398 HydrophobicContact CG2-CG2 3.73Å; T394-T399 WeakPolarHBondContact CG2-OG1 3.39Å; T394-I404 HydrophobicContact CG2-CB 4.25Å; T394-I404 HydrophobicContact CG2-CG2 4.13Å; T394-K405 PolarHBondContact OG1-O 3.1Å; T394-D406 PolarHBondContact N-OD1 3.19Å; T394-D406 VanDerWaalsContact N-OD1 3.07Å
395	D	76.8	Confident	80.7	Confident	63 Å²	63	48 Å²	48	34%	0.337	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-59.3	146.7	175.3	-178	29.2	0	0	0	110.8	T100 I397 T398 T399	T100-D395 PolarHBondContact OG1-OD1 3.19Å; D395-I397 PolarHBondContact O-N 3.38Å; D395-T398 PolarHBondContact O-N 3.11Å; D395-T398 VanDerWaalsContact O-N 3.14Å; D395-T399 WeakPolarHBondContact O-CB 3.32Å; D395-T399 PolarHBondContact O-N 3.45Å; D395-T399 PolarHBondContact O-OG1 3.05Å
396	I	77.1	Confident	80	Confident	90 Å²	90	51 Å²	51	46%	0.462	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-34.1	-178.3	-67.3	161.8	0	0	0	110.5	R97 T100 A400	R97-I396 VanDerWaalsContact NH1-CG2 3.34Å; T100-I396 HydrophobicContact CG2-CD1 3.88Å; I396-A400 VanDerWaalsContact O-CB 3.29Å; I396-A400 WeakPolarHBondContact O-CB 3.49Å; I396-A400 PolarHBondContact O-N 3.24Å
397	I	80.2	Confident	79.7	Confident	15 Å²	15	50.5 Å²	50.5	8%	0.077	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-51	176.7	-63.3	162.7	0	0	0	110.6	A92 P99 D395 T399 A400 L401	A92-I397 HydrophobicContact CB-CD1 3.51Å; A92-I397 HydrophobicContact CB-CG1 3.91Å; A92-I397 HydrophobicContact CB-CG2 4.09Å; P99-I397 VanDerWaalsContact CA-CD1 3.5Å; P99-I397 HydrophobicContact CB-CD1 3.73Å; P99-I397 HydrophobicContact CG-CD1 3.87Å; D395-I397 PolarHBondContact O-N 3.38Å; I397-T399 VanDerWaalsContact C-N 3.25Å; I397-T399 PolarHBondContact O-N 3.41Å; I397-A400 WeakPolarHBondContact O-CB 3.5Å; I397-A400 PolarHBondContact O-N 3.37Å; I397-L401 HydrophobicContact CG2-CD1 3.57Å; I397-L401 HydrophobicContact CG2-CG 4.19Å; I397-L401 WeakPolarHBondContact O-CB 3.39Å; I397-L401 WeakPolarHBondContact O-CG 3.47Å; I397-L401 PolarHBondContact O-N 3.36Å
398	T	78.7	Confident	79.8	Confident	11 Å²	11	53.8 Å²	53.8	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-59.8	-39.4	178.9	-54.2	0	0	0	0	111.3	N112 T394 D395 L401 S402 I404	N112-T398 HydrophobicContact CB-CG2 4.37Å; T394-T398 HydrophobicContact CG2-CG2 3.73Å; D395-T398 PolarHBondContact O-N 3.11Å; D395-T398 VanDerWaalsContact O-N 3.14Å; T398-L401 PolarHBondContact O-N 2.97Å; T398-S402 WeakPolarHBondContact O-CB 3.26Å; T398-S402 PolarHBondContact O-N 3.12Å; T398-S402 PolarHBondContact O-OG 3.36Å; T398-S402 VanDerWaalsContact O-OG 3.13Å; T398-I404 HydrophobicContact CG2-CD1 4.26Å
399	T	79.9	Confident	80.2	Confident	39 Å²	39	50.4 Å²	50.4	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-39	174.9	-53.3	0	0	0	0	112	R192 T394 D395 I397 G403 I404	R192-T399 PolarHBondContact NH1-O 3.13Å; R192-T399 PolarHBondContact NH2-O 3.16Å; R192-T399 VanDerWaalsContact NH2-O 3.09Å; T394-T399 WeakPolarHBondContact CG2-OG1 3.39Å; D395-T399 WeakPolarHBondContact O-CB 3.32Å; D395-T399 PolarHBondContact O-N 3.45Å; D395-T399 PolarHBondContact O-OG1 3.05Å; I397-T399 VanDerWaalsContact C-N 3.25Å; I397-T399 PolarHBondContact O-N 3.41Å; T399-G403 VanDerWaalsContact O-CA 3.23Å; T399-G403 WeakPolarHBondContact O-CA 3.36Å; T399-G403 PolarHBondContact O-N 3.21Å; T399-G403 VanDerWaalsContact O-N 3.12Å; T399-I404 PolarHBondContact OG1-O 3.33Å
400	A	75	Confident	80.8	Confident	17 Å²	17	46.4 Å²	46.4	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-45.6	176.6	0	0	0	0	0	111.5	R192 I396 I397	R192-A400 PolarHBondContact NH1-O 3.37Å; R192-A400 VanDerWaalsContact NH1-O 3.09Å; I396-A400 VanDerWaalsContact O-CB 3.29Å; I396-A400 WeakPolarHBondContact O-CB 3.49Å; I396-A400 PolarHBondContact O-N 3.24Å; I397-A400 WeakPolarHBondContact O-CB 3.5Å; I397-A400 PolarHBondContact O-N 3.37Å
401	L	76.3	Confident	81.3	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-76.7	-43.4	-174.6	-69.4	174	0	0	0	113.8	Q90 A95 V145 I397 T398	Q90-L401 HydrophobicContact CB-CD1 3.71Å; Q90-L401 HydrophobicContact CG-CD1 4.18Å; A95-L401 HydrophobicContact CB-CD2 3.56Å; A95-L401 HydrophobicContact CB-CG 4.26Å; V145-L401 HydrophobicContact CB-CD2 3.63Å; V145-L401 HydrophobicContact CG1-CD2 3.91Å; V145-L401 HydrophobicContact CG2-CD2 3.69Å; I397-L401 HydrophobicContact CG2-CD1 3.57Å; I397-L401 HydrophobicContact CG2-CG 4.19Å; I397-L401 WeakPolarHBondContact O-CB 3.39Å; I397-L401 WeakPolarHBondContact O-CG 3.47Å; I397-L401 PolarHBondContact O-N 3.36Å; T398-L401 PolarHBondContact O-N 2.97Å
402	S	69.9	Low	81.8	Confident	18 Å²	18	47.8 Å²	47.8	13%	0.126	25%	0.247	C	C	.	.	H	α-helix	trans	-115.6	-11.7	-168.4	-21	0	0	0	0	112.6	Q90 N112 T398 I404	Q90-S402 PolarHBondContact NE2-OG 3.47Å; N112-S402 PolarHBondContact ND2-OG 2.89Å; N112-S402 VanDerWaalsContact ND2-OG 3.09Å; T398-S402 WeakPolarHBondContact O-CB 3.26Å; T398-S402 PolarHBondContact O-N 3.12Å; T398-S402 PolarHBondContact O-OG 3.36Å; T398-S402 VanDerWaalsContact O-OG 3.13Å; S402-I404 PolarHBondContact O-N 3.35Å
403	G	69.1	Low	82.5	Confident	17 Å²	17	45.7 Å²	45.7	18%	0.175	23%	0.233	C	C	.	.			trans	71.7	8.9	-180	0	0	0	0	0	118	T399 K405	T399-G403 VanDerWaalsContact O-CA 3.23Å; T399-G403 WeakPolarHBondContact O-CA 3.36Å; T399-G403 PolarHBondContact O-N 3.21Å; T399-G403 VanDerWaalsContact O-N 3.12Å; G403-K405 PolarHBondContact O-N 3.38Å
404	I	73.8	Confident	83.1	Confident	51 Å²	51	43.8 Å²	43.8	26%	0.262	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-64.2	123.3	175	-61.5	168.5	0	0	0	108.3	N112 T394 T398 T399 S402	N112-I404 HydrophobicContact CB-CD1 3.91Å; T394-I404 HydrophobicContact CG2-CB 4.25Å; T394-I404 HydrophobicContact CG2-CG2 4.13Å; T398-I404 HydrophobicContact CG2-CD1 4.26Å; T399-I404 PolarHBondContact OG1-O 3.33Å; S402-I404 PolarHBondContact O-N 3.35Å
405	K	76.5	Confident	84.1	Confident	163 Å²	163	44.1 Å²	44.1	71%	0.709	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-91.4	167.3	175.4	-65.2	-176.5	179	179.6	0	110.5	T394 G403	T394-K405 PolarHBondContact OG1-O 3.1Å; G403-K405 PolarHBondContact O-N 3.38Å
406	D	80.4	Confident	85	Confident	68 Å²	68	41.9 Å²	41.9	36%	0.364	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-49.8	143.2	167.9	-68.6	-6.1	0	0	0	111.6	V392 K393 T394	V392-D406 WeakPolarHBondContact O-CA 3.45Å; K393-D406 WeakPolarHBondContact CA-OD1 3.37Å; K393-D406 HydrophobicContact CD-CB 4.45Å; K393-D406 WeakPolarHBondContact CD-OD2 3.46Å; K393-D406 IonicContact NZ-OD2 3.63Å; K393-D406 PolarHBondContact NZ-OD2 2.99Å; T394-D406 PolarHBondContact N-OD1 3.19Å; T394-D406 VanDerWaalsContact N-OD1 3.07Å
407	K	84.7	Confident	85.9	Confident	50 Å²	50	39 Å²	39	22%	0.217	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-115.1	119.2	-177.8	-56.3	-178.1	179.6	-173.2	0	110.5	S391 V392 F409 E441	S391-K407 WeakPolarHBondContact CB-O 3.39Å; V392-K407 HydrophobicContact CB-CB 4.28Å; V392-K407 PolarHBondContact N-O 3.19Å; V392-K407 PolarHBondContact O-N 3.03Å; K407-F409 VanDerWaalsContact C-N 3.34Å; K407-E441 IonicContact NZ-OE1 3.31Å; K407-E441 PolarHBondContact NZ-OE1 2.94Å; K407-E441 IonicContact NZ-OE2 3.16Å
408	N	89.8	Confident	86.7	Confident	74 Å²	74	44.6 Å²	44.6	40%	0.396	22%	0.222	S	C	.	.	S	Bend	trans	-89.4	-6.1	170.6	-61.3	-0.7	0	0	0	112.1	S391 T455 I456	S391-N408 WeakPolarHBondContact CB-OD1 3.44Å; N408-T455 CarbonylContact O-C 3.58Å; N408-T455 VanDerWaalsContact O-CA 3.3Å; N408-T455 WeakPolarHBondContact O-CA 2.88Å; N408-T455 WeakPolarHBondContact O-CG2 3.5Å; N408-I456 PolarHBondContact O-N 3.11Å
409	F	95.5	Very high	87.6	Confident	13 Å²	13	44.5 Å²	44.5	6%	0.057	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.2	170.5	171	-104.8	0	0	0	108.3	K407 E441 L444 R445 I448 I456 V458 L481	K407-F409 VanDerWaalsContact C-N 3.34Å; F409-E441 HydrophobicContact CD1-CG 3.96Å; F409-E441 HydrophobicContact CE1-CG 3.7Å; F409-L444 HydrophobicContact CE1-CB 4.14Å; F409-L444 HydrophobicContact CZ-CB 3.77Å; F409-L444 HydrophobicContact CZ-CD1 4.34Å; F409-R445 HydrophobicContact CD1-CB 4.34Å; F409-R445 HydrophobicContact CE1-CB 4.34Å; F409-I448 HydrophobicContact CB-CG2 4.29Å; F409-I448 HydrophobicContact CD1-CG1 4.04Å; F409-I448 HydrophobicContact CD2-CD1 3.91Å; F409-I448 HydrophobicContact CD2-CG1 3.9Å; F409-I448 HydrophobicContact CD2-CG2 4.43Å; F409-I448 HydrophobicContact CE1-CG1 4.09Å; F409-I448 HydrophobicContact CE2-CD1 3.66Å; F409-I448 HydrophobicContact CE2-CG1 3.96Å; F409-I448 HydrophobicContact CG-CD1 4.47Å; F409-I448 HydrophobicContact CG-CG1 3.94Å; F409-I448 HydrophobicContact CG-CG2 4.37Å; F409-I448 HydrophobicContact CZ-CD1 4.02Å; F409-I448 HydrophobicContact CZ-CG1 4.06Å; F409-I456 WeakPolarHBondContact CA-O 3.37Å; F409-I456 HydrophobicContact CD2-CB 4Å; F409-I456 HydrophobicContact CD2-CG2 3.9Å; F409-I456 HydrophobicContact CE2-CG2 4.26Å; F409-V458 HydrophobicContact CE2-CG2 3.69Å; F409-V458 HydrophobicContact CZ-CG2 4.25Å; F409-L481 HydrophobicContact CE2-CD1 4.39Å; F409-L481 HydrophobicContact CE2-CD2 4.47Å
410	M	95.7	Very high	88.3	Confident	19 Å²	19	44.3 Å²	44.3	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.1	176.4	68.8	-71.1	-156.2	0	0	111.1	V392 T455 I456 R457 V458	V392-M410 HydrophobicContact CG2-CB 4.06Å; V392-M410 HydrophobicContact CG2-CG 4.04Å; V392-M410 HydrophobicContact CG2-SD 4.42Å; M410-T455 HydrophobicContact CE-CG2 3.81Å; M410-T455 HydrophobicContact SD-CG2 3.77Å; M410-I456 PolarHBondContact N-O 3.35Å; M410-R457 HydrophobicContact CE-CB 3.47Å; M410-R457 VanDerWaalsContact CE-CB 3.47Å; M410-R457 HydrophobicContact CE-CG 3.8Å; M410-R457 HydrophobicContact CG-CB 4.46Å; M410-R457 HydrophobicContact CG-CG 4.26Å; M410-R457 HydrophobicContact SD-CB 3.88Å; M410-R457 HydrophobicContact SD-CG 4.3Å; M410-V458 PolarHBondContact O-N 3.32Å
411	L	97.5	Very high	89.3	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.031	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.4	172.9	-170.7	154	0	0	0	110.4	A440 E441 L444 V458 A460	L411-A440 HydrophobicContact CD1-CB 3.72Å; L411-A440 HydrophobicContact CD2-CB 3.91Å; L411-A440 HydrophobicContact CG-CB 4.47Å; L411-E441 HydrophobicContact CB-CB 3.91Å; L411-E441 HydrophobicContact CB-CG 4.3Å; L411-E441 PolarHBondContact N-OE2 2.77Å; L411-L444 HydrophobicContact CD1-CD1 3.82Å; L411-V458 CarbonylContact C-O 3.44Å; L411-V458 VanDerWaalsContact CA-O 3.29Å; L411-V458 WeakPolarHBondContact CA-O 3.48Å; L411-V458 HydrophobicContact CB-CB 4.26Å; L411-V458 HydrophobicContact CD1-CB 4.05Å; L411-V458 HydrophobicContact CD1-CG1 3.84Å; L411-V458 HydrophobicContact CG-CB 3.94Å; L411-V458 HydrophobicContact CG-CG1 4.01Å; L411-A460 HydrophobicContact CD2-CB 4.36Å
412	H	96.9	Very high	90.1	Very high	77 Å²	77	56 Å²	56	36%	0.356	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.7	171.5	-62.7	140.4	0	0	0	109.4	R457 V458 T459 A460	H412-R457 PolarHBondContact ND1-NE 3.43Å; H412-V458 PolarHBondContact N-O 2.82Å; H412-T459 CarbonylContact O-C 3.5Å; H412-T459 WeakPolarHBondContact O-CA 3.43Å; H412-A460 PolarHBondContact O-N 3.01Å
413	Y	97.8	Very high	91.3	Very high	11 Å²	11	61.9 Å²	61.9	4%	0.043	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.5	-179.8	168.7	-80.3	0	0	0	108.4	F415 E433 H436 A460 V462 S469 S473	Y413-F415 HydrophobicContact CE1-CB 3.72Å; Y413-F415 HydrophobicContact CE1-CD2 4.37Å; Y413-F415 WeakPolarHBondContact OH-CD2 3.49Å; Y413-E433 HydrophobicContact CD1-CB 3.9Å; Y413-E433 HydrophobicContact CD1-CG 4.05Å; Y413-E433 WeakPolarHBondContact CD1-O 3.49Å; Y413-E433 HydrophobicContact CE1-CB 4.32Å; Y413-E433 HydrophobicContact CE1-CG 4.05Å; Y413-H436 HydrophobicContact CD1-CB 3.78Å; Y413-H436 HydrophobicContact CD2-CB 4.12Å; Y413-H436 HydrophobicContact CE1-CB 3.76Å; Y413-H436 AromaticContact CE1-ND1 3.8Å; Y413-H436 HydrophobicContact CE2-CB 4.09Å; Y413-H436 HydrophobicContact CG-CB 3.97Å; Y413-H436 AromaticContact CZ-ND1 3.58Å; Y413-H436 PolarHBondContact OH-ND1 3.26Å; Y413-A460 WeakPolarHBondContact CA-O 3.32Å; Y413-V462 HydrophobicContact CD2-CG2 4.39Å; Y413-V462 HydrophobicContact CE1-CG2 4.49Å; Y413-V462 HydrophobicContact CE2-CG2 3.47Å; Y413-V462 VanDerWaalsContact CE2-CG2 3.47Å; Y413-V462 WeakPolarHBondContact OH-CG2 3.32Å; Y413-S469 PolarHBondContact OH-OG 2.82Å; Y413-S473 WeakPolarHBondContact CD2-OG 3.39Å; Y413-S473 WeakPolarHBondContact CE2-OG 3.48Å
414	E	96.8	Very high	92.3	Very high	85 Å²	85	63.5 Å²	63.5	40%	0.397	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.1	179.1	-64	-176.4	-171.4	0	0	109.5	P416 A460 V462	E414-P416 VanDerWaalsContact C-CD 3.46Å; E414-P416 WeakPolarHBondContact O-CD 3.22Å; E414-A460 PolarHBondContact N-O 3.13Å; E414-V462 WeakPolarHBondContact O-CG2 3.35Å; E414-V462 PolarHBondContact O-N 3.2Å
415	F	97.1	Very high	93	Very high	35 Å²	35	71.2 Å²	71.2	15%	0.154	36%	0.361	C	S	.	.			trans	-122.7	77.6	176.1	-163	-22	0	0	0	109	Y413 A419 T420 E433 V462 S465	Y413-F415 HydrophobicContact CE1-CB 3.72Å; Y413-F415 HydrophobicContact CE1-CD2 4.37Å; Y413-F415 WeakPolarHBondContact OH-CD2 3.49Å; F415-A419 HydrophobicContact CD1-CB 4.01Å; F415-A419 HydrophobicContact CE1-CB 3.75Å; F415-T420 HydrophobicContact CE1-CG2 3.82Å; F415-T420 HydrophobicContact CZ-CG2 3.78Å; F415-E433 WeakPolarHBondContact CA-OE1 3.37Å; F415-E433 HydrophobicContact CB-CG 4.04Å; F415-E433 PolarHBondContact N-OE1 2.96Å; F415-V462 HydrophobicContact CD1-CB 4.32Å; F415-V462 HydrophobicContact CD1-CG1 4.35Å; F415-V462 HydrophobicContact CE1-CG1 4.34Å; F415-V462 HydrophobicContact CG-CB 4.46Å; F415-S465 VanDerWaalsContact CZ-OG 3.31Å; F415-S465 WeakPolarHBondContact CZ-OG 3.48Å
416	P	96.1	Very high	93.5	Very high	16 Å²	16	69 Å²	69	10%	0.104	36%	0.361	C	S	.	.			trans	-64.5	148.9	178.8	27.5	-34.4	0	0	0	111.6	E414 Y418 A419 V462	E414-P416 VanDerWaalsContact C-CD 3.46Å; E414-P416 WeakPolarHBondContact O-CD 3.22Å; P416-Y418 HydrophobicContact CB-CD1 3.71Å; P416-Y418 HydrophobicContact CB-CD2 4.5Å; P416-Y418 HydrophobicContact CB-CE1 3.33Å; P416-Y418 HydrophobicContact CB-CE2 4.17Å; P416-Y418 HydrophobicContact CB-CG 4.28Å; P416-Y418 HydrophobicContact CG-CD1 4.16Å; P416-Y418 HydrophobicContact CG-CD2 4.17Å; P416-Y418 HydrophobicContact CG-CE1 3.52Å; P416-Y418 HydrophobicContact CG-CE2 3.52Å; P416-Y418 HydrophobicContact CG-CG 4.45Å; P416-Y418 VanDerWaalsContact CG-OH 3.31Å; P416-Y418 WeakPolarHBondContact CG-OH 3.38Å; P416-Y418 PolarHBondContact O-N 3.1Å; P416-A419 WeakPolarHBondContact O-CB 3.34Å; P416-A419 PolarHBondContact O-N 3.38Å; P416-V462 WeakPolarHBondContact CD-O 3.48Å; P416-V462 WeakPolarHBondContact CG-O 3.17Å
417	P	96.3	Very high	93.2	Very high	28 Å²	28	69.1 Å²	69.1	18%	0.182	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-67.2	-22.6	-171.4	28.7	-37	0	0	0	113.2	A419 T420 N421 E422 V426	P417-A419 PolarHBondContact O-N 2.91Å; P417-T420 PolarHBondContact O-N 3.38Å; P417-T420 PolarHBondContact O-OG1 3.46Å; P417-N421 PolarHBondContact O-N 3.04Å; P417-E422 CarbonylContact C-O 3.55Å; P417-E422 WeakPolarHBondContact CB-O 3.45Å; P417-E422 PolarHBondContact O-N 3.48Å; P417-V426 HydrophobicContact CG-CG2 4Å
418	Y	96.8	Very high	93.1	Very high	134 Å²	134	70.3 Å²	70.3	53%	0.525	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-63.1	-24.3	174.8	60.7	-113.3	0	0	0	112.8	P416 T420 N421 L463	P416-Y418 HydrophobicContact CB-CD1 3.71Å; P416-Y418 HydrophobicContact CB-CD2 4.5Å; P416-Y418 HydrophobicContact CB-CE1 3.33Å; P416-Y418 HydrophobicContact CB-CE2 4.17Å; P416-Y418 HydrophobicContact CB-CG 4.28Å; P416-Y418 HydrophobicContact CG-CD1 4.16Å; P416-Y418 HydrophobicContact CG-CD2 4.17Å; P416-Y418 HydrophobicContact CG-CE1 3.52Å; P416-Y418 HydrophobicContact CG-CE2 3.52Å; P416-Y418 HydrophobicContact CG-CG 4.45Å; P416-Y418 VanDerWaalsContact CG-OH 3.31Å; P416-Y418 WeakPolarHBondContact CG-OH 3.38Å; P416-Y418 PolarHBondContact O-N 3.1Å; Y418-T420 PolarHBondContact O-N 3.11Å; Y418-N421 PolarHBondContact O-N 3.4Å; Y418-L463 HydrophobicContact CE2-CD2 4.15Å
419	A	97.1	Very high	92.8	Very high	8 Å²	8	71.6 Å²	71.6	7%	0.066	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-69.3	-14.5	-179.7	0	0	0	0	0	113.8	F415 P416 P417 V462 L463 S465	F415-A419 HydrophobicContact CD1-CB 4.01Å; F415-A419 HydrophobicContact CE1-CB 3.75Å; P416-A419 WeakPolarHBondContact O-CB 3.34Å; P416-A419 PolarHBondContact O-N 3.38Å; P417-A419 PolarHBondContact O-N 2.91Å; A419-V462 HydrophobicContact CB-CG1 4.08Å; A419-V462 WeakPolarHBondContact CB-O 3.37Å; A419-L463 WeakPolarHBondContact CA-O 3.16Å; A419-L463 WeakPolarHBondContact CB-O 3.46Å; A419-S465 PolarHBondContact O-N 3.28Å
420	T	95.5	Very high	92.6	Very high	36 Å²	36	74.4 Å²	74.4	22%	0.221	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-116.1	11.4	169.6	48.7	0	0	0	0	112.9	F415 P417 Y418 E422	F415-T420 HydrophobicContact CE1-CG2 3.82Å; F415-T420 HydrophobicContact CZ-CG2 3.78Å; P417-T420 PolarHBondContact O-N 3.38Å; P417-T420 PolarHBondContact O-OG1 3.46Å; Y418-T420 PolarHBondContact O-N 3.11Å; T420-E422 VanDerWaalsContact C-N 3.28Å; T420-E422 PolarHBondContact O-N 3.38Å
421	N	95.6	Very high	92.5	Very high	138 Å²	138	77.4 Å²	77.4	74%	0.738	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	40.1	-173.5	-167.4	34.8	0	0	0	113	P417 Y418	P417-N421 PolarHBondContact O-N 3.04Å; Y418-N421 PolarHBondContact O-N 3.4Å
422	E	93.9	Very high	92.3	Very high	128 Å²	128	83.4 Å²	83.4	60%	0.598	46%	0.459	S	S	*	.			trans	-115.1	171.4	178.8	-70.8	175.8	-147.4	0	0	111.2	P417 T420	P417-E422 CarbonylContact C-O 3.55Å; P417-E422 WeakPolarHBondContact CB-O 3.45Å; P417-E422 PolarHBondContact O-N 3.48Å; T420-E422 VanDerWaalsContact C-N 3.28Å; T420-E422 PolarHBondContact O-N 3.38Å
423	T	93.8	Very high	92.2	Very high	143 Å²	143	81.7 Å²	81.7	88%	0.877	45%	0.451	S	S	*	.			trans	-111.6	144.7	168	60.9	0	0	0	0	109.3
424	G	90.8	Very high	92.1	Very high	50 Å²	50	82.8 Å²	82.8	52%	0.515	46%	0.457	S	S	.	.			trans	-166	168.4	-175.4	0	0	0	0	0	112.5	V426	G424-V426 PolarHBondContact O-N 2.96Å
425	K	88.3	Confident	92	Very high	213 Å²	213	78.8 Å²	78.8	93%	0.926	44%	0.439	S	S	*	.			trans	-71.3	121.1	172.8	-65.9	-176.7	-178.5	-180	0	108.6
426	V	86.6	Confident	92	Very high	117 Å²	117	77.5 Å²	77.5	71%	0.709	43%	0.434	S	S	*	.			trans	-98.6	133.5	173.5	-175.8	0	0	0	0	108.4	P417 G424	P417-V426 HydrophobicContact CG-CG2 4Å; G424-V426 PolarHBondContact O-N 2.96Å
427	G	74.8	Confident	92.1	Very high	70 Å²	70	76.9 Å²	76.9	72%	0.722	43%	0.43	S	S	*	.	S	Bend	trans	91.1	154.1	-178.1	0	0	0	0	0	114.2
428	G	82.9	Confident	92.1	Very high	75 Å²	75	76.3 Å²	76.3	77%	0.773	43%	0.427	S	S	*	.	S	Bend	trans	96	-171.1	-175.1	0	0	0	0	0	113.4	N430	G428-N430 PolarHBondContact O-N 2.88Å
429	L	82.9	Confident	92.2	Very high	102 Å²	102	70 Å²	70	53%	0.534	40%	0.403	S	S	.	.			trans	-85.3	104.7	-171.9	-169.3	96.5	0	0	0	111.5	T109 I114	T109-L429 WeakPolarHBondContact OG1-CD2 3.37Å; I114-L429 HydrophobicContact CD1-CD1 3.62Å; I114-L429 HydrophobicContact CD1-CD2 3.56Å; I114-L429 HydrophobicContact CD1-CG 3.84Å; I114-L429 HydrophobicContact CG1-CD2 4.29Å
430	N	92	Very high	92.2	Very high	72 Å²	72	69.6 Å²	69.6	39%	0.385	40%	0.399	S	S	.	.			trans	-104	112.2	174.3	-173.4	-25.5	0	0	0	111	G428 R432 E433 L434	G428-N430 PolarHBondContact O-N 2.88Å; N430-R432 VanDerWaalsContact C-N 3.25Å; N430-R432 PolarHBondContact O-N 2.98Å; N430-R432 WeakPolarHBondContact OD1-CB 3.32Å; N430-R432 PolarHBondContact OD1-N 3.11Å; N430-E433 HydrophobicContact CB-CB 4.02Å; N430-E433 HydrophobicContact CB-CG 4.03Å; N430-E433 VanDerWaalsContact CB-OE2 3.22Å; N430-E433 WeakPolarHBondContact CB-OE2 3.37Å; N430-E433 PolarHBondContact O-N 3.34Å; N430-E433 PolarHBondContact OD1-N 2.81Å; N430-L434 WeakPolarHBondContact O-CB 3.26Å; N430-L434 PolarHBondContact O-N 2.93Å; N430-L434 VanDerWaalsContact O-N 3.1Å
431	R	93.9	Very high	92.3	Very high	81 Å²	81	68.8 Å²	68.8	31%	0.306	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-35.5	-178.5	-59.7	-172.2	178.4	-169.6	-3.4	112.2	V86 D87 I114 R118 G435	V86-R431 PolarHBondContact O-NH1 2.91Å; D87-R431 IonicContact OD1-CZ 3.32Å; D87-R431 IonicContact OD1-NH1 2.98Å; D87-R431 IonicContact OD1-NH2 3.53Å; D87-R431 PolarHBondContact OD1-NH2 2.84Å; I114-R431 HydrophobicContact CG2-CB 3.78Å; I114-R431 HydrophobicContact CG2-CG 3.73Å; R118-R431 WeakPolarHBondContact CD-O 3.17Å; R118-R431 PolarHBondContact NE-O 3.01Å; R431-G435 PolarHBondContact O-N 3.4Å; R431-G435 VanDerWaalsContact O-N 3.1Å
432	R	91.8	Very high	92.4	Very high	133 Å²	133	64.3 Å²	64.3	50%	0.502	37%	0.367	S	S	.	.	H	α-helix	trans	-71.6	-46.4	-177.7	-174.7	178.5	-175.1	172.7	1.7	111.2	N430 G435 H436	N430-R432 VanDerWaalsContact C-N 3.25Å; N430-R432 PolarHBondContact O-N 2.98Å; N430-R432 WeakPolarHBondContact OD1-CB 3.32Å; N430-R432 PolarHBondContact OD1-N 3.11Å; R432-G435 PolarHBondContact O-N 3.06Å; R432-H436 PolarHBondContact O-N 3.07Å
433	E	95.1	Very high	92.6	Very high	41 Å²	41	58.2 Å²	58.2	19%	0.192	34%	0.339	C	S	.	.	H	α-helix	trans	-60.3	-47.7	177.9	-71.8	177.1	161.6	0	0	111.3	Y413 F415 N430 G435 H436 G437	Y413-E433 HydrophobicContact CD1-CB 3.9Å; Y413-E433 HydrophobicContact CD1-CG 4.05Å; Y413-E433 WeakPolarHBondContact CD1-O 3.49Å; Y413-E433 HydrophobicContact CE1-CB 4.32Å; Y413-E433 HydrophobicContact CE1-CG 4.05Å; F415-E433 WeakPolarHBondContact CA-OE1 3.37Å; F415-E433 HydrophobicContact CB-CG 4.04Å; F415-E433 PolarHBondContact N-OE1 2.96Å; N430-E433 HydrophobicContact CB-CB 4.02Å; N430-E433 HydrophobicContact CB-CG 4.03Å; N430-E433 VanDerWaalsContact CB-OE2 3.22Å; N430-E433 WeakPolarHBondContact CB-OE2 3.37Å; N430-E433 PolarHBondContact O-N 3.34Å; N430-E433 PolarHBondContact OD1-N 2.81Å; E433-G435 VanDerWaalsContact C-N 3.3Å; E433-G435 PolarHBondContact O-N 3.31Å; E433-H436 PolarHBondContact O-N 3.44Å; E433-H436 VanDerWaalsContact O-N 3.15Å; E433-G437 PolarHBondContact O-N 3.24Å
434	L	95.7	Very high	92.8	Very high	33 Å²	33	51.4 Å²	51.4	17%	0.173	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-41.8	176.2	-167.5	157.2	0	0	0	111.8	D111 I114 L115 N430 A438	D111-L434 HydrophobicContact CB-CD1 4.27Å; D111-L434 HydrophobicContact CB-CD2 4.24Å; D111-L434 WeakPolarHBondContact OD1-CD1 3.15Å; I114-L434 HydrophobicContact CB-CD2 4.47Å; I114-L434 HydrophobicContact CD1-CD1 3.71Å; I114-L434 HydrophobicContact CG2-CD1 4.48Å; I114-L434 HydrophobicContact CG2-CD2 4.25Å; L115-L434 HydrophobicContact CD1-CD2 4.1Å; L115-L434 HydrophobicContact CD2-CD2 3.59Å; L115-L434 HydrophobicContact CG-CD2 3.56Å; N430-L434 WeakPolarHBondContact O-CB 3.26Å; N430-L434 PolarHBondContact O-N 2.93Å; N430-L434 VanDerWaalsContact O-N 3.1Å; L434-A438 VanDerWaalsContact O-CB 3.25Å; L434-A438 WeakPolarHBondContact O-CB 3.23Å; L434-A438 PolarHBondContact O-N 3.5Å
435	G	95.9	Very high	93.1	Very high	2 Å²	2	54.7 Å²	54.7	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-40.4	175.5	0	0	0	0	0	114.1	R431 R432 E433 L439	R431-G435 PolarHBondContact O-N 3.4Å; R431-G435 VanDerWaalsContact O-N 3.1Å; R432-G435 PolarHBondContact O-N 3.06Å; E433-G435 VanDerWaalsContact C-N 3.3Å; E433-G435 PolarHBondContact O-N 3.31Å; G435-L439 PolarHBondContact O-N 2.88Å; G435-L439 VanDerWaalsContact O-N 3.11Å
436	H	96.8	Very high	93.5	Very high	8 Å²	8	45.7 Å²	45.7	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-72	-42.4	176.8	-75.5	-172.4	0	0	0	112	Y413 R432 E433 L439 A440	Y413-H436 HydrophobicContact CD1-CB 3.78Å; Y413-H436 HydrophobicContact CD2-CB 4.12Å; Y413-H436 HydrophobicContact CE1-CB 3.76Å; Y413-H436 AromaticContact CE1-ND1 3.8Å; Y413-H436 HydrophobicContact CE2-CB 4.09Å; Y413-H436 HydrophobicContact CG-CB 3.97Å; Y413-H436 AromaticContact CZ-ND1 3.58Å; Y413-H436 PolarHBondContact OH-ND1 3.26Å; R432-H436 PolarHBondContact O-N 3.07Å; E433-H436 PolarHBondContact O-N 3.44Å; E433-H436 VanDerWaalsContact O-N 3.15Å; H436-L439 WeakPolarHBondContact O-CB 3.45Å; H436-L439 PolarHBondContact O-N 3.44Å; H436-A440 PolarHBondContact O-N 2.73Å
437	G	97.3	Very high	94	Very high	2 Å²	2	40.2 Å²	40.2	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-47.1	175.2	0	0	0	0	0	111.4	E433 L439 A440 E441	E433-G437 PolarHBondContact O-N 3.24Å; G437-L439 VanDerWaalsContact C-N 3.32Å; G437-L439 PolarHBondContact O-N 2.85Å; G437-A440 PolarHBondContact O-N 2.84Å; G437-E441 WeakPolarHBondContact O-CB 3.46Å; G437-E441 PolarHBondContact O-N 2.81Å
438	A	96.8	Very high	95.1	Very high	16 Å²	16	38 Å²	38	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-45.5	173.2	0	0	0	0	0	111.3	L115 L434 E441 K442	L115-A438 HydrophobicContact CD1-CB 3.92Å; L115-A438 HydrophobicContact CD2-CB 3.68Å; L115-A438 HydrophobicContact CG-CB 4.45Å; L434-A438 VanDerWaalsContact O-CB 3.25Å; L434-A438 WeakPolarHBondContact O-CB 3.23Å; L434-A438 PolarHBondContact O-N 3.5Å; A438-E441 WeakPolarHBondContact O-CB 3.3Å; A438-E441 PolarHBondContact O-N 3.39Å; A438-K442 WeakPolarHBondContact O-CE 3.33Å; A438-K442 WeakPolarHBondContact O-CG 3.47Å; A438-K442 PolarHBondContact O-N 2.84Å
439	L	98.1	Very high	95.7	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-45.8	177.5	-178.6	61.7	0	0	0	113.3	G435 H436 G437 E441 K442 A443 M471 K533 A543 Q545	G435-L439 PolarHBondContact O-N 2.88Å; G435-L439 VanDerWaalsContact O-N 3.11Å; H436-L439 WeakPolarHBondContact O-CB 3.45Å; H436-L439 PolarHBondContact O-N 3.44Å; G437-L439 VanDerWaalsContact C-N 3.32Å; G437-L439 PolarHBondContact O-N 2.85Å; L439-E441 VanDerWaalsContact C-N 3.35Å; L439-K442 HydrophobicContact CD1-CD 4.4Å; L439-A443 PolarHBondContact O-N 3.21Å; L439-A443 VanDerWaalsContact O-N 3.11Å; L439-M471 HydrophobicContact CD2-CE 3.54Å; L439-M471 HydrophobicContact CG-CE 3.81Å; L439-K533 HydrophobicContact CD2-CB 4.11Å; L439-K533 HydrophobicContact CD2-CD 3.64Å; L439-A543 HydrophobicContact CD1-CB 4.21Å; L439-Q545 HydrophobicContact CD1-CB 3.76Å; L439-Q545 HydrophobicContact CD2-CB 3.88Å; L439-Q545 HydrophobicContact CD2-CG 4.43Å; L439-Q545 HydrophobicContact CG-CB 4.48Å
440	A	98.3	Very high	95.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-35.2	176.7	0	0	0	0	0	111.9	L411 H436 G437 A443 L444 A474	L411-A440 HydrophobicContact CD1-CB 3.72Å; L411-A440 HydrophobicContact CD2-CB 3.91Å; L411-A440 HydrophobicContact CG-CB 4.47Å; H436-A440 PolarHBondContact O-N 2.73Å; G437-A440 PolarHBondContact O-N 2.84Å; A440-A443 WeakPolarHBondContact O-CB 3.31Å; A440-A443 PolarHBondContact O-N 2.83Å; A440-L444 PolarHBondContact O-N 3.35Å; A440-L444 VanDerWaalsContact O-N 3.16Å; A440-A474 HydrophobicContact CB-CB 4.48Å
441	E	98.1	Very high	95.6	Very high	20 Å²	20	45 Å²	45	9%	0.093	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-50.8	174	-167.9	-175.7	116.1	0	0	111.3	K407 F409 L411 G437 A438 L439 A443 L444 R445	K407-E441 IonicContact NZ-OE1 3.31Å; K407-E441 PolarHBondContact NZ-OE1 2.94Å; K407-E441 IonicContact NZ-OE2 3.16Å; F409-E441 HydrophobicContact CD1-CG 3.96Å; F409-E441 HydrophobicContact CE1-CG 3.7Å; L411-E441 HydrophobicContact CB-CB 3.91Å; L411-E441 HydrophobicContact CB-CG 4.3Å; L411-E441 PolarHBondContact N-OE2 2.77Å; G437-E441 WeakPolarHBondContact O-CB 3.46Å; G437-E441 PolarHBondContact O-N 2.81Å; A438-E441 WeakPolarHBondContact O-CB 3.3Å; A438-E441 PolarHBondContact O-N 3.39Å; L439-E441 VanDerWaalsContact C-N 3.35Å; E441-A443 VanDerWaalsContact C-N 3.26Å; E441-A443 PolarHBondContact O-N 3.49Å; E441-L444 PolarHBondContact O-N 2.79Å; E441-R445 VanDerWaalsContact O-CB 3.29Å; E441-R445 WeakPolarHBondContact O-CB 3.47Å; E441-R445 PolarHBondContact O-N 2.69Å
442	K	96.3	Very high	95.4	Very high	43 Å²	43	42.3 Å²	42.3	19%	0.187	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-32.4	177.3	4.6	173.2	167.2	-177.4	0	112.2	E216 A438 L439 L444 P446 A543	E216-K442 IonicContact OE1-NZ 2.83Å; E216-K442 PolarHBondContact OE1-NZ 2.97Å; A438-K442 WeakPolarHBondContact O-CE 3.33Å; A438-K442 WeakPolarHBondContact O-CG 3.47Å; A438-K442 PolarHBondContact O-N 2.84Å; L439-K442 HydrophobicContact CD1-CD 4.4Å; K442-L444 VanDerWaalsContact C-N 3.33Å; K442-P446 WeakPolarHBondContact O-CD 3.48Å; K442-A543 HydrophobicContact CB-CB 4.37Å
443	A	98.4	Very high	95.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-38.7	176.8	0	0	0	0	0	112.1	L439 A440 E441 A474 V492 A535 T542 A543	L439-A443 PolarHBondContact O-N 3.21Å; L439-A443 VanDerWaalsContact O-N 3.11Å; A440-A443 WeakPolarHBondContact O-CB 3.31Å; A440-A443 PolarHBondContact O-N 2.83Å; E441-A443 VanDerWaalsContact C-N 3.26Å; E441-A443 PolarHBondContact O-N 3.49Å; A443-A474 HydrophobicContact CB-CB 4.11Å; A443-V492 HydrophobicContact CB-CG1 4.47Å; A443-A535 HydrophobicContact CB-CB 3.56Å; A443-T542 WeakPolarHBondContact CA-OG1 3.41Å; A443-T542 WeakPolarHBondContact O-CB 3.38Å; A443-T542 PolarHBondContact O-OG1 2.94Å; A443-A543 HydrophobicContact CB-CB 3.97Å
444	L	98.4	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-90	-32.2	-176.5	-70.5	169.5	0	0	0	113.5	F409 L411 A440 E441 K442 P446 V447 I448 L481 V492	F409-L444 HydrophobicContact CE1-CB 4.14Å; F409-L444 HydrophobicContact CZ-CB 3.77Å; F409-L444 HydrophobicContact CZ-CD1 4.34Å; L411-L444 HydrophobicContact CD1-CD1 3.82Å; A440-L444 PolarHBondContact O-N 3.35Å; A440-L444 VanDerWaalsContact O-N 3.16Å; E441-L444 PolarHBondContact O-N 2.79Å; K442-L444 VanDerWaalsContact C-N 3.33Å; L444-P446 VanDerWaalsContact C-CD 3.43Å; L444-P446 VanDerWaalsContact C-N 3.34Å; L444-P446 VanDerWaalsContact O-N 3.15Å; L444-V447 WeakPolarHBondContact O-CG2 3.4Å; L444-V447 PolarHBondContact O-N 2.84Å; L444-I448 WeakPolarHBondContact O-CG1 3.23Å; L444-L481 HydrophobicContact CD1-CD1 4.29Å; L444-L481 HydrophobicContact CD2-CD1 4.28Å; L444-V492 HydrophobicContact CD2-CB 3.94Å; L444-V492 HydrophobicContact CD2-CG1 4.34Å; L444-V492 HydrophobicContact CD2-CG2 4.36Å
445	R	96.8	Very high	94.9	Very high	120 Å²	120	35.9 Å²	35.9	45%	0.453	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-48.4	-43.2	-174.6	-178.5	179.2	-176	117.6	1.6	114.7	F409 E441 V447 I448	F409-R445 HydrophobicContact CD1-CB 4.34Å; F409-R445 HydrophobicContact CE1-CB 4.34Å; E441-R445 VanDerWaalsContact O-CB 3.29Å; E441-R445 WeakPolarHBondContact O-CB 3.47Å; E441-R445 PolarHBondContact O-N 2.69Å; R445-V447 PolarHBondContact O-N 3.35Å; R445-V447 VanDerWaalsContact O-N 3.16Å; R445-I448 WeakPolarHBondContact O-CB 3.47Å; R445-I448 PolarHBondContact O-N 2.9Å; R445-I448 VanDerWaalsContact O-N 3.09Å
446	P	97.1	Very high	94.9	Very high	23 Å²	23	36 Å²	36	15%	0.149	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-63.7	-19.4	-179.5	-28	39	0	0	0	115.3	A219 K442 L444 T542	A219-P446 WeakPolarHBondContact O-CG 3.33Å; K442-P446 WeakPolarHBondContact O-CD 3.48Å; L444-P446 VanDerWaalsContact C-CD 3.43Å; L444-P446 VanDerWaalsContact C-N 3.34Å; L444-P446 VanDerWaalsContact O-N 3.15Å; P446-T542 HydrophobicContact CB-CG2 3.97Å; P446-T542 HydrophobicContact CG-CG2 3.95Å
447	V	97.7	Very high	95	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-98.4	-5.3	177.6	-57.8	0	0	0	0	113.2	L444 R445 I488 S489 V492 T537	L444-V447 WeakPolarHBondContact O-CG2 3.4Å; L444-V447 PolarHBondContact O-N 2.84Å; R445-V447 PolarHBondContact O-N 3.35Å; R445-V447 VanDerWaalsContact O-N 3.16Å; V447-I488 HydrophobicContact CB-CB 4.33Å; V447-I488 HydrophobicContact CG2-CB 4.16Å; V447-I488 HydrophobicContact CG2-CG2 4.46Å; V447-I488 CarbonylContact O-C 3.57Å; V447-I488 WeakPolarHBondContact O-CA 3.29Å; V447-I488 WeakPolarHBondContact O-CB 3.37Å; V447-S489 WeakPolarHBondContact CA-OG 3.39Å; V447-S489 PolarHBondContact O-N 2.85Å; V447-V492 HydrophobicContact CB-CG2 4.25Å; V447-V492 HydrophobicContact CG1-CG2 3.58Å; V447-V492 HydrophobicContact CG2-CG2 3.61Å; V447-T537 HydrophobicContact CG1-CG2 3.74Å
448	I	97.1	Very high	95	Very high	25 Å²	25	40 Å²	40	13%	0.128	19%	0.193	C	C	.	.	S	Bend	trans	-75.8	133.4	178.8	-57	-58.1	0	0	0	109.8	F409 L444 R445 I456 L481 I488	F409-I448 HydrophobicContact CB-CG2 4.29Å; F409-I448 HydrophobicContact CD1-CG1 4.04Å; F409-I448 HydrophobicContact CD2-CD1 3.91Å; F409-I448 HydrophobicContact CD2-CG1 3.9Å; F409-I448 HydrophobicContact CD2-CG2 4.43Å; F409-I448 HydrophobicContact CE1-CG1 4.09Å; F409-I448 HydrophobicContact CE2-CD1 3.66Å; F409-I448 HydrophobicContact CE2-CG1 3.96Å; F409-I448 HydrophobicContact CG-CD1 4.47Å; F409-I448 HydrophobicContact CG-CG1 3.94Å; F409-I448 HydrophobicContact CG-CG2 4.37Å; F409-I448 HydrophobicContact CZ-CD1 4.02Å; F409-I448 HydrophobicContact CZ-CG1 4.06Å; L444-I448 WeakPolarHBondContact O-CG1 3.23Å; R445-I448 WeakPolarHBondContact O-CB 3.47Å; R445-I448 PolarHBondContact O-N 2.9Å; R445-I448 VanDerWaalsContact O-N 3.09Å; I448-I456 HydrophobicContact CG2-CD1 4.12Å; I448-L481 HydrophobicContact CD1-CD1 3.6Å; I448-L481 HydrophobicContact CD1-CD2 4.2Å; I448-I488 HydrophobicContact CD1-CG2 4.08Å
449	P	94.6	Very high	95.1	Very high	35 Å²	35	39.8 Å²	39.8	23%	0.227	19%	0.19	C	C	.	.			trans	-63.7	138.3	174.3	26.2	-35.8	0	0	0	111.9	F452 V486 P487	P449-F452 HydrophobicContact CG-CB 4.09Å; P449-F452 HydrophobicContact CG-CD2 4.09Å; P449-F452 HydrophobicContact CG-CG 4.36Å; P449-V486 HydrophobicContact CG-CG1 3.93Å; P449-P487 HydrophobicContact CB-CG 4.39Å; P449-P487 HydrophobicContact CG-CG 4.04Å
450	K	87.5	Confident	95.1	Very high	199 Å²	199	39.8 Å²	39.8	87%	0.865	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-42.4	-179.9	-67.2	-177.9	179.5	178.1	0	112.8	F452	K450-F452 PolarHBondContact O-N 3.41Å
451	D	85.1	Confident	95.1	Very high	160 Å²	160	42.4 Å²	42.4	86%	0.856	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	48	-173.1	-55.1	-48.3	0	0	0	112.1
452	F	89.5	Confident	95.1	Very high	26 Å²	26	41.5 Å²	41.5	11%	0.114	20%	0.198	C	C	.	.			trans	-83.4	134.3	174.5	-160.5	-108.7	0	0	0	110.3	F385 P449 K450 F454 I456 V486	F385-F452 AromaticContact CD1-CE1 3.77Å; F385-F452 HydrophobicContact CD1-CE1 3.77Å; F385-F452 HydrophobicContact CD1-CZ 4.44Å; F385-F452 AromaticContact CE1-CE1 3.46Å; F385-F452 HydrophobicContact CE1-CE1 3.46Å; F385-F452 VanDerWaalsContact CE1-CE1 3.46Å; F385-F452 AromaticContact CE1-CZ 3.79Å; F385-F452 HydrophobicContact CE1-CZ 3.79Å; F385-F452 HydrophobicContact CZ-CE1 4.11Å; F385-F452 AromaticContact CZ-CZ 3.98Å; F385-F452 HydrophobicContact CZ-CZ 3.98Å; P449-F452 HydrophobicContact CG-CB 4.09Å; P449-F452 HydrophobicContact CG-CD2 4.09Å; P449-F452 HydrophobicContact CG-CG 4.36Å; K450-F452 PolarHBondContact O-N 3.41Å; F452-F454 HydrophobicContact CD1-CB 3.96Å; F452-F454 HydrophobicContact CD1-CD2 4.36Å; F452-F454 HydrophobicContact CE1-CB 3.87Å; F452-F454 AromaticContact CE1-CD2 3.67Å; F452-F454 HydrophobicContact CE1-CD2 3.67Å; F452-F454 HydrophobicContact CE1-CG 4.22Å; F452-F454 HydrophobicContact CZ-CD2 4.13Å; F452-F454 PolarHBondContact O-N 3.45Å; F452-I456 HydrophobicContact CB-CD1 4.47Å; F452-I456 HydrophobicContact CD1-CD1 3.61Å; F452-I456 HydrophobicContact CD1-CG1 3.69Å; F452-I456 HydrophobicContact CE1-CD1 4.01Å; F452-I456 HydrophobicContact CE1-CG1 3.93Å; F452-I456 HydrophobicContact CG-CD1 4.1Å; F452-V486 HydrophobicContact CE1-CG2 4.41Å; F452-V486 HydrophobicContact CZ-CG2 4.09Å
453	P	88	Confident	95.2	Very high	66 Å²	66	41.6 Å²	41.6	43%	0.429	20%	0.2	S	C	.	.	S	Bend	trans	-71.8	-1.3	-171.6	28.9	-36.4	0	0	0	114.5
454	F	91	Very high	95.2	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.022	22%	0.218	C	C	.	.	S	Bend	trans	-132.1	154.7	-173.9	-54.8	-53.4	0	0	0	111.5	F385 F452 P592 V594 F637	F385-F454 HydrophobicContact CB-CB 4.16Å; F385-F454 HydrophobicContact CB-CD2 4.32Å; F385-F454 HydrophobicContact CB-CG 4.32Å; F385-F454 HydrophobicContact CD1-CB 4.27Å; F385-F454 HydrophobicContact CD1-CD2 4.45Å; F385-F454 HydrophobicContact CG-CB 4.47Å; F385-F454 HydrophobicContact CG-CD2 4.24Å; F452-F454 HydrophobicContact CD1-CB 3.96Å; F452-F454 HydrophobicContact CD1-CD2 4.36Å; F452-F454 HydrophobicContact CE1-CB 3.87Å; F452-F454 AromaticContact CE1-CD2 3.67Å; F452-F454 HydrophobicContact CE1-CD2 3.67Å; F452-F454 HydrophobicContact CE1-CG 4.22Å; F452-F454 HydrophobicContact CZ-CD2 4.13Å; F452-F454 PolarHBondContact O-N 3.45Å; F454-P592 HydrophobicContact CD1-CG 4.26Å; F454-P592 HydrophobicContact CD2-CG 4.16Å; F454-P592 HydrophobicContact CE1-CB 4.25Å; F454-P592 HydrophobicContact CE1-CG 3.97Å; F454-P592 HydrophobicContact CE2-CG 3.84Å; F454-P592 HydrophobicContact CG-CG 4.35Å; F454-P592 HydrophobicContact CZ-CB 4.27Å; F454-P592 HydrophobicContact CZ-CG 3.77Å; F454-P592 WeakPolarHBondContact CZ-O 3.27Å; F454-V594 HydrophobicContact CD1-CG2 4.44Å; F454-V594 HydrophobicContact CE1-CG2 3.52Å; F454-V594 HydrophobicContact CZ-CG2 4.25Å; F454-F637 AromaticContact CD1-CD2 3.9Å; F454-F637 HydrophobicContact CD1-CD2 3.9Å; F454-F637 AromaticContact CD1-CE2 3.49Å; F454-F637 HydrophobicContact CD1-CE2 3.49Å; F454-F637 VanDerWaalsContact CD1-CE2 3.49Å; F454-F637 AromaticContact CE1-CD2 3.73Å; F454-F637 HydrophobicContact CE1-CD2 3.73Å; F454-F637 AromaticContact CE1-CE2 3.54Å; F454-F637 HydrophobicContact CE1-CE2 3.54Å
455	T	94	Very high	95.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	134.5	160.8	-61.2	0	0	0	0	108.6	F385 D386 S387 N408 M410	F385-T455 WeakPolarHBondContact CA-O 3.4Å; D386-T455 PolarHBondContact N-O 3.25Å; D386-T455 PolarHBondContact O-N 2.97Å; S387-T455 WeakPolarHBondContact O-CB 3.29Å; S387-T455 PolarHBondContact O-OG1 3.18Å; N408-T455 CarbonylContact O-C 3.58Å; N408-T455 VanDerWaalsContact O-CA 3.3Å; N408-T455 WeakPolarHBondContact O-CA 2.88Å; N408-T455 WeakPolarHBondContact O-CG2 3.5Å; M410-T455 HydrophobicContact CE-CG2 3.81Å; M410-T455 HydrophobicContact SD-CG2 3.77Å
456	I	96.4	Very high	95.2	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.015	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	112.7	-179.1	-55.4	172.6	0	0	0	108.7	V383 F385 N408 F409 M410 I448 F452 L481 V486	V383-I456 HydrophobicContact CG1-CG2 4.05Å; F385-I456 HydrophobicContact CD1-CG1 4.15Å; F385-I456 HydrophobicContact CE1-CG1 4.07Å; N408-I456 PolarHBondContact O-N 3.11Å; F409-I456 WeakPolarHBondContact CA-O 3.37Å; F409-I456 HydrophobicContact CD2-CB 4Å; F409-I456 HydrophobicContact CD2-CG2 3.9Å; F409-I456 HydrophobicContact CE2-CG2 4.26Å; M410-I456 PolarHBondContact N-O 3.35Å; I448-I456 HydrophobicContact CG2-CD1 4.12Å; F452-I456 HydrophobicContact CB-CD1 4.47Å; F452-I456 HydrophobicContact CD1-CD1 3.61Å; F452-I456 HydrophobicContact CD1-CG1 3.69Å; F452-I456 HydrophobicContact CE1-CD1 4.01Å; F452-I456 HydrophobicContact CE1-CG1 3.93Å; F452-I456 HydrophobicContact CG-CD1 4.1Å; I456-L481 HydrophobicContact CG2-CD2 3.67Å; I456-V486 HydrophobicContact CD1-CG1 3.9Å; I456-V486 HydrophobicContact CD1-CG2 4.04Å
457	R	97.8	Very high	95.1	Very high	95 Å²	95	40.2 Å²	40.2	36%	0.358	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.1	169.5	-174.1	177.6	163.8	175.3	-0.6	109.8	V383 T384 M410 H412 T459	V383-R457 CarbonylContact C-O 3.26Å; V383-R457 WeakPolarHBondContact CA-O 3.19Å; T384-R457 PolarHBondContact N-O 2.84Å; T384-R457 PolarHBondContact O-N 2.88Å; M410-R457 HydrophobicContact CE-CB 3.47Å; M410-R457 VanDerWaalsContact CE-CB 3.47Å; M410-R457 HydrophobicContact CE-CG 3.8Å; M410-R457 HydrophobicContact CG-CB 4.46Å; M410-R457 HydrophobicContact CG-CG 4.26Å; M410-R457 HydrophobicContact SD-CB 3.88Å; M410-R457 HydrophobicContact SD-CG 4.3Å; H412-R457 PolarHBondContact ND1-NE 3.43Å; R457-T459 PolarHBondContact NE-OG1 3.21Å; R457-T459 VanDerWaalsContact NE-OG1 3.15Å
458	V	98.5	Very high	94.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.6	163.8	-177.2	0	0	0	0	108.1	S382 V383 F409 M410 L411 H412 L481	S382-V458 CarbonylContact O-C 3.59Å; S382-V458 WeakPolarHBondContact O-CA 3.23Å; V383-V458 HydrophobicContact CG2-CG2 4.22Å; F409-V458 HydrophobicContact CE2-CG2 3.69Å; F409-V458 HydrophobicContact CZ-CG2 4.25Å; M410-V458 PolarHBondContact O-N 3.32Å; L411-V458 CarbonylContact C-O 3.44Å; L411-V458 VanDerWaalsContact CA-O 3.29Å; L411-V458 WeakPolarHBondContact CA-O 3.48Å; L411-V458 HydrophobicContact CB-CB 4.26Å; L411-V458 HydrophobicContact CD1-CB 4.05Å; L411-V458 HydrophobicContact CD1-CG1 3.84Å; L411-V458 HydrophobicContact CG-CB 3.94Å; L411-V458 HydrophobicContact CG-CG1 4.01Å; H412-V458 PolarHBondContact N-O 2.82Å; V458-L481 HydrophobicContact CG2-CD1 4.48Å; V458-L481 HydrophobicContact CG2-CD2 4.15Å; V458-L481 HydrophobicContact CG2-CG 4.3Å
459	T	98.4	Very high	94.9	Very high	12 Å²	12	39.7 Å²	39.7	7%	0.074	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.3	168.6	-53.6	0	0	0	0	107.8	S381 S382 H412 R457 E461	S381-T459 CarbonylContact C-O 3.53Å; S381-T459 VanDerWaalsContact CA-O 3.27Å; S381-T459 WeakPolarHBondContact CA-O 3.29Å; S382-T459 PolarHBondContact N-O 3.33Å; S382-T459 PolarHBondContact O-N 2.96Å; H412-T459 CarbonylContact O-C 3.5Å; H412-T459 WeakPolarHBondContact O-CA 3.43Å; R457-T459 PolarHBondContact NE-OG1 3.21Å; R457-T459 VanDerWaalsContact NE-OG1 3.15Å; T459-E461 HydrophobicContact CG2-CG 4.11Å
460	A	98.3	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	106	-179.8	0	0	0	0	0	109.9	V379 L380 L411 H412 Y413 E414	V379-A460 HydrophobicContact CG1-CB 4.03Å; L380-A460 WeakPolarHBondContact O-CA 3.49Å; L411-A460 HydrophobicContact CD2-CB 4.36Å; H412-A460 PolarHBondContact O-N 3.01Å; Y413-A460 WeakPolarHBondContact CA-O 3.32Å; E414-A460 PolarHBondContact N-O 3.13Å
461	E	98.4	Very high	95.5	Very high	56 Å²	56	28.7 Å²	28.7	26%	0.262	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.4	-178	-65.2	168.5	88.2	0	0	109	V379 L380 T459 L463	V379-E461 WeakPolarHBondContact CA-O 3.35Å; L380-E461 PolarHBondContact N-O 3.08Å; L380-E461 PolarHBondContact O-N 3.21Å; T459-E461 HydrophobicContact CG2-CG 4.11Å; E461-L463 HydrophobicContact CB-CD2 4.48Å; E461-L463 PolarHBondContact O-N 3.03Å
462	V	98.6	Very high	96.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.3	175.7	-174.8	0	0	0	0	108.8	V379 Y413 E414 F415 P416 A419 E464	V379-V462 HydrophobicContact CG2-CG2 4.18Å; Y413-V462 HydrophobicContact CD2-CG2 4.39Å; Y413-V462 HydrophobicContact CE1-CG2 4.49Å; Y413-V462 HydrophobicContact CE2-CG2 3.47Å; Y413-V462 VanDerWaalsContact CE2-CG2 3.47Å; Y413-V462 WeakPolarHBondContact OH-CG2 3.32Å; E414-V462 WeakPolarHBondContact O-CG2 3.35Å; E414-V462 PolarHBondContact O-N 3.2Å; F415-V462 HydrophobicContact CD1-CB 4.32Å; F415-V462 HydrophobicContact CD1-CG1 4.35Å; F415-V462 HydrophobicContact CE1-CG1 4.34Å; F415-V462 HydrophobicContact CG-CB 4.46Å; P416-V462 WeakPolarHBondContact CD-O 3.48Å; P416-V462 WeakPolarHBondContact CG-O 3.17Å; A419-V462 HydrophobicContact CB-CG1 4.08Å; A419-V462 WeakPolarHBondContact CB-O 3.37Å; V462-E464 WeakPolarHBondContact CG1-O 3.26Å
463	L	98.5	Very high	96.6	Very high	45 Å²	45	19.8 Å²	19.8	24%	0.236	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-32.3	179.2	-55.8	-175.6	0	0	0	112.1	L371 Q378 L380 Y418 A419 E461	L371-L463 HydrophobicContact CD1-CD1 4.13Å; Q378-L463 HydrophobicContact CB-CB 4.14Å; Q378-L463 HydrophobicContact CG-CB 4.09Å; Q378-L463 HydrophobicContact CG-CD1 4.36Å; Q378-L463 PolarHBondContact O-N 3.02Å; L380-L463 HydrophobicContact CB-CD1 3.91Å; L380-L463 HydrophobicContact CB-CG 4.22Å; Y418-L463 HydrophobicContact CE2-CD2 4.15Å; A419-L463 WeakPolarHBondContact CA-O 3.16Å; A419-L463 WeakPolarHBondContact CB-O 3.46Å; E461-L463 HydrophobicContact CB-CD2 4.48Å; E461-L463 PolarHBondContact O-N 3.03Å
464	E	98.6	Very high	97.1	Very high	78 Å²	78	16.7 Å²	16.7	36%	0.364	8%	0.083	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141.9	174.9	-59	176	168.1	0	0	109.1	Q373 T377 Q378 V462	Q373-E464 PolarHBondContact NE2-OE2 3.24Å; T377-E464 WeakPolarHBondContact CA-O 3.49Å; Q378-E464 HydrophobicContact CB-CB 3.72Å; Q378-E464 HydrophobicContact CB-CG 3.86Å; Q378-E464 PolarHBondContact N-O 2.88Å; Q378-E464 PolarHBondContact O-N 3.32Å; V462-E464 WeakPolarHBondContact CG1-O 3.26Å
465	S	97.9	Very high	97.5	Very high	18 Å²	18	16.4 Å²	16.4	13%	0.126	8%	0.082	C	C	.	.			trans	-133.4	116.7	176	176.1	0	0	0	0	113.2	K292 Q376 F415 A419	K292-S465 PolarHBondContact NZ-O 3.44Å; Q376-S465 CarbonylContact O-C 3.43Å; F415-S465 VanDerWaalsContact CZ-OG 3.31Å; F415-S465 WeakPolarHBondContact CZ-OG 3.48Å; A419-S465 PolarHBondContact O-N 3.28Å
466	N	97.1	Very high	97.7	Very high	8 Å²	8	16.4 Å²	16.4	4%	0.043	8%	0.082	C	C	.	.	S	Bend	trans	-135.8	36.8	165.7	-165.9	12.3	0	0	0	111.3	K292 R354 Q376 T377 L521 G522	K292-N466 HydrophobicContact CD-CB 4Å; R354-N466 PolarHBondContact NH1-O 3.36Å; Q376-N466 HydrophobicContact CB-CB 3.77Å; Q376-N466 VanDerWaalsContact O-CB 3.31Å; Q376-N466 WeakPolarHBondContact O-CB 3.49Å; Q376-N466 PolarHBondContact O-N 3.09Å; Q376-N466 PolarHBondContact OE1-ND2 2.94Å; T377-N466 VanDerWaalsContact OG1-C 3.31Å; T377-N466 PolarHBondContact OG1-N 2.89Å; N466-L521 WeakPolarHBondContact O-CA 2.86Å; N466-G522 PolarHBondContact O-N 3.42Å; N466-G522 PolarHBondContact OD1-N 3.38Å
467	G	93.8	Very high	97.8	Very high	10 Å²	10	16.2 Å²	16.2	10%	0.103	8%	0.081	C	C	.	.	S	Bend	trans	123.6	130.6	171.9	0	0	0	0	0	114.5	R354 T377	R354-G467 PolarHBondContact NH2-O 2.84Å; T377-G467 PolarHBondContact OG1-N 3.44Å; T377-G467 PolarHBondContact OG1-O 3.21Å; T377-G467 VanDerWaalsContact OG1-O 3.07Å
468	S	93.6	Very high	97.9	Very high	13 Å²	13	11.8 Å²	11.8	9%	0.091	6%	0.064	C	C	.	.			trans	58.5	44.1	173.1	-154.8	0	0	0	0	115.8	S470 M471 A472 A496	S468-S470 VanDerWaalsContact C-N 3.26Å; S468-S470 PolarHBondContact O-N 3.15Å; S468-M471 PolarHBondContact O-N 3.35Å; S468-M471 VanDerWaalsContact O-N 3.15Å; S468-M471 VanDerWaalsContact OG-CB 3.28Å; S468-M471 WeakPolarHBondContact OG-CB 3.48Å; S468-M471 WeakPolarHBondContact OG-CG 3.44Å; S468-A472 PolarHBondContact O-N 3.35Å; S468-A472 VanDerWaalsContact O-N 3.11Å; S468-A496 WeakPolarHBondContact OG-CB 3.25Å
469	S	97.5	Very high	97.9	Very high	4 Å²	4	11.9 Å²	11.9	3%	0.028	7%	0.065	C	C	.	.	H	α-helix	trans	-56.3	-38	173.6	57.2	0	0	0	0	112.8	Y413 M471 A472 S473	Y413-S469 PolarHBondContact OH-OG 2.82Å; S469-M471 VanDerWaalsContact C-N 3.32Å; S469-M471 PolarHBondContact O-N 3.25Å; S469-A472 CarbonylContact O-C 3.49Å; S469-A472 WeakPolarHBondContact O-CB 3.45Å; S469-A472 PolarHBondContact O-N 3.26Å; S469-A472 VanDerWaalsContact O-N 3.15Å; S469-S473 PolarHBondContact O-N 3.15Å; S469-S473 PolarHBondContact O-OG 2.88Å
470	S	97.1	Very high	97.9	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.007	6%	0.061	C	C	.	.	H	α-helix	trans	-58.5	-38.5	175.7	54.6	0	0	0	0	113.7	S468 S473 A474	S468-S470 VanDerWaalsContact C-N 3.26Å; S468-S470 PolarHBondContact O-N 3.15Å; S470-S473 WeakPolarHBondContact O-CB 3.22Å; S470-S473 PolarHBondContact O-N 2.98Å; S470-A474 PolarHBondContact O-N 3.07Å
471	M	98.6	Very high	97.9	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-76.3	-33.9	176.2	-64	-62.3	92.9	0	0	111.8	L439 S468 S469 S473 A474 C475 K533 A535	L439-M471 HydrophobicContact CD2-CE 3.54Å; L439-M471 HydrophobicContact CG-CE 3.81Å; S468-M471 PolarHBondContact O-N 3.35Å; S468-M471 VanDerWaalsContact O-N 3.15Å; S468-M471 VanDerWaalsContact OG-CB 3.28Å; S468-M471 WeakPolarHBondContact OG-CB 3.48Å; S468-M471 WeakPolarHBondContact OG-CG 3.44Å; S469-M471 VanDerWaalsContact C-N 3.32Å; S469-M471 PolarHBondContact O-N 3.25Å; M471-S473 VanDerWaalsContact C-N 3.27Å; M471-S473 PolarHBondContact O-N 3.1Å; M471-A474 PolarHBondContact O-N 3.1Å; M471-C475 PolarHBondContact O-N 2.74Å; M471-C475 PolarHBondContact O-SG 2.97Å; M471-K533 HydrophobicContact CE-CB 4.05Å; M471-K533 HydrophobicContact CG-CB 4.23Å; M471-K533 HydrophobicContact CG-CG 4.29Å; M471-K533 HydrophobicContact SD-CB 3.94Å; M471-A535 HydrophobicContact SD-CB 4.15Å
472	A	98.7	Very high	97.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.9	-36	169.9	0	0	0	0	0	111.6	F372 T377 V379 S468 S469 C475 G476	F372-A472 HydrophobicContact CD1-CB 3.78Å; F372-A472 HydrophobicContact CE1-CB 4.09Å; T377-A472 HydrophobicContact CG2-CB 4.11Å; V379-A472 HydrophobicContact CB-CB 4.27Å; V379-A472 HydrophobicContact CG2-CB 3.54Å; S468-A472 PolarHBondContact O-N 3.35Å; S468-A472 VanDerWaalsContact O-N 3.11Å; S469-A472 CarbonylContact O-C 3.49Å; S469-A472 WeakPolarHBondContact O-CB 3.45Å; S469-A472 PolarHBondContact O-N 3.26Å; S469-A472 VanDerWaalsContact O-N 3.15Å; A472-C475 PolarHBondContact O-N 3.5Å; A472-G476 PolarHBondContact O-N 3.47Å
473	S	98.8	Very high	97.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.8	-36.9	172.4	-52.8	0	0	0	0	113.2	Y413 S469 S470 M471 G477	Y413-S473 WeakPolarHBondContact CD2-OG 3.39Å; Y413-S473 WeakPolarHBondContact CE2-OG 3.48Å; S469-S473 PolarHBondContact O-N 3.15Å; S469-S473 PolarHBondContact O-OG 2.88Å; S470-S473 WeakPolarHBondContact O-CB 3.22Å; S470-S473 PolarHBondContact O-N 2.98Å; M471-S473 VanDerWaalsContact C-N 3.27Å; M471-S473 PolarHBondContact O-N 3.1Å; S473-G477 WeakPolarHBondContact O-CA 3.14Å; S473-G477 PolarHBondContact O-N 3.21Å
474	A	98.8	Very high	97.9	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-65.3	-43.9	172.8	0	0	0	0	0	111.3	A440 A443 S470 M471 S478	A440-A474 HydrophobicContact CB-CB 4.48Å; A443-A474 HydrophobicContact CB-CB 4.11Å; S470-A474 PolarHBondContact O-N 3.07Å; M471-A474 PolarHBondContact O-N 3.1Å; A474-S478 WeakPolarHBondContact O-CB 3.21Å; A474-S478 PolarHBondContact O-N 2.98Å
475	C	98.8	Very high	97.8	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63.5	-51	176.3	-61.1	0	0	0	0	112.1	F372 M471 A472 G477 S478 L479 G494 M576	F372-C475 HydrophobicContact CD1-CB 4.07Å; F372-C475 HydrophobicContact CD2-CB 3.6Å; F372-C475 HydrophobicContact CE1-CB 3.98Å; F372-C475 HydrophobicContact CE2-CB 3.5Å; F372-C475 HydrophobicContact CG-CB 3.89Å; F372-C475 HydrophobicContact CZ-CB 3.7Å; M471-C475 PolarHBondContact O-N 2.74Å; M471-C475 PolarHBondContact O-SG 2.97Å; A472-C475 PolarHBondContact O-N 3.5Å; C475-G477 PolarHBondContact O-N 2.69Å; C475-S478 WeakPolarHBondContact O-CB 3.42Å; C475-S478 PolarHBondContact O-N 3.12Å; C475-L479 WeakPolarHBondContact O-CG 3.45Å; C475-L479 PolarHBondContact O-N 2.97Å; C475-L479 VanDerWaalsContact O-N 3.07Å; C475-G494 PolarHBondContact SG-N 3.29Å; C475-G494 VanDerWaalsContact SG-N 3.4Å; C475-M576 HydrophobicContact CB-CE 4.1Å; C475-M576 HydrophobicContact CB-SD 3.91Å; C475-M576 WeakPolarHBondContact O-CE 3.39Å
476	G	98.6	Very high	97.7	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.2	-41.4	178.2	0	0	0	0	0	112.3	S381 A472 S478 L479 A480	S381-G476 WeakPolarHBondContact CB-O 3.49Å; S381-G476 VanDerWaalsContact OG-C 3.26Å; S381-G476 WeakPolarHBondContact OG-CA 3.32Å; A472-G476 PolarHBondContact O-N 3.47Å; G476-S478 PolarHBondContact O-N 3.03Å; G476-L479 PolarHBondContact O-N 2.97Å; G476-A480 WeakPolarHBondContact O-CB 3.37Å; G476-A480 PolarHBondContact O-N 3.05Å
477	G	98.6	Very high	97.7	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-60.9	-43.2	173.5	0	0	0	0	0	112.3	S381 S473 C475 L479 A480 L481	S381-G477 PolarHBondContact OG-N 3.09Å; S473-G477 WeakPolarHBondContact O-CA 3.14Å; S473-G477 PolarHBondContact O-N 3.21Å; C475-G477 PolarHBondContact O-N 2.69Å; G477-L479 VanDerWaalsContact C-N 3.35Å; G477-L479 PolarHBondContact O-N 2.94Å; G477-A480 PolarHBondContact O-N 3.3Å; G477-L481 WeakPolarHBondContact O-CB 3.37Å; G477-L481 WeakPolarHBondContact O-CD1 3.39Å; G477-L481 WeakPolarHBondContact O-CG 3.49Å; G477-L481 PolarHBondContact O-N 3.14Å
478	S	98.8	Very high	97.9	Very high	1 Å²	1	6 Å²	6	1%	0.007	4%	0.04	C	C	.	.	H	α-helix	trans	-59.7	-43.7	174.7	-174	0	0	0	0	112.1	A474 C475 G476 M482 A491 V492	A474-S478 WeakPolarHBondContact O-CB 3.21Å; A474-S478 PolarHBondContact O-N 2.98Å; C475-S478 WeakPolarHBondContact O-CB 3.42Å; C475-S478 PolarHBondContact O-N 3.12Å; G476-S478 PolarHBondContact O-N 3.03Å; S478-M482 WeakPolarHBondContact O-CG 3.41Å; S478-M482 PolarHBondContact O-N 2.93Å; S478-A491 WeakPolarHBondContact OG-CA 3.39Å; S478-V492 VanDerWaalsContact CB-O 3.3Å; S478-V492 WeakPolarHBondContact CB-O 3.43Å; S478-V492 PolarHBondContact OG-N 2.9Å
479	L	98.8	Very high	98.1	Very high	2 Å²	2	9.8 Å²	9.8	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-65.8	-46.1	178.2	-69	167.1	0	0	0	111.5	C358 I360 A370 F372 C475 G476 G477 L481 M482 D483 M576 I580	C358-L479 HydrophobicContact CB-CD1 3.83Å; I360-L479 HydrophobicContact CG2-CB 4.1Å; A370-L479 HydrophobicContact CB-CB 3.5Å; A370-L479 HydrophobicContact CB-CD1 4.38Å; F372-L479 HydrophobicContact CD2-CD1 3.97Å; C475-L479 WeakPolarHBondContact O-CG 3.45Å; C475-L479 PolarHBondContact O-N 2.97Å; C475-L479 VanDerWaalsContact O-N 3.07Å; G476-L479 PolarHBondContact O-N 2.97Å; G477-L479 VanDerWaalsContact C-N 3.35Å; G477-L479 PolarHBondContact O-N 2.94Å; L479-L481 VanDerWaalsContact C-N 3.33Å; L479-L481 PolarHBondContact O-N 2.77Å; L479-M482 PolarHBondContact O-N 2.8Å; L479-D483 WeakPolarHBondContact O-CB 3.26Å; L479-D483 PolarHBondContact O-N 2.55Å; L479-M576 HydrophobicContact CD2-CB 4.12Å; L479-M576 HydrophobicContact CD2-CE 4.28Å; L479-M576 HydrophobicContact CD2-CG 4.46Å; L479-M576 HydrophobicContact CG-CE 4Å; L479-I580 HydrophobicContact CD2-CG2 3.47Å; L479-I580 VanDerWaalsContact CD2-CG2 3.47Å
480	A	98.7	Very high	98.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-67	-33.5	-179	0	0	0	0	0	112.3	A370 V383 G476 G477 D483 S484	A370-A480 HydrophobicContact CB-CB 3.98Å; V383-A480 HydrophobicContact CG2-CB 3.73Å; G476-A480 WeakPolarHBondContact O-CB 3.37Å; G476-A480 PolarHBondContact O-N 3.05Å; G477-A480 PolarHBondContact O-N 3.3Å; A480-D483 PolarHBondContact O-N 3.12Å; A480-S484 WeakPolarHBondContact O-CB 3.36Å; A480-S484 PolarHBondContact O-N 3.48Å; A480-S484 PolarHBondContact O-OG 3.07Å
481	L	98.6	Very high	98.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.9	-42.8	171.7	-73.7	165.5	0	0	0	111.9	V383 F409 L444 I448 I456 V458 G477 L479 S484 G485 V486 I488	V383-L481 HydrophobicContact CG1-CD2 4.47Å; V383-L481 HydrophobicContact CG2-CD2 4.04Å; V383-L481 HydrophobicContact CG2-CG 4.17Å; F409-L481 HydrophobicContact CE2-CD1 4.39Å; F409-L481 HydrophobicContact CE2-CD2 4.47Å; L444-L481 HydrophobicContact CD1-CD1 4.29Å; L444-L481 HydrophobicContact CD2-CD1 4.28Å; I448-L481 HydrophobicContact CD1-CD1 3.6Å; I448-L481 HydrophobicContact CD1-CD2 4.2Å; I456-L481 HydrophobicContact CG2-CD2 3.67Å; V458-L481 HydrophobicContact CG2-CD1 4.48Å; V458-L481 HydrophobicContact CG2-CD2 4.15Å; V458-L481 HydrophobicContact CG2-CG 4.3Å; G477-L481 WeakPolarHBondContact O-CB 3.37Å; G477-L481 WeakPolarHBondContact O-CD1 3.39Å; G477-L481 WeakPolarHBondContact O-CG 3.49Å; G477-L481 PolarHBondContact O-N 3.14Å; L479-L481 VanDerWaalsContact C-N 3.33Å; L479-L481 PolarHBondContact O-N 2.77Å; L481-S484 WeakPolarHBondContact CA-OG 3.39Å; L481-S484 PolarHBondContact O-N 3.25Å; L481-S484 PolarHBondContact O-OG 3.07Å; L481-G485 PolarHBondContact O-N 2.93Å; L481-V486 HydrophobicContact CB-CB 4.41Å; L481-V486 HydrophobicContact CD2-CB 4.21Å; L481-V486 HydrophobicContact CD2-CG1 4.37Å; L481-V486 HydrophobicContact CD2-CG2 3.92Å; L481-V486 WeakPolarHBondContact O-CB 3.27Å; L481-V486 PolarHBondContact O-N 3.42Å; L481-I488 HydrophobicContact CB-CD1 4.4Å; L481-I488 HydrophobicContact CB-CG2 4.05Å; L481-I488 HydrophobicContact CD1-CG2 4.29Å
482	M	98.6	Very high	98.2	Very high	5 Å²	5	11.5 Å²	11.5	3%	0.025	8%	0.079	C	C	.	.	H	α-helix	trans	-65.7	-42.3	173.7	-68.7	-171.9	171.9	0	0	112.1	S478 L479 S484 G485 I488 A491 I580 P583 R584	S478-M482 WeakPolarHBondContact O-CG 3.41Å; S478-M482 PolarHBondContact O-N 2.93Å; L479-M482 PolarHBondContact O-N 2.8Å; M482-S484 VanDerWaalsContact C-N 3.28Å; M482-S484 PolarHBondContact O-N 3.47Å; M482-G485 PolarHBondContact O-N 2.87Å; M482-G485 VanDerWaalsContact O-N 3.11Å; M482-I488 HydrophobicContact CE-CD1 3.7Å; M482-I488 HydrophobicContact CE-CG1 3.98Å; M482-I488 HydrophobicContact CG-CD1 3.66Å; M482-I488 HydrophobicContact CG-CG1 4Å; M482-I488 HydrophobicContact SD-CD1 4.49Å; M482-A491 HydrophobicContact CE-CB 3.59Å; M482-I580 HydrophobicContact CB-CD1 3.71Å; M482-I580 HydrophobicContact CB-CG1 4.11Å; M482-I580 HydrophobicContact CB-CG2 4.27Å; M482-I580 HydrophobicContact SD-CG1 4.44Å; M482-I580 HydrophobicContact SD-CG2 4.28Å; M482-P583 HydrophobicContact CG-CG 4.15Å; M482-R584 PolarHBondContact O-N 2.77Å
483	D	98.4	Very high	98.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63	-33.2	177.7	-178.3	49.9	0	0	0	112.5	I360 D361 G368 S369 L479 A480 G485 R584 K588	I360-D483 HydrophobicContact CB-CB 4.18Å; I360-D483 HydrophobicContact CD1-CB 4.49Å; I360-D483 HydrophobicContact CG2-CB 4.43Å; D361-D483 PolarHBondContact N-OD2 3.34Å; G368-D483 WeakPolarHBondContact CA-OD2 3.42Å; S369-D483 PolarHBondContact N-OD2 3.39Å; L479-D483 WeakPolarHBondContact O-CB 3.26Å; L479-D483 PolarHBondContact O-N 2.55Å; A480-D483 PolarHBondContact O-N 3.12Å; D483-G485 VanDerWaalsContact C-N 3.27Å; D483-G485 PolarHBondContact O-N 2.91Å; D483-R584 WeakPolarHBondContact O-CD 3.1Å; D483-R584 PolarHBondContact O-NE 2.83Å; D483-R584 VanDerWaalsContact O-NE 3.16Å; D483-R584 IonicContact OD1-CZ 3.46Å; D483-R584 IonicContact OD1-NE 2.62Å; D483-R584 PolarHBondContact OD1-NE 3.05Å; D483-R584 IonicContact OD1-NH2 2.73Å; D483-R584 PolarHBondContact OD1-NH2 3.01Å; D483-K588 IonicContact OD1-NZ 3.69Å; D483-K588 VanDerWaalsContact OD2-CE 3.29Å; D483-K588 WeakPolarHBondContact OD2-CE 3.27Å; D483-K588 IonicContact OD2-NZ 3.4Å; D483-K588 PolarHBondContact OD2-NZ 3.33Å
484	S	97.3	Very high	98.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.9	175.5	54	0	0	0	0	114.8	H367 A480 L481 M482	H367-S484 VanDerWaalsContact O-CA 3.23Å; H367-S484 WeakPolarHBondContact O-CA 3.29Å; H367-S484 WeakPolarHBondContact O-CB 2.8Å; A480-S484 WeakPolarHBondContact O-CB 3.36Å; A480-S484 PolarHBondContact O-N 3.48Å; A480-S484 PolarHBondContact O-OG 3.07Å; L481-S484 WeakPolarHBondContact CA-OG 3.39Å; L481-S484 PolarHBondContact O-N 3.25Å; L481-S484 PolarHBondContact O-OG 3.07Å; M482-S484 VanDerWaalsContact C-N 3.28Å; M482-S484 PolarHBondContact O-N 3.47Å
485	G	96.3	Very high	98.2	Very high	11 Å²	11	11.5 Å²	11.5	11%	0.113	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	20.1	-176.9	0	0	0	0	0	113.7	L481 M482 D483 P487	L481-G485 PolarHBondContact O-N 2.93Å; M482-G485 PolarHBondContact O-N 2.87Å; M482-G485 VanDerWaalsContact O-N 3.11Å; D483-G485 VanDerWaalsContact C-N 3.27Å; D483-G485 PolarHBondContact O-N 2.91Å; G485-P487 WeakPolarHBondContact O-CD 3.37Å
486	V	97.2	Very high	98.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.079	C	C	.	.			trans	-68.7	124.6	167.4	-179.6	0	0	0	0	108	F385 P449 F452 I456 L481 I488 P583	F385-V486 HydrophobicContact CE1-CG2 3.51Å; F385-V486 HydrophobicContact CZ-CG2 3.58Å; P449-V486 HydrophobicContact CG-CG1 3.93Å; F452-V486 HydrophobicContact CE1-CG2 4.41Å; F452-V486 HydrophobicContact CZ-CG2 4.09Å; I456-V486 HydrophobicContact CD1-CG1 3.9Å; I456-V486 HydrophobicContact CD1-CG2 4.04Å; L481-V486 HydrophobicContact CB-CB 4.41Å; L481-V486 HydrophobicContact CD2-CB 4.21Å; L481-V486 HydrophobicContact CD2-CG1 4.37Å; L481-V486 HydrophobicContact CD2-CG2 3.92Å; L481-V486 WeakPolarHBondContact O-CB 3.27Å; L481-V486 PolarHBondContact O-N 3.42Å; V486-I488 HydrophobicContact CB-CG2 4.27Å; V486-I488 HydrophobicContact CG1-CG2 3.75Å; V486-I488 PolarHBondContact O-N 2.85Å; V486-P583 VanDerWaalsContact O-CB 3.3Å; V486-P583 WeakPolarHBondContact O-CB 3.48Å; V486-P583 WeakPolarHBondContact O-CG 3.21Å
487	P	96.5	Very high	98.1	Very high	77 Å²	77	11.5 Å²	11.5	50%	0.5	8%	0.079	S	C	.	.			trans	-77.8	67.5	-178.7	32.6	-35.4	0	0	0	110.7	P449 G485	P449-P487 HydrophobicContact CB-CG 4.39Å; P449-P487 HydrophobicContact CG-CG 4.04Å; G485-P487 WeakPolarHBondContact O-CD 3.37Å
488	I	98	Very high	98.1	Very high	10 Å²	10	11.5 Å²	11.5	5%	0.051	8%	0.079	C	C	.	.			trans	-66.9	142.8	175.6	65.3	174.4	0	0	0	110.5	V447 I448 L481 M482 V486 S490 P583	V447-I488 HydrophobicContact CB-CB 4.33Å; V447-I488 HydrophobicContact CG2-CB 4.16Å; V447-I488 HydrophobicContact CG2-CG2 4.46Å; V447-I488 CarbonylContact O-C 3.57Å; V447-I488 WeakPolarHBondContact O-CA 3.29Å; V447-I488 WeakPolarHBondContact O-CB 3.37Å; I448-I488 HydrophobicContact CD1-CG2 4.08Å; L481-I488 HydrophobicContact CB-CD1 4.4Å; L481-I488 HydrophobicContact CB-CG2 4.05Å; L481-I488 HydrophobicContact CD1-CG2 4.29Å; M482-I488 HydrophobicContact CE-CD1 3.7Å; M482-I488 HydrophobicContact CE-CG1 3.98Å; M482-I488 HydrophobicContact CG-CD1 3.66Å; M482-I488 HydrophobicContact CG-CG1 4Å; M482-I488 HydrophobicContact SD-CD1 4.49Å; V486-I488 HydrophobicContact CB-CG2 4.27Å; V486-I488 HydrophobicContact CG1-CG2 3.75Å; V486-I488 PolarHBondContact O-N 2.85Å; I488-S490 VanDerWaalsContact C-N 3.3Å; I488-S490 PolarHBondContact O-N 2.75Å; I488-P583 HydrophobicContact CG1-CG 4.2Å
489	S	97.5	Very high	98.1	Very high	94 Å²	94	11.5 Å²	11.5	66%	0.657	8%	0.079	S	C	*	.	S	Bend	trans	-68.2	-28.5	-174	64.6	0	0	0	0	113.6	V447	V447-S489 WeakPolarHBondContact CA-OG 3.39Å; V447-S489 PolarHBondContact O-N 2.85Å
490	S	98.1	Very high	98	Very high	34 Å²	34	11.4 Å²	11.4	24%	0.238	8%	0.079	C	C	.	.	S	Bend	trans	-162.8	159.2	174.9	-158.6	0	0	0	0	111.4	I488	I488-S490 VanDerWaalsContact C-N 3.3Å; I488-S490 PolarHBondContact O-N 2.75Å
491	A	98.5	Very high	97.8	Very high	8 Å²	8	11.8 Å²	11.8	7%	0.066	8%	0.081	C	C	.	.			trans	-66	142.9	169.7	0	0	0	0	0	111.1	S478 M482 T537 L573	S478-A491 WeakPolarHBondContact OG-CA 3.39Å; M482-A491 HydrophobicContact CE-CB 3.59Å; A491-T537 WeakPolarHBondContact O-CA 3.38Å; A491-L573 HydrophobicContact CB-CD2 3.72Å; A491-L573 WeakPolarHBondContact O-CD2 3.49Å
492	V	98.7	Very high	97.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.102	C	C	.	.			trans	-118.9	131.6	176.7	176.3	0	0	0	0	109.4	A443 L444 V447 S478 G536 T537 M576	A443-V492 HydrophobicContact CB-CG1 4.47Å; L444-V492 HydrophobicContact CD2-CB 3.94Å; L444-V492 HydrophobicContact CD2-CG1 4.34Å; L444-V492 HydrophobicContact CD2-CG2 4.36Å; V447-V492 HydrophobicContact CB-CG2 4.25Å; V447-V492 HydrophobicContact CG1-CG2 3.58Å; V447-V492 HydrophobicContact CG2-CG2 3.61Å; S478-V492 VanDerWaalsContact CB-O 3.3Å; S478-V492 WeakPolarHBondContact CB-O 3.43Å; S478-V492 PolarHBondContact OG-N 2.9Å; V492-G536 WeakPolarHBondContact CA-O 3.43Å; V492-T537 HydrophobicContact CG2-CG2 4.05Å; V492-M576 WeakPolarHBondContact O-CE 3.31Å
493	A	98.8	Very high	96.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.3	170.9	0	0	0	0	0	110.9	A535 G536 K569 I572 L573 M576	A493-A535 CarbonylContact O-C 3.6Å; A493-A535 VanDerWaalsContact O-CA 3.26Å; A493-A535 WeakPolarHBondContact O-CA 3.4Å; A493-G536 PolarHBondContact N-O 3.3Å; A493-G536 PolarHBondContact O-N 3.24Å; A493-K569 HydrophobicContact CB-CG 4.24Å; A493-I572 HydrophobicContact CB-CB 4.07Å; A493-I572 HydrophobicContact CB-CG2 3.74Å; A493-L573 HydrophobicContact CB-CD2 3.67Å; A493-L573 HydrophobicContact CB-CG 3.62Å; A493-M576 HydrophobicContact CB-SD 3.78Å
494	G	98.3	Very high	96.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.3	175.5	0	0	0	0	0	113.5	R374 C475 L534 I572	R374-G494 PolarHBondContact NH1-O 3.47Å; C475-G494 PolarHBondContact SG-N 3.29Å; C475-G494 VanDerWaalsContact SG-N 3.4Å; G494-L534 CarbonylContact C-O 3.56Å; G494-L534 VanDerWaalsContact CA-O 3.23Å; G494-L534 WeakPolarHBondContact CA-O 3.33Å; G494-I572 WeakPolarHBondContact O-CD1 3.33Å
495	V	98.6	Very high	95	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.5	176.8	67.5	0	0	0	0	110.1	L353 I497 T518 D519 K533 L534 A565 A568 I572	L353-V495 HydrophobicContact CD2-CG2 4.32Å; V495-I497 HydrophobicContact CG1-CD1 4.36Å; V495-I497 HydrophobicContact CG2-CD1 4.34Å; V495-T518 HydrophobicContact CG2-CG2 4.08Å; V495-D519 HydrophobicContact CG2-CB 4.21Å; V495-K533 WeakPolarHBondContact O-CA 3.15Å; V495-L534 PolarHBondContact N-O 2.91Å; V495-L534 PolarHBondContact O-N 2.8Å; V495-A565 HydrophobicContact CG1-CB 3.79Å; V495-A568 HydrophobicContact CB-CB 4.48Å; V495-A568 HydrophobicContact CG1-CB 4.23Å; V495-A568 HydrophobicContact CG2-CB 4.08Å; V495-I572 HydrophobicContact CB-CD1 3.92Å; V495-I572 HydrophobicContact CG2-CD1 4.23Å
496	A	98.4	Very high	93.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135	167.6	0	0	0	0	0	110.2	S468 D519 I520 F532 K533	S468-A496 WeakPolarHBondContact OG-CB 3.25Å; A496-D519 WeakPolarHBondContact O-CA 3.42Å; A496-D519 PolarHBondContact O-N 2.93Å; A496-I520 HydrophobicContact CB-CD1 4.22Å; A496-I520 HydrophobicContact CB-CG1 3.85Å; A496-F532 CarbonylContact C-O 3.51Å; A496-F532 VanDerWaalsContact CA-O 3.29Å; A496-F532 WeakPolarHBondContact CA-O 3.44Å; A496-K533 HydrophobicContact CB-CG 4.26Å
497	I	98.6	Very high	92.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131	172.5	-53.7	-56.7	0	0	0	108.2	V495 L516 L517 T518 M530 F532 A561 Q564 A565	V495-I497 HydrophobicContact CG1-CD1 4.36Å; V495-I497 HydrophobicContact CG2-CD1 4.34Å; I497-L516 HydrophobicContact CG2-CB 4.32Å; I497-L516 HydrophobicContact CG2-CD2 3.98Å; I497-L517 CarbonylContact C-O 3.5Å; I497-L517 WeakPolarHBondContact CA-O 3.13Å; I497-T518 HydrophobicContact CD1-CG2 4.11Å; I497-M530 HydrophobicContact CG2-CE 4.29Å; I497-F532 HydrophobicContact CB-CB 4.21Å; I497-F532 HydrophobicContact CB-CD1 4.37Å; I497-F532 HydrophobicContact CG1-CD1 4.49Å; I497-F532 PolarHBondContact N-O 3.23Å; I497-F532 VanDerWaalsContact O-CB 3.28Å; I497-F532 WeakPolarHBondContact O-CB 3.47Å; I497-F532 PolarHBondContact O-N 3.22Å; I497-A561 HydrophobicContact CG2-CB 4.24Å; I497-Q564 HydrophobicContact CD1-CG 4.36Å; I497-A565 HydrophobicContact CD1-CB 4.13Å; I497-A565 HydrophobicContact CG1-CB 3.69Å
498	G	98.2	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	173.4	171.9	0	0	0	0	0	112.7	L516 L517 I520 M530	G498-L516 WeakPolarHBondContact O-CA 3.37Å; G498-L517 PolarHBondContact N-O 2.94Å; G498-L517 PolarHBondContact O-N 2.83Å; G498-I520 VanDerWaalsContact N-CG2 3.3Å; G498-M530 WeakPolarHBondContact CA-O 3.28Å
499	L	97.9	Very high	89.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	135	175	-175.5	69.9	0	0	0	109.6	M511 Y514 R515 L516 G528 D529 M530 L553 V557	L499-M511 HydrophobicContact CD2-CE 4.06Å; L499-Y514 HydrophobicContact CD1-CD2 3.81Å; L499-Y514 HydrophobicContact CD1-CG 4.17Å; L499-R515 WeakPolarHBondContact CA-O 2.94Å; L499-L516 HydrophobicContact CD1-CD2 3.79Å; L499-L516 HydrophobicContact CD1-CG 4.34Å; L499-G528 CarbonylContact O-C 3.49Å; L499-G528 WeakPolarHBondContact O-CA 3.29Å; L499-D529 HydrophobicContact CB-CB 4.39Å; L499-D529 HydrophobicContact CD2-CB 4.26Å; L499-D529 HydrophobicContact CG-CB 4.43Å; L499-D529 PolarHBondContact O-N 2.81Å; L499-M530 HydrophobicContact CB-CB 3.62Å; L499-M530 HydrophobicContact CB-CE 4.11Å; L499-M530 HydrophobicContact CD2-CB 4.42Å; L499-L553 HydrophobicContact CD2-CD1 4.27Å; L499-L553 HydrophobicContact CD2-CD2 3.39Å; L499-L553 HydrophobicContact CD2-CG 4.49Å; L499-V557 HydrophobicContact CD1-CG1 3.81Å; L499-V557 HydrophobicContact CD2-CG1 4.12Å
500	I	97.7	Very high	89	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.5	160.7	-66.9	179.8	0	0	0	107	F334 R335 V338 L339 Y514 R515 L517	F334-I500 HydrophobicContact CD1-CD1 4.15Å; F334-I500 HydrophobicContact CE1-CD1 3.91Å; R335-I500 HydrophobicContact CB-CG2 3.74Å; R335-I500 HydrophobicContact CG-CD1 4.39Å; R335-I500 HydrophobicContact CG-CG2 3.84Å; V338-I500 HydrophobicContact CB-CD1 3.78Å; V338-I500 HydrophobicContact CG1-CD1 3.95Å; V338-I500 HydrophobicContact CG2-CD1 3.74Å; L339-I500 HydrophobicContact CD1-CG2 4.03Å; L339-I500 HydrophobicContact CD2-CG2 4.33Å; L339-I500 HydrophobicContact CG-CG2 3.91Å; I500-Y514 CarbonylContact O-C 3.01Å; I500-Y514 WeakPolarHBondContact O-CA 3.37Å; I500-R515 PolarHBondContact N-O 3.11Å; I500-R515 PolarHBondContact O-N 2.84Å; I500-L517 HydrophobicContact CD1-CD1 3.94Å; I500-L517 HydrophobicContact CG1-CD1 4.14Å
501	S	94.8	Very high	88.4	Confident	7 Å²	7	45 Å²	45	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	159.2	-178.4	68.4	0	0	0	0	112.6	R335 D513 D529	R335-S501 PolarHBondContact NH2-O 2.97Å; S501-D513 CarbonylContact C-O 3.55Å; S501-D513 WeakPolarHBondContact CA-O 3.21Å; S501-D529 WeakPolarHBondContact CB-OD2 3.41Å; S501-D529 PolarHBondContact N-OD2 3.46Å; S501-D529 PolarHBondContact OG-OD2 2.67Å
502	K	92.3	Very high	88	Confident	99 Å²	99	50 Å²	50	43%	0.43	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.3	168.9	-169	178.1	172.8	-148.3	0	107.6	L339 E512 D513	L339-K502 HydrophobicContact CD1-CB 4.2Å; K502-E512 VanDerWaalsContact CD-OE2 3.27Å; K502-E512 WeakPolarHBondContact CD-OE2 3.28Å; K502-E512 WeakPolarHBondContact CE-OE2 3.34Å; K502-E512 IonicContact NZ-OE1 2.77Å; K502-E512 IonicContact NZ-OE2 3.82Å; K502-E512 PolarHBondContact NZ-OE2 3.15Å; K502-E512 WeakPolarHBondContact O-CB 3.47Å; K502-E512 PolarHBondContact O-N 2.64Å; K502-D513 HydrophobicContact CB-CB 4.46Å; K502-D513 PolarHBondContact N-O 3.43Å; K502-D513 PolarHBondContact O-N 3.34Å
503	A	85.2	Confident	87.7	Confident	54 Å²	54	52.7 Å²	52.7	45%	0.446	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	146.2	177.6	0	0	0	0	0	110.2	P505	A503-P505 WeakPolarHBondContact O-CD 3.49Å
504	N	80.7	Confident	87.6	Confident	42 Å²	42	54.9 Å²	54.9	23%	0.225	29%	0.291	C	S	.	.			trans	-71.4	123.3	172.5	-177.8	-24.9	0	0	0	109.6	E506 K507 P508 E510	N504-E506 VanDerWaalsContact C-N 3.28Å; N504-E506 PolarHBondContact O-N 3.36Å; N504-E506 PolarHBondContact OD1-N 3.45Å; N504-K507 CarbonylContact O-C 3.46Å; N504-K507 PolarHBondContact O-N 3.06Å; N504-K507 VanDerWaalsContact O-O 3.14Å; N504-P508 WeakPolarHBondContact O-CA 3.21Å; N504-E510 HydrophobicContact CB-CB 4.44Å; N504-E510 PolarHBondContact N-O 2.86Å
505	P	74.3	Confident	87.6	Confident	115 Å²	115	56 Å²	56	75%	0.747	30%	0.295	S	S	*	.	S	Bend	trans	-59.9	-34	180	-22.2	32.4	0	0	0	114	A503	A503-P505 WeakPolarHBondContact O-CD 3.49Å
506	E	73.1	Confident	87.6	Confident	176 Å²	176	56.6 Å²	56.6	82%	0.822	30%	0.298	S	S	*	.	S	Bend	trans	-79.4	-28	-179.3	-60	-173.9	167.4	0	0	112.1	N504	N504-E506 VanDerWaalsContact C-N 3.28Å; N504-E506 PolarHBondContact O-N 3.36Å; N504-E506 PolarHBondContact OD1-N 3.45Å
507	K	73.9	Confident	87.6	Confident	104 Å²	104	56.6 Å²	56.6	45%	0.452	30%	0.298	S	S	.	.			trans	-137.6	86.4	178.2	-67.9	-176.8	-177.5	174.6	0	110.2	N504 T509 E510	N504-K507 CarbonylContact O-C 3.46Å; N504-K507 PolarHBondContact O-N 3.06Å; N504-K507 VanDerWaalsContact O-O 3.14Å; K507-T509 PolarHBondContact O-N 3.35Å; K507-E510 HydrophobicContact CB-CB 4.21Å; K507-E510 HydrophobicContact CB-CG 4.22Å; K507-E510 HydrophobicContact CD-CG 4.23Å; K507-E510 WeakPolarHBondContact CD-OE1 3.28Å; K507-E510 WeakPolarHBondContact CD-OE2 3.17Å; K507-E510 IonicContact NZ-OE1 2.58Å; K507-E510 PolarHBondContact NZ-OE1 2.71Å; K507-E510 IonicContact NZ-OE2 3.98Å; K507-E510 PolarHBondContact O-N 2.82Å
508	P	67.4	Low	87.6	Confident	95 Å²	95	56.6 Å²	56.6	62%	0.617	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.1	-175.3	-25.6	34.5	0	0	0	115	N504 E510	N504-P508 WeakPolarHBondContact O-CA 3.21Å; P508-E510 VanDerWaalsContact C-N 3.35Å
509	T	65.3	Low	87.6	Confident	108 Å²	108	56.6 Å²	56.6	66%	0.663	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-9	175.4	56.3	0	0	0	0	113.6	K507	K507-T509 PolarHBondContact O-N 3.35Å
510	E	79.6	Confident	87.6	Confident	90 Å²	90	56.7 Å²	56.7	42%	0.421	30%	0.299	S	S	.	.	S	Bend	trans	-105	138.9	177.3	-67.9	-179.6	-165.9	0	0	110.2	N504 K507 P508	N504-E510 HydrophobicContact CB-CB 4.44Å; N504-E510 PolarHBondContact N-O 2.86Å; K507-E510 HydrophobicContact CB-CB 4.21Å; K507-E510 HydrophobicContact CB-CG 4.22Å; K507-E510 HydrophobicContact CD-CG 4.23Å; K507-E510 WeakPolarHBondContact CD-OE1 3.28Å; K507-E510 WeakPolarHBondContact CD-OE2 3.17Å; K507-E510 IonicContact NZ-OE1 2.58Å; K507-E510 PolarHBondContact NZ-OE1 2.71Å; K507-E510 IonicContact NZ-OE2 3.98Å; K507-E510 PolarHBondContact O-N 2.82Å; P508-E510 VanDerWaalsContact C-N 3.35Å
511	M	86.6	Confident	87.6	Confident	45 Å²	45	56.9 Å²	56.9	22%	0.222	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	119	179.8	-167.6	172.1	-71.5	0	0	108.9	L499 Y514 I550 L553 V557	L499-M511 HydrophobicContact CD2-CE 4.06Å; M511-Y514 HydrophobicContact CG-CD1 4.21Å; M511-Y514 VanDerWaalsContact SD-CB 3.58Å; M511-Y514 HydrophobicContact SD-CD1 3.66Å; M511-Y514 HydrophobicContact SD-CG 3.79Å; M511-I550 HydrophobicContact CE-CD1 3.65Å; M511-L553 HydrophobicContact CE-CD2 4.06Å; M511-V557 HydrophobicContact SD-CG2 4.27Å
512	E	89.2	Confident	87.7	Confident	113 Å²	113	58 Å²	58	53%	0.528	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-50.6	178.3	-176.9	-171.2	-172.7	0	0	110.3	K502	K502-E512 VanDerWaalsContact CD-OE2 3.27Å; K502-E512 WeakPolarHBondContact CD-OE2 3.28Å; K502-E512 WeakPolarHBondContact CE-OE2 3.34Å; K502-E512 IonicContact NZ-OE1 2.77Å; K502-E512 IonicContact NZ-OE2 3.82Å; K502-E512 PolarHBondContact NZ-OE2 3.15Å; K502-E512 WeakPolarHBondContact O-CB 3.47Å; K502-E512 PolarHBondContact O-N 2.64Å
513	D	93.1	Very high	88	Confident	57 Å²	57	54.5 Å²	54.5	31%	0.305	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.1	-177.6	-164.5	15.3	0	0	0	111.1	S501 K502 R515	S501-D513 CarbonylContact C-O 3.55Å; S501-D513 WeakPolarHBondContact CA-O 3.21Å; K502-D513 HydrophobicContact CB-CB 4.46Å; K502-D513 PolarHBondContact N-O 3.43Å; K502-D513 PolarHBondContact O-N 3.34Å; D513-R515 IonicContact OD1-CZ 3.75Å; D513-R515 IonicContact OD1-NH1 2.87Å; D513-R515 PolarHBondContact OD1-NH1 2.85Å; D513-R515 IonicContact OD1-NH2 3.24Å; D513-R515 IonicContact OD2-CZ 3.56Å; D513-R515 VanDerWaalsContact OD2-CZ 3.31Å; D513-R515 IonicContact OD2-NH1 3.51Å; D513-R515 PolarHBondContact OD2-NH1 3.15Å; D513-R515 VanDerWaalsContact OD2-NH1 3.13Å; D513-R515 IonicContact OD2-NH2 3.39Å; D513-R515 PolarHBondContact OD2-NH2 2.82Å
514	Y	96.9	Very high	88.6	Confident	47 Å²	47	52 Å²	52	18%	0.184	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	157.5	177.4	66.7	-86.3	0	0	0	114.8	L499 I500 M511 L516 V557 E560	L499-Y514 HydrophobicContact CD1-CD2 3.81Å; L499-Y514 HydrophobicContact CD1-CG 4.17Å; I500-Y514 CarbonylContact O-C 3.01Å; I500-Y514 WeakPolarHBondContact O-CA 3.37Å; M511-Y514 HydrophobicContact CG-CD1 4.21Å; M511-Y514 VanDerWaalsContact SD-CB 3.58Å; M511-Y514 HydrophobicContact SD-CD1 3.66Å; M511-Y514 HydrophobicContact SD-CG 3.79Å; Y514-L516 HydrophobicContact CD2-CG 4.47Å; Y514-L516 HydrophobicContact CE2-CG 4.49Å; Y514-V557 HydrophobicContact CD1-CG2 4.31Å; Y514-V557 HydrophobicContact CD2-CG1 4.33Å; Y514-V557 HydrophobicContact CD2-CG2 4.37Å; Y514-V557 HydrophobicContact CE1-CG2 3.97Å; Y514-V557 HydrophobicContact CE2-CG1 4.28Å; Y514-V557 HydrophobicContact CE2-CG2 4.03Å; Y514-E560 WeakPolarHBondContact CE2-OE2 3.37Å; Y514-E560 VanDerWaalsContact OH-CD 3.28Å; Y514-E560 PolarHBondContact OH-OE1 2.99Å; Y514-E560 PolarHBondContact OH-OE2 3.32Å
515	R	98.1	Very high	89.4	Confident	22 Å²	22	51.8 Å²	51.8	8%	0.083	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.7	173.6	-57.1	-64.5	175.7	-92.7	-11.9	110.5	V338 L339 Y342 L350 L499 I500 D513	V338-R515 HydrophobicContact CG1-CB 4.02Å; V338-R515 HydrophobicContact CG1-CG 4.2Å; L339-R515 HydrophobicContact CD2-CG 4.11Å; L339-R515 PolarHBondContact O-NE 2.84Å; L339-R515 PolarHBondContact O-NH2 2.98Å; Y342-R515 VanDerWaalsContact CE1-CZ 3.47Å; Y342-R515 VanDerWaalsContact CZ-NH2 3.28Å; Y342-R515 PolarHBondContact OH-NH2 3.01Å; L350-R515 HydrophobicContact CD1-CB 4.23Å; L350-R515 HydrophobicContact CD1-CG 4.28Å; L350-R515 HydrophobicContact CD2-CB 4.32Å; L499-R515 WeakPolarHBondContact CA-O 2.94Å; I500-R515 PolarHBondContact N-O 3.11Å; I500-R515 PolarHBondContact O-N 2.84Å; D513-R515 IonicContact OD1-CZ 3.75Å; D513-R515 IonicContact OD1-NH1 2.87Å; D513-R515 PolarHBondContact OD1-NH1 2.85Å; D513-R515 IonicContact OD1-NH2 3.24Å; D513-R515 IonicContact OD2-CZ 3.56Å; D513-R515 VanDerWaalsContact OD2-CZ 3.31Å; D513-R515 IonicContact OD2-NH1 3.51Å; D513-R515 PolarHBondContact OD2-NH1 3.15Å; D513-R515 VanDerWaalsContact OD2-NH1 3.13Å; D513-R515 IonicContact OD2-NH2 3.39Å; D513-R515 PolarHBondContact OD2-NH2 2.82Å
516	L	98.6	Very high	90.3	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.068	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.6	171.7	-72.7	170.4	0	0	0	110.1	I497 G498 L499 Y514 M530 V557 E560 A561 Q564	I497-L516 HydrophobicContact CG2-CB 4.32Å; I497-L516 HydrophobicContact CG2-CD2 3.98Å; G498-L516 WeakPolarHBondContact O-CA 3.37Å; L499-L516 HydrophobicContact CD1-CD2 3.79Å; L499-L516 HydrophobicContact CD1-CG 4.34Å; Y514-L516 HydrophobicContact CD2-CG 4.47Å; Y514-L516 HydrophobicContact CE2-CG 4.49Å; L516-M530 HydrophobicContact CD2-CE 4.02Å; L516-V557 HydrophobicContact CD2-CG1 4.15Å; L516-E560 HydrophobicContact CD1-CB 3.66Å; L516-A561 HydrophobicContact CD1-CB 4.32Å; L516-A561 HydrophobicContact CD2-CB 3.95Å; L516-Q564 PolarHBondContact O-NE2 3.4Å; L516-Q564 VanDerWaalsContact O-NE2 3.12Å
517	L	98.6	Very high	91.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	116.1	-174.3	-60.2	178.8	0	0	0	110.6	V338 R344 L350 I497 G498 I500 I520 E524	V338-L517 HydrophobicContact CG1-CD1 4.48Å; V338-L517 HydrophobicContact CG1-CD2 3.86Å; R344-L517 HydrophobicContact CG-CD2 4.13Å; L350-L517 HydrophobicContact CB-CD2 4.36Å; L350-L517 HydrophobicContact CD2-CD2 3.48Å; L350-L517 VanDerWaalsContact CD2-CD2 3.48Å; L350-L517 CarbonylContact O-C 3.53Å; L350-L517 WeakPolarHBondContact O-CA 3.32Å; I497-L517 CarbonylContact C-O 3.5Å; I497-L517 WeakPolarHBondContact CA-O 3.13Å; G498-L517 PolarHBondContact N-O 2.94Å; G498-L517 PolarHBondContact O-N 2.83Å; I500-L517 HydrophobicContact CD1-CD1 3.94Å; I500-L517 HydrophobicContact CG1-CD1 4.14Å; L517-I520 HydrophobicContact CB-CG2 3.66Å; L517-I520 WeakPolarHBondContact O-CG2 3.44Å; L517-E524 HydrophobicContact CD1-CB 4.31Å; L517-E524 HydrophobicContact CD1-CG 4.21Å
518	T	98.7	Very high	92.5	Very high	1 Å²	1	41 Å²	41	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.1	173.5	-61.5	0	0	0	0	110.9	R344 R348 L350 T351 L353 V495 I497 Q564 A568	R344-T518 PolarHBondContact NH1-O 3.07Å; R344-T518 PolarHBondContact NH2-O 3.38Å; R348-T518 PolarHBondContact NH1-O 2.83Å; L350-T518 PolarHBondContact O-N 3.21Å; T351-T518 WeakPolarHBondContact O-CB 3.39Å; T351-T518 PolarHBondContact O-OG1 3.13Å; L353-T518 HydrophobicContact CD2-CG2 3.82Å; L353-T518 HydrophobicContact CG-CG2 4.45Å; V495-T518 HydrophobicContact CG2-CG2 4.08Å; I497-T518 HydrophobicContact CD1-CG2 4.11Å; T518-Q564 VanDerWaalsContact OG1-CG 3.27Å; T518-Q564 WeakPolarHBondContact OG1-CG 3.21Å; T518-Q564 PolarHBondContact OG1-NE2 2.99Å; T518-A568 HydrophobicContact CG2-CB 3.4Å
519	D	98.3	Very high	93.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	56.4	67.3	173.3	-176.6	40.5	0	0	0	111.6	R344 R348 L353 R354 R374 V495 A496	R344-D519 PolarHBondContact NH2-O 2.79Å; R348-D519 PolarHBondContact NH1-O 2.87Å; R348-D519 IonicContact NH1-OD2 2.75Å; R348-D519 PolarHBondContact NH2-O 3.38Å; L353-D519 HydrophobicContact CD2-CB 3.64Å; R354-D519 VanDerWaalsContact CB-OD2 3.31Å; R354-D519 WeakPolarHBondContact CB-OD2 3.47Å; R354-D519 VanDerWaalsContact CG-OD2 3.3Å; R354-D519 WeakPolarHBondContact CG-OD2 3.27Å; R354-D519 IonicContact CZ-OD1 3.38Å; R354-D519 IonicContact CZ-OD2 3.18Å; R354-D519 PolarHBondContact N-OD2 3.3Å; R354-D519 VanDerWaalsContact NE-CG 3.3Å; R354-D519 IonicContact NE-OD1 2.75Å; R354-D519 PolarHBondContact NE-OD1 2.78Å; R354-D519 IonicContact NE-OD2 2.73Å; R354-D519 PolarHBondContact NE-OD2 2.77Å; R354-D519 IonicContact NH2-OD1 3.09Å; R354-D519 PolarHBondContact NH2-OD1 3.3Å; R354-D519 IonicContact NH2-OD2 2.74Å; R374-D519 VanDerWaalsContact CD-OD1 3.28Å; R374-D519 WeakPolarHBondContact CD-OD1 3.48Å; R374-D519 WeakPolarHBondContact CD-OD2 3.26Å; R374-D519 IonicContact CZ-OD1 2.84Å; R374-D519 IonicContact NE-OD1 3.76Å; R374-D519 PolarHBondContact NE-OD1 3.1Å; R374-D519 IonicContact NH1-OD1 2.85Å; R374-D519 IonicContact NH2-OD1 3.93Å; V495-D519 HydrophobicContact CG2-CB 4.21Å; A496-D519 WeakPolarHBondContact O-CA 3.42Å; A496-D519 PolarHBondContact O-N 2.93Å
520	I	98.3	Very high	95.3	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.153	C	C	.	.			trans	-68.1	146.1	-174.2	56.4	177.9	0	0	0	114	R354 A496 G498 L517 E524 D525	R354-I520 PolarHBondContact NH2-O 3.24Å; A496-I520 HydrophobicContact CB-CD1 4.22Å; A496-I520 HydrophobicContact CB-CG1 3.85Å; G498-I520 VanDerWaalsContact N-CG2 3.3Å; L517-I520 HydrophobicContact CB-CG2 3.66Å; L517-I520 WeakPolarHBondContact O-CG2 3.44Å; I520-E524 WeakPolarHBondContact CA-OE2 3.39Å; I520-E524 HydrophobicContact CB-CB 3.99Å; I520-E524 HydrophobicContact CG2-CB 4.15Å; I520-D525 HydrophobicContact CD1-CB 3.96Å
521	L	97.8	Very high	96.1	Very high	5 Å²	5	28 Å²	28	3%	0.026	14%	0.137	C	C	.	.			trans	-76	165	167.1	-58.3	179	0	0	0	111.2	D346 N466 I523 E524 D525	D346-L521 HydrophobicContact CB-CD1 4.28Å; N466-L521 WeakPolarHBondContact O-CA 2.86Å; L521-I523 VanDerWaalsContact C-N 3.28Å; L521-I523 HydrophobicContact CB-CG2 3.93Å; L521-I523 HydrophobicContact CD1-CG2 4.23Å; L521-I523 PolarHBondContact O-N 3.21Å; L521-E524 HydrophobicContact CB-CB 4.37Å; L521-E524 HydrophobicContact CB-CG 4.15Å; L521-E524 PolarHBondContact N-OE2 3.35Å; L521-E524 PolarHBondContact O-N 2.74Å; L521-D525 PolarHBondContact O-N 2.76Å
522	G	96.4	Very high	96.7	Very high	29 Å²	29	25.9 Å²	25.9	30%	0.299	13%	0.126	S	C	.	.	H	α-helix	trans	-59.8	-37.9	173.3	0	0	0	0	0	113.1	N466 D525 Y526	N466-G522 PolarHBondContact O-N 3.42Å; N466-G522 PolarHBondContact OD1-N 3.38Å; G522-D525 PolarHBondContact O-N 3.2Å; G522-Y526 PolarHBondContact O-N 2.96Å
523	I	97.5	Very high	97.1	Very high	27 Å²	27	21 Å²	21	14%	0.138	10%	0.103	C	C	.	.	H	α-helix	trans	-68	-37.2	176.7	-170.7	170.1	0	0	0	112.5	F285 F334 L521 Y526 L527	F285-I523 HydrophobicContact CE1-CD1 3.73Å; F285-I523 HydrophobicContact CZ-CD1 4.25Å; F334-I523 HydrophobicContact CD2-CD1 4.22Å; F334-I523 HydrophobicContact CE2-CD1 4.01Å; F334-I523 HydrophobicContact CE2-CG1 4.14Å; F334-I523 HydrophobicContact CE2-CG2 4.2Å; F334-I523 HydrophobicContact CZ-CG1 4.44Å; F334-I523 HydrophobicContact CZ-CG2 4.21Å; L521-I523 VanDerWaalsContact C-N 3.28Å; L521-I523 HydrophobicContact CB-CG2 3.93Å; L521-I523 HydrophobicContact CD1-CG2 4.23Å; L521-I523 PolarHBondContact O-N 3.21Å; I523-Y526 PolarHBondContact O-N 2.87Å; I523-L527 HydrophobicContact CD1-CD1 4.08Å; I523-L527 HydrophobicContact CG1-CD1 3.65Å; I523-L527 HydrophobicContact CG1-CG 4.15Å; I523-L527 WeakPolarHBondContact O-CB 3.32Å; I523-L527 WeakPolarHBondContact O-CG 3.42Å; I523-L527 PolarHBondContact O-N 3.18Å
524	E	98.1	Very high	97.4	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-70.2	-32.9	178.1	-71.1	173.1	148.3	0	0	111.9	F334 R344 L517 I520 L521 G528	F334-E524 HydrophobicContact CE1-CG 4.05Å; F334-E524 HydrophobicContact CZ-CG 3.61Å; R344-E524 IonicContact CZ-OE1 3.01Å; R344-E524 IonicContact CZ-OE2 2.77Å; R344-E524 IonicContact NE-OE1 3.74Å; R344-E524 PolarHBondContact NE-OE1 2.96Å; R344-E524 IonicContact NE-OE2 3.44Å; R344-E524 IonicContact NH2-OE1 3.82Å; R344-E524 PolarHBondContact NH2-OE1 3.26Å; R344-E524 IonicContact NH2-OE2 3.75Å; R344-E524 PolarHBondContact NH2-OE2 3.22Å; L517-E524 HydrophobicContact CD1-CB 4.31Å; L517-E524 HydrophobicContact CD1-CG 4.21Å; I520-E524 WeakPolarHBondContact CA-OE2 3.39Å; I520-E524 HydrophobicContact CB-CB 3.99Å; I520-E524 HydrophobicContact CG2-CB 4.15Å; L521-E524 HydrophobicContact CB-CB 4.37Å; L521-E524 HydrophobicContact CB-CG 4.15Å; L521-E524 PolarHBondContact N-OE2 3.35Å; L521-E524 PolarHBondContact O-N 2.74Å; E524-G528 VanDerWaalsContact O-CA 3.22Å; E524-G528 WeakPolarHBondContact O-CA 3.44Å; E524-G528 PolarHBondContact O-N 2.93Å
525	D	96.8	Very high	97.5	Very high	37 Å²	37	16.1 Å²	16.1	20%	0.198	8%	0.08	C	C	.	.	H	α-helix	trans	-64.1	-57.6	167.3	177.2	12.4	0	0	0	109.5	I520 L521 G522 L527 G528 K549	I520-D525 HydrophobicContact CD1-CB 3.96Å; L521-D525 PolarHBondContact O-N 2.76Å; G522-D525 PolarHBondContact O-N 3.2Å; D525-L527 PolarHBondContact O-N 2.79Å; D525-G528 PolarHBondContact O-N 2.68Å; D525-K549 VanDerWaalsContact C-NZ 3.3Å; D525-K549 PolarHBondContact O-NZ 2.85Å; D525-K549 VanDerWaalsContact OD1-CE 3.31Å; D525-K549 WeakPolarHBondContact OD1-CE 3.44Å; D525-K549 IonicContact OD1-NZ 3.37Å; D525-K549 PolarHBondContact OD1-NZ 2.97Å
526	Y	94.6	Very high	97.5	Very high	157 Å²	157	15.1 Å²	15.1	62%	0.616	8%	0.077	S	C	*	.	H	α-helix	trans	-56.8	-44.9	-175.4	-179.9	-109.9	0	0	0	113.8	G522 I523	G522-Y526 PolarHBondContact O-N 2.96Å; I523-Y526 PolarHBondContact O-N 2.87Å
527	L	96.1	Very high	97.5	Very high	11 Å²	11	14.5 Å²	14.5	6%	0.058	7%	0.073	C	C	.	.	H	α-helix	trans	-89.8	-10.7	-178.6	-59.3	-179.7	0	0	0	113.6	K331 F334 R335 I523 D525	K331-L527 HydrophobicContact CB-CD2 3.9Å; K331-L527 HydrophobicContact CD-CD2 4.47Å; K331-L527 WeakPolarHBondContact CE-O 3.31Å; K331-L527 HydrophobicContact CG-CB 4.48Å; K331-L527 HydrophobicContact CG-CD2 4.05Å; F334-L527 HydrophobicContact CB-CD1 3.7Å; F334-L527 HydrophobicContact CD1-CB 3.98Å; F334-L527 HydrophobicContact CD1-CD1 3.8Å; F334-L527 HydrophobicContact CD2-CD1 3.95Å; F334-L527 HydrophobicContact CE1-CB 4.39Å; F334-L527 HydrophobicContact CE1-CD1 4.44Å; F334-L527 HydrophobicContact CG-CD1 3.53Å; R335-L527 PolarHBondContact NH1-O 3.45Å; I523-L527 HydrophobicContact CD1-CD1 4.08Å; I523-L527 HydrophobicContact CG1-CD1 3.65Å; I523-L527 HydrophobicContact CG1-CG 4.15Å; I523-L527 WeakPolarHBondContact O-CB 3.32Å; I523-L527 WeakPolarHBondContact O-CG 3.42Å; I523-L527 PolarHBondContact O-N 3.18Å; D525-L527 PolarHBondContact O-N 2.79Å
528	G	96.2	Very high	97.4	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.021	10%	0.095	C	C	.	.	S	Bend	trans	-83.2	-178.6	177.5	0	0	0	0	0	114	L499 E524 D525	L499-G528 CarbonylContact O-C 3.49Å; L499-G528 WeakPolarHBondContact O-CA 3.29Å; E524-G528 VanDerWaalsContact O-CA 3.22Å; E524-G528 WeakPolarHBondContact O-CA 3.44Å; E524-G528 PolarHBondContact O-N 2.93Å; D525-G528 PolarHBondContact O-N 2.68Å
529	D	96.3	Very high	97.2	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.021	13%	0.128	C	C	.	.	S	Bend	trans	-109.8	-8.8	-173.8	-60.1	-33.7	0	0	0	113.2	R335 L499 S501 K549 I550	R335-D529 IonicContact CZ-OD1 3.24Å; R335-D529 IonicContact CZ-OD2 3.34Å; R335-D529 VanDerWaalsContact NH1-CG 3.31Å; R335-D529 IonicContact NH1-OD1 3.65Å; R335-D529 PolarHBondContact NH1-OD1 2.93Å; R335-D529 IonicContact NH1-OD2 2.73Å; R335-D529 PolarHBondContact NH1-OD2 2.83Å; R335-D529 VanDerWaalsContact NH2-CG 3.31Å; R335-D529 IonicContact NH2-OD1 2.74Å; R335-D529 PolarHBondContact NH2-OD1 2.92Å; R335-D529 VanDerWaalsContact NH2-OD1 3.09Å; R335-D529 IonicContact NH2-OD2 3.66Å; R335-D529 PolarHBondContact NH2-OD2 2.76Å; L499-D529 HydrophobicContact CB-CB 4.39Å; L499-D529 HydrophobicContact CD2-CB 4.26Å; L499-D529 HydrophobicContact CG-CB 4.43Å; L499-D529 PolarHBondContact O-N 2.81Å; S501-D529 WeakPolarHBondContact CB-OD2 3.41Å; S501-D529 PolarHBondContact N-OD2 3.46Å; S501-D529 PolarHBondContact OG-OD2 2.67Å; D529-K549 PolarHBondContact O-N 2.83Å; D529-I550 HydrophobicContact CB-CD1 4.1Å; D529-I550 HydrophobicContact CB-CG1 4.11Å; D529-I550 HydrophobicContact CB-CG2 3.78Å
530	M	96.3	Very high	97.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	142.5	-176	-173.9	-175.3	67.5	0	0	111	I497 G498 L499 L516 F532 D547 V548 L553 A561	I497-M530 HydrophobicContact CG2-CE 4.29Å; G498-M530 WeakPolarHBondContact CA-O 3.28Å; L499-M530 HydrophobicContact CB-CB 3.62Å; L499-M530 HydrophobicContact CB-CE 4.11Å; L499-M530 HydrophobicContact CD2-CB 4.42Å; L516-M530 HydrophobicContact CD2-CE 4.02Å; M530-F532 HydrophobicContact CE-CB 3.47Å; M530-F532 VanDerWaalsContact CE-CB 3.47Å; M530-F532 HydrophobicContact CE-CD2 4.37Å; M530-F532 HydrophobicContact CE-CG 4.13Å; M530-F532 HydrophobicContact CG-CB 4.03Å; M530-F532 HydrophobicContact SD-CB 3.74Å; M530-F532 HydrophobicContact SD-CD2 3.92Å; M530-F532 HydrophobicContact SD-CG 4.22Å; M530-D547 CarbonylContact C-O 3.59Å; M530-D547 WeakPolarHBondContact CA-O 3.35Å; M530-V548 HydrophobicContact CG-CG2 4.47Å; M530-L553 HydrophobicContact CB-CD1 4.23Å; M530-L553 HydrophobicContact CG-CD1 3.9Å; M530-L553 HydrophobicContact SD-CD1 3.25Å; M530-L553 WeakPolarHBondContact SD-CD1 3.3Å; M530-A561 HydrophobicContact CE-CB 4.16Å
531	D	96.6	Very high	97.2	Very high	15 Å²	15	26.2 Å²	26.2	8%	0.08	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	100.8	164	174.8	19.8	0	0	0	109	K533 D547	D531-K533 WeakPolarHBondContact OD1-CE 3.48Å; D531-K533 IonicContact OD1-NZ 3.34Å; D531-K533 WeakPolarHBondContact OD2-CE 3.47Å; D531-K533 IonicContact OD2-NZ 2.7Å; D531-K533 PolarHBondContact OD2-NZ 3.13Å; D531-D547 PolarHBondContact N-O 2.92Å; D531-D547 PolarHBondContact O-N 2.89Å
532	F	97.7	Very high	97.2	Very high	1 Å²	1	26 Å²	26	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	103.5	-172.4	-172.6	-83	0	0	0	111.1	A496 I497 M530 L534 L544 A546 V558 A561 I562	A496-F532 CarbonylContact C-O 3.51Å; A496-F532 VanDerWaalsContact CA-O 3.29Å; A496-F532 WeakPolarHBondContact CA-O 3.44Å; I497-F532 HydrophobicContact CB-CB 4.21Å; I497-F532 HydrophobicContact CB-CD1 4.37Å; I497-F532 HydrophobicContact CG1-CD1 4.49Å; I497-F532 PolarHBondContact N-O 3.23Å; I497-F532 VanDerWaalsContact O-CB 3.28Å; I497-F532 WeakPolarHBondContact O-CB 3.47Å; I497-F532 PolarHBondContact O-N 3.22Å; M530-F532 HydrophobicContact CE-CB 3.47Å; M530-F532 VanDerWaalsContact CE-CB 3.47Å; M530-F532 HydrophobicContact CE-CD2 4.37Å; M530-F532 HydrophobicContact CE-CG 4.13Å; M530-F532 HydrophobicContact CG-CB 4.03Å; M530-F532 HydrophobicContact SD-CB 3.74Å; M530-F532 HydrophobicContact SD-CD2 3.92Å; M530-F532 HydrophobicContact SD-CG 4.22Å; F532-L534 HydrophobicContact CE1-CB 4.19Å; F532-L534 HydrophobicContact CE1-CD1 4.25Å; F532-L544 HydrophobicContact CD1-CD1 3.9Å; F532-L544 HydrophobicContact CD2-CD1 4.49Å; F532-L544 HydrophobicContact CE1-CD1 3.18Å; F532-L544 HydrophobicContact CE1-CG 4.41Å; F532-L544 HydrophobicContact CE2-CD1 3.85Å; F532-L544 HydrophobicContact CE2-CD2 4.06Å; F532-L544 HydrophobicContact CE2-CG 4.36Å; F532-L544 HydrophobicContact CG-CD1 4.5Å; F532-L544 HydrophobicContact CZ-CD1 3.13Å; F532-L544 HydrophobicContact CZ-CD2 3.67Å; F532-L544 HydrophobicContact CZ-CG 3.94Å; F532-A546 HydrophobicContact CD2-CB 3.42Å; F532-A546 VanDerWaalsContact CD2-CB 3.42Å; F532-A546 HydrophobicContact CE2-CB 3.77Å; F532-A546 HydrophobicContact CG-CB 4.36Å; F532-V558 HydrophobicContact CE2-CG1 4.14Å; F532-A561 HydrophobicContact CD1-CB 4.32Å; F532-A561 HydrophobicContact CE1-CB 4.38Å; F532-A561 HydrophobicContact CG-CB 4.44Å; F532-I562 HydrophobicContact CE1-CG1 4Å; F532-I562 HydrophobicContact CZ-CD1 4.33Å; F532-I562 HydrophobicContact CZ-CG1 3.5Å; F532-I562 VanDerWaalsContact CZ-CG1 3.5Å
533	K	98.5	Very high	97.3	Very high	11 Å²	11	24.6 Å²	24.6	5%	0.048	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.2	-176.2	-64.4	162.9	-173.7	139.2	0	110.2	L439 M471 V495 A496 D531 L544 Q545	L439-K533 HydrophobicContact CD2-CB 4.11Å; L439-K533 HydrophobicContact CD2-CD 3.64Å; M471-K533 HydrophobicContact CE-CB 4.05Å; M471-K533 HydrophobicContact CG-CB 4.23Å; M471-K533 HydrophobicContact CG-CG 4.29Å; M471-K533 HydrophobicContact SD-CB 3.94Å; V495-K533 WeakPolarHBondContact O-CA 3.15Å; A496-K533 HydrophobicContact CB-CG 4.26Å; D531-K533 WeakPolarHBondContact OD1-CE 3.48Å; D531-K533 IonicContact OD1-NZ 3.34Å; D531-K533 WeakPolarHBondContact OD2-CE 3.47Å; D531-K533 IonicContact OD2-NZ 2.7Å; D531-K533 PolarHBondContact OD2-NZ 3.13Å; K533-L544 CarbonylContact O-C 3.57Å; K533-L544 WeakPolarHBondContact O-CA 3.36Å; K533-L544 VanDerWaalsContact O-CD1 3.26Å; K533-L544 WeakPolarHBondContact O-CD1 3.22Å; K533-Q545 HydrophobicContact CB-CB 4.44Å; K533-Q545 PolarHBondContact N-O 3.22Å; K533-Q545 PolarHBondContact O-N 3.49Å
534	L	98.6	Very high	97.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.7	176.5	-176.1	149.9	0	0	0	110.1	G494 V495 F532 I541 L544 I562 A565 K569	G494-L534 CarbonylContact C-O 3.56Å; G494-L534 VanDerWaalsContact CA-O 3.23Å; G494-L534 WeakPolarHBondContact CA-O 3.33Å; V495-L534 PolarHBondContact N-O 2.91Å; V495-L534 PolarHBondContact O-N 2.8Å; F532-L534 HydrophobicContact CE1-CB 4.19Å; F532-L534 HydrophobicContact CE1-CD1 4.25Å; L534-I541 HydrophobicContact CD1-CD1 4.02Å; L534-I541 HydrophobicContact CD1-CG1 4.29Å; L534-I541 HydrophobicContact CD2-CG1 4.49Å; L534-I541 HydrophobicContact CG-CG2 4.44Å; L534-L544 HydrophobicContact CB-CD1 3.76Å; L534-L544 HydrophobicContact CD1-CD1 4.06Å; L534-L544 HydrophobicContact CG-CD1 4.15Å; L534-I562 HydrophobicContact CD1-CB 4.49Å; L534-I562 HydrophobicContact CD1-CG1 4.44Å; L534-I562 HydrophobicContact CD1-CG2 4.09Å; L534-A565 HydrophobicContact CB-CB 3.88Å; L534-A565 HydrophobicContact CD1-CB 4.02Å; L534-A565 HydrophobicContact CD2-CB 4.19Å; L534-A565 HydrophobicContact CG-CB 4.25Å; L534-K569 HydrophobicContact CD2-CD 4.04Å
535	A	98.8	Very high	97.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.008	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.7	174.3	0	0	0	0	0	112	A443 M471 A493 T542 A543	A443-A535 HydrophobicContact CB-CB 3.56Å; M471-A535 HydrophobicContact SD-CB 4.15Å; A493-A535 CarbonylContact O-C 3.6Å; A493-A535 VanDerWaalsContact O-CA 3.26Å; A493-A535 WeakPolarHBondContact O-CA 3.4Å; A535-T542 PolarHBondContact O-N 2.83Å; A535-T542 PolarHBondContact O-OG1 3.28Å; A535-A543 PolarHBondContact N-O 3Å; A535-A543 PolarHBondContact O-N 3Å
536	G	98.4	Very high	97.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-173.4	175.8	0	0	0	0	0	114	V492 A493 G540 T542	V492-G536 WeakPolarHBondContact CA-O 3.43Å; A493-G536 PolarHBondContact N-O 3.3Å; A493-G536 PolarHBondContact O-N 3.24Å; G536-G540 WeakPolarHBondContact CA-O 3.45Å; G536-T542 WeakPolarHBondContact CA-OG1 3.5Å
537	T	98.6	Very high	97.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.			trans	-89	-176.5	173.1	75.4	0	0	0	0	110.4	N221 V447 A491 V492 K539 G540 K569	N221-T537 VanDerWaalsContact CG-OG1 3.24Å; N221-T537 PolarHBondContact ND2-OG1 2.81Å; N221-T537 VanDerWaalsContact ND2-OG1 3.1Å; N221-T537 WeakPolarHBondContact OD1-CG2 3.44Å; N221-T537 PolarHBondContact OD1-OG1 3.28Å; V447-T537 HydrophobicContact CG1-CG2 3.74Å; A491-T537 WeakPolarHBondContact O-CA 3.38Å; V492-T537 HydrophobicContact CG2-CG2 4.05Å; T537-K539 PolarHBondContact O-N 3.48Å; T537-K539 PolarHBondContact OG1-N 2.92Å; T537-K539 VanDerWaalsContact OG1-N 3.08Å; T537-G540 PolarHBondContact N-O 2.78Å; T537-G540 VanDerWaalsContact N-O 3.09Å; T537-G540 PolarHBondContact OG1-N 2.83Å; T537-K569 WeakPolarHBondContact O-CE 3.32Å; T537-K569 PolarHBondContact O-NZ 2.93Å
538	N	96.8	Very high	97.1	Very high	87 Å²	87	16 Å²	16	47%	0.465	8%	0.079	S	C	.	.	S	Bend	trans	-64.7	-23.8	170.4	64.5	-16.4	0	0	0	113.5	L573	N538-L573 HydrophobicContact CB-CD1 4.12Å
539	K	95.4	Very high	96.9	Very high	159 Å²	159	19.9 Å²	19.9	69%	0.691	10%	0.095	S	C	*	.	S	Bend	trans	-90.5	-36.2	-176.8	-70.2	178.8	-177.5	-177.7	0	113.3	T537	T537-K539 PolarHBondContact O-N 3.48Å; T537-K539 PolarHBondContact OG1-N 2.92Å; T537-K539 VanDerWaalsContact OG1-N 3.08Å
540	G	96.9	Very high	96.7	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.021	10%	0.102	C	C	.	.			trans	-154.9	-178.6	-168.1	0	0	0	0	0	114.5	N221 M222 G536 T537 K569	N221-G540 VanDerWaalsContact OD1-CA 3.24Å; N221-G540 WeakPolarHBondContact OD1-CA 3.22Å; N221-G540 PolarHBondContact OD1-N 3.46Å; N221-G540 PolarHBondContact OD1-O 2.81Å; M222-G540 CarbonylContact O-C 3.6Å; M222-G540 WeakPolarHBondContact O-CA 3.37Å; G536-G540 WeakPolarHBondContact CA-O 3.45Å; T537-G540 PolarHBondContact N-O 2.78Å; T537-G540 VanDerWaalsContact N-O 3.09Å; T537-G540 PolarHBondContact OG1-N 2.83Å; G540-K569 PolarHBondContact O-NZ 2.91Å
541	I	98.6	Very high	96.5	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.1	179.2	-61.3	169.4	0	0	0	108	N221 M222 Q224 F227 L534 I562	N221-I541 CarbonylContact C-O 3.54Å; N221-I541 VanDerWaalsContact CA-O 3.31Å; N221-I541 WeakPolarHBondContact CA-O 3.37Å; N221-I541 PolarHBondContact N-O 2.98Å; M222-I541 PolarHBondContact N-O 3.16Å; M222-I541 PolarHBondContact O-N 2.81Å; Q224-I541 HydrophobicContact CG-CD1 4.45Å; F227-I541 HydrophobicContact CB-CD1 3.93Å; F227-I541 HydrophobicContact CD1-CD1 4.21Å; F227-I541 HydrophobicContact CD2-CB 4.22Å; F227-I541 HydrophobicContact CD2-CD1 4.17Å; F227-I541 HydrophobicContact CD2-CG2 4.03Å; F227-I541 HydrophobicContact CE2-CG2 4.01Å; F227-I541 HydrophobicContact CG-CD1 3.83Å; L534-I541 HydrophobicContact CD1-CD1 4.02Å; L534-I541 HydrophobicContact CD1-CG1 4.29Å; L534-I541 HydrophobicContact CD2-CG1 4.49Å; L534-I541 HydrophobicContact CG-CG2 4.44Å; I541-I562 HydrophobicContact CD1-CG2 4.09Å
542	T	98.6	Very high	96.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-32.3	175.9	57.5	0	0	0	0	112.8	S218 A219 N221 A443 P446 A535 G536	S218-T542 CarbonylContact C-O 3.55Å; S218-T542 WeakPolarHBondContact CA-O 3.09Å; A219-T542 PolarHBondContact N-O 3.19Å; A219-T542 WeakPolarHBondContact O-CA 3.38Å; N221-T542 HydrophobicContact CB-CG2 4.34Å; A443-T542 WeakPolarHBondContact CA-OG1 3.41Å; A443-T542 WeakPolarHBondContact O-CB 3.38Å; A443-T542 PolarHBondContact O-OG1 2.94Å; P446-T542 HydrophobicContact CB-CG2 3.97Å; P446-T542 HydrophobicContact CG-CG2 3.95Å; A535-T542 PolarHBondContact O-N 2.83Å; A535-T542 PolarHBondContact O-OG1 3.28Å; G536-T542 WeakPolarHBondContact CA-OG1 3.5Å
543	A	98.4	Very high	96	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	150.2	175.5	0	0	0	0	0	111.9	A217 L439 K442 A443 A535	A217-A543 VanDerWaalsContact O-CA 3.31Å; A217-A543 WeakPolarHBondContact O-CA 3.5Å; L439-A543 HydrophobicContact CD1-CB 4.21Å; K442-A543 HydrophobicContact CB-CB 4.37Å; A443-A543 HydrophobicContact CB-CB 3.97Å; A535-A543 PolarHBondContact N-O 3Å; A535-A543 PolarHBondContact O-N 3Å
544	L	98.3	Very high	95.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	136.2	172	-178.3	70.5	0	0	0	110.2	I215 E216 A217 F227 F532 K533 L534	I215-L544 HydrophobicContact CB-CD2 4.4Å; I215-L544 HydrophobicContact CD1-CD2 4.48Å; I215-L544 HydrophobicContact CG2-CD2 3.73Å; I215-L544 HydrophobicContact CG2-CG 4.35Å; E216-L544 CarbonylContact C-O 3.58Å; E216-L544 WeakPolarHBondContact CA-O 3.49Å; A217-L544 HydrophobicContact CB-CB 4.07Å; A217-L544 PolarHBondContact N-O 2.67Å; A217-L544 PolarHBondContact O-N 2.85Å; F227-L544 HydrophobicContact CE1-CB 4.39Å; F227-L544 HydrophobicContact CE1-CD2 3.43Å; F227-L544 VanDerWaalsContact CE1-CD2 3.43Å; F227-L544 HydrophobicContact CZ-CB 3.77Å; F227-L544 HydrophobicContact CZ-CD2 3.62Å; F227-L544 HydrophobicContact CZ-CG 4.34Å; F532-L544 HydrophobicContact CD1-CD1 3.9Å; F532-L544 HydrophobicContact CD2-CD1 4.49Å; F532-L544 HydrophobicContact CE1-CD1 3.18Å; F532-L544 HydrophobicContact CE1-CG 4.41Å; F532-L544 HydrophobicContact CE2-CD1 3.85Å; F532-L544 HydrophobicContact CE2-CD2 4.06Å; F532-L544 HydrophobicContact CE2-CG 4.36Å; F532-L544 HydrophobicContact CG-CD1 4.5Å; F532-L544 HydrophobicContact CZ-CD1 3.13Å; F532-L544 HydrophobicContact CZ-CD2 3.67Å; F532-L544 HydrophobicContact CZ-CG 3.94Å; K533-L544 CarbonylContact O-C 3.57Å; K533-L544 WeakPolarHBondContact O-CA 3.36Å; K533-L544 VanDerWaalsContact O-CD1 3.26Å; K533-L544 WeakPolarHBondContact O-CD1 3.22Å; L534-L544 HydrophobicContact CB-CD1 3.76Å; L534-L544 HydrophobicContact CD1-CD1 4.06Å; L534-L544 HydrophobicContact CG-CD1 4.15Å
545	Q	98.3	Very high	95.6	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.019	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	118.9	170	176	174.9	104.6	0	0	109	I215 E216 L439 K533	I215-Q545 CarbonylContact O-C 3.58Å; I215-Q545 WeakPolarHBondContact O-CA 3.29Å; E216-Q545 PolarHBondContact OE1-NE2 3.35Å; E216-Q545 WeakPolarHBondContact OE2-CG 3.25Å; E216-Q545 PolarHBondContact OE2-NE2 2.91Å; L439-Q545 HydrophobicContact CD1-CB 3.76Å; L439-Q545 HydrophobicContact CD2-CB 3.88Å; L439-Q545 HydrophobicContact CD2-CG 4.43Å; L439-Q545 HydrophobicContact CG-CB 4.48Å; K533-Q545 HydrophobicContact CB-CB 4.44Å; K533-Q545 PolarHBondContact N-O 3.22Å; K533-Q545 PolarHBondContact O-N 3.49Å
546	A	95.7	Very high	95.4	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.2	178.6	0	0	0	0	0	110.1	I215 F532	I215-A546 HydrophobicContact CB-CB 4.02Å; I215-A546 PolarHBondContact N-O 3.23Å; I215-A546 PolarHBondContact O-N 3.07Å; F532-A546 HydrophobicContact CD2-CB 3.42Å; F532-A546 VanDerWaalsContact CD2-CB 3.42Å; F532-A546 HydrophobicContact CE2-CB 3.77Å; F532-A546 HydrophobicContact CG-CB 4.36Å
547	D	91.4	Very high	95.3	Very high	45 Å²	45	33.9 Å²	33.9	24%	0.241	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.8	172.3	-153.6	-20.9	0	0	0	108.6	R122 M530 D531	R122-D547 WeakPolarHBondContact CD-OD2 3.44Å; R122-D547 WeakPolarHBondContact CG-OD2 3.42Å; M530-D547 CarbonylContact C-O 3.59Å; M530-D547 WeakPolarHBondContact CA-O 3.35Å; D531-D547 PolarHBondContact N-O 2.92Å; D531-D547 PolarHBondContact O-N 2.89Å
548	V	94.1	Very high	95.3	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.6	-179.4	-178.1	0	0	0	0	108.4	P126 V213 M530 I550 L553	P126-V548 WeakPolarHBondContact CB-O 3.46Å; P126-V548 WeakPolarHBondContact CG-O 3.47Å; V213-V548 WeakPolarHBondContact O-CB 3.45Å; V213-V548 VanDerWaalsContact O-CG2 3.23Å; V213-V548 WeakPolarHBondContact O-CG2 3.44Å; M530-V548 HydrophobicContact CG-CG2 4.47Å; V548-I550 HydrophobicContact CG1-CG1 3.76Å; V548-I550 WeakPolarHBondContact CG1-O 3.21Å; V548-L553 HydrophobicContact CB-CD1 4.43Å; V548-L553 HydrophobicContact CB-CG 4.36Å; V548-L553 HydrophobicContact CG1-CD1 4.05Å; V548-L553 HydrophobicContact CG1-CD2 3.96Å; V548-L553 HydrophobicContact CG1-CG 3.56Å; V548-L553 HydrophobicContact CG2-CD1 3.55Å; V548-L553 HydrophobicContact CG2-CG 3.8Å
549	K	93.7	Very high	95.3	Very high	82 Å²	82	31.2 Å²	31.2	36%	0.357	16%	0.156	S	C	.	.			trans	-100.6	-13.3	-177.4	-57.8	-177.1	-176.1	-178.3	0	113.9	D525 D529	D525-K549 VanDerWaalsContact C-NZ 3.3Å; D525-K549 PolarHBondContact O-NZ 2.85Å; D525-K549 VanDerWaalsContact OD1-CE 3.31Å; D525-K549 WeakPolarHBondContact OD1-CE 3.44Å; D525-K549 IonicContact OD1-NZ 3.37Å; D525-K549 PolarHBondContact OD1-NZ 2.97Å; D529-K549 PolarHBondContact O-N 2.83Å
550	I	92.1	Very high	95.4	Very high	34 Å²	34	26.9 Å²	26.9	17%	0.174	14%	0.138	C	C	.	.	S	Bend	trans	-98.3	165.9	173.7	58.3	167.3	0	0	0	110.1	M511 D529 V548 G552 L553	M511-I550 HydrophobicContact CE-CD1 3.65Å; D529-I550 HydrophobicContact CB-CD1 4.1Å; D529-I550 HydrophobicContact CB-CG1 4.11Å; D529-I550 HydrophobicContact CB-CG2 3.78Å; V548-I550 HydrophobicContact CG1-CG1 3.76Å; V548-I550 WeakPolarHBondContact CG1-O 3.21Å; I550-G552 PolarHBondContact O-N 3.4Å; I550-L553 HydrophobicContact CD1-CD2 3.5Å; I550-L553 HydrophobicContact CG1-CD2 3.8Å
551	P	90.2	Very high	95.5	Very high	70 Å²	70	26.8 Å²	26.8	46%	0.455	14%	0.137	S	C	.	.	S	Bend	trans	-73.4	57.9	-175.9	30.5	-37.6	0	0	0	113.4	L127	L127-P551 HydrophobicContact CD2-CB 3.61Å
552	G	91.1	Very high	95.5	Very high	6 Å²	6	26.8 Å²	26.8	6%	0.062	14%	0.137	C	C	.	.			trans	96.7	155.7	178.4	0	0	0	0	0	114.6	V212 I550	V212-G552 CarbonylContact O-C 3.53Å; V212-G552 VanDerWaalsContact O-CA 3.31Å; V212-G552 WeakPolarHBondContact O-CA 3.32Å; I550-G552 PolarHBondContact O-N 3.4Å
553	L	93.9	Very high	95.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-115.8	143.1	176.5	-63.4	-179.8	0	0	0	112.3	Q211 V212 L499 M511 M530 V548 I550 V558	Q211-L553 CarbonylContact C-O 3.54Å; Q211-L553 WeakPolarHBondContact CA-O 3.43Å; Q211-L553 PolarHBondContact OE1-O 3.23Å; V212-L553 PolarHBondContact N-O 3.01Å; V212-L553 PolarHBondContact O-N 2.93Å; L499-L553 HydrophobicContact CD2-CD1 4.27Å; L499-L553 HydrophobicContact CD2-CD2 3.39Å; L499-L553 HydrophobicContact CD2-CG 4.49Å; M511-L553 HydrophobicContact CE-CD2 4.06Å; M530-L553 HydrophobicContact CB-CD1 4.23Å; M530-L553 HydrophobicContact CG-CD1 3.9Å; M530-L553 HydrophobicContact SD-CD1 3.25Å; M530-L553 WeakPolarHBondContact SD-CD1 3.3Å; V548-L553 HydrophobicContact CB-CD1 4.43Å; V548-L553 HydrophobicContact CB-CG 4.36Å; V548-L553 HydrophobicContact CG1-CD1 4.05Å; V548-L553 HydrophobicContact CG1-CD2 3.96Å; V548-L553 HydrophobicContact CG1-CG 3.56Å; V548-L553 HydrophobicContact CG2-CD1 3.55Å; V548-L553 HydrophobicContact CG2-CG 3.8Å; I550-L553 HydrophobicContact CD1-CD2 3.5Å; I550-L553 HydrophobicContact CG1-CD2 3.8Å; L553-V558 HydrophobicContact CB-CG2 4.21Å
554	P	94.5	Very high	95.5	Very high	35 Å²	35	32.9 Å²	32.9	23%	0.227	17%	0.166	C	C	.	.			trans	-62.5	140.9	170.6	-21	31.9	0	0	0	110.5	Q211 K556 V557 V558	Q211-P554 VanDerWaalsContact OE1-CD 3.3Å; P554-K556 PolarHBondContact O-N 2.94Å; P554-K556 VanDerWaalsContact O-N 3.1Å; P554-V557 HydrophobicContact CB-CG2 4.24Å; P554-V557 HydrophobicContact CG-CG2 4.24Å; P554-V557 WeakPolarHBondContact O-CB 3.28Å; P554-V557 PolarHBondContact O-N 3.32Å; P554-V558 PolarHBondContact O-N 2.79Å
555	L	93.9	Very high	95.5	Very high	43 Å²	43	32.9 Å²	32.9	23%	0.225	17%	0.166	C	C	.	.	H	α-helix	trans	-55.8	-33.8	-179.9	-168.1	60.6	0	0	0	112.7	V212 V231 K232 V235 V557 V558 M559	V212-L555 HydrophobicContact CG2-CD1 4.15Å; V231-L555 HydrophobicContact CG1-CD1 3.88Å; K232-L555 HydrophobicContact CB-CD2 4.37Å; K232-L555 HydrophobicContact CG-CD2 3.71Å; K232-L555 HydrophobicContact CG-CG 4.45Å; V235-L555 HydrophobicContact CG2-CD1 4.23Å; L555-V557 VanDerWaalsContact C-N 3.35Å; L555-V557 PolarHBondContact O-N 3.22Å; L555-V558 PolarHBondContact O-N 3.3Å; L555-M559 HydrophobicContact CD1-CE 3.54Å; L555-M559 HydrophobicContact CG-CE 3.97Å; L555-M559 VanDerWaalsContact O-CG 3.28Å; L555-M559 WeakPolarHBondContact O-CG 3.31Å; L555-M559 PolarHBondContact O-N 2.96Å
556	K	95.5	Very high	95.5	Very high	135 Å²	135	33.3 Å²	33.3	59%	0.587	17%	0.169	S	C	*	.	H	α-helix	trans	-55.1	-47.5	174.8	179.6	-176.6	168.4	-171.7	0	112.1	P554 V558 M559 E560	P554-K556 PolarHBondContact O-N 2.94Å; P554-K556 VanDerWaalsContact O-N 3.1Å; K556-V558 VanDerWaalsContact C-N 3.32Å; K556-V558 PolarHBondContact O-N 2.59Å; K556-M559 PolarHBondContact O-N 2.82Å; K556-E560 WeakPolarHBondContact CE-OE1 3.41Å; K556-E560 IonicContact NZ-OE1 3.75Å; K556-E560 WeakPolarHBondContact O-CG 3.32Å; K556-E560 PolarHBondContact O-N 2.73Å
557	V	96.4	Very high	95.6	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-41.1	-179.2	-178.7	0	0	0	0	110.5	L499 M511 Y514 L516 P554 L555 M559 E560 A561	L499-V557 HydrophobicContact CD1-CG1 3.81Å; L499-V557 HydrophobicContact CD2-CG1 4.12Å; M511-V557 HydrophobicContact SD-CG2 4.27Å; Y514-V557 HydrophobicContact CD1-CG2 4.31Å; Y514-V557 HydrophobicContact CD2-CG1 4.33Å; Y514-V557 HydrophobicContact CD2-CG2 4.37Å; Y514-V557 HydrophobicContact CE1-CG2 3.97Å; Y514-V557 HydrophobicContact CE2-CG1 4.28Å; Y514-V557 HydrophobicContact CE2-CG2 4.03Å; L516-V557 HydrophobicContact CD2-CG1 4.15Å; P554-V557 HydrophobicContact CB-CG2 4.24Å; P554-V557 HydrophobicContact CG-CG2 4.24Å; P554-V557 WeakPolarHBondContact O-CB 3.28Å; P554-V557 PolarHBondContact O-N 3.32Å; L555-V557 VanDerWaalsContact C-N 3.35Å; L555-V557 PolarHBondContact O-N 3.22Å; V557-M559 VanDerWaalsContact C-N 3.35Å; V557-M559 PolarHBondContact O-N 2.98Å; V557-E560 PolarHBondContact O-N 3.26Å; V557-A561 WeakPolarHBondContact O-CB 3.49Å; V557-A561 PolarHBondContact O-N 2.63Å
558	V	96.7	Very high	95.9	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-42.6	176	179.5	0	0	0	0	111.4	V212 I215 F532 L553 P554 L555 K556 A561 I562	V212-V558 HydrophobicContact CB-CG2 4.17Å; V212-V558 HydrophobicContact CG1-CG2 4.47Å; V212-V558 HydrophobicContact CG2-CG2 4.29Å; I215-V558 HydrophobicContact CD1-CG1 3.88Å; F532-V558 HydrophobicContact CE2-CG1 4.14Å; L553-V558 HydrophobicContact CB-CG2 4.21Å; P554-V558 PolarHBondContact O-N 2.79Å; L555-V558 PolarHBondContact O-N 3.3Å; K556-V558 VanDerWaalsContact C-N 3.32Å; K556-V558 PolarHBondContact O-N 2.59Å; V558-A561 PolarHBondContact O-N 3.32Å; V558-I562 HydrophobicContact CG1-CD1 4.25Å; V558-I562 WeakPolarHBondContact O-CG1 3.33Å; V558-I562 PolarHBondContact O-N 3.35Å
559	M	97.4	Very high	96.1	Very high	30 Å²	30	34.5 Å²	34.5	15%	0.148	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-42.5	178.7	-62.1	-63	131.8	0	0	112.1	C228 V231 K232 L555 K556 V557 I562 Q563	C228-M559 HydrophobicContact CB-CE 4.42Å; C228-M559 HydrophobicContact CB-SD 3.51Å; C228-M559 VanDerWaalsContact CB-SD 3.51Å; V231-M559 HydrophobicContact CB-CE 4.04Å; V231-M559 HydrophobicContact CG1-CE 3.89Å; K232-M559 HydrophobicContact CG-CE 4.28Å; L555-M559 HydrophobicContact CD1-CE 3.54Å; L555-M559 HydrophobicContact CG-CE 3.97Å; L555-M559 VanDerWaalsContact O-CG 3.28Å; L555-M559 WeakPolarHBondContact O-CG 3.31Å; L555-M559 PolarHBondContact O-N 2.96Å; K556-M559 PolarHBondContact O-N 2.82Å; V557-M559 VanDerWaalsContact C-N 3.35Å; V557-M559 PolarHBondContact O-N 2.98Å; M559-I562 PolarHBondContact O-N 2.7Å; M559-Q563 PolarHBondContact O-N 3.34Å; M559-Q563 VanDerWaalsContact O-N 3.11Å
560	E	98.1	Very high	96.3	Very high	68 Å²	68	38 Å²	38	32%	0.318	19%	0.188	S	C	.	.	H	α-helix	trans	-64.4	-40.5	176.1	-71.5	172.5	-171.6	0	0	111.5	Y514 L516 K556 V557 I562 Q563 Q564	Y514-E560 WeakPolarHBondContact CE2-OE2 3.37Å; Y514-E560 VanDerWaalsContact OH-CD 3.28Å; Y514-E560 PolarHBondContact OH-OE1 2.99Å; Y514-E560 PolarHBondContact OH-OE2 3.32Å; L516-E560 HydrophobicContact CD1-CB 3.66Å; K556-E560 WeakPolarHBondContact CE-OE1 3.41Å; K556-E560 IonicContact NZ-OE1 3.75Å; K556-E560 WeakPolarHBondContact O-CG 3.32Å; K556-E560 PolarHBondContact O-N 2.73Å; V557-E560 PolarHBondContact O-N 3.26Å; E560-I562 PolarHBondContact O-N 2.87Å; E560-Q563 PolarHBondContact O-N 2.99Å; E560-Q564 WeakPolarHBondContact O-CB 3.21Å; E560-Q564 PolarHBondContact O-N 2.92Å
561	A	98.3	Very high	96.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-42.2	175.2	0	0	0	0	0	112.3	I497 L516 M530 F532 V557 V558 Q563 Q564 A565	I497-A561 HydrophobicContact CG2-CB 4.24Å; L516-A561 HydrophobicContact CD1-CB 4.32Å; L516-A561 HydrophobicContact CD2-CB 3.95Å; M530-A561 HydrophobicContact CE-CB 4.16Å; F532-A561 HydrophobicContact CD1-CB 4.32Å; F532-A561 HydrophobicContact CE1-CB 4.38Å; F532-A561 HydrophobicContact CG-CB 4.44Å; V557-A561 WeakPolarHBondContact O-CB 3.49Å; V557-A561 PolarHBondContact O-N 2.63Å; V558-A561 PolarHBondContact O-N 3.32Å; A561-Q563 VanDerWaalsContact C-N 3.34Å; A561-Q563 PolarHBondContact O-N 3.07Å; A561-Q564 PolarHBondContact O-N 2.92Å; A561-A565 VanDerWaalsContact O-CB 3.22Å; A561-A565 WeakPolarHBondContact O-CB 3.38Å; A561-A565 PolarHBondContact O-N 2.65Å
562	I	98.4	Very high	97	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-43.5	175	-68.6	167.3	0	0	0	110.9	Q224 F227 F532 L534 I541 V558 M559 E560 T566	Q224-I562 HydrophobicContact CG-CG2 3.7Å; F227-I562 HydrophobicContact CD1-CD1 4.28Å; F227-I562 HydrophobicContact CE1-CD1 4.48Å; F532-I562 HydrophobicContact CE1-CG1 4Å; F532-I562 HydrophobicContact CZ-CD1 4.33Å; F532-I562 HydrophobicContact CZ-CG1 3.5Å; F532-I562 VanDerWaalsContact CZ-CG1 3.5Å; L534-I562 HydrophobicContact CD1-CB 4.49Å; L534-I562 HydrophobicContact CD1-CG1 4.44Å; L534-I562 HydrophobicContact CD1-CG2 4.09Å; I541-I562 HydrophobicContact CD1-CG2 4.09Å; V558-I562 HydrophobicContact CG1-CD1 4.25Å; V558-I562 WeakPolarHBondContact O-CG1 3.33Å; V558-I562 PolarHBondContact O-N 3.35Å; M559-I562 PolarHBondContact O-N 2.7Å; E560-I562 PolarHBondContact O-N 2.87Å; I562-T566 WeakPolarHBondContact O-CB 3.31Å; I562-T566 PolarHBondContact O-N 3.21Å; I562-T566 PolarHBondContact O-OG1 3.22Å
563	Q	98.4	Very high	97.4	Very high	96 Å²	96	37.7 Å²	37.7	45%	0.449	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-49.7	178.9	179	60.7	36.4	0	0	111.2	M559 E560 A561 A565 T566 V567	M559-Q563 PolarHBondContact O-N 3.34Å; M559-Q563 VanDerWaalsContact O-N 3.11Å; E560-Q563 PolarHBondContact O-N 2.99Å; A561-Q563 VanDerWaalsContact C-N 3.34Å; A561-Q563 PolarHBondContact O-N 3.07Å; Q563-A565 VanDerWaalsContact C-N 3.34Å; Q563-A565 PolarHBondContact O-N 3.35Å; Q563-T566 WeakPolarHBondContact O-CB 3.39Å; Q563-T566 PolarHBondContact O-N 2.88Å; Q563-T566 VanDerWaalsContact O-N 3.11Å; Q563-V567 PolarHBondContact O-N 2.8Å
564	Q	98.5	Very high	97.6	Very high	34 Å²	34	39.2 Å²	39.2	16%	0.159	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-42.4	179.1	-176.9	167.9	-28.2	0	0	111.5	I497 L516 T518 E560 A561 T566 V567 A568	I497-Q564 HydrophobicContact CD1-CG 4.36Å; L516-Q564 PolarHBondContact O-NE2 3.4Å; L516-Q564 VanDerWaalsContact O-NE2 3.12Å; T518-Q564 VanDerWaalsContact OG1-CG 3.27Å; T518-Q564 WeakPolarHBondContact OG1-CG 3.21Å; T518-Q564 PolarHBondContact OG1-NE2 2.99Å; E560-Q564 WeakPolarHBondContact O-CB 3.21Å; E560-Q564 PolarHBondContact O-N 2.92Å; A561-Q564 PolarHBondContact O-N 2.92Å; Q564-T566 VanDerWaalsContact C-N 3.31Å; Q564-T566 PolarHBondContact O-N 2.71Å; Q564-V567 PolarHBondContact O-N 3.17Å; Q564-A568 PolarHBondContact O-N 2.83Å; Q564-A568 VanDerWaalsContact O-N 3.13Å
565	A	98.4	Very high	97.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-37	173.7	0	0	0	0	0	112.9	V495 I497 L534 A561 Q563 A568 K569	V495-A565 HydrophobicContact CG1-CB 3.79Å; I497-A565 HydrophobicContact CD1-CB 4.13Å; I497-A565 HydrophobicContact CG1-CB 3.69Å; L534-A565 HydrophobicContact CB-CB 3.88Å; L534-A565 HydrophobicContact CD1-CB 4.02Å; L534-A565 HydrophobicContact CD2-CB 4.19Å; L534-A565 HydrophobicContact CG-CB 4.25Å; A561-A565 VanDerWaalsContact O-CB 3.22Å; A561-A565 WeakPolarHBondContact O-CB 3.38Å; A561-A565 PolarHBondContact O-N 2.65Å; Q563-A565 VanDerWaalsContact C-N 3.34Å; Q563-A565 PolarHBondContact O-N 3.35Å; A565-A568 PolarHBondContact O-N 2.79Å; A565-K569 WeakPolarHBondContact O-CB 3.47Å; A565-K569 PolarHBondContact O-N 3.48Å
566	T	98.1	Very high	98.1	Very high	13 Å²	13	38.2 Å²	38.2	8%	0.08	19%	0.187	C	C	.	.	H	α-helix	trans	-66.4	-39	-179.7	-63.2	0	0	0	0	111.9	Q224 I562 Q563 Q564 R570	Q224-T566 PolarHBondContact OE1-OG1 3.4Å; I562-T566 WeakPolarHBondContact O-CB 3.31Å; I562-T566 PolarHBondContact O-N 3.21Å; I562-T566 PolarHBondContact O-OG1 3.22Å; Q563-T566 WeakPolarHBondContact O-CB 3.39Å; Q563-T566 PolarHBondContact O-N 2.88Å; Q563-T566 VanDerWaalsContact O-N 3.11Å; Q564-T566 VanDerWaalsContact C-N 3.31Å; Q564-T566 PolarHBondContact O-N 2.71Å; T566-R570 PolarHBondContact O-N 3.06Å
567	V	98.2	Very high	98.2	Very high	66 Å²	66	35 Å²	35	40%	0.4	18%	0.176	S	C	.	.	H	α-helix	trans	-64.3	-52.4	174	178.1	0	0	0	0	110.3	Q563 Q564 K569 R570 E571	Q563-V567 PolarHBondContact O-N 2.8Å; Q564-V567 PolarHBondContact O-N 3.17Å; V567-K569 VanDerWaalsContact C-N 3.34Å; V567-K569 PolarHBondContact O-N 2.99Å; V567-R570 WeakPolarHBondContact O-CB 3.45Å; V567-R570 PolarHBondContact O-N 2.99Å; V567-E571 PolarHBondContact O-N 2.83Å; V567-E571 VanDerWaalsContact O-N 3.16Å
568	A	98.4	Very high	98.3	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-41.5	-179.3	0	0	0	0	0	112.8	L353 V495 T518 Q564 A565 R570 E571 I572	L353-A568 HydrophobicContact CD2-CB 4.17Å; V495-A568 HydrophobicContact CB-CB 4.48Å; V495-A568 HydrophobicContact CG1-CB 4.23Å; V495-A568 HydrophobicContact CG2-CB 4.08Å; T518-A568 HydrophobicContact CG2-CB 3.4Å; Q564-A568 PolarHBondContact O-N 2.83Å; Q564-A568 VanDerWaalsContact O-N 3.13Å; A565-A568 PolarHBondContact O-N 2.79Å; A568-R570 VanDerWaalsContact C-N 3.29Å; A568-R570 PolarHBondContact O-N 2.65Å; A568-E571 PolarHBondContact O-N 3.47Å; A568-I572 VanDerWaalsContact O-CG1 3.29Å; A568-I572 WeakPolarHBondContact O-CG1 3.31Å; A568-I572 PolarHBondContact O-N 2.78Å
569	K	98.2	Very high	98.3	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-55.9	-43.5	173.5	177.6	-171.4	65.5	170.6	0	111.7	A493 L534 T537 G540 A565 V567 E571 I572 L573	A493-K569 HydrophobicContact CB-CG 4.24Å; L534-K569 HydrophobicContact CD2-CD 4.04Å; T537-K569 WeakPolarHBondContact O-CE 3.32Å; T537-K569 PolarHBondContact O-NZ 2.93Å; G540-K569 PolarHBondContact O-NZ 2.91Å; A565-K569 WeakPolarHBondContact O-CB 3.47Å; A565-K569 PolarHBondContact O-N 3.48Å; V567-K569 VanDerWaalsContact C-N 3.34Å; V567-K569 PolarHBondContact O-N 2.99Å; K569-E571 VanDerWaalsContact C-N 3.35Å; K569-I572 PolarHBondContact O-N 3.11Å; K569-L573 HydrophobicContact CG-CD1 4.22Å; K569-L573 WeakPolarHBondContact O-CG 3.12Å; K569-L573 PolarHBondContact O-N 3.01Å
570	R	98.3	Very high	98.4	Very high	155 Å²	155	45 Å²	45	59%	0.585	22%	0.224	S	C	*	.	H	α-helix	trans	-64.4	-39.8	179.1	-174.1	-177	-66.8	162	-0.5	111.7	T566 V567 A568 L573 G574	T566-R570 PolarHBondContact O-N 3.06Å; V567-R570 WeakPolarHBondContact O-CB 3.45Å; V567-R570 PolarHBondContact O-N 2.99Å; A568-R570 VanDerWaalsContact C-N 3.29Å; A568-R570 PolarHBondContact O-N 2.65Å; R570-L573 PolarHBondContact O-N 2.72Å; R570-G574 PolarHBondContact O-N 3.24Å
571	E	98.6	Very high	98.3	Very high	98 Å²	98	45.2 Å²	45.2	46%	0.458	24%	0.237	S	C	.	.	H	α-helix	trans	-64.3	-44.5	175.8	-68.8	174.9	-159.1	0	0	111.9	L353 V567 A568 K569 L573 G574 I575	L353-E571 HydrophobicContact CD1-CB 3.69Å; V567-E571 PolarHBondContact O-N 2.83Å; V567-E571 VanDerWaalsContact O-N 3.16Å; A568-E571 PolarHBondContact O-N 3.47Å; K569-E571 VanDerWaalsContact C-N 3.35Å; E571-L573 PolarHBondContact O-N 3.31Å; E571-G574 WeakPolarHBondContact O-CA 3.36Å; E571-G574 PolarHBondContact O-N 2.73Å; E571-G574 VanDerWaalsContact O-N 3.12Å; E571-I575 PolarHBondContact O-N 3.34Å; E571-I575 VanDerWaalsContact O-N 3.07Å
572	I	98.8	Very high	98.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-47	176.1	-62.2	160.4	0	0	0	110.7	L353 I356 F372 A493 G494 V495 A568 K569 G574 I575 M576	L353-I572 HydrophobicContact CD1-CD1 4.41Å; L353-I572 HydrophobicContact CD1-CG1 3.66Å; L353-I572 HydrophobicContact CD2-CD1 4.02Å; L353-I572 HydrophobicContact CD2-CG1 4.1Å; I356-I572 HydrophobicContact CD1-CB 4.29Å; I356-I572 HydrophobicContact CD1-CG1 3.7Å; I356-I572 HydrophobicContact CD1-CG2 4.11Å; F372-I572 HydrophobicContact CE2-CG2 4.33Å; F372-I572 HydrophobicContact CZ-CG2 4.1Å; A493-I572 HydrophobicContact CB-CB 4.07Å; A493-I572 HydrophobicContact CB-CG2 3.74Å; G494-I572 WeakPolarHBondContact O-CD1 3.33Å; V495-I572 HydrophobicContact CB-CD1 3.92Å; V495-I572 HydrophobicContact CG2-CD1 4.23Å; A568-I572 VanDerWaalsContact O-CG1 3.29Å; A568-I572 WeakPolarHBondContact O-CG1 3.31Å; A568-I572 PolarHBondContact O-N 2.78Å; K569-I572 PolarHBondContact O-N 3.11Å; I572-G574 VanDerWaalsContact C-N 3.26Å; I572-G574 PolarHBondContact O-N 2.74Å; I572-I575 PolarHBondContact O-N 2.75Å; I572-I575 VanDerWaalsContact O-N 3.07Å; I572-M576 HydrophobicContact CG2-CG 4.31Å; I572-M576 HydrophobicContact CG2-SD 3.75Å; I572-M576 WeakPolarHBondContact O-CG 3.4Å; I572-M576 PolarHBondContact O-N 2.92Å
573	L	98.7	Very high	98.2	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-57.3	-41.1	174.7	-74.6	168.9	0	0	0	111.6	A491 A493 N538 K569 R570 E571 I575 M576 N577	A491-L573 HydrophobicContact CB-CD2 3.72Å; A491-L573 WeakPolarHBondContact O-CD2 3.49Å; A493-L573 HydrophobicContact CB-CD2 3.67Å; A493-L573 HydrophobicContact CB-CG 3.62Å; N538-L573 HydrophobicContact CB-CD1 4.12Å; K569-L573 HydrophobicContact CG-CD1 4.22Å; K569-L573 WeakPolarHBondContact O-CG 3.12Å; K569-L573 PolarHBondContact O-N 3.01Å; R570-L573 PolarHBondContact O-N 2.72Å; E571-L573 PolarHBondContact O-N 3.31Å; L573-I575 VanDerWaalsContact C-N 3.28Å; L573-I575 PolarHBondContact O-N 2.95Å; L573-M576 HydrophobicContact CD2-SD 4.49Å; L573-M576 PolarHBondContact O-N 3.39Å; L573-N577 WeakPolarHBondContact O-CB 3.4Å; L573-N577 PolarHBondContact O-N 2.73Å; L573-N577 PolarHBondContact O-ND2 2.64Å
574	G	98.5	Very high	98.2	Very high	34 Å²	34	52.4 Å²	52.4	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-36.8	175.7	0	0	0	0	0	113	R570 E571 I572 K578	R570-G574 PolarHBondContact O-N 3.24Å; E571-G574 WeakPolarHBondContact O-CA 3.36Å; E571-G574 PolarHBondContact O-N 2.73Å; E571-G574 VanDerWaalsContact O-N 3.12Å; I572-G574 VanDerWaalsContact C-N 3.26Å; I572-G574 PolarHBondContact O-N 2.74Å; G574-K578 WeakPolarHBondContact O-CG 3.35Å
575	I	98.7	Very high	97.9	Very high	55 Å²	55	58.6 Å²	58.6	28%	0.282	30%	0.296	S	S	.	.	H	α-helix	trans	-73.7	-46.3	175.7	-63.2	164.1	0	0	0	110.7	I356 E571 I572 L573 N577 K578	I356-I575 HydrophobicContact CB-CD1 4.17Å; I356-I575 HydrophobicContact CB-CG2 4.09Å; I356-I575 HydrophobicContact CD1-CD1 4.12Å; I356-I575 HydrophobicContact CG2-CG2 3.84Å; E571-I575 PolarHBondContact O-N 3.34Å; E571-I575 VanDerWaalsContact O-N 3.07Å; I572-I575 PolarHBondContact O-N 2.75Å; I572-I575 VanDerWaalsContact O-N 3.07Å; L573-I575 VanDerWaalsContact C-N 3.28Å; L573-I575 PolarHBondContact O-N 2.95Å; I575-N577 VanDerWaalsContact C-N 3.3Å; I575-N577 PolarHBondContact O-N 2.86Å; I575-K578 WeakPolarHBondContact O-CB 3.31Å; I575-K578 PolarHBondContact O-N 3.09Å; I575-K578 VanDerWaalsContact O-N 3.1Å
576	M	98.8	Very high	97.5	Very high	1 Å²	1	67 Å²	67	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-57.5	-42.7	177.6	-70.6	167.3	63	0	0	112.1	F372 C475 L479 V492 A493 I572 L573 K578 C579 I580	F372-M576 HydrophobicContact CE2-CG 4.02Å; F372-M576 HydrophobicContact CE2-SD 4.28Å; C475-M576 HydrophobicContact CB-CE 4.1Å; C475-M576 HydrophobicContact CB-SD 3.91Å; C475-M576 WeakPolarHBondContact O-CE 3.39Å; L479-M576 HydrophobicContact CD2-CB 4.12Å; L479-M576 HydrophobicContact CD2-CE 4.28Å; L479-M576 HydrophobicContact CD2-CG 4.46Å; L479-M576 HydrophobicContact CG-CE 4Å; V492-M576 WeakPolarHBondContact O-CE 3.31Å; A493-M576 HydrophobicContact CB-SD 3.78Å; I572-M576 HydrophobicContact CG2-CG 4.31Å; I572-M576 HydrophobicContact CG2-SD 3.75Å; I572-M576 WeakPolarHBondContact O-CG 3.4Å; I572-M576 PolarHBondContact O-N 2.92Å; L573-M576 HydrophobicContact CD2-SD 4.49Å; L573-M576 PolarHBondContact O-N 3.39Å; M576-K578 PolarHBondContact O-N 2.75Å; M576-C579 WeakPolarHBondContact O-CA 3.26Å; M576-C579 VanDerWaalsContact O-CB 3.32Å; M576-C579 WeakPolarHBondContact O-CB 3.37Å; M576-C579 PolarHBondContact O-N 2.87Å; M576-I580 PolarHBondContact O-N 3.34Å; M576-I580 VanDerWaalsContact O-N 3.11Å
577	N	98.4	Very high	97.2	Very high	67 Å²	67	71.6 Å²	71.6	36%	0.358	35%	0.349	S	S	.	.	H	α-helix	trans	-64.4	-20.4	179.7	-72.6	-22	0	0	0	113.4	L573 I575 C579 A581	L573-N577 WeakPolarHBondContact O-CB 3.4Å; L573-N577 PolarHBondContact O-N 2.73Å; L573-N577 PolarHBondContact O-ND2 2.64Å; I575-N577 VanDerWaalsContact C-N 3.3Å; I575-N577 PolarHBondContact O-N 2.86Å; N577-C579 VanDerWaalsContact C-N 3.28Å; N577-A581 HydrophobicContact CB-CB 4.45Å
578	K	98.4	Very high	96.9	Very high	182 Å²	182	69.9 Å²	69.9	79%	0.791	34%	0.336	S	S	*	.	H	α-helix	trans	-71.4	-25.8	171.8	-64.1	174	-175.4	179.4	0	112.1	G574 I575 M576	G574-K578 WeakPolarHBondContact O-CG 3.35Å; I575-K578 WeakPolarHBondContact O-CB 3.31Å; I575-K578 PolarHBondContact O-N 3.09Å; I575-K578 VanDerWaalsContact O-N 3.1Å; M576-K578 PolarHBondContact O-N 2.75Å
579	C	97.8	Very high	96.3	Very high	46 Å²	46	78.7 Å²	78.7	31%	0.311	38%	0.377	S	S	.	.	H	α-helix	trans	-83.6	-52.2	175.7	-177.6	0	0	0	0	110.8	C358 M576 N577	C358-C579 HydrophobicContact CB-CB 3.84Å; C358-C579 PolarHBondContact O-SG 2.98Å; M576-C579 WeakPolarHBondContact O-CA 3.26Å; M576-C579 VanDerWaalsContact O-CB 3.32Å; M576-C579 WeakPolarHBondContact O-CB 3.37Å; M576-C579 PolarHBondContact O-N 2.87Å; N577-C579 VanDerWaalsContact C-N 3.28Å
580	I	97.8	Very high	95.8	Very high	18 Å²	18	80 Å²	80	9%	0.092	38%	0.384	C	S	.	.			trans	-151.3	120.5	175	-175.3	164.2	0	0	0	109.8	I360 L479 M482 M576 K582	I360-I580 HydrophobicContact CD1-CB 3.98Å; I360-I580 HydrophobicContact CD1-CD1 3.79Å; I360-I580 HydrophobicContact CD1-CG1 4.42Å; I360-I580 HydrophobicContact CD1-CG2 4.31Å; I360-I580 HydrophobicContact CG2-CG2 4.28Å; L479-I580 HydrophobicContact CD2-CG2 3.47Å; L479-I580 VanDerWaalsContact CD2-CG2 3.47Å; M482-I580 HydrophobicContact CB-CD1 3.71Å; M482-I580 HydrophobicContact CB-CG1 4.11Å; M482-I580 HydrophobicContact CB-CG2 4.27Å; M482-I580 HydrophobicContact SD-CG1 4.44Å; M482-I580 HydrophobicContact SD-CG2 4.28Å; M576-I580 PolarHBondContact O-N 3.34Å; M576-I580 VanDerWaalsContact O-N 3.11Å; I580-K582 WeakPolarHBondContact CG1-O 3.29Å
581	A	97.1	Very high	95.1	Very high	71 Å²	71	72.9 Å²	72.9	59%	0.587	36%	0.359	S	S	*	.	S	Bend	trans	-96.9	-23.9	-175.5	0	0	0	0	0	113.8	N577	N577-A581 HydrophobicContact CB-CB 4.45Å
582	K	97.3	Very high	94.6	Very high	127 Å²	127	68.4 Å²	68.4	55%	0.552	34%	0.338	S	S	*	.	S	Bend	trans	-139	151.1	179.5	62.2	172.1	-176.5	164.7	0	109.9	I580 E585	I580-K582 WeakPolarHBondContact CG1-O 3.29Å; K582-E585 IonicContact NZ-OE1 2.81Å; K582-E585 PolarHBondContact NZ-OE1 3.24Å
583	P	98	Very high	94.1	Very high	30 Å²	30	70.5 Å²	70.5	20%	0.195	35%	0.351	C	S	.	.			trans	-51.8	149.2	169.9	-25.1	33.8	0	0	0	112.2	M482 V486 I488	M482-P583 HydrophobicContact CG-CG 4.15Å; V486-P583 VanDerWaalsContact O-CB 3.3Å; V486-P583 WeakPolarHBondContact O-CB 3.48Å; V486-P583 WeakPolarHBondContact O-CG 3.21Å; I488-P583 HydrophobicContact CG1-CG 4.2Å
584	R	96.8	Very high	93.5	Very high	90 Å²	90	73.2 Å²	73.2	34%	0.34	37%	0.368	S	S	.	.			trans	-58.5	139.7	170	-66	-168.5	-173.5	-110.6	6.6	110	D361 M482 D483 K586	D361-R584 VanDerWaalsContact CG-NH2 3.33Å; D361-R584 IonicContact OD2-CZ 3.5Å; D361-R584 IonicContact OD2-NH1 3.75Å; D361-R584 IonicContact OD2-NH2 2.78Å; D361-R584 PolarHBondContact OD2-NH2 3.27Å; M482-R584 PolarHBondContact O-N 2.77Å; D483-R584 WeakPolarHBondContact O-CD 3.1Å; D483-R584 PolarHBondContact O-NE 2.83Å; D483-R584 VanDerWaalsContact O-NE 3.16Å; D483-R584 IonicContact OD1-CZ 3.46Å; D483-R584 IonicContact OD1-NE 2.62Å; D483-R584 PolarHBondContact OD1-NE 3.05Å; D483-R584 IonicContact OD1-NH2 2.73Å; D483-R584 PolarHBondContact OD1-NH2 3.01Å; R584-K586 WeakPolarHBondContact CB-O 3.45Å; R584-K586 PolarHBondContact O-N 2.75Å
585	E	93.5	Very high	93	Very high	164 Å²	164	75.3 Å²	75.3	77%	0.766	37%	0.368	S	S	*	.	S	Bend	trans	-67.1	-28.5	-177.6	-66.6	178.7	-176.6	0	0	112.7	K582	K582-E585 IonicContact NZ-OE1 2.81Å; K582-E585 PolarHBondContact NZ-OE1 3.24Å
586	K	89.9	Confident	92.5	Very high	176 Å²	176	77.8 Å²	77.8	77%	0.765	38%	0.382	S	S	*	.	S	Bend	trans	-128.3	147	174.6	-63.5	-177.4	-178.6	179.4	0	109.2	R584	R584-K586 WeakPolarHBondContact CB-O 3.45Å; R584-K586 PolarHBondContact O-N 2.75Å
587	R	91.1	Very high	92	Very high	110 Å²	110	79.1 Å²	79.1	42%	0.415	39%	0.39	S	S	.	.			trans	-60.4	155.7	166	-66.1	174.4	-69.9	-134.7	1.8	109.3	F385	F385-R587 HydrophobicContact CE2-CG 4.41Å
588	K	91.2	Very high	91.4	Very high	30 Å²	30	83.1 Å²	83.1	13%	0.13	41%	0.407	C	S	.	.			trans	-63.4	157.6	176.7	-61.4	-171.3	-169.3	-177.4	0	111.4	D361 H367 D483 N590 G591	D361-K588 WeakPolarHBondContact OD1-CE 3.49Å; D361-K588 IonicContact OD1-NZ 2.65Å; D361-K588 PolarHBondContact OD1-NZ 2.88Å; H367-K588 VanDerWaalsContact O-CD 3.23Å; H367-K588 WeakPolarHBondContact O-CD 3.19Å; H367-K588 WeakPolarHBondContact O-CE 3.17Å; D483-K588 IonicContact OD1-NZ 3.69Å; D483-K588 VanDerWaalsContact OD2-CE 3.29Å; D483-K588 WeakPolarHBondContact OD2-CE 3.27Å; D483-K588 IonicContact OD2-NZ 3.4Å; D483-K588 PolarHBondContact OD2-NZ 3.33Å; K588-N590 WeakPolarHBondContact CB-OD1 3.22Å; K588-N590 PolarHBondContact O-N 2.76Å; K588-G591 PolarHBondContact O-N 2.83Å
589	E	87.3	Confident	90.8	Very high	188 Å²	188	74.5 Å²	74.5	88%	0.879	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.5	-176.2	-64.9	179.5	172.7	0	0	113.5	G591 P641	E589-G591 VanDerWaalsContact C-N 3.26Å; E589-G591 PolarHBondContact O-N 3.25Å; E589-P641 WeakPolarHBondContact O-CG 3.4Å
590	N	86.2	Confident	90.1	Very high	33 Å²	33	75.1 Å²	75.1	18%	0.176	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	0.8	174.8	63.5	-28.4	0	0	0	113.9	K364 P365 L366 H367 K588	K364-N590 PolarHBondContact O-ND2 3.07Å; P365-N590 WeakPolarHBondContact CA-ND2 3.46Å; P365-N590 PolarHBondContact O-ND2 3.37Å; L366-N590 PolarHBondContact O-ND2 3.31Å; H367-N590 PolarHBondContact CD2-O 3Å; H367-N590 PolarHBondContact NE2-O 3.47Å; K588-N590 WeakPolarHBondContact CB-OD1 3.22Å; K588-N590 PolarHBondContact O-N 2.76Å
591	G	84.7	Confident	89.4	Confident	5 Å²	5	77.8 Å²	77.8	5%	0.052	39%	0.39	C	S	.	.	S	Bend	trans	-63.8	158.1	180	0	0	0	0	0	113.2	K588 E589	K588-G591 PolarHBondContact O-N 2.83Å; E589-G591 VanDerWaalsContact C-N 3.26Å; E589-G591 PolarHBondContact O-N 3.25Å
592	P	87.4	Confident	88.6	Confident	4 Å²	4	79.5 Å²	79.5	3%	0.026	40%	0.398	C	S	.	.			trans	-69.4	154.1	177.1	30.6	-36.1	0	0	0	111.7	F385 F454 F637 A638 P639	F385-P592 HydrophobicContact CB-CG 3.51Å; F385-P592 HydrophobicContact CD2-CG 4.23Å; F385-P592 HydrophobicContact CG-CG 4.27Å; F454-P592 HydrophobicContact CD1-CG 4.26Å; F454-P592 HydrophobicContact CD2-CG 4.16Å; F454-P592 HydrophobicContact CE1-CB 4.25Å; F454-P592 HydrophobicContact CE1-CG 3.97Å; F454-P592 HydrophobicContact CE2-CG 3.84Å; F454-P592 HydrophobicContact CG-CG 4.35Å; F454-P592 HydrophobicContact CZ-CB 4.27Å; F454-P592 HydrophobicContact CZ-CG 3.77Å; F454-P592 WeakPolarHBondContact CZ-O 3.27Å; P592-F637 HydrophobicContact CB-CD2 4.37Å; P592-F637 HydrophobicContact CB-CE2 3.42Å; P592-F637 VanDerWaalsContact CB-CE2 3.42Å; P592-F637 HydrophobicContact CB-CZ 3.52Å; P592-F637 HydrophobicContact CG-CE2 3.93Å; P592-F637 HydrophobicContact CG-CZ 4.16Å; P592-A638 CarbonylContact C-O 3.48Å; P592-A638 WeakPolarHBondContact CA-O 3.34Å; P592-A638 WeakPolarHBondContact CB-O 3.47Å; P592-P639 WeakPolarHBondContact CA-O 3.13Å
593	V	87.6	Confident	87.8	Confident	43 Å²	43	77.1 Å²	77.1	26%	0.261	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.3	179.3	-67.6	0	0	0	0	109.8	A638 P641 M644	V593-A638 HydrophobicContact CG2-CB 3.95Å; V593-A638 PolarHBondContact N-O 3.22Å; V593-A638 PolarHBondContact O-N 2.82Å; V593-P641 HydrophobicContact CG1-CG 4.45Å; V593-M644 HydrophobicContact CB-CE 4.43Å; V593-M644 HydrophobicContact CG2-CB 3.53Å; V593-M644 HydrophobicContact CG2-CE 3.71Å; V593-M644 HydrophobicContact CG2-CG 3.84Å
594	V	88.1	Confident	87.1	Confident	64 Å²	64	79.1 Å²	79.1	39%	0.388	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125	173.9	172.6	0	0	0	0	107.6	F454 V636 F637	F454-V594 HydrophobicContact CD1-CG2 4.44Å; F454-V594 HydrophobicContact CE1-CG2 3.52Å; F454-V594 HydrophobicContact CZ-CG2 4.25Å; V594-V636 VanDerWaalsContact CA-O 3.31Å; V594-V636 WeakPolarHBondContact CA-O 3.49Å; V594-F637 HydrophobicContact CG2-CB 4.21Å; V594-F637 HydrophobicContact CG2-CD2 3.77Å; V594-F637 HydrophobicContact CG2-CG 4.48Å
595	E	87	Confident	86.6	Confident	78 Å²	78	78.8 Å²	78.8	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.5	177.2	-68.2	-174.5	-178.8	0	0	109.9	V636 M644 Q648	E595-V636 PolarHBondContact N-O 3.09Å; E595-V636 PolarHBondContact O-N 3.27Å; E595-M644 HydrophobicContact CB-CE 3.91Å; E595-M644 HydrophobicContact CB-SD 4.4Å; E595-M644 HydrophobicContact CG-CE 4Å; E595-Q648 PolarHBondContact OE2-NE2 3.44Å
596	N	88.9	Confident	86.2	Confident	107 Å²	107	75.5 Å²	75.5	57%	0.572	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.8	174.2	-70.7	-23	0	0	0	109.1	T633 F634 S635	N596-T633 HydrophobicContact CB-CG2 3.95Å; N596-F634 CarbonylContact C-O 3.6Å; N596-F634 WeakPolarHBondContact CA-O 3.32Å; N596-S635 WeakPolarHBondContact OD1-CB 3.44Å
597	V	88.1	Confident	86.1	Confident	28 Å²	28	67.2 Å²	67.2	17%	0.17	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.9	175	179.1	0	0	0	0	108.4	V599 F634 V636 I651	V597-V599 HydrophobicContact CG1-CG2 3.97Å; V597-F634 PolarHBondContact N-O 3.18Å; V597-F634 PolarHBondContact O-N 3.39Å; V597-V636 HydrophobicContact CB-CG2 4.39Å; V597-V636 HydrophobicContact CG2-CG2 3.67Å; V597-I651 HydrophobicContact CG1-CG2 4Å; V597-I651 HydrophobicContact CG2-CD1 4.17Å
598	Q	86.3	Confident	86	Confident	151 Å²	151	63.7 Å²	63.7	71%	0.706	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	123	170.6	-68.7	-164.6	-13	0	0	110.5	E632	Q598-E632 CarbonylContact C-O 3.52Å; Q598-E632 WeakPolarHBondContact CA-O 3.5Å
599	V	85.5	Confident	85.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	34%	0.339	C	S	.	.			trans	-120.5	108.8	177.9	-177.2	0	0	0	0	107.4	V597 R603 F607 E632 F634	V597-V599 HydrophobicContact CG1-CG2 3.97Å; V599-R603 HydrophobicContact CG1-CB 4.18Å; V599-F607 HydrophobicContact CB-CD1 4.41Å; V599-F607 HydrophobicContact CG1-CB 3.75Å; V599-F607 HydrophobicContact CG1-CD1 4.12Å; V599-F607 HydrophobicContact CG1-CG 3.94Å; V599-F607 HydrophobicContact CG2-CD1 3.93Å; V599-F607 HydrophobicContact CG2-CD2 4.29Å; V599-F607 HydrophobicContact CG2-CE1 4.05Å; V599-F607 HydrophobicContact CG2-CE2 4.42Å; V599-F607 HydrophobicContact CG2-CG 4.05Å; V599-F607 HydrophobicContact CG2-CZ 4.3Å; V599-E632 PolarHBondContact N-O 3.49Å; V599-E632 WeakPolarHBondContact O-CA 3.39Å; V599-F634 HydrophobicContact CB-CD2 4.09Å; V599-F634 HydrophobicContact CB-CE2 4.14Å; V599-F634 HydrophobicContact CG2-CD2 3.93Å; V599-F634 HydrophobicContact CG2-CE2 4.37Å
600	P	83.4	Confident	85.9	Confident	59 Å²	59	59.2 Å²	59.2	38%	0.383	33%	0.332	S	S	.	.			trans	-54.2	145.9	178.5	-25.8	33.3	0	0	0	112	S602 R603 R604	P600-S602 PolarHBondContact O-N 3.06Å; P600-R603 PolarHBondContact O-N 3.03Å; P600-R604 PolarHBondContact O-N 2.87Å; P600-R604 VanDerWaalsContact O-N 3.12Å
601	V	82.4	Confident	86	Confident	75 Å²	75	61.1 Å²	61.1	46%	0.455	36%	0.36	S	S	.	.	H	α-helix	trans	-51.5	-37.5	-179.2	179.3	0	0	0	0	112.3	R603 R604 E632	V601-R603 PolarHBondContact O-N 3.19Å; V601-R604 WeakPolarHBondContact O-CB 3.44Å; V601-R604 PolarHBondContact O-N 2.98Å; V601-E632 HydrophobicContact CG2-CG 3.72Å; V601-E632 WeakPolarHBondContact CG2-OE1 3.45Å
602	S	80.4	Confident	86.2	Confident	107 Å²	107	61.6 Å²	61.6	75%	0.748	37%	0.365	S	S	*	.	H	α-helix	trans	-60.3	-28.1	177.7	59.9	0	0	0	0	114	P600	P600-S602 PolarHBondContact O-N 3.06Å
603	R	79.9	Confident	86.4	Confident	77 Å²	77	67.8 Å²	67.8	29%	0.291	39%	0.389	S	S	.	.	H	α-helix	trans	-102.3	-13.1	-177.9	-58.6	-174.7	-167.9	-152.2	-3.8	113.1	V599 P600 V601 A605 R606 F607 C655 D657	V599-R603 HydrophobicContact CG1-CB 4.18Å; P600-R603 PolarHBondContact O-N 3.03Å; V601-R603 PolarHBondContact O-N 3.19Å; R603-A605 VanDerWaalsContact C-N 3.32Å; R603-A605 PolarHBondContact O-N 3.06Å; R603-R606 PolarHBondContact O-N 3.24Å; R603-R606 VanDerWaalsContact O-N 3.08Å; R603-F607 WeakPolarHBondContact O-CB 3.26Å; R603-F607 PolarHBondContact O-N 3.39Å; R603-C655 PolarHBondContact NH1-O 3.07Å; R603-D657 IonicContact CZ-OD1 2.87Å; R603-D657 IonicContact NH1-OD1 3.93Å; R603-D657 PolarHBondContact NH1-OD1 3.22Å; R603-D657 IonicContact NH2-OD1 3.07Å; R603-D657 PolarHBondContact NH2-OD1 3.19Å; R603-D657 IonicContact NH2-OD2 2.76Å
604	R	83.7	Confident	86.6	Confident	71 Å²	71	67 Å²	67	27%	0.268	38%	0.383	S	S	.	.	H	α-helix	trans	-54.7	-43.9	-177	-177.3	177.9	171.2	-161.3	-5.4	113	P600 V601 R606 F607 V608 Q628 E631 F634	P600-R604 PolarHBondContact O-N 2.87Å; P600-R604 VanDerWaalsContact O-N 3.12Å; V601-R604 WeakPolarHBondContact O-CB 3.44Å; V601-R604 PolarHBondContact O-N 2.98Å; R604-R606 VanDerWaalsContact C-N 3.3Å; R604-R606 PolarHBondContact O-N 2.65Å; R604-F607 PolarHBondContact O-N 3.09Å; R604-V608 HydrophobicContact CG-CG2 4.12Å; R604-V608 WeakPolarHBondContact O-CB 3.1Å; R604-V608 WeakPolarHBondContact O-CG2 3.22Å; R604-V608 PolarHBondContact O-N 3.04Å; R604-Q628 VanDerWaalsContact NH2-CD 3.3Å; R604-E631 WeakPolarHBondContact CD-O 3.2Å; R604-F634 HydrophobicContact CG-CE2 4.43Å; R604-F634 HydrophobicContact CG-CZ 4.22Å
605	A	85.6	Confident	86.7	Confident	83 Å²	83	65.3 Å²	65.3	69%	0.686	37%	0.372	S	S	*	.	H	α-helix	trans	-61.3	-38.5	179.9	0	0	0	0	0	112.5	R603 G609	R603-A605 VanDerWaalsContact C-N 3.32Å; R603-A605 PolarHBondContact O-N 3.06Å; A605-G609 WeakPolarHBondContact O-CA 3.34Å; A605-G609 PolarHBondContact O-N 3.24Å
606	R	84.8	Confident	86.8	Confident	95 Å²	95	69.9 Å²	69.9	36%	0.358	39%	0.385	S	S	.	.	H	α-helix	trans	-73.8	-41.1	176	-169.1	173.9	76.1	173.8	2.8	111.5	R603 R604 G609 N614 I654 C655 K656 D658	R603-R606 PolarHBondContact O-N 3.24Å; R603-R606 VanDerWaalsContact O-N 3.08Å; R604-R606 VanDerWaalsContact C-N 3.3Å; R604-R606 PolarHBondContact O-N 2.65Å; R606-G609 PolarHBondContact O-N 3.38Å; R606-N614 PolarHBondContact O-ND2 3.03Å; R606-I654 PolarHBondContact NE-O 3.17Å; R606-I654 PolarHBondContact NH2-O 3Å; R606-C655 VanDerWaalsContact NH2-C 3.29Å; R606-C655 PolarHBondContact NH2-O 2.87Å; R606-K656 PolarHBondContact NH1-O 2.76Å; R606-K656 PolarHBondContact NH2-O 3.46Å; R606-D658 IonicContact NH1-OD2 2.69Å; R606-D658 PolarHBondContact NH1-OD2 2.83Å
607	F	87.6	Confident	86.9	Confident	3 Å²	3	69 Å²	69	1%	0.013	37%	0.374	C	S	.	.	H	α-helix	trans	-59.6	-51.2	177.4	176.2	-113.3	0	0	0	112.2	V599 R603 R604 N614 L615 I626 F634 I651 I654	V599-F607 HydrophobicContact CB-CD1 4.41Å; V599-F607 HydrophobicContact CG1-CB 3.75Å; V599-F607 HydrophobicContact CG1-CD1 4.12Å; V599-F607 HydrophobicContact CG1-CG 3.94Å; V599-F607 HydrophobicContact CG2-CD1 3.93Å; V599-F607 HydrophobicContact CG2-CD2 4.29Å; V599-F607 HydrophobicContact CG2-CE1 4.05Å; V599-F607 HydrophobicContact CG2-CE2 4.42Å; V599-F607 HydrophobicContact CG2-CG 4.05Å; V599-F607 HydrophobicContact CG2-CZ 4.3Å; R603-F607 WeakPolarHBondContact O-CB 3.26Å; R603-F607 PolarHBondContact O-N 3.39Å; R604-F607 PolarHBondContact O-N 3.09Å; F607-N614 VanDerWaalsContact O-CB 3.24Å; F607-N614 WeakPolarHBondContact O-CB 3.47Å; F607-L615 HydrophobicContact CD1-CD2 4.27Å; F607-L615 HydrophobicContact CE1-CD2 3.68Å; F607-L615 HydrophobicContact CE2-CD2 4.39Å; F607-L615 HydrophobicContact CZ-CD2 3.74Å; F607-I626 HydrophobicContact CZ-CD1 4.42Å; F607-F634 HydrophobicContact CD1-CD2 4.19Å; F607-F634 HydrophobicContact CD1-CE1 4.34Å; F607-F634 AromaticContact CD1-CE2 3.97Å; F607-F634 HydrophobicContact CD1-CE2 3.97Å; F607-F634 HydrophobicContact CD1-CG 4.49Å; F607-F634 HydrophobicContact CD1-CZ 4.04Å; F607-F634 HydrophobicContact CE1-CB 4.33Å; F607-F634 AromaticContact CE1-CD1 3.79Å; F607-F634 HydrophobicContact CE1-CD1 3.79Å; F607-F634 AromaticContact CE1-CD2 3.79Å; F607-F634 HydrophobicContact CE1-CD2 3.79Å; F607-F634 AromaticContact CE1-CE1 3.96Å; F607-F634 HydrophobicContact CE1-CE1 3.96Å; F607-F634 AromaticContact CE1-CE2 3.98Å; F607-F634 HydrophobicContact CE1-CE2 3.98Å; F607-F634 AromaticContact CE1-CG 3.69Å; F607-F634 HydrophobicContact CE1-CG 3.69Å; F607-F634 HydrophobicContact CE1-CZ 4.06Å; F607-F634 HydrophobicContact CZ-CG 4.49Å; F607-I651 HydrophobicContact CE2-CG1 4.02Å; F607-I651 HydrophobicContact CE2-CG2 4.07Å; F607-I654 HydrophobicContact CD2-CG2 4.48Å
608	V	89.4	Confident	87.1	Confident	35 Å²	35	67.7 Å²	67.7	21%	0.212	37%	0.366	C	S	.	.	H	α-helix	trans	-69.5	-38.5	178.9	177.5	0	0	0	0	111	R604 G612 Y613 N614 L615 F634	R604-V608 HydrophobicContact CG-CG2 4.12Å; R604-V608 WeakPolarHBondContact O-CB 3.1Å; R604-V608 WeakPolarHBondContact O-CG2 3.22Å; R604-V608 PolarHBondContact O-N 3.04Å; V608-G612 CarbonylContact O-C 3.59Å; V608-G612 VanDerWaalsContact O-C 3.26Å; V608-G612 VanDerWaalsContact O-CA 3.26Å; V608-G612 WeakPolarHBondContact O-CA 3.5Å; V608-Y613 PolarHBondContact O-N 3.35Å; V608-N614 PolarHBondContact O-N 3.01Å; V608-L615 HydrophobicContact CB-CD1 4.49Å; V608-L615 HydrophobicContact CG1-CD1 4.15Å; V608-L615 HydrophobicContact CG2-CD1 4.26Å; V608-F634 HydrophobicContact CG2-CE1 4.42Å; V608-F634 HydrophobicContact CG2-CZ 4.14Å
609	G	88.8	Confident	87.3	Confident	11 Å²	11	63.4 Å²	63.4	11%	0.113	35%	0.346	C	S	.	.			trans	73.3	169.4	-175	0	0	0	0	0	112.9	A605 R606 G611 G612	A605-G609 WeakPolarHBondContact O-CA 3.34Å; A605-G609 PolarHBondContact O-N 3.24Å; R606-G609 PolarHBondContact O-N 3.38Å; G609-G611 PolarHBondContact O-N 3.27Å; G609-G611 VanDerWaalsContact O-N 3.14Å; G609-G612 PolarHBondContact O-N 3.03Å; G609-G612 VanDerWaalsContact O-N 3.1Å
610	P	88.8	Confident	87.5	Confident	113 Å²	113	67.6 Å²	67.6	73%	0.734	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-59.8	119.5	-178.8	24	-32.5	0	0	0	110.6	G612 Y613	P610-G612 PolarHBondContact O-N 2.97Å; P610-Y613 WeakPolarHBondContact O-CB 3.43Å; P610-Y613 PolarHBondContact O-N 2.89Å
611	G	86.8	Confident	87.8	Confident	74 Å²	74	70.7 Å²	70.7	76%	0.763	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	63.5	20	-179.1	0	0	0	0	0	115.3	G609	G609-G611 PolarHBondContact O-N 3.27Å; G609-G611 VanDerWaalsContact O-N 3.14Å
612	G	89.5	Confident	88.1	Confident	14 Å²	14	68 Å²	68	14%	0.144	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	80.7	16.4	-176.6	0	0	0	0	0	114.4	V608 G609 P610 N614 L615 R616	V608-G612 CarbonylContact O-C 3.59Å; V608-G612 VanDerWaalsContact O-C 3.26Å; V608-G612 VanDerWaalsContact O-CA 3.26Å; V608-G612 WeakPolarHBondContact O-CA 3.5Å; G609-G612 PolarHBondContact O-N 3.03Å; G609-G612 VanDerWaalsContact O-N 3.1Å; P610-G612 PolarHBondContact O-N 2.97Å; G612-N614 VanDerWaalsContact C-N 3.34Å; G612-N614 PolarHBondContact O-N 3.24Å; G612-L615 PolarHBondContact O-N 3.33Å; G612-R616 PolarHBondContact O-N 3.45Å; G612-R616 VanDerWaalsContact O-N 3.08Å
613	Y	91.8	Very high	88.4	Confident	134 Å²	134	65 Å²	65	53%	0.525	36%	0.36	S	S	.	.	H	α-helix	trans	-55.6	-43.8	-176.8	176.8	-98.4	0	0	0	113.4	V608 P610 R616 R617	V608-Y613 PolarHBondContact O-N 3.35Å; P610-Y613 WeakPolarHBondContact O-CB 3.43Å; P610-Y613 PolarHBondContact O-N 2.89Å; Y613-R616 PolarHBondContact O-N 3.45Å; Y613-R617 WeakPolarHBondContact O-CB 3.48Å; Y613-R617 PolarHBondContact O-N 2.91Å
614	N	91.3	Very high	89	Confident	26 Å²	26	61.4 Å²	61.4	14%	0.139	35%	0.347	C	S	.	.	H	α-helix	trans	-68.3	-38.4	-176.9	-73.9	-14.7	0	0	0	111.7	R606 F607 V608 G612 R617 L618 I654	R606-N614 PolarHBondContact O-ND2 3.03Å; F607-N614 VanDerWaalsContact O-CB 3.24Å; F607-N614 WeakPolarHBondContact O-CB 3.47Å; V608-N614 PolarHBondContact O-N 3.01Å; G612-N614 VanDerWaalsContact C-N 3.34Å; G612-N614 PolarHBondContact O-N 3.24Å; N614-R617 PolarHBondContact O-N 2.97Å; N614-L618 WeakPolarHBondContact O-CB 3.34Å; N614-L618 PolarHBondContact O-N 3.49Å; N614-I654 HydrophobicContact CB-CD1 4.02Å
615	L	90.4	Very high	89.3	Confident	29 Å²	29	59.1 Å²	59.1	15%	0.152	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-47.7	174.5	-60.7	-177.1	0	0	0	111.1	F607 V608 G612 R617 L618 Q619 I626	F607-L615 HydrophobicContact CD1-CD2 4.27Å; F607-L615 HydrophobicContact CE1-CD2 3.68Å; F607-L615 HydrophobicContact CE2-CD2 4.39Å; F607-L615 HydrophobicContact CZ-CD2 3.74Å; V608-L615 HydrophobicContact CB-CD1 4.49Å; V608-L615 HydrophobicContact CG1-CD1 4.15Å; V608-L615 HydrophobicContact CG2-CD1 4.26Å; G612-L615 PolarHBondContact O-N 3.33Å; L615-R617 VanDerWaalsContact C-N 3.3Å; L615-R617 PolarHBondContact O-N 3.25Å; L615-L618 WeakPolarHBondContact O-CB 3.36Å; L615-L618 PolarHBondContact O-N 2.9Å; L615-Q619 VanDerWaalsContact O-CG 3.25Å; L615-Q619 WeakPolarHBondContact O-CG 3.33Å; L615-Q619 PolarHBondContact O-N 3.03Å; L615-I626 HydrophobicContact CD2-CD1 4.36Å; L615-I626 HydrophobicContact CD2-CG2 4.13Å
616	R	90.4	Very high	89.4	Confident	174 Å²	174	55.8 Å²	55.8	66%	0.657	31%	0.311	S	S	*	.	H	α-helix	trans	-61.4	-39.2	177	-68.2	-179.3	-172.7	175	3.9	112.1	G612 Y613 A620	G612-R616 PolarHBondContact O-N 3.45Å; G612-R616 VanDerWaalsContact O-N 3.08Å; Y613-R616 PolarHBondContact O-N 3.45Å; R616-A620 VanDerWaalsContact O-CB 3.28Å; R616-A620 WeakPolarHBondContact O-CB 3.39Å; R616-A620 PolarHBondContact O-N 3.03Å
617	R	91.2	Very high	89.5	Confident	89 Å²	89	53.1 Å²	53.1	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-45.5	175.9	-167.7	177.9	82.7	-173.2	-1.7	111.2	Y613 N614 L615 A620 Q621 F650	Y613-R617 WeakPolarHBondContact O-CB 3.48Å; Y613-R617 PolarHBondContact O-N 2.91Å; N614-R617 PolarHBondContact O-N 2.97Å; L615-R617 VanDerWaalsContact C-N 3.3Å; L615-R617 PolarHBondContact O-N 3.25Å; R617-A620 PolarHBondContact O-N 3.06Å; R617-Q621 HydrophobicContact CG-CG 4.49Å; R617-Q621 WeakPolarHBondContact O-CB 3.31Å; R617-Q621 WeakPolarHBondContact O-CG 3.35Å; R617-Q621 PolarHBondContact O-N 3.39Å; R617-F650 HydrophobicContact CG-CZ 4.46Å; R617-F650 VanDerWaalsContact NE-CZ 3.3Å; R617-F650 VanDerWaalsContact NH2-CE2 3.31Å
618	L	90.4	Very high	89.5	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-50	176.7	179.8	48.2	0	0	0	111.4	N614 L615 A620 Q621 T622 V624 I626 A647 F650 I651	N614-L618 WeakPolarHBondContact O-CB 3.34Å; N614-L618 PolarHBondContact O-N 3.49Å; L615-L618 WeakPolarHBondContact O-CB 3.36Å; L615-L618 PolarHBondContact O-N 2.9Å; L618-A620 VanDerWaalsContact C-N 3.33Å; L618-A620 PolarHBondContact O-N 3.28Å; L618-Q621 PolarHBondContact O-N 3.43Å; L618-T622 HydrophobicContact CD1-CG2 3.81Å; L618-T622 PolarHBondContact O-N 3.49Å; L618-T622 PolarHBondContact O-OG1 3.26Å; L618-V624 HydrophobicContact CD1-CG2 4.36Å; L618-V624 HydrophobicContact CG-CG2 4.04Å; L618-I626 HydrophobicContact CD2-CD1 3.31Å; L618-I626 HydrophobicContact CG-CD1 4.06Å; L618-A647 HydrophobicContact CD1-CB 4.05Å; L618-F650 HydrophobicContact CB-CD1 4.06Å; L618-F650 HydrophobicContact CB-CE1 3.68Å; L618-F650 HydrophobicContact CB-CZ 4.3Å; L618-F650 HydrophobicContact CD1-CB 3.94Å; L618-F650 HydrophobicContact CD1-CD1 3.54Å; L618-F650 HydrophobicContact CD1-CE1 4.04Å; L618-F650 HydrophobicContact CD1-CG 3.82Å; L618-F650 HydrophobicContact CD2-CD1 3.9Å; L618-F650 HydrophobicContact CD2-CE1 4.18Å; L618-F650 HydrophobicContact CG-CD1 4.05Å; L618-F650 HydrophobicContact CG-CE1 4.19Å; L618-I651 HydrophobicContact CD2-CD1 4.23Å; L618-I651 HydrophobicContact CD2-CG1 3.78Å
619	Q	90.8	Very high	89.3	Confident	61 Å²	61	60 Å²	60	29%	0.285	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-43.7	176.8	-66.1	176.1	-57.2	0	0	111.7	L615 G623 V624	L615-Q619 VanDerWaalsContact O-CG 3.25Å; L615-Q619 WeakPolarHBondContact O-CG 3.33Å; L615-Q619 PolarHBondContact O-N 3.03Å; Q619-G623 WeakPolarHBondContact O-CA 3.46Å; Q619-G623 PolarHBondContact O-N 3.39Å; Q619-V624 WeakPolarHBondContact CA-O 3.11Å; Q619-V624 WeakPolarHBondContact CB-O 3.17Å; Q619-V624 VanDerWaalsContact CG-O 3.26Å; Q619-V624 WeakPolarHBondContact CG-O 3.49Å
620	A	90.2	Very high	89.1	Confident	89 Å²	89	63.2 Å²	63.2	74%	0.736	36%	0.358	S	S	*	.	H	α-helix	trans	-70.3	-32.9	-179	0	0	0	0	0	113.9	R616 R617 L618	R616-A620 VanDerWaalsContact O-CB 3.28Å; R616-A620 WeakPolarHBondContact O-CB 3.39Å; R616-A620 PolarHBondContact O-N 3.03Å; R617-A620 PolarHBondContact O-N 3.06Å; L618-A620 VanDerWaalsContact C-N 3.33Å; L618-A620 PolarHBondContact O-N 3.28Å
621	Q	90.2	Very high	88.8	Confident	123 Å²	123	64 Å²	64	58%	0.575	35%	0.352	S	S	*	.	H	α-helix	trans	-83.6	-39.6	-178.2	-73.7	-179.5	-34.9	0	0	113	R617 L618 F650	R617-Q621 HydrophobicContact CG-CG 4.49Å; R617-Q621 WeakPolarHBondContact O-CB 3.31Å; R617-Q621 WeakPolarHBondContact O-CG 3.35Å; R617-Q621 PolarHBondContact O-N 3.39Å; L618-Q621 PolarHBondContact O-N 3.43Å; Q621-F650 VanDerWaalsContact OE1-CE2 3.3Å
622	T	89.1	Confident	88.7	Confident	18 Å²	18	64.7 Å²	64.7	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-105.7	-14.6	-172.4	62.5	0	0	0	0	113.3	L618 V624 A643 E646 A647	L618-T622 HydrophobicContact CD1-CG2 3.81Å; L618-T622 PolarHBondContact O-N 3.49Å; L618-T622 PolarHBondContact O-OG1 3.26Å; T622-V624 PolarHBondContact O-N 3.45Å; T622-V624 WeakPolarHBondContact OG1-CG2 3.42Å; T622-V624 PolarHBondContact OG1-N 3.18Å; T622-A643 WeakPolarHBondContact O-CB 3.34Å; T622-E646 HydrophobicContact CG2-CB 3.92Å; T622-A647 HydrophobicContact CG2-CB 4.48Å
623	G	86.8	Confident	88.7	Confident	44 Å²	44	64.7 Å²	64.7	45%	0.454	33%	0.332	S	S	.	.			trans	72.6	7.8	-175	0	0	0	0	0	114.5	Q619	Q619-G623 WeakPolarHBondContact O-CA 3.46Å; Q619-G623 PolarHBondContact O-N 3.39Å
624	V	91.3	Very high	88.5	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	31%	0.308	C	S	.	.			trans	-74.1	160.1	174.2	-55.2	0	0	0	0	111.3	L618 Q619 T622 I626 V636 F637 A638 A643 A647	L618-V624 HydrophobicContact CD1-CG2 4.36Å; L618-V624 HydrophobicContact CG-CG2 4.04Å; Q619-V624 WeakPolarHBondContact CA-O 3.11Å; Q619-V624 WeakPolarHBondContact CB-O 3.17Å; Q619-V624 VanDerWaalsContact CG-O 3.26Å; Q619-V624 WeakPolarHBondContact CG-O 3.49Å; T622-V624 PolarHBondContact O-N 3.45Å; T622-V624 WeakPolarHBondContact OG1-CG2 3.42Å; T622-V624 PolarHBondContact OG1-N 3.18Å; V624-I626 HydrophobicContact CG2-CD1 4.42Å; V624-I626 HydrophobicContact CG2-CG1 4.23Å; V624-V636 HydrophobicContact CB-CG1 4.18Å; V624-V636 HydrophobicContact CG2-CG1 4.26Å; V624-F637 CarbonylContact C-O 3.55Å; V624-F637 VanDerWaalsContact CA-O 3.23Å; V624-F637 WeakPolarHBondContact CA-O 3.2Å; V624-F637 VanDerWaalsContact CB-O 3.24Å; V624-F637 WeakPolarHBondContact CB-O 3.39Å; V624-A638 HydrophobicContact CG1-CB 3.67Å; V624-A643 HydrophobicContact CG1-CB 4.32Å; V624-A647 HydrophobicContact CB-CB 4.39Å; V624-A647 HydrophobicContact CG1-CB 3.66Å; V624-A647 HydrophobicContact CG2-CB 4.03Å
625	T	89.6	Confident	88.4	Confident	24 Å²	24	58.2 Å²	58.2	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.4	171.5	-59.3	0	0	0	0	108.9	E389 F637	E389-T625 HydrophobicContact CB-CG2 4.35Å; E389-T625 HydrophobicContact CG-CG2 4.26Å; E389-T625 WeakPolarHBondContact OE2-CG2 3.14Å; T625-F637 PolarHBondContact N-O 3.44Å; T625-F637 PolarHBondContact O-N 3.01Å
626	I	88.9	Confident	88.4	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.067	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.3	-179.7	-66.6	-175.2	0	0	0	109.3	F607 L615 L618 V624 F634 S635 V636 I651	F607-I626 HydrophobicContact CZ-CD1 4.42Å; L615-I626 HydrophobicContact CD2-CD1 4.36Å; L615-I626 HydrophobicContact CD2-CG2 4.13Å; L618-I626 HydrophobicContact CD2-CD1 3.31Å; L618-I626 HydrophobicContact CG-CD1 4.06Å; V624-I626 HydrophobicContact CG2-CD1 4.42Å; V624-I626 HydrophobicContact CG2-CG1 4.23Å; I626-F634 HydrophobicContact CG2-CB 4.21Å; I626-F634 HydrophobicContact CG2-CD1 3.95Å; I626-S635 WeakPolarHBondContact CA-O 3.37Å; I626-V636 HydrophobicContact CD1-CG1 4.39Å; I626-V636 HydrophobicContact CD1-CG2 4.06Å; I626-V636 HydrophobicContact CG1-CB 4.35Å; I626-V636 HydrophobicContact CG1-CG1 4.05Å; I626-V636 HydrophobicContact CG1-CG2 4Å; I626-I651 HydrophobicContact CD1-CD1 4.45Å
627	S	86.8	Confident	88.5	Confident	39 Å²	39	49 Å²	49	27%	0.273	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.4	175.2	58.1	0	0	0	0	109.9	E389 F634 S635	E389-S627 VanDerWaalsContact OE1-CB 3.32Å; E389-S627 WeakPolarHBondContact OE1-CB 3.5Å; S627-F634 CarbonylContact O-C 3.51Å; S627-F634 WeakPolarHBondContact O-CA 3.42Å; S627-S635 PolarHBondContact N-O 2.97Å; S627-S635 PolarHBondContact O-N 2.94Å; S627-S635 PolarHBondContact OG-O 2.92Å
628	Q	86.8	Confident	88.5	Confident	90 Å²	90	44.8 Å²	44.8	42%	0.421	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124	173.9	-171.7	178.5	-8.1	0	0	109.1	R604 D630 F634	R604-Q628 VanDerWaalsContact NH2-CD 3.3Å; Q628-D630 WeakPolarHBondContact CG-O 3.31Å; Q628-D630 PolarHBondContact NE2-O 3.06Å; Q628-F634 HydrophobicContact CB-CD1 3.94Å; Q628-F634 HydrophobicContact CB-CE1 3.69Å; Q628-F634 HydrophobicContact CB-CZ 4.43Å; Q628-F634 HydrophobicContact CG-CD1 4.13Å; Q628-F634 HydrophobicContact CG-CE1 3.69Å; Q628-F634 HydrophobicContact CG-CZ 3.94Å
629	V	85.1	Confident	88.2	Confident	92 Å²	92	46.7 Å²	46.7	56%	0.558	27%	0.268	S	S	*	.			trans	-94	-48.5	179.6	-178.6	0	0	0	0	110.5	T633	V629-T633 HydrophobicContact CB-CG2 4.4Å; V629-T633 PolarHBondContact N-O 3.49Å
630	D	85.4	Confident	88	Confident	79 Å²	79	46.7 Å²	46.7	42%	0.422	27%	0.273	S	S	.	.	S	Bend	trans	-141.9	-170	175.8	66.6	47.8	0	0	0	110.2	Q628 E632 T633	Q628-D630 WeakPolarHBondContact CG-O 3.31Å; Q628-D630 PolarHBondContact NE2-O 3.06Å; D630-E632 VanDerWaalsContact C-N 3.26Å; D630-E632 PolarHBondContact O-N 2.88Å; D630-E632 PolarHBondContact OD1-N 3.01Å; D630-T633 VanDerWaalsContact CG-CB 3.43Å; D630-T633 VanDerWaalsContact CG-OG1 3.28Å; D630-T633 PolarHBondContact N-O 3Å; D630-T633 WeakPolarHBondContact OD1-CA 3.27Å; D630-T633 VanDerWaalsContact OD1-CB 3.26Å; D630-T633 WeakPolarHBondContact OD1-CB 3.27Å; D630-T633 PolarHBondContact OD1-N 3.11Å; D630-T633 PolarHBondContact OD1-OG1 3.37Å; D630-T633 VanDerWaalsContact OD1-OG1 3.08Å; D630-T633 WeakPolarHBondContact OD2-CB 3.15Å; D630-T633 PolarHBondContact OD2-OG1 3.43Å
631	E	81.7	Confident	87.8	Confident	129 Å²	129	44.9 Å²	44.9	60%	0.603	25%	0.253	S	S	*	.	S	Bend	trans	-63.3	-28.2	-177.3	-67.6	-155.3	154.2	0	0	114.7	R604	R604-E631 WeakPolarHBondContact CD-O 3.2Å
632	E	85.9	Confident	87.7	Confident	88 Å²	88	40.9 Å²	40.9	41%	0.411	25%	0.245	S	C	.	.	S	Bend	trans	-116.8	-16.1	-175.9	-61.9	-168.2	141	0	0	112.7	Q598 V599 V601 D630	Q598-E632 CarbonylContact C-O 3.52Å; Q598-E632 WeakPolarHBondContact CA-O 3.5Å; V599-E632 PolarHBondContact N-O 3.49Å; V599-E632 WeakPolarHBondContact O-CA 3.39Å; V601-E632 HydrophobicContact CG2-CG 3.72Å; V601-E632 WeakPolarHBondContact CG2-OE1 3.45Å; D630-E632 VanDerWaalsContact C-N 3.26Å; D630-E632 PolarHBondContact O-N 2.88Å; D630-E632 PolarHBondContact OD1-N 3.01Å
633	T	87.9	Confident	87.7	Confident	15 Å²	15	40.4 Å²	40.4	9%	0.092	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.1	-173.6	-51	0	0	0	0	111.1	N596 V629 D630	N596-T633 HydrophobicContact CB-CG2 3.95Å; V629-T633 HydrophobicContact CB-CG2 4.4Å; V629-T633 PolarHBondContact N-O 3.49Å; D630-T633 VanDerWaalsContact CG-CB 3.43Å; D630-T633 VanDerWaalsContact CG-OG1 3.28Å; D630-T633 PolarHBondContact N-O 3Å; D630-T633 WeakPolarHBondContact OD1-CA 3.27Å; D630-T633 VanDerWaalsContact OD1-CB 3.26Å; D630-T633 WeakPolarHBondContact OD1-CB 3.27Å; D630-T633 PolarHBondContact OD1-N 3.11Å; D630-T633 PolarHBondContact OD1-OG1 3.37Å; D630-T633 VanDerWaalsContact OD1-OG1 3.08Å; D630-T633 WeakPolarHBondContact OD2-CB 3.15Å; D630-T633 PolarHBondContact OD2-OG1 3.43Å
634	F	88.8	Confident	88	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.9	172.5	-69.6	-95.6	0	0	0	109.6	N596 V597 V599 R604 F607 V608 I626 S627 Q628	N596-F634 CarbonylContact C-O 3.6Å; N596-F634 WeakPolarHBondContact CA-O 3.32Å; V597-F634 PolarHBondContact N-O 3.18Å; V597-F634 PolarHBondContact O-N 3.39Å; V599-F634 HydrophobicContact CB-CD2 4.09Å; V599-F634 HydrophobicContact CB-CE2 4.14Å; V599-F634 HydrophobicContact CG2-CD2 3.93Å; V599-F634 HydrophobicContact CG2-CE2 4.37Å; R604-F634 HydrophobicContact CG-CE2 4.43Å; R604-F634 HydrophobicContact CG-CZ 4.22Å; F607-F634 HydrophobicContact CD1-CD2 4.19Å; F607-F634 HydrophobicContact CD1-CE1 4.34Å; F607-F634 AromaticContact CD1-CE2 3.97Å; F607-F634 HydrophobicContact CD1-CE2 3.97Å; F607-F634 HydrophobicContact CD1-CG 4.49Å; F607-F634 HydrophobicContact CD1-CZ 4.04Å; F607-F634 HydrophobicContact CE1-CB 4.33Å; F607-F634 AromaticContact CE1-CD1 3.79Å; F607-F634 HydrophobicContact CE1-CD1 3.79Å; F607-F634 AromaticContact CE1-CD2 3.79Å; F607-F634 HydrophobicContact CE1-CD2 3.79Å; F607-F634 AromaticContact CE1-CE1 3.96Å; F607-F634 HydrophobicContact CE1-CE1 3.96Å; F607-F634 AromaticContact CE1-CE2 3.98Å; F607-F634 HydrophobicContact CE1-CE2 3.98Å; F607-F634 AromaticContact CE1-CG 3.69Å; F607-F634 HydrophobicContact CE1-CG 3.69Å; F607-F634 HydrophobicContact CE1-CZ 4.06Å; F607-F634 HydrophobicContact CZ-CG 4.49Å; V608-F634 HydrophobicContact CG2-CE1 4.42Å; V608-F634 HydrophobicContact CG2-CZ 4.14Å; I626-F634 HydrophobicContact CG2-CB 4.21Å; I626-F634 HydrophobicContact CG2-CD1 3.95Å; S627-F634 CarbonylContact O-C 3.51Å; S627-F634 WeakPolarHBondContact O-CA 3.42Å; Q628-F634 HydrophobicContact CB-CD1 3.94Å; Q628-F634 HydrophobicContact CB-CE1 3.69Å; Q628-F634 HydrophobicContact CB-CZ 4.43Å; Q628-F634 HydrophobicContact CG-CD1 4.13Å; Q628-F634 HydrophobicContact CG-CE1 3.69Å; Q628-F634 HydrophobicContact CG-CZ 3.94Å
635	S	89.6	Confident	87.9	Confident	21 Å²	21	42.9 Å²	42.9	15%	0.147	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.4	173.7	172.1	0	0	0	0	109	N596 I626 S627	N596-S635 WeakPolarHBondContact OD1-CB 3.44Å; I626-S635 WeakPolarHBondContact CA-O 3.37Å; S627-S635 PolarHBondContact N-O 2.97Å; S627-S635 PolarHBondContact O-N 2.94Å; S627-S635 PolarHBondContact OG-O 2.92Å
636	V	90.4	Very high	88.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118	176.4	-172.5	0	0	0	0	108.1	V594 E595 V597 V624 I626 M644 I651	V594-V636 VanDerWaalsContact CA-O 3.31Å; V594-V636 WeakPolarHBondContact CA-O 3.49Å; E595-V636 PolarHBondContact N-O 3.09Å; E595-V636 PolarHBondContact O-N 3.27Å; V597-V636 HydrophobicContact CB-CG2 4.39Å; V597-V636 HydrophobicContact CG2-CG2 3.67Å; V624-V636 HydrophobicContact CB-CG1 4.18Å; V624-V636 HydrophobicContact CG2-CG1 4.26Å; I626-V636 HydrophobicContact CD1-CG1 4.39Å; I626-V636 HydrophobicContact CD1-CG2 4.06Å; I626-V636 HydrophobicContact CG1-CB 4.35Å; I626-V636 HydrophobicContact CG1-CG1 4.05Å; I626-V636 HydrophobicContact CG1-CG2 4Å; V636-M644 HydrophobicContact CB-CE 4.15Å; V636-M644 HydrophobicContact CB-SD 4.33Å; V636-M644 HydrophobicContact CG1-CE 3.98Å; V636-M644 HydrophobicContact CG1-SD 3.88Å; V636-M644 WeakPolarHBondContact O-CE 3.48Å; V636-I651 HydrophobicContact CG2-CD1 4.05Å
637	F	92.1	Very high	88.1	Confident	10 Å²	10	46.5 Å²	46.5	4%	0.044	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.2	168.5	168.2	-88.3	0	0	0	108.5	S387 F454 P592 V594 V624 T625	S387-F637 VanDerWaalsContact N-CZ 3.3Å; F454-F637 AromaticContact CD1-CD2 3.9Å; F454-F637 HydrophobicContact CD1-CD2 3.9Å; F454-F637 AromaticContact CD1-CE2 3.49Å; F454-F637 HydrophobicContact CD1-CE2 3.49Å; F454-F637 VanDerWaalsContact CD1-CE2 3.49Å; F454-F637 AromaticContact CE1-CD2 3.73Å; F454-F637 HydrophobicContact CE1-CD2 3.73Å; F454-F637 AromaticContact CE1-CE2 3.54Å; F454-F637 HydrophobicContact CE1-CE2 3.54Å; P592-F637 HydrophobicContact CB-CD2 4.37Å; P592-F637 HydrophobicContact CB-CE2 3.42Å; P592-F637 VanDerWaalsContact CB-CE2 3.42Å; P592-F637 HydrophobicContact CB-CZ 3.52Å; P592-F637 HydrophobicContact CG-CE2 3.93Å; P592-F637 HydrophobicContact CG-CZ 4.16Å; V594-F637 HydrophobicContact CG2-CB 4.21Å; V594-F637 HydrophobicContact CG2-CD2 3.77Å; V594-F637 HydrophobicContact CG2-CG 4.48Å; V624-F637 CarbonylContact C-O 3.55Å; V624-F637 VanDerWaalsContact CA-O 3.23Å; V624-F637 WeakPolarHBondContact CA-O 3.2Å; V624-F637 VanDerWaalsContact CB-O 3.24Å; V624-F637 WeakPolarHBondContact CB-O 3.39Å; T625-F637 PolarHBondContact N-O 3.44Å; T625-F637 PolarHBondContact O-N 3.01Å
638	A	89.9	Confident	88.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.3	172.3	0	0	0	0	0	110.9	P592 V593 V624 T640 A643 M644	P592-A638 CarbonylContact C-O 3.48Å; P592-A638 WeakPolarHBondContact CA-O 3.34Å; P592-A638 WeakPolarHBondContact CB-O 3.47Å; V593-A638 HydrophobicContact CG2-CB 3.95Å; V593-A638 PolarHBondContact N-O 3.22Å; V593-A638 PolarHBondContact O-N 2.82Å; V624-A638 HydrophobicContact CG1-CB 3.67Å; A638-T640 PolarHBondContact O-N 3.33Å; A638-A643 HydrophobicContact CB-CB 4.26Å; A638-M644 HydrophobicContact CB-CB 3.62Å; A638-M644 HydrophobicContact CB-CE 3.76Å; A638-M644 HydrophobicContact CB-CG 4.41Å; A638-M644 HydrophobicContact CB-SD 4.2Å
639	P	84.7	Confident	88.4	Confident	41 Å²	41	47.1 Å²	47.1	27%	0.266	26%	0.262	S	S	.	.	S	Bend	trans	-67	-25.8	-179	26.5	-34.1	0	0	0	112.8	P592 A643	P592-P639 WeakPolarHBondContact CA-O 3.13Å; P639-A643 HydrophobicContact CG-CB 4.19Å
640	T	86.2	Confident	88.6	Confident	62 Å²	62	43.6 Å²	43.6	38%	0.38	24%	0.239	S	C	.	.	S	Bend	trans	-140.9	158.7	175.7	65.5	0	0	0	0	110.5	A638 G642 A643 M644	A638-T640 PolarHBondContact O-N 3.33Å; T640-G642 PolarHBondContact O-N 2.85Å; T640-A643 PolarHBondContact O-N 3.47Å; T640-A643 PolarHBondContact OG1-N 3.02Å; T640-M644 PolarHBondContact O-N 3.32Å; T640-M644 VanDerWaalsContact O-N 3.15Å
641	P	86.9	Confident	88.7	Confident	51 Å²	51	40.4 Å²	40.4	33%	0.331	22%	0.222	S	C	.	.	H	α-helix	trans	-59.4	-32.7	173.9	-25.1	34.9	0	0	0	113.6	E589 V593 M644 N645	E589-P641 WeakPolarHBondContact O-CG 3.4Å; V593-P641 HydrophobicContact CG1-CG 4.45Å; P641-M644 WeakPolarHBondContact O-CB 3.22Å; P641-M644 PolarHBondContact O-N 3.25Å; P641-N645 PolarHBondContact O-N 3.02Å; P641-N645 VanDerWaalsContact O-N 3.1Å
642	G	87.9	Confident	88.9	Confident	38 Å²	38	39.9 Å²	39.9	39%	0.392	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-47	175.2	0	0	0	0	0	112.1	T640 M644 N645 E646	T640-G642 PolarHBondContact O-N 2.85Å; G642-M644 VanDerWaalsContact C-N 3.26Å; G642-M644 PolarHBondContact O-N 3.45Å; G642-N645 PolarHBondContact O-N 3.5Å; G642-E646 PolarHBondContact O-N 2.9Å; G642-E646 VanDerWaalsContact O-N 3.14Å
643	A	89.3	Confident	88.9	Confident	9 Å²	9	42.1 Å²	42.1	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-32.9	175.4	0	0	0	0	0	112.5	T622 V624 A638 P639 T640 A647	T622-A643 WeakPolarHBondContact O-CB 3.34Å; V624-A643 HydrophobicContact CG1-CB 4.32Å; A638-A643 HydrophobicContact CB-CB 4.26Å; P639-A643 HydrophobicContact CG-CB 4.19Å; T640-A643 PolarHBondContact O-N 3.47Å; T640-A643 PolarHBondContact OG1-N 3.02Å; A643-A647 WeakPolarHBondContact O-CB 3.45Å; A643-A647 PolarHBondContact O-N 3.01Å
644	M	92.4	Very high	88.7	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-43.6	174.7	-173.4	55.9	85.3	0	0	111.9	V593 E595 V636 A638 T640 P641 G642 A647 Q648	V593-M644 HydrophobicContact CB-CE 4.43Å; V593-M644 HydrophobicContact CG2-CB 3.53Å; V593-M644 HydrophobicContact CG2-CE 3.71Å; V593-M644 HydrophobicContact CG2-CG 3.84Å; E595-M644 HydrophobicContact CB-CE 3.91Å; E595-M644 HydrophobicContact CB-SD 4.4Å; E595-M644 HydrophobicContact CG-CE 4Å; V636-M644 HydrophobicContact CB-CE 4.15Å; V636-M644 HydrophobicContact CB-SD 4.33Å; V636-M644 HydrophobicContact CG1-CE 3.98Å; V636-M644 HydrophobicContact CG1-SD 3.88Å; V636-M644 WeakPolarHBondContact O-CE 3.48Å; A638-M644 HydrophobicContact CB-CB 3.62Å; A638-M644 HydrophobicContact CB-CE 3.76Å; A638-M644 HydrophobicContact CB-CG 4.41Å; A638-M644 HydrophobicContact CB-SD 4.2Å; T640-M644 PolarHBondContact O-N 3.32Å; T640-M644 VanDerWaalsContact O-N 3.15Å; P641-M644 WeakPolarHBondContact O-CB 3.22Å; P641-M644 PolarHBondContact O-N 3.25Å; G642-M644 VanDerWaalsContact C-N 3.26Å; G642-M644 PolarHBondContact O-N 3.45Å; M644-A647 PolarHBondContact O-N 3.12Å; M644-Q648 HydrophobicContact CG-CG 4.41Å; M644-Q648 WeakPolarHBondContact O-CG 3.36Å; M644-Q648 PolarHBondContact O-N 2.64Å; M644-Q648 HydrophobicContact SD-CG 4.41Å
645	N	90.6	Very high	88.1	Confident	93 Å²	93	43.6 Å²	43.6	50%	0.497	24%	0.237	S	C	.	.	H	α-helix	trans	-62.2	-45.8	178.6	-71	-24.9	0	0	0	111.5	P641 G642 A647 Q648 D649	P641-N645 PolarHBondContact O-N 3.02Å; P641-N645 VanDerWaalsContact O-N 3.1Å; G642-N645 PolarHBondContact O-N 3.5Å; N645-A647 VanDerWaalsContact C-N 3.29Å; N645-A647 PolarHBondContact O-N 2.77Å; N645-Q648 PolarHBondContact O-N 2.87Å; N645-D649 PolarHBondContact O-N 3.22Å
646	E	91.8	Very high	87.3	Confident	114 Å²	114	49.5 Å²	49.5	53%	0.533	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-42.6	175	-68.4	176.8	-170.3	0	0	111.6	T622 G642 D649 F650	T622-E646 HydrophobicContact CG2-CB 3.92Å; G642-E646 PolarHBondContact O-N 2.9Å; G642-E646 VanDerWaalsContact O-N 3.14Å; E646-D649 PolarHBondContact O-N 2.65Å; E646-F650 WeakPolarHBondContact O-CB 3.36Å; E646-F650 PolarHBondContact O-N 2.91Å
647	A	90.8	Very high	85.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-46	177.1	0	0	0	0	0	111.8	L618 T622 V624 A643 M644 N645 D649 F650 I651	L618-A647 HydrophobicContact CD1-CB 4.05Å; T622-A647 HydrophobicContact CG2-CB 4.48Å; V624-A647 HydrophobicContact CB-CB 4.39Å; V624-A647 HydrophobicContact CG1-CB 3.66Å; V624-A647 HydrophobicContact CG2-CB 4.03Å; A643-A647 WeakPolarHBondContact O-CB 3.45Å; A643-A647 PolarHBondContact O-N 3.01Å; M644-A647 PolarHBondContact O-N 3.12Å; N645-A647 VanDerWaalsContact C-N 3.29Å; N645-A647 PolarHBondContact O-N 2.77Å; A647-D649 VanDerWaalsContact C-N 3.29Å; A647-D649 PolarHBondContact O-N 3.04Å; A647-F650 PolarHBondContact O-N 3.01Å; A647-I651 WeakPolarHBondContact O-CB 3.38Å; A647-I651 WeakPolarHBondContact O-CG1 3.5Å; A647-I651 PolarHBondContact O-N 3.12Å
648	Q	89.8	Confident	84	Confident	48 Å²	48	59.3 Å²	59.3	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-41.9	175.9	-76.1	-174.3	4.5	0	0	111.9	E595 M644 N645 I651 K652	E595-Q648 PolarHBondContact OE2-NE2 3.44Å; M644-Q648 HydrophobicContact CG-CG 4.41Å; M644-Q648 WeakPolarHBondContact O-CG 3.36Å; M644-Q648 PolarHBondContact O-N 2.64Å; M644-Q648 HydrophobicContact SD-CG 4.41Å; N645-Q648 PolarHBondContact O-N 2.87Å; Q648-I651 PolarHBondContact O-N 3.43Å; Q648-K652 WeakPolarHBondContact O-CB 3.5Å; Q648-K652 WeakPolarHBondContact O-CG 3.31Å; Q648-K652 PolarHBondContact O-N 3.34Å
649	D	90.1	Very high	82.3	Confident	93 Å²	93	65.8 Å²	65.8	50%	0.497	34%	0.344	S	S	.	.	H	α-helix	trans	-68.1	-40.3	-179.4	-71.6	-15.4	0	0	0	111.6	N645 E646 A647 K652 E653	N645-D649 PolarHBondContact O-N 3.22Å; E646-D649 PolarHBondContact O-N 2.65Å; A647-D649 VanDerWaalsContact C-N 3.29Å; A647-D649 PolarHBondContact O-N 3.04Å; D649-K652 PolarHBondContact O-N 2.83Å; D649-K652 IonicContact OD1-NZ 3.42Å; D649-K652 PolarHBondContact OD1-NZ 3.38Å; D649-K652 VanDerWaalsContact OD1-NZ 3.16Å; D649-E653 WeakPolarHBondContact O-CB 3.49Å; D649-E653 PolarHBondContact O-N 2.86Å
650	F	88.5	Confident	80.8	Confident	19 Å²	19	68 Å²	68	8%	0.083	35%	0.35	C	S	.	.	H	α-helix	trans	-63.8	-41.7	172.1	-174.9	-84	0	0	0	112.3	R617 L618 Q621 E646 A647 E653 I654	R617-F650 HydrophobicContact CG-CZ 4.46Å; R617-F650 VanDerWaalsContact NE-CZ 3.3Å; R617-F650 VanDerWaalsContact NH2-CE2 3.31Å; L618-F650 HydrophobicContact CB-CD1 4.06Å; L618-F650 HydrophobicContact CB-CE1 3.68Å; L618-F650 HydrophobicContact CB-CZ 4.3Å; L618-F650 HydrophobicContact CD1-CB 3.94Å; L618-F650 HydrophobicContact CD1-CD1 3.54Å; L618-F650 HydrophobicContact CD1-CE1 4.04Å; L618-F650 HydrophobicContact CD1-CG 3.82Å; L618-F650 HydrophobicContact CD2-CD1 3.9Å; L618-F650 HydrophobicContact CD2-CE1 4.18Å; L618-F650 HydrophobicContact CG-CD1 4.05Å; L618-F650 HydrophobicContact CG-CE1 4.19Å; Q621-F650 VanDerWaalsContact OE1-CE2 3.3Å; E646-F650 WeakPolarHBondContact O-CB 3.36Å; E646-F650 PolarHBondContact O-N 2.91Å; A647-F650 PolarHBondContact O-N 3.01Å; F650-E653 PolarHBondContact O-N 3.14Å; F650-I654 HydrophobicContact CD1-CD1 3.67Å; F650-I654 HydrophobicContact CD1-CG1 4.26Å; F650-I654 HydrophobicContact CE1-CD1 3.11Å; F650-I654 HydrophobicContact CE1-CG1 4.09Å; F650-I654 HydrophobicContact CZ-CD1 3.71Å; F650-I654 WeakPolarHBondContact O-CG1 3.44Å; F650-I654 PolarHBondContact O-N 2.81Å
651	I	87.2	Confident	79.3	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-45.5	175.8	-67.5	170.7	0	0	0	110	V597 F607 L618 I626 V636 A647 Q648 E653 I654 C655	V597-I651 HydrophobicContact CG1-CG2 4Å; V597-I651 HydrophobicContact CG2-CD1 4.17Å; F607-I651 HydrophobicContact CE2-CG1 4.02Å; F607-I651 HydrophobicContact CE2-CG2 4.07Å; L618-I651 HydrophobicContact CD2-CD1 4.23Å; L618-I651 HydrophobicContact CD2-CG1 3.78Å; I626-I651 HydrophobicContact CD1-CD1 4.45Å; V636-I651 HydrophobicContact CG2-CD1 4.05Å; A647-I651 WeakPolarHBondContact O-CB 3.38Å; A647-I651 WeakPolarHBondContact O-CG1 3.5Å; A647-I651 PolarHBondContact O-N 3.12Å; Q648-I651 PolarHBondContact O-N 3.43Å; I651-E653 VanDerWaalsContact C-N 3.29Å; I651-E653 PolarHBondContact O-N 3.19Å; I651-I654 PolarHBondContact O-N 3.35Å; I651-C655 WeakPolarHBondContact O-CB 3.46Å; I651-C655 PolarHBondContact O-N 2.89Å; I651-C655 PolarHBondContact O-SG 3.02Å
652	K	86.3	Confident	78	Confident	117 Å²	117	76.8 Å²	76.8	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-60.9	-38.5	176.2	-74.6	167.2	-161.4	155.7	0	111.1	Q648 D649 C655 K656	Q648-K652 WeakPolarHBondContact O-CB 3.5Å; Q648-K652 WeakPolarHBondContact O-CG 3.31Å; Q648-K652 PolarHBondContact O-N 3.34Å; D649-K652 PolarHBondContact O-N 2.83Å; D649-K652 IonicContact OD1-NZ 3.42Å; D649-K652 PolarHBondContact OD1-NZ 3.38Å; D649-K652 VanDerWaalsContact OD1-NZ 3.16Å; K652-C655 CarbonylContact O-C 3.5Å; K652-C655 PolarHBondContact O-N 3.28Å; K652-K656 VanDerWaalsContact O-CA 3.29Å; K652-K656 WeakPolarHBondContact O-CA 3.31Å; K652-K656 VanDerWaalsContact O-CB 3.29Å; K652-K656 WeakPolarHBondContact O-CB 3.19Å; K652-K656 PolarHBondContact O-N 3.19Å
653	E	85.9	Confident	77.1	Confident	136 Å²	136	76 Å²	76	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-65.9	-47.5	176.5	-170.4	-176.8	175.9	0	0	111.7	D649 F650 I651 C655 K656	D649-E653 WeakPolarHBondContact O-CB 3.49Å; D649-E653 PolarHBondContact O-N 2.86Å; F650-E653 PolarHBondContact O-N 3.14Å; I651-E653 VanDerWaalsContact C-N 3.29Å; I651-E653 PolarHBondContact O-N 3.19Å; E653-C655 VanDerWaalsContact C-N 3.29Å; E653-C655 PolarHBondContact O-N 3.46Å; E653-K656 WeakPolarHBondContact O-CB 3.23Å; E653-K656 PolarHBondContact O-N 3.32Å; E653-K656 VanDerWaalsContact O-N 3.15Å
654	I	82.8	Confident	76.4	Confident	22 Å²	22	82.3 Å²	82.3	11%	0.113	40%	0.397	C	S	.	.	H	α-helix	trans	-67.2	-32.5	176.9	-69.4	-175.4	0	0	0	111.8	R606 F607 N614 F650 I651 K656	R606-I654 PolarHBondContact NE-O 3.17Å; R606-I654 PolarHBondContact NH2-O 3Å; F607-I654 HydrophobicContact CD2-CG2 4.48Å; N614-I654 HydrophobicContact CB-CD1 4.02Å; F650-I654 HydrophobicContact CD1-CD1 3.67Å; F650-I654 HydrophobicContact CD1-CG1 4.26Å; F650-I654 HydrophobicContact CE1-CD1 3.11Å; F650-I654 HydrophobicContact CE1-CG1 4.09Å; F650-I654 HydrophobicContact CZ-CD1 3.71Å; F650-I654 WeakPolarHBondContact O-CG1 3.44Å; F650-I654 PolarHBondContact O-N 2.81Å; I651-I654 PolarHBondContact O-N 3.35Å; I654-K656 VanDerWaalsContact C-N 3.32Å
655	C	77.5	Confident	75.8	Confident	26 Å²	26	89.3 Å²	89.3	18%	0.176	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-1.2	177.1	-62.2	0	0	0	0	112.5	R603 R606 I651 K652 E653 D657	R603-C655 PolarHBondContact NH1-O 3.07Å; R606-C655 VanDerWaalsContact NH2-C 3.29Å; R606-C655 PolarHBondContact NH2-O 2.87Å; I651-C655 WeakPolarHBondContact O-CB 3.46Å; I651-C655 PolarHBondContact O-N 2.89Å; I651-C655 PolarHBondContact O-SG 3.02Å; K652-C655 CarbonylContact O-C 3.5Å; K652-C655 PolarHBondContact O-N 3.28Å; E653-C655 VanDerWaalsContact C-N 3.29Å; E653-C655 PolarHBondContact O-N 3.46Å; C655-D657 PolarHBondContact O-N 3.46Å
656	K	72.5	Confident	75.2	Confident	144 Å²	144	86 Å²	86	63%	0.626	42%	0.416	S	S	*	.			trans	-61.1	134.4	-178.1	-162.1	170.9	-179.8	177.6	0	109.2	R606 K652 E653 I654 D658	R606-K656 PolarHBondContact NH1-O 2.76Å; R606-K656 PolarHBondContact NH2-O 3.46Å; K652-K656 VanDerWaalsContact O-CA 3.29Å; K652-K656 WeakPolarHBondContact O-CA 3.31Å; K652-K656 VanDerWaalsContact O-CB 3.29Å; K652-K656 WeakPolarHBondContact O-CB 3.19Å; K652-K656 PolarHBondContact O-N 3.19Å; E653-K656 WeakPolarHBondContact O-CB 3.23Å; E653-K656 PolarHBondContact O-N 3.32Å; E653-K656 VanDerWaalsContact O-N 3.15Å; I654-K656 VanDerWaalsContact C-N 3.32Å; K656-D658 PolarHBondContact O-N 3.48Å; K656-D658 VanDerWaalsContact O-N 3.15Å
657	D	60.1	Low	74.8	Confident	87 Å²	87	81.7 Å²	81.7	47%	0.465	40%	0.4	S	S	.	.			trans	-65.3	116.1	173.8	-67.4	-30	0	0	0	107.7	R603 C655 Q659	R603-D657 IonicContact CZ-OD1 2.87Å; R603-D657 IonicContact NH1-OD1 3.93Å; R603-D657 PolarHBondContact NH1-OD1 3.22Å; R603-D657 IonicContact NH2-OD1 3.07Å; R603-D657 PolarHBondContact NH2-OD1 3.19Å; R603-D657 IonicContact NH2-OD2 2.76Å; C655-D657 PolarHBondContact O-N 3.46Å; D657-Q659 PolarHBondContact O-N 2.85Å
658	D	52.5	Low	74.6	Confident	129 Å²	129	86 Å²	86	69%	0.69	42%	0.422	S	S	*	.			trans	-69.5	80.7	163	-76.4	-42.3	0	0	0	106.5	R606 K656 E660	R606-D658 IonicContact NH1-OD2 2.69Å; R606-D658 PolarHBondContact NH1-OD2 2.83Å; K656-D658 PolarHBondContact O-N 3.48Å; K656-D658 VanDerWaalsContact O-N 3.15Å; D658-E660 VanDerWaalsContact C-N 3.33Å; D658-E660 PolarHBondContact O-N 3.5Å
659	Q	55.1	Low	74.5	Confident	137 Å²	137	85.9 Å²	85.9	64%	0.64	42%	0.42	S	S	*	.			trans	29	64.2	174.4	-67.9	-170.2	-19	0	0	113.7	D657 Q661 Y686	D657-Q659 PolarHBondContact O-N 2.85Å; Q659-Q661 PolarHBondContact O-N 3.3Å; Q659-Y686 VanDerWaalsContact O-CE2 3.24Å; Q659-Y686 WeakPolarHBondContact O-CE2 3.4Å
660	E	52.3	Low	74.4	Confident	88 Å²	88	84.8 Å²	84.8	41%	0.411	42%	0.416	S	S	.	.			trans	-71.5	95.6	151.7	-76.5	-177.6	-162.7	0	0	104.7	D658 Q662 R725	D658-E660 VanDerWaalsContact C-N 3.33Å; D658-E660 PolarHBondContact O-N 3.5Å; E660-Q662 PolarHBondContact O-N 3.45Å; E660-R725 IonicContact OE1-CZ 3.39Å; E660-R725 IonicContact OE1-NH1 2.63Å; E660-R725 PolarHBondContact OE1-NH1 3.2Å; E660-R725 IonicContact OE1-NH2 3.15Å; E660-R725 PolarHBondContact OE1-NH2 2.92Å; E660-R725 IonicContact OE2-CZ 2.83Å; E660-R725 IonicContact OE2-NH1 3.29Å; E660-R725 PolarHBondContact OE2-NH1 2.71Å; E660-R725 IonicContact OE2-NH2 3.47Å; E660-R725 PolarHBondContact OE2-NH2 2.65Å
661	Q	55.4	Low	74.4	Confident	112 Å²	112	83.9 Å²	83.9	52%	0.523	41%	0.412	S	S	.	.			trans	-46.2	118.3	153.8	-75.4	-177.8	-10.3	0	0	105.1	Q659 L663	Q659-Q661 PolarHBondContact O-N 3.3Å; Q661-L663 VanDerWaalsContact C-N 3.29Å; Q661-L663 WeakPolarHBondContact O-CG 3.11Å; Q661-L663 PolarHBondContact O-N 2.97Å
662	Q	59.3	Low	74.5	Confident	184 Å²	184	85.9 Å²	85.9	86%	0.86	43%	0.425	S	S	*	.			trans	-59.2	99	179.6	-81.5	-179.8	-17.6	0	0	107.4	E660 E664	E660-Q662 PolarHBondContact O-N 3.45Å; Q662-E664 PolarHBondContact O-N 3.42Å
663	L	69.7	Low	74.7	Confident	22 Å²	22	80.4 Å²	80.4	12%	0.115	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-75	116.5	179.6	-60.3	173.7	0	0	0	106.9	Q661 Y669 L685 Y722 M732	Q661-L663 VanDerWaalsContact C-N 3.29Å; Q661-L663 WeakPolarHBondContact O-CG 3.11Å; Q661-L663 PolarHBondContact O-N 2.97Å; L663-Y669 VanDerWaalsContact CA-OH 3.3Å; L663-Y669 WeakPolarHBondContact CA-OH 3.32Å; L663-Y669 HydrophobicContact CB-CE2 3.87Å; L663-Y669 HydrophobicContact CD2-CD1 3.76Å; L663-Y669 HydrophobicContact CD2-CD2 3.9Å; L663-Y669 HydrophobicContact CD2-CE1 3.51Å; L663-Y669 HydrophobicContact CD2-CE2 3.64Å; L663-Y669 HydrophobicContact CD2-CG 3.96Å; L663-Y669 VanDerWaalsContact CD2-CZ 3.46Å; L663-Y669 HydrophobicContact CG-CE2 4.3Å; L663-L685 HydrophobicContact CD1-CD1 3.37Å; L663-L685 HydrophobicContact CD2-CD1 4.16Å; L663-L685 HydrophobicContact CG-CD1 4.42Å; L663-Y722 HydrophobicContact CB-CD1 3.49Å; L663-Y722 VanDerWaalsContact CB-CD1 3.49Å; L663-Y722 HydrophobicContact CB-CD2 4.5Å; L663-Y722 HydrophobicContact CB-CE1 3.51Å; L663-Y722 HydrophobicContact CB-CG 3.99Å; L663-Y722 HydrophobicContact CD1-CD2 4.18Å; L663-Y722 HydrophobicContact CD1-CE2 4.15Å; L663-Y722 HydrophobicContact CD1-CG 4.38Å; L663-Y722 WeakPolarHBondContact O-CE1 3.47Å; L663-M732 HydrophobicContact CD1-CE 3.87Å; L663-M732 HydrophobicContact CD1-SD 3.79Å
664	E	73.9	Confident	74.9	Confident	141 Å²	141	75.9 Å²	75.9	66%	0.659	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-71.6	132.2	178.3	-70.5	-176	170.3	0	0	109.8	Q662 G666 A667 Y669	Q662-E664 PolarHBondContact O-N 3.42Å; E664-G666 PolarHBondContact O-N 3.5Å; E664-A667 HydrophobicContact CB-CB 3.85Å; E664-A667 WeakPolarHBondContact O-CB 3.47Å; E664-A667 PolarHBondContact O-N 3.09Å; E664-Y669 PolarHBondContact N-OH 3.31Å
665	F	79.5	Confident	75.3	Confident	152 Å²	152	78.7 Å²	78.7	67%	0.667	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	124.2	176.2	180	-83.9	0	0	0	109.7	A667 F723	F665-A667 VanDerWaalsContact C-N 3.33Å; F665-F723 HydrophobicContact CE1-CD1 4.44Å; F665-F723 HydrophobicContact CE2-CB 4.08Å; F665-F723 HydrophobicContact CE2-CD1 4.17Å; F665-F723 WeakPolarHBondContact CE2-O 3.45Å; F665-F723 AromaticContact CZ-CD1 3.84Å; F665-F723 HydrophobicContact CZ-CD1 3.84Å
666	G	78.6	Confident	75.8	Confident	23 Å²	23	79.5 Å²	79.5	24%	0.237	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-2.4	-178.2	0	0	0	0	0	114.7	E664 K721 Y722	E664-G666 PolarHBondContact O-N 3.5Å; G666-K721 WeakPolarHBondContact O-CE 3.35Å; G666-Y722 WeakPolarHBondContact CA-O 3.27Å; G666-Y722 PolarHBondContact N-O 3.36Å
667	A	83.3	Confident	76.6	Confident	24 Å²	24	78.1 Å²	78.1	20%	0.198	39%	0.39	C	S	.	.			trans	-73.3	156.5	171.8	0	0	0	0	0	111.7	E664 F665 Y669 K721 Y722	E664-A667 HydrophobicContact CB-CB 3.85Å; E664-A667 WeakPolarHBondContact O-CB 3.47Å; E664-A667 PolarHBondContact O-N 3.09Å; F665-A667 VanDerWaalsContact C-N 3.33Å; A667-Y669 HydrophobicContact CB-CD2 4.42Å; A667-Y669 HydrophobicContact CB-CE2 3.58Å; A667-K721 WeakPolarHBondContact O-CA 3.35Å; A667-Y722 PolarHBondContact O-N 3.07Å
668	I	87.3	Confident	77.7	Confident	91 Å²	91	79.7 Å²	79.7	47%	0.467	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.9	-179.3	-55.4	175.4	0	0	0	107.8	Q719 V720 K721 L739	I668-Q719 HydrophobicContact CG2-CB 3.92Å; I668-Q719 HydrophobicContact CG2-CG 4.36Å; I668-V720 CarbonylContact C-O 3.56Å; I668-V720 WeakPolarHBondContact CA-O 3.46Å; I668-K721 HydrophobicContact CG1-CG 4.48Å; I668-L739 HydrophobicContact CD1-CD2 3.51Å; I668-L739 HydrophobicContact CG1-CD2 3.78Å; I668-L739 HydrophobicContact CG2-CD1 3.9Å; I668-L739 HydrophobicContact CG2-CD2 4.39Å
669	Y	86.6	Confident	79.2	Confident	45 Å²	45	77.2 Å²	77.2	18%	0.176	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.1	-179.8	-65.7	-79.3	0	0	0	110.5	L663 E664 A667 Q719 V720	L663-Y669 VanDerWaalsContact CA-OH 3.3Å; L663-Y669 WeakPolarHBondContact CA-OH 3.32Å; L663-Y669 HydrophobicContact CB-CE2 3.87Å; L663-Y669 HydrophobicContact CD2-CD1 3.76Å; L663-Y669 HydrophobicContact CD2-CD2 3.9Å; L663-Y669 HydrophobicContact CD2-CE1 3.51Å; L663-Y669 HydrophobicContact CD2-CE2 3.64Å; L663-Y669 HydrophobicContact CD2-CG 3.96Å; L663-Y669 VanDerWaalsContact CD2-CZ 3.46Å; L663-Y669 HydrophobicContact CG-CE2 4.3Å; E664-Y669 PolarHBondContact N-OH 3.31Å; A667-Y669 HydrophobicContact CB-CD2 4.42Å; A667-Y669 HydrophobicContact CB-CE2 3.58Å; Y669-Q719 WeakPolarHBondContact O-CA 3.49Å; Y669-V720 PolarHBondContact N-O 2.68Å; Y669-V720 PolarHBondContact O-N 2.88Å
670	T	87.8	Confident	80.8	Confident	69 Å²	69	70.7 Å²	70.7	42%	0.423	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.7	170.2	-54.8	0	0	0	0	108.5	E717	T670-E717 HydrophobicContact CG2-CB 3.75Å; T670-E717 HydrophobicContact CG2-CG 4.11Å
671	A	88.4	Confident	82.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.7	-179.1	0	0	0	0	0	109.9	V683 K684 L685 E717 L718 V720	A671-V683 HydrophobicContact CB-CB 3.89Å; A671-V683 HydrophobicContact CB-CG1 4.42Å; A671-V683 HydrophobicContact CB-CG2 4.18Å; A671-K684 CarbonylContact C-O 3.47Å; A671-K684 VanDerWaalsContact CA-O 3.32Å; A671-K684 WeakPolarHBondContact CA-O 3.47Å; A671-L685 HydrophobicContact CB-CD2 3.55Å; A671-E717 CarbonylContact O-C 3.49Å; A671-E717 WeakPolarHBondContact O-CA 3.23Å; A671-L718 HydrophobicContact CB-CD1 4.34Å; A671-L718 PolarHBondContact N-O 3.2Å; A671-L718 PolarHBondContact O-N 3.48Å; A671-V720 HydrophobicContact CB-CG1 4.24Å; A671-V720 HydrophobicContact CB-CG2 3.96Å
672	T	90	Very high	84.2	Confident	54 Å²	54	62.2 Å²	62.2	33%	0.331	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	131.6	174.2	-44.7	0	0	0	0	109.7	S674 V683 K684	T672-S674 PolarHBondContact O-N 3.36Å; T672-V683 WeakPolarHBondContact O-CA 3Å; T672-K684 PolarHBondContact N-O 2.94Å; T672-K684 PolarHBondContact O-N 3.33Å
673	I	91.1	Very high	85.7	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.6	175.3	-63	173.8	0	0	0	109.5	I676 V681 V683 L712 E713 G715 Q716 L718	I673-I676 HydrophobicContact CG2-CG1 3.94Å; I673-V681 HydrophobicContact CB-CG1 4.01Å; I673-V681 HydrophobicContact CD1-CG1 3.88Å; I673-V681 HydrophobicContact CG1-CG1 3.61Å; I673-V681 HydrophobicContact CG2-CG1 3.32Å; I673-V683 HydrophobicContact CG1-CG1 4.29Å; I673-L712 HydrophobicContact CD1-CB 3.88Å; I673-L712 HydrophobicContact CD1-CD1 4.48Å; I673-L712 HydrophobicContact CD1-CD2 4.08Å; I673-L712 HydrophobicContact CD1-CG 4.36Å; I673-E713 WeakPolarHBondContact CD1-O 3.24Å; I673-G715 WeakPolarHBondContact O-CA 3.39Å; I673-G715 PolarHBondContact O-N 2.87Å; I673-Q716 HydrophobicContact CD1-CB 4.27Å; I673-Q716 WeakPolarHBondContact CG1-O 3.42Å; I673-Q716 PolarHBondContact N-O 3.24Å; I673-L718 HydrophobicContact CD1-CD2 3.45Å; I673-L718 VanDerWaalsContact CD1-CD2 3.45Å; I673-L718 HydrophobicContact CG1-CD2 3.41Å; I673-L718 VanDerWaalsContact CG1-CD2 3.41Å; I673-L718 HydrophobicContact CG1-CG 4.48Å
674	S	89.6	Confident	86.5	Confident	42 Å²	42	55.5 Å²	55.5	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-37	174.4	66.9	0	0	0	0	112.9	T672 M682 P691 V714	T672-S674 PolarHBondContact O-N 3.36Å; S674-M682 PolarHBondContact N-O 3.44Å; S674-M682 WeakPolarHBondContact OG-CB 3.31Å; S674-M682 PolarHBondContact OG-O 3.32Å; S674-P691 WeakPolarHBondContact OG-CB 3.48Å; S674-V714 WeakPolarHBondContact O-CG1 3.4Å
675	E	90.4	Very high	86.9	Confident	81 Å²	81	49.7 Å²	49.7	38%	0.379	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	146.8	-174.2	-164.5	-165	147.5	0	0	109.5	R677 M682	E675-R677 IonicContact OE1-CZ 3.31Å; E675-R677 IonicContact OE1-NE 3.34Å; E675-R677 PolarHBondContact OE1-NE 3.43Å; E675-R677 IonicContact OE1-NH2 3.52Å; E675-R677 PolarHBondContact OE1-NH2 3.44Å; E675-R677 IonicContact OE2-CZ 3.28Å; E675-R677 IonicContact OE2-NE 2.84Å; E675-R677 PolarHBondContact OE2-NE 3.03Å; E675-R677 IonicContact OE2-NH2 3.55Å; E675-R677 PolarHBondContact OE2-NH2 2.87Å; E675-M682 HydrophobicContact CB-CB 4Å; E675-M682 HydrophobicContact CB-CG 4.15Å; E675-M682 PolarHBondContact N-O 2.63Å; E675-M682 PolarHBondContact O-N 3.49Å
676	I	88.4	Confident	87	Confident	43 Å²	43	43.7 Å²	43.7	22%	0.221	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.6	175.6	-61.3	172.4	0	0	0	108.5	I673 V681 P707 L712 V714	I673-I676 HydrophobicContact CG2-CG1 3.94Å; I676-V681 HydrophobicContact CG1-CG1 4.22Å; I676-P707 HydrophobicContact CG2-CB 3.83Å; I676-P707 HydrophobicContact CG2-CG 3.97Å; I676-L712 WeakPolarHBondContact CD1-O 3.46Å; I676-V714 HydrophobicContact CD1-CG2 4.14Å; I676-V714 HydrophobicContact CG1-CG2 4.1Å
677	R	88.6	Confident	86.5	Confident	114 Å²	114	47.9 Å²	47.9	43%	0.43	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	162.7	178.4	-62.1	-174	178.1	-179.3	6.1	110.6	E675 V679 G680 P707	E675-R677 IonicContact OE1-CZ 3.31Å; E675-R677 IonicContact OE1-NE 3.34Å; E675-R677 PolarHBondContact OE1-NE 3.43Å; E675-R677 IonicContact OE1-NH2 3.52Å; E675-R677 PolarHBondContact OE1-NH2 3.44Å; E675-R677 IonicContact OE2-CZ 3.28Å; E675-R677 IonicContact OE2-NE 2.84Å; E675-R677 PolarHBondContact OE2-NE 3.03Å; E675-R677 IonicContact OE2-NH2 3.55Å; E675-R677 PolarHBondContact OE2-NH2 2.87Å; R677-V679 HydrophobicContact CB-CG2 4.32Å; R677-V679 PolarHBondContact O-N 3.28Å; R677-V679 VanDerWaalsContact O-N 3.15Å; R677-G680 CarbonylContact C-O 3.57Å; R677-G680 WeakPolarHBondContact CA-O 3.29Å; R677-G680 PolarHBondContact N-O 3.2Å; R677-G680 PolarHBondContact O-N 3.26Å; R677-G680 VanDerWaalsContact O-N 3.1Å; R677-P707 WeakPolarHBondContact O-CD 3.33Å; R677-P707 WeakPolarHBondContact O-CG 3.44Å
678	D	84.2	Confident	85.9	Confident	121 Å²	121	53.3 Å²	53.3	65%	0.647	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-35.5	179.8	-66.3	-31.1	0	0	0	113.1	N696 H706	D678-N696 PolarHBondContact O-ND2 3Å; D678-H706 IonicContact OD1-CD2 3.18Å; D678-H706 PolarHBondContact OD1-CD2 3.1Å; D678-H706 VanDerWaalsContact OD1-CD2 3.28Å; D678-H706 IonicContact OD1-NE2 2.87Å; D678-H706 PolarHBondContact OD1-NE2 3.01Å
679	V	84.6	Confident	85.3	Confident	77 Å²	77	49.5 Å²	49.5	47%	0.467	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.6	-177.8	-71.3	0	0	0	0	114.3	R677 L693 H695 N696	R677-V679 HydrophobicContact CB-CG2 4.32Å; R677-V679 PolarHBondContact O-N 3.28Å; R677-V679 VanDerWaalsContact O-N 3.15Å; V679-L693 HydrophobicContact CG2-CD1 4.37Å; V679-L693 HydrophobicContact CG2-CD2 4.33Å; V679-H695 PolarHBondContact O-CD2 2.84Å; V679-N696 PolarHBondContact O-N 2.94Å
680	G	87.7	Confident	84.8	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	-172	-174.7	0	0	0	0	0	114.2	R677 L694 N696	R677-G680 CarbonylContact C-O 3.57Å; R677-G680 WeakPolarHBondContact CA-O 3.29Å; R677-G680 PolarHBondContact N-O 3.2Å; R677-G680 PolarHBondContact O-N 3.26Å; R677-G680 VanDerWaalsContact O-N 3.1Å; G680-L694 CarbonylContact C-O 3.59Å; G680-L694 VanDerWaalsContact CA-O 3.26Å; G680-L694 WeakPolarHBondContact CA-O 3.5Å; G680-N696 VanDerWaalsContact CA-OD1 3.28Å; G680-N696 WeakPolarHBondContact CA-OD1 3.29Å; G680-N696 PolarHBondContact N-OD1 3.49Å
681	V	90.1	Very high	84.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.6	-178.3	-171.7	0	0	0	0	109.6	I673 I676 V683 L694 L699 P707 L712	I673-V681 HydrophobicContact CB-CG1 4.01Å; I673-V681 HydrophobicContact CD1-CG1 3.88Å; I673-V681 HydrophobicContact CG1-CG1 3.61Å; I673-V681 HydrophobicContact CG2-CG1 3.32Å; I676-V681 HydrophobicContact CG1-CG1 4.22Å; V681-V683 HydrophobicContact CG1-CG1 4.07Å; V681-L694 PolarHBondContact N-O 2.82Å; V681-L694 WeakPolarHBondContact O-CB 3.44Å; V681-L694 PolarHBondContact O-N 3.3Å; V681-L699 HydrophobicContact CG2-CD1 3.98Å; V681-L699 HydrophobicContact CG2-CD2 4.14Å; V681-P707 HydrophobicContact CG2-CB 3.47Å; V681-P707 VanDerWaalsContact CG2-CB 3.47Å; V681-P707 HydrophobicContact CG2-CG 3.73Å; V681-L712 HydrophobicContact CG2-CD1 4.12Å
682	M	90.4	Very high	84.5	Confident	22 Å²	22	53 Å²	53	11%	0.108	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.8	173.2	-59.2	-62.3	-71.6	0	0	108.6	S674 E675 P691 V692 L693	S674-M682 PolarHBondContact N-O 3.44Å; S674-M682 WeakPolarHBondContact OG-CB 3.31Å; S674-M682 PolarHBondContact OG-O 3.32Å; E675-M682 HydrophobicContact CB-CB 4Å; E675-M682 HydrophobicContact CB-CG 4.15Å; E675-M682 PolarHBondContact N-O 2.63Å; E675-M682 PolarHBondContact O-N 3.49Å; M682-P691 HydrophobicContact CB-CB 3.95Å; M682-P691 HydrophobicContact CE-CB 3.94Å; M682-P691 WeakPolarHBondContact CE-O 3.45Å; M682-V692 WeakPolarHBondContact CA-O 3.43Å; M682-L693 HydrophobicContact SD-CB 3.68Å; M682-L693 HydrophobicContact SD-CD1 3.63Å; M682-L693 HydrophobicContact SD-CG 4.26Å
683	V	89.3	Confident	84.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.3	-175.5	-61.3	0	0	0	0	111.6	A671 T672 I673 V681 V692 L694 L718 L734	A671-V683 HydrophobicContact CB-CB 3.89Å; A671-V683 HydrophobicContact CB-CG1 4.42Å; A671-V683 HydrophobicContact CB-CG2 4.18Å; T672-V683 WeakPolarHBondContact O-CA 3Å; I673-V683 HydrophobicContact CG1-CG1 4.29Å; V681-V683 HydrophobicContact CG1-CG1 4.07Å; V683-V692 PolarHBondContact N-O 3.14Å; V683-V692 PolarHBondContact O-N 2.97Å; V683-L694 HydrophobicContact CG2-CB 4.34Å; V683-L718 HydrophobicContact CG1-CD2 4.31Å; V683-L734 HydrophobicContact CG2-CD1 3.73Å
684	K	87	Confident	84.3	Confident	64 Å²	64	53.7 Å²	53.7	28%	0.278	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.2	171.9	-67.7	-173.9	174.9	-166.6	0	109.5	A671 T672 P687 M689 P691	A671-K684 CarbonylContact C-O 3.47Å; A671-K684 VanDerWaalsContact CA-O 3.32Å; A671-K684 WeakPolarHBondContact CA-O 3.47Å; T672-K684 PolarHBondContact N-O 2.94Å; T672-K684 PolarHBondContact O-N 3.33Å; K684-P687 PolarHBondContact NZ-O 3.38Å; K684-M689 WeakPolarHBondContact CD-O 3.42Å; K684-M689 WeakPolarHBondContact CE-O 3.26Å; K684-P691 HydrophobicContact CG-CB 4.21Å; K684-P691 HydrophobicContact CG-CG 4.26Å
685	L	82.8	Confident	84.2	Confident	20 Å²	20	56 Å²	56	11%	0.105	30%	0.295	C	S	.	.	S	Bend	trans	-86.1	-24	175.6	-59.5	176.8	0	0	0	112.3	L663 A671 M689 V720 M732 L734	L663-L685 HydrophobicContact CD1-CD1 3.37Å; L663-L685 HydrophobicContact CD2-CD1 4.16Å; L663-L685 HydrophobicContact CG-CD1 4.42Å; A671-L685 HydrophobicContact CB-CD2 3.55Å; L685-M689 HydrophobicContact CB-SD 3.75Å; L685-M689 HydrophobicContact CD1-CE 4.45Å; L685-M689 HydrophobicContact CD1-SD 4.23Å; L685-M689 HydrophobicContact CG-CE 4.4Å; L685-M689 HydrophobicContact CG-SD 3.91Å; L685-M689 PolarHBondContact N-SD 3.35Å; L685-M689 VanDerWaalsContact N-SD 3.43Å; L685-V720 HydrophobicContact CD2-CG2 3.64Å; L685-M732 HydrophobicContact CD1-SD 4.39Å; L685-L734 HydrophobicContact CD1-CD2 4.08Å
686	Y	80.9	Confident	84	Confident	25 Å²	25	52.9 Å²	52.9	10%	0.098	28%	0.281	C	S	.	.	S	Bend	trans	-149.5	155.4	175.8	44.5	-87.7	0	0	0	109.2	Q659 N688 M689	Q659-Y686 VanDerWaalsContact O-CE2 3.24Å; Q659-Y686 WeakPolarHBondContact O-CE2 3.4Å; Y686-N688 VanDerWaalsContact C-N 3.3Å; Y686-N688 PolarHBondContact O-N 3.34Å; Y686-N688 VanDerWaalsContact O-N 3.15Å; Y686-M689 HydrophobicContact CD1-CB 4.48Å; Y686-M689 HydrophobicContact CD1-SD 4.27Å; Y686-M689 HydrophobicContact CD2-CB 3.73Å; Y686-M689 HydrophobicContact CE1-CB 4.32Å; Y686-M689 HydrophobicContact CE1-CG 4.21Å; Y686-M689 HydrophobicContact CE1-SD 3.8Å; Y686-M689 HydrophobicContact CE2-CB 3.56Å; Y686-M689 HydrophobicContact CE2-CG 4Å; Y686-M689 HydrophobicContact CG-CB 4.19Å; Y686-M689 VanDerWaalsContact O-CB 3.24Å; Y686-M689 WeakPolarHBondContact O-CB 3.35Å; Y686-M689 PolarHBondContact O-N 3.35Å; Y686-M689 VanDerWaalsContact O-N 3.07Å
687	P	68.3	Low	83.8	Confident	111 Å²	111	53.7 Å²	53.7	72%	0.721	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.5	-165.7	-28.9	36	0	0	0	115.4	K684 M689	K684-P687 PolarHBondContact NZ-O 3.38Å; P687-M689 VanDerWaalsContact C-N 3.33Å; P687-M689 PolarHBondContact O-N 2.82Å
688	N	70.4	Confident	83.8	Confident	138 Å²	138	51.8 Å²	51.8	74%	0.738	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	3.1	-175.9	-62.3	-18.8	0	0	0	113.8	Y686	Y686-N688 VanDerWaalsContact C-N 3.3Å; Y686-N688 PolarHBondContact O-N 3.34Å; Y686-N688 VanDerWaalsContact O-N 3.15Å
689	M	75.1	Confident	83.8	Confident	11 Å²	11	46 Å²	46	5%	0.054	26%	0.256	C	S	.	.	S	Bend	trans	-75.9	140.6	179.5	-166.1	-179	151.1	0	0	111.8	K684 L685 Y686 P687 V692 M732	K684-M689 WeakPolarHBondContact CD-O 3.42Å; K684-M689 WeakPolarHBondContact CE-O 3.26Å; L685-M689 HydrophobicContact CB-SD 3.75Å; L685-M689 HydrophobicContact CD1-CE 4.45Å; L685-M689 HydrophobicContact CD1-SD 4.23Å; L685-M689 HydrophobicContact CG-CE 4.4Å; L685-M689 HydrophobicContact CG-SD 3.91Å; L685-M689 PolarHBondContact N-SD 3.35Å; L685-M689 VanDerWaalsContact N-SD 3.43Å; Y686-M689 HydrophobicContact CD1-CB 4.48Å; Y686-M689 HydrophobicContact CD1-SD 4.27Å; Y686-M689 HydrophobicContact CD2-CB 3.73Å; Y686-M689 HydrophobicContact CE1-CB 4.32Å; Y686-M689 HydrophobicContact CE1-CG 4.21Å; Y686-M689 HydrophobicContact CE1-SD 3.8Å; Y686-M689 HydrophobicContact CE2-CB 3.56Å; Y686-M689 HydrophobicContact CE2-CG 4Å; Y686-M689 HydrophobicContact CG-CB 4.19Å; Y686-M689 VanDerWaalsContact O-CB 3.24Å; Y686-M689 WeakPolarHBondContact O-CB 3.35Å; Y686-M689 PolarHBondContact O-N 3.35Å; Y686-M689 VanDerWaalsContact O-N 3.07Å; P687-M689 VanDerWaalsContact C-N 3.33Å; P687-M689 PolarHBondContact O-N 2.82Å; M689-V692 HydrophobicContact CE-CB 3.92Å; M689-V692 HydrophobicContact CE-CG2 3.27Å; M689-M732 HydrophobicContact CE-CE 4.02Å; M689-M732 HydrophobicContact CE-SD 3.32Å; M689-M732 WeakPolarHBondContact CE-SD 3.45Å; M689-M732 HydrophobicContact SD-CE 4.43Å; M689-M732 HydrophobicContact SD-SD 4.24Å
690	T	76.3	Confident	83.7	Confident	118 Å²	118	44.1 Å²	44.1	72%	0.724	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-64.1	130	164.7	-45.3	0	0	0	0	109.1	V692	T690-V692 PolarHBondContact O-N 3.42Å
691	P	83.4	Confident	83.3	Confident	45 Å²	45	48.8 Å²	48.8	29%	0.292	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-60	134	-177.2	-13	20.9	0	0	0	111.8	S674 M682 K684	S674-P691 WeakPolarHBondContact OG-CB 3.48Å; M682-P691 HydrophobicContact CB-CB 3.95Å; M682-P691 HydrophobicContact CE-CB 3.94Å; M682-P691 WeakPolarHBondContact CE-O 3.45Å; K684-P691 HydrophobicContact CG-CB 4.21Å; K684-P691 HydrophobicContact CG-CG 4.26Å
692	V	85.8	Confident	82.7	Confident	25 Å²	25	56.6 Å²	56.6	15%	0.152	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	138.2	179.6	170.3	0	0	0	0	109.7	M682 V683 M689 T690 L694 M732 L734	M682-V692 WeakPolarHBondContact CA-O 3.43Å; V683-V692 PolarHBondContact N-O 3.14Å; V683-V692 PolarHBondContact O-N 2.97Å; M689-V692 HydrophobicContact CE-CB 3.92Å; M689-V692 HydrophobicContact CE-CG2 3.27Å; T690-V692 PolarHBondContact O-N 3.42Å; V692-L694 PolarHBondContact O-N 3.12Å; V692-M732 HydrophobicContact CG1-CB 4.2Å; V692-M732 WeakPolarHBondContact CG1-O 3.39Å; V692-M732 HydrophobicContact CG2-CB 4.22Å; V692-L734 HydrophobicContact CB-CD1 4.31Å; V692-L734 HydrophobicContact CG1-CD1 4.05Å
693	L	88.3	Confident	82.1	Confident	70 Å²	70	67.5 Å²	67.5	37%	0.366	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.4	179.9	-177.8	68.5	0	0	0	111.2	V679 M682	V679-L693 HydrophobicContact CG2-CD1 4.37Å; V679-L693 HydrophobicContact CG2-CD2 4.33Å; M682-L693 HydrophobicContact SD-CB 3.68Å; M682-L693 HydrophobicContact SD-CD1 3.63Å; M682-L693 HydrophobicContact SD-CG 4.26Å
694	L	88.8	Confident	81.6	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	99.5	164	-173.2	63.4	0	0	0	108.9	G680 V681 V683 V692 Q698 L699 L718 V720 L734 R736	G680-L694 CarbonylContact C-O 3.59Å; G680-L694 VanDerWaalsContact CA-O 3.26Å; G680-L694 WeakPolarHBondContact CA-O 3.5Å; V681-L694 PolarHBondContact N-O 2.82Å; V681-L694 WeakPolarHBondContact O-CB 3.44Å; V681-L694 PolarHBondContact O-N 3.3Å; V683-L694 HydrophobicContact CG2-CB 4.34Å; V692-L694 PolarHBondContact O-N 3.12Å; L694-Q698 HydrophobicContact CD1-CB 3.86Å; L694-L699 HydrophobicContact CD2-CD2 3.46Å; L694-L699 VanDerWaalsContact CD2-CD2 3.46Å; L694-L699 HydrophobicContact CG-CD2 3.78Å; L694-L699 HydrophobicContact CG-CG 4.42Å; L694-L718 HydrophobicContact CD2-CD1 4.01Å; L694-V720 HydrophobicContact CD2-CG1 3.85Å; L694-L734 HydrophobicContact CD1-CB 3.94Å; L694-L734 VanDerWaalsContact CD1-O 3.22Å; L694-L734 WeakPolarHBondContact CD1-O 3.45Å; L694-R736 HydrophobicContact CD2-CB 4.23Å
695	H	87.9	Confident	81.1	Confident	90 Å²	90	75.2 Å²	75.2	42%	0.417	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	149.8	-175.6	-171.4	-103.2	0	0	0	112.4	V679 S697 Q698 L699	V679-H695 PolarHBondContact O-CD2 2.84Å; H695-S697 PolarHBondContact ND1-N 3.4Å; H695-S697 PolarHBondContact ND1-OG 3.24Å; H695-S697 PolarHBondContact O-N 3.29Å; H695-Q698 WeakPolarHBondContact O-CA 3.37Å; H695-Q698 WeakPolarHBondContact O-CB 3.5Å; H695-Q698 PolarHBondContact O-N 2.84Å; H695-L699 PolarHBondContact O-N 3.36Å
696	N	86.3	Confident	81.1	Confident	15 Å²	15	77.2 Å²	77.2	8%	0.08	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-50.9	-34.9	-179.3	-73.7	-18.2	0	0	0	113.9	D678 V679 G680 Q698 L699 K705 P707	D678-N696 PolarHBondContact O-ND2 3Å; V679-N696 PolarHBondContact O-N 2.94Å; G680-N696 VanDerWaalsContact CA-OD1 3.28Å; G680-N696 WeakPolarHBondContact CA-OD1 3.29Å; G680-N696 PolarHBondContact N-OD1 3.49Å; N696-Q698 PolarHBondContact O-N 3.42Å; N696-L699 PolarHBondContact O-N 3.35Å; N696-K705 PolarHBondContact ND2-O 3.46Å; N696-P707 WeakPolarHBondContact OD1-CD 3.28Å; N696-P707 VanDerWaalsContact OD1-CG 3.28Å; N696-P707 WeakPolarHBondContact OD1-CG 3.1Å
697	S	84.8	Confident	81	Confident	60 Å²	60	76 Å²	76	42%	0.42	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-68.6	-15.2	178.2	65.4	0	0	0	0	114.6	H695 K737	H695-S697 PolarHBondContact ND1-N 3.4Å; H695-S697 PolarHBondContact ND1-OG 3.24Å; H695-S697 PolarHBondContact O-N 3.29Å; S697-K737 WeakPolarHBondContact O-CD 3.38Å
698	Q	86.6	Confident	81.5	Confident	74 Å²	74	74.1 Å²	74.1	35%	0.346	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-107.3	-0	-179.2	-59.6	-58.6	-28	0	0	112.7	L694 H695 N696 S735 R736 K737	L694-Q698 HydrophobicContact CD1-CB 3.86Å; H695-Q698 WeakPolarHBondContact O-CA 3.37Å; H695-Q698 WeakPolarHBondContact O-CB 3.5Å; H695-Q698 PolarHBondContact O-N 2.84Å; N696-Q698 PolarHBondContact O-N 3.42Å; Q698-S735 PolarHBondContact OE1-OG 3.16Å; Q698-R736 PolarHBondContact O-N 3.44Å; Q698-K737 PolarHBondContact O-N 3.09Å
699	L	85.1	Confident	81.8	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-43.5	178.8	-71.7	172.7	0	0	0	112.7	V681 L694 H695 N696 P707 L710 L712	V681-L699 HydrophobicContact CG2-CD1 3.98Å; V681-L699 HydrophobicContact CG2-CD2 4.14Å; L694-L699 HydrophobicContact CD2-CD2 3.46Å; L694-L699 VanDerWaalsContact CD2-CD2 3.46Å; L694-L699 HydrophobicContact CG-CD2 3.78Å; L694-L699 HydrophobicContact CG-CG 4.42Å; H695-L699 PolarHBondContact O-N 3.36Å; N696-L699 PolarHBondContact O-N 3.35Å; L699-P707 HydrophobicContact CD1-CB 4.12Å; L699-P707 HydrophobicContact CD1-CG 4.16Å; L699-L710 HydrophobicContact CB-CD1 3.8Å; L699-L710 HydrophobicContact CD1-CD1 4.41Å; L699-L712 HydrophobicContact CD2-CD1 4.18Å
700	D	82.6	Confident	81.9	Confident	38 Å²	38	73.2 Å²	73.2	20%	0.203	37%	0.373	C	S	.	.			trans	-154.8	167.5	-175.4	-162.3	-4.6	0	0	0	111	I704 L710	D700-I704 HydrophobicContact CB-CD1 3.62Å; D700-L710 HydrophobicContact CB-CD1 4.13Å; D700-L710 HydrophobicContact CB-CD2 4.19Å; D700-L710 WeakPolarHBondContact OD2-CD2 3.34Å
701	H	78.6	Confident	82	Confident	98 Å²	98	70.2 Å²	70.2	45%	0.454	37%	0.365	S	S	.	.	S	Bend	trans	-71	-33.6	174.8	-74.2	-88.9	0	0	0	112.9	K737	H701-K737 WeakPolarHBondContact ND1-CE 3.37Å; H701-K737 PolarHBondContact NE2-O 3.04Å
702	K	78.7	Confident	82.1	Confident	164 Å²	164	68.4 Å²	68.4	71%	0.713	35%	0.353	S	S	*	.	S	Bend	trans	-69.9	138.1	176.5	-66.6	179.5	-176.7	174.6	0	109.4	I704	K702-I704 WeakPolarHBondContact O-CG1 3.39Å; K702-I704 PolarHBondContact O-N 3.31Å
703	R	77.2	Confident	82	Confident	251 Å²	251	74 Å²	74	95%	0.947	38%	0.378	S	S	*	.			trans	-71.2	106.5	176.3	-170.7	176.3	-177.8	-179.4	1	109
704	I	79.5	Confident	82	Confident	24 Å²	24	75.1 Å²	75.1	12%	0.123	39%	0.387	C	S	.	.			trans	-103.2	134.3	-178	-65.3	150.8	0	0	0	109.3	D700 K702 H706 A709 L710	D700-I704 HydrophobicContact CB-CD1 3.62Å; K702-I704 WeakPolarHBondContact O-CG1 3.39Å; K702-I704 PolarHBondContact O-N 3.31Å; I704-H706 WeakPolarHBondContact CG2-O 3.21Å; I704-A709 HydrophobicContact CG2-CB 3.98Å; I704-L710 HydrophobicContact CD1-CD1 3.51Å; I704-L710 HydrophobicContact CD1-CD2 3.74Å; I704-L710 HydrophobicContact CD1-CG 3.57Å
705	K	76.8	Confident	81.8	Confident	201 Å²	201	77.4 Å²	77.4	87%	0.874	41%	0.411	S	S	*	.	S	Bend	trans	-84.1	-30.1	174.4	-72.3	-172.6	178.2	-178	0	112.9	N696	N696-K705 PolarHBondContact ND2-O 3.46Å
706	H	82.4	Confident	81.8	Confident	62 Å²	62	77 Å²	77	29%	0.287	41%	0.409	S	S	.	.	S	Bend	trans	-145.4	136.1	-179.2	-167.8	-88.6	0	0	0	111.7	D678 I704 S708 A709	D678-H706 IonicContact OD1-CD2 3.18Å; D678-H706 PolarHBondContact OD1-CD2 3.1Å; D678-H706 VanDerWaalsContact OD1-CD2 3.28Å; D678-H706 IonicContact OD1-NE2 2.87Å; D678-H706 PolarHBondContact OD1-NE2 3.01Å; I704-H706 WeakPolarHBondContact CG2-O 3.21Å; H706-S708 PolarHBondContact CE1-OG 3.42Å; H706-S708 WeakPolarHBondContact ND1-CB 3.48Å; H706-S708 PolarHBondContact ND1-N 2.88Å; H706-S708 VanDerWaalsContact ND1-N 3.19Å; H706-S708 PolarHBondContact ND1-OG 2.7Å; H706-S708 PolarHBondContact O-N 2.97Å; H706-S708 VanDerWaalsContact O-N 3.09Å; H706-A709 WeakPolarHBondContact O-CB 3.29Å; H706-A709 PolarHBondContact O-N 3.4Å; H706-A709 VanDerWaalsContact O-N 3.1Å
707	P	79	Confident	81.9	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-55.1	-28.1	-177.6	-26.7	32.6	0	0	0	115.9	I676 R677 V681 N696 L699 A709 L710	I676-P707 HydrophobicContact CG2-CB 3.83Å; I676-P707 HydrophobicContact CG2-CG 3.97Å; R677-P707 WeakPolarHBondContact O-CD 3.33Å; R677-P707 WeakPolarHBondContact O-CG 3.44Å; V681-P707 HydrophobicContact CG2-CB 3.47Å; V681-P707 VanDerWaalsContact CG2-CB 3.47Å; V681-P707 HydrophobicContact CG2-CG 3.73Å; N696-P707 WeakPolarHBondContact OD1-CD 3.28Å; N696-P707 VanDerWaalsContact OD1-CG 3.28Å; N696-P707 WeakPolarHBondContact OD1-CG 3.1Å; L699-P707 HydrophobicContact CD1-CB 4.12Å; L699-P707 HydrophobicContact CD1-CG 4.16Å; P707-A709 PolarHBondContact O-N 2.82Å; P707-A709 VanDerWaalsContact O-N 3.11Å; P707-L710 PolarHBondContact O-N 3.05Å
708	S	78.2	Confident	82.1	Confident	72 Å²	72	80 Å²	80	50%	0.503	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-58.9	-21.6	177.2	-52.8	0	0	0	0	114	H706 L710 G711	H706-S708 PolarHBondContact CE1-OG 3.42Å; H706-S708 WeakPolarHBondContact ND1-CB 3.48Å; H706-S708 PolarHBondContact ND1-N 2.88Å; H706-S708 VanDerWaalsContact ND1-N 3.19Å; H706-S708 PolarHBondContact ND1-OG 2.7Å; H706-S708 PolarHBondContact O-N 2.97Å; H706-S708 VanDerWaalsContact O-N 3.09Å; S708-L710 PolarHBondContact O-N 3.3Å; S708-L710 VanDerWaalsContact O-N 3.16Å; S708-G711 PolarHBondContact O-N 3.1Å; S708-G711 VanDerWaalsContact O-N 3.13Å
709	A	76.9	Confident	82.3	Confident	81 Å²	81	82.1 Å²	82.1	67%	0.669	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-65	-14.8	175.2	0	0	0	0	0	113.4	I704 H706 P707	I704-A709 HydrophobicContact CG2-CB 3.98Å; H706-A709 WeakPolarHBondContact O-CB 3.29Å; H706-A709 PolarHBondContact O-N 3.4Å; H706-A709 VanDerWaalsContact O-N 3.1Å; P707-A709 PolarHBondContact O-N 2.82Å; P707-A709 VanDerWaalsContact O-N 3.11Å
710	L	76.3	Confident	82.5	Confident	48 Å²	48	82.1 Å²	82.1	25%	0.251	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-99	5	176.9	-70.1	175.2	0	0	0	113.7	L699 D700 I704 P707 S708 L712	L699-L710 HydrophobicContact CB-CD1 3.8Å; L699-L710 HydrophobicContact CD1-CD1 4.41Å; D700-L710 HydrophobicContact CB-CD1 4.13Å; D700-L710 HydrophobicContact CB-CD2 4.19Å; D700-L710 WeakPolarHBondContact OD2-CD2 3.34Å; I704-L710 HydrophobicContact CD1-CD1 3.51Å; I704-L710 HydrophobicContact CD1-CD2 3.74Å; I704-L710 HydrophobicContact CD1-CG 3.57Å; P707-L710 PolarHBondContact O-N 3.05Å; S708-L710 PolarHBondContact O-N 3.3Å; S708-L710 VanDerWaalsContact O-N 3.16Å; L710-L712 VanDerWaalsContact C-N 3.26Å; L710-L712 HydrophobicContact CB-CD1 4.14Å; L710-L712 HydrophobicContact CB-CG 3.95Å; L710-L712 HydrophobicContact CD1-CD1 4.23Å; L710-L712 PolarHBondContact O-N 3.38Å
711	G	79.2	Confident	82.8	Confident	55 Å²	55	83.2 Å²	83.2	57%	0.567	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	33	-176.5	0	0	0	0	0	113.1	S708	S708-G711 PolarHBondContact O-N 3.1Å; S708-G711 VanDerWaalsContact O-N 3.13Å
712	L	84.3	Confident	83.2	Confident	8 Å²	8	79.6 Å²	79.6	4%	0.042	41%	0.412	C	S	.	.			trans	-86	130.2	178.1	-67	175.8	0	0	0	110.5	I673 I676 V681 L699 L710 L718	I673-L712 HydrophobicContact CD1-CB 3.88Å; I673-L712 HydrophobicContact CD1-CD1 4.48Å; I673-L712 HydrophobicContact CD1-CD2 4.08Å; I673-L712 HydrophobicContact CD1-CG 4.36Å; I676-L712 WeakPolarHBondContact CD1-O 3.46Å; V681-L712 HydrophobicContact CG2-CD1 4.12Å; L699-L712 HydrophobicContact CD2-CD1 4.18Å; L710-L712 VanDerWaalsContact C-N 3.26Å; L710-L712 HydrophobicContact CB-CD1 4.14Å; L710-L712 HydrophobicContact CB-CG 3.95Å; L710-L712 HydrophobicContact CD1-CD1 4.23Å; L710-L712 PolarHBondContact O-N 3.38Å; L712-L718 HydrophobicContact CD2-CD2 4.35Å
713	E	85.1	Confident	83.5	Confident	143 Å²	143	74.5 Å²	74.5	67%	0.668	39%	0.39	S	S	*	.			trans	-116.7	155.4	179.2	-65.6	-175.8	176.8	0	0	112	I673 G715 Q716	I673-E713 WeakPolarHBondContact CD1-O 3.24Å; E713-G715 PolarHBondContact O-N 2.67Å; E713-Q716 VanDerWaalsContact N-OE1 3.08Å; E713-Q716 VanDerWaalsContact O-CB 3.26Å; E713-Q716 WeakPolarHBondContact O-CB 3.27Å; E713-Q716 PolarHBondContact O-N 2.97Å
714	V	88.1	Confident	83.7	Confident	93 Å²	93	63.1 Å²	63.1	56%	0.564	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	132.9	175.3	178.8	0	0	0	0	109.3	S674 I676 Q716	S674-V714 WeakPolarHBondContact O-CG1 3.4Å; I676-V714 HydrophobicContact CD1-CG2 4.14Å; I676-V714 HydrophobicContact CG1-CG2 4.1Å; V714-Q716 VanDerWaalsContact C-N 3.34Å
715	G	84.1	Confident	83.6	Confident	49 Å²	49	67 Å²	67	51%	0.505	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	-10.5	-174.7	0	0	0	0	0	114.4	I673 E713	I673-G715 WeakPolarHBondContact O-CA 3.39Å; I673-G715 PolarHBondContact O-N 2.87Å; E713-G715 PolarHBondContact O-N 2.67Å
716	Q	88	Confident	83.5	Confident	81 Å²	81	59.5 Å²	59.5	38%	0.379	33%	0.333	S	S	.	.			trans	-71.9	142.3	176.6	-173.2	-179	11.4	0	0	111.4	I673 E713 V714	I673-Q716 HydrophobicContact CD1-CB 4.27Å; I673-Q716 WeakPolarHBondContact CG1-O 3.42Å; I673-Q716 PolarHBondContact N-O 3.24Å; E713-Q716 VanDerWaalsContact N-OE1 3.08Å; E713-Q716 VanDerWaalsContact O-CB 3.26Å; E713-Q716 WeakPolarHBondContact O-CB 3.27Å; E713-Q716 PolarHBondContact O-N 2.97Å; V714-Q716 VanDerWaalsContact C-N 3.34Å
717	E	89	Confident	82.6	Confident	130 Å²	130	62.5 Å²	62.5	61%	0.607	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	136.4	174.6	-66.6	-174.2	170.8	0	0	111.5	T670 A671	T670-E717 HydrophobicContact CG2-CB 3.75Å; T670-E717 HydrophobicContact CG2-CG 4.11Å; A671-E717 CarbonylContact O-C 3.49Å; A671-E717 WeakPolarHBondContact O-CA 3.23Å
718	L	88.9	Confident	81.9	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144	176.5	62.9	95.7	0	0	0	110.9	A671 I673 V683 L694 L712 V720	A671-L718 HydrophobicContact CB-CD1 4.34Å; A671-L718 PolarHBondContact N-O 3.2Å; A671-L718 PolarHBondContact O-N 3.48Å; I673-L718 HydrophobicContact CD1-CD2 3.45Å; I673-L718 VanDerWaalsContact CD1-CD2 3.45Å; I673-L718 HydrophobicContact CG1-CD2 3.41Å; I673-L718 VanDerWaalsContact CG1-CD2 3.41Å; I673-L718 HydrophobicContact CG1-CG 4.48Å; V683-L718 HydrophobicContact CG1-CD2 4.31Å; L694-L718 HydrophobicContact CD2-CD1 4.01Å; L712-L718 HydrophobicContact CD2-CD2 4.35Å; L718-V720 HydrophobicContact CD1-CG1 3.25Å
719	Q	89.4	Confident	81.2	Confident	118 Å²	118	69.3 Å²	69.3	55%	0.551	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	135.1	176.2	-67.5	-175.3	-9.1	0	0	111	I668 Y669 L739	I668-Q719 HydrophobicContact CG2-CB 3.92Å; I668-Q719 HydrophobicContact CG2-CG 4.36Å; Y669-Q719 WeakPolarHBondContact O-CA 3.49Å; Q719-L739 HydrophobicContact CB-CD1 3.73Å; Q719-L739 WeakPolarHBondContact O-CD1 3.42Å
720	V	89.8	Confident	80.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.6	173.8	-60.3	0	0	0	0	110.6	I668 Y669 A671 L685 L694 L718 L734 R736	I668-V720 CarbonylContact C-O 3.56Å; I668-V720 WeakPolarHBondContact CA-O 3.46Å; Y669-V720 PolarHBondContact N-O 2.68Å; Y669-V720 PolarHBondContact O-N 2.88Å; A671-V720 HydrophobicContact CB-CG1 4.24Å; A671-V720 HydrophobicContact CB-CG2 3.96Å; L685-V720 HydrophobicContact CD2-CG2 3.64Å; L694-V720 HydrophobicContact CD2-CG1 3.85Å; L718-V720 HydrophobicContact CD1-CG1 3.25Å; V720-L734 HydrophobicContact CB-CB 4.42Å; V720-L734 HydrophobicContact CG2-CB 4.46Å; V720-L734 HydrophobicContact CG2-CD1 4.39Å; V720-L734 HydrophobicContact CG2-CD2 4Å; V720-R736 HydrophobicContact CG1-CB 4.42Å
721	K	88.6	Confident	80.8	Confident	62 Å²	62	73.7 Å²	73.7	27%	0.27	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.1	170.1	-159	172.5	-170.3	177.2	0	110.1	G666 A667 I668 F723 L734 S735 V738 L739	G666-K721 WeakPolarHBondContact O-CE 3.35Å; A667-K721 WeakPolarHBondContact O-CA 3.35Å; I668-K721 HydrophobicContact CG1-CG 4.48Å; K721-F723 HydrophobicContact CB-CE2 4.08Å; K721-F723 HydrophobicContact CB-CZ 4.44Å; K721-F723 HydrophobicContact CD-CE1 4.44Å; K721-F723 HydrophobicContact CD-CE2 4.37Å; K721-F723 HydrophobicContact CD-CZ 3.88Å; K721-F723 HydrophobicContact CG-CE2 4.3Å; K721-F723 HydrophobicContact CG-CZ 4.24Å; K721-L734 WeakPolarHBondContact O-CA 3.36Å; K721-S735 PolarHBondContact N-O 3.28Å; K721-S735 PolarHBondContact O-N 3.43Å; K721-V738 HydrophobicContact CD-CG1 4.1Å; K721-L739 HydrophobicContact CB-CD2 4.07Å; K721-L739 HydrophobicContact CB-CG 4.5Å; K721-L739 HydrophobicContact CD-CD2 4.44Å
722	Y	87	Confident	80.9	Confident	21 Å²	21	71.9 Å²	71.9	8%	0.082	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.9	176.9	178.4	-117	0	0	0	111.4	L663 G666 A667 G724 M732 L734	L663-Y722 HydrophobicContact CB-CD1 3.49Å; L663-Y722 VanDerWaalsContact CB-CD1 3.49Å; L663-Y722 HydrophobicContact CB-CD2 4.5Å; L663-Y722 HydrophobicContact CB-CE1 3.51Å; L663-Y722 HydrophobicContact CB-CG 3.99Å; L663-Y722 HydrophobicContact CD1-CD2 4.18Å; L663-Y722 HydrophobicContact CD1-CE2 4.15Å; L663-Y722 HydrophobicContact CD1-CG 4.38Å; L663-Y722 WeakPolarHBondContact O-CE1 3.47Å; G666-Y722 WeakPolarHBondContact CA-O 3.27Å; G666-Y722 PolarHBondContact N-O 3.36Å; A667-Y722 PolarHBondContact O-N 3.07Å; Y722-G724 WeakPolarHBondContact CE2-O 3.47Å; Y722-G724 WeakPolarHBondContact OH-CA 3.45Å; Y722-M732 HydrophobicContact CE2-CB 3.94Å; Y722-M732 HydrophobicContact CE2-CG 3.91Å; Y722-M732 HydrophobicContact CE2-SD 4.17Å; Y722-L734 HydrophobicContact CD2-CD2 3.77Å; Y722-L734 HydrophobicContact CG-CD2 4.49Å
723	F	85	Confident	80.9	Confident	57 Å²	57	78 Å²	78	25%	0.25	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	30.4	-179.5	-71.8	-75.3	0	0	0	112.6	F665 K721 R733 V738	F665-F723 HydrophobicContact CE1-CD1 4.44Å; F665-F723 HydrophobicContact CE2-CB 4.08Å; F665-F723 HydrophobicContact CE2-CD1 4.17Å; F665-F723 WeakPolarHBondContact CE2-O 3.45Å; F665-F723 AromaticContact CZ-CD1 3.84Å; F665-F723 HydrophobicContact CZ-CD1 3.84Å; K721-F723 HydrophobicContact CB-CE2 4.08Å; K721-F723 HydrophobicContact CB-CZ 4.44Å; K721-F723 HydrophobicContact CD-CE1 4.44Å; K721-F723 HydrophobicContact CD-CE2 4.37Å; K721-F723 HydrophobicContact CD-CZ 3.88Å; K721-F723 HydrophobicContact CG-CE2 4.3Å; K721-F723 HydrophobicContact CG-CZ 4.24Å; F723-R733 HydrophobicContact CB-CB 3.98Å; F723-R733 PolarHBondContact N-O 2.89Å; F723-V738 HydrophobicContact CE2-CG2 4.07Å; F723-V738 HydrophobicContact CZ-CB 4.36Å; F723-V738 HydrophobicContact CZ-CG1 4.19Å; F723-V738 HydrophobicContact CZ-CG2 3.99Å
724	G	82	Confident	81.1	Confident	13 Å²	13	71.9 Å²	71.9	13%	0.134	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.8	-171.8	-178.7	0	0	0	0	0	113	Y722 R733	Y722-G724 WeakPolarHBondContact CE2-O 3.47Å; Y722-G724 WeakPolarHBondContact OH-CA 3.45Å; G724-R733 PolarHBondContact O-N 3.35Å
725	R	77.6	Confident	81.1	Confident	105 Å²	105	67.5 Å²	67.5	40%	0.396	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	147.4	173.6	-71.8	-179.8	172.4	-175.1	-5.3	110.4	E660 P727 G730 R731 M732	E660-R725 IonicContact OE1-CZ 3.39Å; E660-R725 IonicContact OE1-NH1 2.63Å; E660-R725 PolarHBondContact OE1-NH1 3.2Å; E660-R725 IonicContact OE1-NH2 3.15Å; E660-R725 PolarHBondContact OE1-NH2 2.92Å; E660-R725 IonicContact OE2-CZ 2.83Å; E660-R725 IonicContact OE2-NH1 3.29Å; E660-R725 PolarHBondContact OE2-NH1 2.71Å; E660-R725 IonicContact OE2-NH2 3.47Å; E660-R725 PolarHBondContact OE2-NH2 2.65Å; R725-P727 WeakPolarHBondContact O-CD 3.19Å; R725-G730 VanDerWaalsContact CD-O 3.32Å; R725-G730 WeakPolarHBondContact CD-O 3.46Å; R725-R731 CarbonylContact C-O 3.6Å; R725-R731 VanDerWaalsContact CA-O 3.31Å; R725-R731 WeakPolarHBondContact CA-O 3.43Å; R725-M732 HydrophobicContact CG-CG 4.24Å; R725-M732 VanDerWaalsContact NH2-CE 3.32Å
726	D	74.8	Confident	81.3	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.23	33%	0.332	C	S	.	.			trans	-64.6	124.4	170.2	-158.2	-43	0	0	0	109.5	T728 D729 G730 R731	D726-T728 PolarHBondContact O-N 2.85Å; D726-T728 PolarHBondContact OD1-N 2.91Å; D726-T728 PolarHBondContact OD1-OG1 3.41Å; D726-D729 WeakPolarHBondContact CB-OD1 3.47Å; D726-G730 VanDerWaalsContact O-CA 3.29Å; D726-G730 WeakPolarHBondContact O-CA 3.41Å; D726-G730 PolarHBondContact O-N 3.38Å; D726-R731 PolarHBondContact N-O 2.67Å
727	P	64.4	Low	81.2	Confident	125 Å²	125	66.9 Å²	66.9	81%	0.812	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.2	-179.3	21.9	-33.4	0	0	0	114.4	R725	R725-P727 WeakPolarHBondContact O-CD 3.19Å
728	T	63.8	Low	80.9	Confident	127 Å²	127	63.9 Å²	63.9	78%	0.779	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-37.8	-178.6	41.3	0	0	0	0	114.6	D726	D726-T728 PolarHBondContact O-N 2.85Å; D726-T728 PolarHBondContact OD1-N 2.91Å; D726-T728 PolarHBondContact OD1-OG1 3.41Å
729	D	63.9	Low	80.5	Confident	88 Å²	88	65.9 Å²	65.9	47%	0.471	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-2.2	-168.7	46.7	-47.8	0	0	0	112.8	D726 R731	D726-D729 WeakPolarHBondContact CB-OD1 3.47Å; D729-R731 PolarHBondContact O-N 3.24Å
730	G	66.3	Low	79.7	Confident	41 Å²	41	64.8 Å²	64.8	42%	0.423	32%	0.324	S	S	.	.			trans	68.2	4.1	172.3	0	0	0	0	0	114.7	R725 D726	R725-G730 VanDerWaalsContact CD-O 3.32Å; R725-G730 WeakPolarHBondContact CD-O 3.46Å; D726-G730 VanDerWaalsContact O-CA 3.29Å; D726-G730 WeakPolarHBondContact O-CA 3.41Å; D726-G730 PolarHBondContact O-N 3.38Å
731	R	76.6	Confident	78.1	Confident	181 Å²	181	67.6 Å²	67.6	68%	0.683	34%	0.343	S	S	*	.			trans	-77.3	143.3	-178.8	-69.4	-176.9	175.4	-173.2	1	111.3	R725 D726 D729	R725-R731 CarbonylContact C-O 3.6Å; R725-R731 VanDerWaalsContact CA-O 3.31Å; R725-R731 WeakPolarHBondContact CA-O 3.43Å; D726-R731 PolarHBondContact N-O 2.67Å; D729-R731 PolarHBondContact O-N 3.24Å
732	M	82.4	Confident	76	Confident	17 Å²	17	70 Å²	70	8%	0.084	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	135.9	177.1	-66.4	-172.1	-176.9	0	0	111.5	L663 L685 M689 V692 Y722 R725	L663-M732 HydrophobicContact CD1-CE 3.87Å; L663-M732 HydrophobicContact CD1-SD 3.79Å; L685-M732 HydrophobicContact CD1-SD 4.39Å; M689-M732 HydrophobicContact CE-CE 4.02Å; M689-M732 HydrophobicContact CE-SD 3.32Å; M689-M732 WeakPolarHBondContact CE-SD 3.45Å; M689-M732 HydrophobicContact SD-CE 4.43Å; M689-M732 HydrophobicContact SD-SD 4.24Å; V692-M732 HydrophobicContact CG1-CB 4.2Å; V692-M732 WeakPolarHBondContact CG1-O 3.39Å; V692-M732 HydrophobicContact CG2-CB 4.22Å; Y722-M732 HydrophobicContact CE2-CB 3.94Å; Y722-M732 HydrophobicContact CE2-CG 3.91Å; Y722-M732 HydrophobicContact CE2-SD 4.17Å; R725-M732 HydrophobicContact CG-CG 4.24Å; R725-M732 VanDerWaalsContact NH2-CE 3.32Å
733	R	84.7	Confident	73.8	Confident	137 Å²	137	73.8 Å²	73.8	52%	0.517	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	114.7	175.8	-65.4	177	61.3	179.3	-1.1	109.6	F723 G724	F723-R733 HydrophobicContact CB-CB 3.98Å; F723-R733 PolarHBondContact N-O 2.89Å; G724-R733 PolarHBondContact O-N 3.35Å
734	L	89.2	Confident	71.5	Confident	13 Å²	13	74.8 Å²	74.8	7%	0.068	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.7	-178.8	-59.1	175.1	0	0	0	110.5	V683 L685 V692 L694 V720 K721 Y722	V683-L734 HydrophobicContact CG2-CD1 3.73Å; L685-L734 HydrophobicContact CD1-CD2 4.08Å; V692-L734 HydrophobicContact CB-CD1 4.31Å; V692-L734 HydrophobicContact CG1-CD1 4.05Å; L694-L734 HydrophobicContact CD1-CB 3.94Å; L694-L734 VanDerWaalsContact CD1-O 3.22Å; L694-L734 WeakPolarHBondContact CD1-O 3.45Å; V720-L734 HydrophobicContact CB-CB 4.42Å; V720-L734 HydrophobicContact CG2-CB 4.46Å; V720-L734 HydrophobicContact CG2-CD1 4.39Å; V720-L734 HydrophobicContact CG2-CD2 4Å; K721-L734 WeakPolarHBondContact O-CA 3.36Å; Y722-L734 HydrophobicContact CD2-CD2 3.77Å; Y722-L734 HydrophobicContact CG-CD2 4.49Å
735	S	88.2	Confident	69.4	Low	1 Å²	1	80.5 Å²	80.5	1%	0.007	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	129.5	171.6	-166.3	0	0	0	0	112.3	Q698 K721	Q698-S735 PolarHBondContact OE1-OG 3.16Å; K721-S735 PolarHBondContact N-O 3.28Å; K721-S735 PolarHBondContact O-N 3.43Å
736	R	87.9	Confident	67.4	Low	49 Å²	49	81.1 Å²	81.1	19%	0.185	47%	0.467	C	S	.	.	S	Bend	trans	-89.3	-33.2	168.3	-178.9	-179.8	-176.9	-147.1	3.1	111.1	L694 Q698 V720 V738 L739 H740	L694-R736 HydrophobicContact CD2-CB 4.23Å; Q698-R736 PolarHBondContact O-N 3.44Å; V720-R736 HydrophobicContact CG1-CB 4.42Å; R736-V738 PolarHBondContact O-N 3.34Å; R736-L739 WeakPolarHBondContact O-CB 3.46Å; R736-L739 PolarHBondContact O-N 2.95Å; R736-H740 PolarHBondContact NE-NE2 3.27Å; R736-H740 PolarHBondContact O-CD2 2.75Å
737	K	85.8	Confident	65.6	Low	69 Å²	69	84.3 Å²	84.3	30%	0.3	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-51.6	-41.9	-179.5	177.2	178.2	176.5	172.9	0	112.8	S697 Q698 H701 L739 H740	S697-K737 WeakPolarHBondContact O-CD 3.38Å; Q698-K737 PolarHBondContact O-N 3.09Å; H701-K737 WeakPolarHBondContact ND1-CE 3.37Å; H701-K737 PolarHBondContact NE2-O 3.04Å; K737-L739 PolarHBondContact O-N 3.02Å; K737-H740 PolarHBondContact O-N 3.21Å; K737-H740 VanDerWaalsContact O-N 3.15Å
738	V	82.1	Confident	64.2	Low	67 Å²	67	87.5 Å²	87.5	41%	0.406	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-64.4	-21.3	-177.8	-179.8	0	0	0	0	112.7	K721 F723 R736	K721-V738 HydrophobicContact CD-CG1 4.1Å; F723-V738 HydrophobicContact CE2-CG2 4.07Å; F723-V738 HydrophobicContact CZ-CB 4.36Å; F723-V738 HydrophobicContact CZ-CG1 4.19Å; F723-V738 HydrophobicContact CZ-CG2 3.99Å; R736-V738 PolarHBondContact O-N 3.34Å
739	L	80.8	Confident	62.7	Low	50 Å²	50	87.4 Å²	87.4	26%	0.262	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-81.8	-18.8	178.8	-56.2	-179	0	0	0	113.5	I668 Q719 K721 R736 K737	I668-L739 HydrophobicContact CD1-CD2 3.51Å; I668-L739 HydrophobicContact CG1-CD2 3.78Å; I668-L739 HydrophobicContact CG2-CD1 3.9Å; I668-L739 HydrophobicContact CG2-CD2 4.39Å; Q719-L739 HydrophobicContact CB-CD1 3.73Å; Q719-L739 WeakPolarHBondContact O-CD1 3.42Å; K721-L739 HydrophobicContact CB-CD2 4.07Å; K721-L739 HydrophobicContact CB-CG 4.5Å; K721-L739 HydrophobicContact CD-CD2 4.44Å; R736-L739 WeakPolarHBondContact O-CB 3.46Å; R736-L739 PolarHBondContact O-N 2.95Å; K737-L739 PolarHBondContact O-N 3.02Å
740	H	72	Confident	61.2	Low	95 Å²	95	91.4 Å²	91.4	44%	0.44	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-96.7	7.8	-177	-67.6	-62.5	0	0	0	113.5	R736 K737	R736-H740 PolarHBondContact NE-NE2 3.27Å; R736-H740 PolarHBondContact O-CD2 2.75Å; K737-H740 PolarHBondContact O-N 3.21Å; K737-H740 VanDerWaalsContact O-N 3.15Å
741	S	57	Low	59.5	Low	59 Å²	59	95 Å²	95	41%	0.413	53%	0.528	S	S	.	.	S	Bend	trans	-81.5	132.2	175.3	-170.6	0	0	0	0	110.6
742	P	44.2	Very low	57.4	Low	112 Å²	112	95.5 Å²	95.5	73%	0.727	54%	0.538	S	S	*	.			trans	-59.4	144.7	158.3	25.6	-29.5	0	0	0	108.6	A744	P742-A744 PolarHBondContact O-N 3.37Å
743	A	41.4	Very low	54.9	Low	101 Å²	101	104 Å²	104	84%	0.835	58%	0.575	S	S	*	*			trans	-51.2	107.7	-178.3	0	0	0	0	0	110.4	T745	A743-T745 PolarHBondContact O-N 3.11Å
744	A	36.8	Very low	52.2	Low	78 Å²	78	105.6 Å²	105.6	65%	0.645	59%	0.588	S	S	*	*			trans	-75.7	107.6	174	0	0	0	0	0	108.1	P742 V746	P742-A744 PolarHBondContact O-N 3.37Å; A744-V746 PolarHBondContact O-N 3.22Å
745	T	37.6	Very low	49.5	Very low	132 Å²	132	110.5 Å²	110.5	81%	0.81	62%	0.623	S	S	*	*			trans	-57.6	101.3	161.7	-39.7	0	0	0	0	107.6	A743 V747	A743-T745 PolarHBondContact O-N 3.11Å; T745-V747 PolarHBondContact O-N 3.37Å; T745-V747 VanDerWaalsContact O-N 3.08Å
746	V	36.8	Very low	46.8	Very low	119 Å²	119	118.4 Å²	118.4	72%	0.721	66%	0.663	S	S	*	*			trans	-76.1	96.9	170.2	179.5	0	0	0	0	107.2	A744 K748	A744-V746 PolarHBondContact O-N 3.22Å; V746-K748 HydrophobicContact CG1-CG 4.49Å; V746-K748 PolarHBondContact O-N 3.01Å
747	V	36.4	Very low	44.1	Very low	109 Å²	109	120.9 Å²	120.9	66%	0.661	69%	0.688	S	S	*	*			trans	-64.6	110.4	155.8	175.3	0	0	0	0	106.4	T745 T749	T745-V747 PolarHBondContact O-N 3.37Å; T745-V747 VanDerWaalsContact O-N 3.08Å; V747-T749 HydrophobicContact CG1-CG2 4.22Å; V747-T749 PolarHBondContact O-N 3.09Å
748	K	35.5	Very low	41.5	Very low	192 Å²	192	126.5 Å²	126.5	84%	0.835	72%	0.718	S	S	*	*			trans	-74.3	116.7	162.9	-80.1	-176.5	176.5	179	0	107.8	V746	V746-K748 HydrophobicContact CG1-CG 4.49Å; V746-K748 PolarHBondContact O-N 3.01Å
749	T	30.6	Very low	38.9	Very low	125 Å²	125	127.2 Å²	127.2	77%	0.767	74%	0.739	S	S	*	*			trans	-119.8	96.7	160.3	28.3	0	0	0	0	108.6	V747	V747-T749 HydrophobicContact CG1-CG2 4.22Å; V747-T749 PolarHBondContact O-N 3.09Å
750	L	32.3	Very low	36.5	Very low	173 Å²	173	129.3 Å²	129.3	91%	0.906	76%	0.763	S	S	*	*			trans	-94.9	110	154.7	-90.9	157.6	0	0	0	105.7
751	S	31.4	Very low	34.4	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	78%	0.778	S	S	*	*			trans	-80.2	134.7	170.5	37.1	0	0	0	0	109.5
752	E	31.5	Very low	33.1	Very low	191 Å²	191	132.1 Å²	132.1	89%	0.893	79%	0.793	S	S	*	*			trans	-66.8	140.4	178.3	-66.1	172.3	138	0	0	112.9
753	K	30.4	Very low	32.6	Very low	196 Å²	196	132.1 Å²	132.1	85%	0.852	79%	0.791	S	S	*	*			trans	-173.3	122.6	147.4	-100.2	-178.5	-171.3	-176.3	0	105
754	Q	28.8	Very low	32.1	Very low	170 Å²	170	134.2 Å²	134.2	79%	0.794	78%	0.783	S	S	*	*			cis	-150.3	140.5	10.9	-83.2	164.9	-47.2	0	0	108.2
755	S	31.5	Very low	32	Very low	116 Å²	116	140 Å²	140	81%	0.811	79%	0.789	S	S	*	*			trans	-78.1	132.5	157.7	43	0	0	0	0	109.4
756	I	31.7	Very low	31.8	Very low	166 Å²	166	139 Å²	139	85%	0.851	78%	0.779	S	S	*	*			trans	-123.8	114.9	155.5	-62.6	177.3	0	0	0	105.7
757	S	32.2	Very low	31.7	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	78%	0.781	S	S	*	*			trans	-130.6	154.9	161.6	71.8	0	0	0	0	109.3
758	M	30.4	Very low	31.6	Very low	188 Å²	188	139.1 Å²	139.1	93%	0.926	78%	0.778	S	S	*	*			trans	92.5	118.2	162.2	-59.4	-81	-79.7	0	0	117.7
759	G	28.5	Very low	32	Very low	82 Å²	82	137.4 Å²	137.4	85%	0.845	78%	0.778	S	S	*	*			trans	175.1	96.8	163.3	0	0	0	0	0	112.1
760	A	28.9	Very low	32.4	Very low	94 Å²	94	140.4 Å²	140.4	78%	0.777	80%	0.804	S	S	*	*			trans	-78.6	170.9	-171.7	0	0	0	0	0	115.5
761	S	29.6	Very low	32.4	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	80%	0.799	S	S	*	*			trans	95.8	100.6	143.8	71.6	0	0	0	0	120.7
762	S	29.7	Very low	32.4	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	80%	0.798	S	S	*	*				90.5	132.5	111.9	74.1	0	0	0	0	121.4
763	V	32.5	Very low	32.5	Very low	112 Å²	112	137.1 Å²	137.1	68%	0.679	79%	0.792	S	S	*	*			trans	115.7	122.8	136.8	-175.1	0	0	0	0	118.6
764	H	31.9	Very low	32.6	Very low	145 Å²	145	133.6 Å²	133.6	67%	0.671	79%	0.789	S	S	*	*			trans	81.6	113	154.2	-76.3	-30.4	0	0	0	120.2
765	R	32.8	Very low	32.9	Very low	200 Å²	200	131.3 Å²	131.3	76%	0.755	79%	0.789	S	S	*	*				71.4	135.6	89.9	-83.2	-172.6	175.6	174.5	-1.9	111
766	D	34.3	Very low	33	Very low	112 Å²	112	132.3 Å²	132.3	60%	0.599	79%	0.787	S	S	*	*			cis	-165	156.7	13.3	-101.5	-29.7	0	0	0	107
767	N	34.7	Very low	33.1	Very low	143 Å²	143	129.9 Å²	129.9	77%	0.765	78%	0.783	S	S	*	*			trans	55	145.9	141.1	-71	-8	0	0	0	120.7
768	S	35.2	Very low	33.1	Very low	86 Å²	86	132.2 Å²	132.2	60%	0.601	79%	0.788	S	S	*	*			cis	178.8	146.2	-2	45.5	0	0	0	0	105.9
769	D	43.1	Very low	33.3	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	78%	0.777	S	S	*	*				39	138	128.4	-53.3	-22.6	0	0	0	118.6
770	S	39	Very low	33.8	Very low	188 Å²	188	131.6 Å²	131.6	100%	1.315	77%	0.771	S	S	*	*			cis	-165.8	0	28.9	49.5	0	0	0	0	109.7

Retrieved 770 of 770 residues in 218.2 ms (Link to these results)

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