A0A3Q0KND6_SCHMA Loading...

Interleukin enhancer binding factor, putative

AlphaFold DB , UniProt , Accession A0A3Q0KND6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 401 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	35.6	Very low	31.6	Very low	238 Å²	238	170.8 Å²	170.8	100%	1.172	86%	0.863	S	S	*	*				0	99.9	0	-80.2	-178.3	166.5	0	0	108.4	V3	M1-V3 PolarHBondContact O-N 3.01Å
2	A	33.8	Very low	31.4	Very low	107 Å²	107	176.6 Å²	176.6	88%	0.884	87%	0.866	S	S	*	*			trans	-80.5	101.6	-176.9	0	0	0	0	0	110	R4	A2-R4 PolarHBondContact O-N 3.05Å
3	V	33.1	Very low	31.2	Very low	126 Å²	126	181.2 Å²	181.2	76%	0.764	87%	0.868	S	S	*	*			trans	-79.1	107.7	170.6	177.4	0	0	0	0	107.6	M1 T5	M1-V3 PolarHBondContact O-N 3.01Å; V3-T5 PolarHBondContact O-N 3.35Å; V3-T5 VanDerWaalsContact O-N 3.12Å
4	R	31.2	Very low	31.3	Very low	242 Å²	242	176.2 Å²	176.2	91%	0.913	86%	0.862	S	S	*	*			trans	-70.5	97.9	168.4	-92	-179	172	174.3	-2.4	108.6	A2 Q6	A2-R4 PolarHBondContact O-N 3.05Å; R4-Q6 PolarHBondContact O-N 3.33Å
5	T	32.4	Very low	31.2	Very low	118 Å²	118	172.1 Å²	172.1	72%	0.724	85%	0.845	S	S	*	*			trans	-68.9	110.4	168.2	-38.9	0	0	0	0	108.5	V3 Q7	V3-T5 PolarHBondContact O-N 3.35Å; V3-T5 VanDerWaalsContact O-N 3.12Å; T5-Q7 PolarHBondContact O-N 2.83Å
6	Q	32.8	Very low	31.8	Very low	188 Å²	188	169 Å²	169	88%	0.879	84%	0.842	S	S	*	*			trans	-64.3	97.4	166.7	-74	180	-6.5	0	0	108.2	R4 R8	R4-Q6 PolarHBondContact O-N 3.33Å; Q6-R8 PolarHBondContact O-N 2.72Å; Q6-R8 VanDerWaalsContact O-N 3.17Å
7	Q	32.4	Very low	32.2	Very low	186 Å²	186	163.9 Å²	163.9	87%	0.869	83%	0.827	S	S	*	*			trans	-67.7	111.3	168.1	-79.2	-177.6	-14.7	0	0	108.2	T5 A9	T5-Q7 PolarHBondContact O-N 2.83Å; Q7-A9 PolarHBondContact O-N 3Å
8	R	27.1	Very low	32.9	Very low	242 Å²	242	164.1 Å²	164.1	91%	0.913	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-48.1	132.1	168.9	-84.2	177.1	164.4	179.2	-5.3	109.6	Q6	Q6-R8 PolarHBondContact O-N 2.72Å; Q6-R8 VanDerWaalsContact O-N 3.17Å
9	A	29.5	Very low	33.7	Very low	84 Å²	84	161.9 Å²	161.9	69%	0.694	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-51.6	137.7	172.9	0	0	0	0	0	110.3	Q7 Y11	Q7-A9 PolarHBondContact O-N 3Å; A9-Y11 PolarHBondContact O-N 2.82Å
10	P	30.3	Very low	34.7	Very low	121 Å²	121	156.8 Å²	156.8	79%	0.786	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-65.3	123.8	179	27.5	-31	0	0	0	108	R12	P10-R12 PolarHBondContact O-N 2.84Å
11	Y	29.6	Very low	36.4	Very low	227 Å²	227	155.1 Å²	155.1	89%	0.89	81%	0.809	S	S	*	*			trans	-48.5	109.4	164.9	-99.9	-98.7	0	0	0	107.7	A9 R13	A9-Y11 PolarHBondContact O-N 2.82Å; Y11-R13 VanDerWaalsContact C-N 3.35Å; Y11-R13 PolarHBondContact O-N 2.78Å
12	R	28.6	Very low	38.2	Very low	240 Å²	240	148.8 Å²	148.8	91%	0.906	78%	0.775	S	S	*	*			trans	-57.2	103.9	167	-96.5	-173.2	178.8	-169.9	1	106.3	P10 S14	P10-R12 PolarHBondContact O-N 2.84Å; R12-S14 PolarHBondContact O-N 3.38Å
13	R	29.3	Very low	40.3	Very low	237 Å²	237	148.6 Å²	148.6	89%	0.894	76%	0.763	S	S	*	*			trans	-56.2	112	157.4	-75.3	-177.6	175.9	-179.2	-1.7	105.5	Y11 N15	Y11-R13 VanDerWaalsContact C-N 3.35Å; Y11-R13 PolarHBondContact O-N 2.78Å; R13-N15 PolarHBondContact O-N 3.31Å; R13-N15 VanDerWaalsContact O-N 3.11Å
14	S	32.7	Very low	42.6	Very low	111 Å²	111	145.7 Å²	145.7	78%	0.776	75%	0.747	S	S	*	*			trans	-53.6	118.6	168.6	39.5	0	0	0	0	107.3	R12 P16	R12-S14 PolarHBondContact O-N 3.38Å; S14-P16 WeakPolarHBondContact O-CD 3Å
15	N	30.6	Very low	45.1	Very low	115 Å²	115	139.1 Å²	139.1	62%	0.615	73%	0.726	S	S	*	*			trans	-66.2	124.9	178.6	-133.9	3.1	0	0	0	107.2	R13 S17	R13-N15 PolarHBondContact O-N 3.31Å; R13-N15 VanDerWaalsContact O-N 3.11Å; N15-S17 PolarHBondContact ND2-OG 3.38Å; N15-S17 PolarHBondContact O-N 3.05Å
16	P	40.2	Very low	47.5	Very low	122 Å²	122	141.5 Å²	141.5	79%	0.792	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	7.8	176	2.3	6.2	0	0	0	113.6	S14	S14-P16 WeakPolarHBondContact O-CD 3Å
17	S	39.1	Very low	49.7	Very low	83 Å²	83	133.9 Å²	133.9	58%	0.58	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	8.2	-169	70.7	0	0	0	0	115.1	N15	N15-S17 PolarHBondContact ND2-OG 3.38Å; N15-S17 PolarHBondContact O-N 3.05Å
18	Q	44.3	Very low	52.2	Low	167 Å²	167	128.7 Å²	128.7	78%	0.78	67%	0.671	S	S	*	*	S	Bend	trans	-95.9	-7.2	-178.3	-78.8	-170.7	-1.4	0	0	115.1
19	T	47.4	Very low	55.2	Low	123 Å²	123	117.8 Å²	117.8	76%	0.755	63%	0.631	S	S	*	*	S	Bend	trans	-109.3	108	167.4	55.3	0	0	0	0	107.4
20	G	55	Low	57.8	Low	59 Å²	59	115.9 Å²	115.9	61%	0.608	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-54.9	168.5	171.5	0	0	0	0	0	111.8	F22	G20-F22 PolarHBondContact O-N 3.29Å
21	P	70	Confident	60.5	Low	122 Å²	122	110.7 Å²	110.7	79%	0.792	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-53.6	134.5	179.7	23.7	-33.1	0	0	0	110.2	T23	P21-T23 PolarHBondContact O-N 2.63Å; P21-T23 PolarHBondContact O-OG1 2.91Å
22	F	73.3	Confident	63.2	Low	104 Å²	104	103 Å²	103	46%	0.456	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-53.5	117.5	176.2	172.9	-100.5	0	0	0	109.4	G20 P24 R294	G20-F22 PolarHBondContact O-N 3.29Å; F22-P24 HydrophobicContact CD1-CB 4.49Å; F22-P24 HydrophobicContact CE1-CB 3.79Å; F22-P24 HydrophobicContact CZ-CB 4.45Å; F22-P24 WeakPolarHBondContact O-CD 3.4Å; F22-R294 VanDerWaalsContact CE2-NH2 3.32Å
23	T	78.2	Confident	65.9	Low	103 Å²	103	96.9 Å²	96.9	63%	0.632	53%	0.533	S	S	*	.			trans	-98	107.8	175.8	-57.3	0	0	0	0	107.6	P21 Q25	P21-T23 PolarHBondContact O-N 2.63Å; P21-T23 PolarHBondContact O-OG1 2.91Å; T23-Q25 PolarHBondContact O-N 2.93Å
24	P	80.3	Confident	68.2	Low	66 Å²	66	90.5 Å²	90.5	43%	0.429	51%	0.513	S	S	.	.			trans	-63.8	124.9	-178.4	23.9	-31.3	0	0	0	110.3	F22 T282	F22-P24 HydrophobicContact CD1-CB 4.49Å; F22-P24 HydrophobicContact CE1-CB 3.79Å; F22-P24 HydrophobicContact CZ-CB 4.45Å; F22-P24 WeakPolarHBondContact O-CD 3.4Å; P24-T282 HydrophobicContact CB-CG2 3.56Å
25	Q	84.5	Confident	69.9	Low	103 Å²	103	88 Å²	88	48%	0.481	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-100.6	127.2	170.3	-64.8	-173.7	-5.9	0	0	109.3	T23 P27 S280 S281 T282	T23-Q25 PolarHBondContact O-N 2.93Å; Q25-P27 VanDerWaalsContact O-CD 3.26Å; Q25-P27 WeakPolarHBondContact O-CD 3.34Å; Q25-S280 PolarHBondContact N-O 2.86Å; Q25-S281 CarbonylContact O-C 3.47Å; Q25-S281 WeakPolarHBondContact O-CA 3.48Å; Q25-T282 PolarHBondContact O-N 2.89Å
26	F	82.3	Confident	71.8	Confident	169 Å²	169	88.8 Å²	88.8	74%	0.741	50%	0.498	S	S	*	.			trans	-85.8	112.5	172.4	-68.4	-84.4	0	0	0	108.5	T282	F26-T282 HydrophobicContact CD1-CG2 3.99Å; F26-T282 HydrophobicContact CE1-CG2 3.81Å; F26-T282 HydrophobicContact CE2-CG2 4.45Å; F26-T282 HydrophobicContact CG-CG2 4.4Å; F26-T282 HydrophobicContact CZ-CG2 4.06Å
27	P	79	Confident	73.2	Confident	27 Å²	27	88.9 Å²	88.9	18%	0.175	49%	0.492	C	S	.	.			trans	-64.1	153.7	177.6	27.1	-36	0	0	0	110.9	Q25 D29 F276	Q25-P27 VanDerWaalsContact O-CD 3.26Å; Q25-P27 WeakPolarHBondContact O-CD 3.34Å; P27-D29 PolarHBondContact O-N 2.86Å; P27-D29 VanDerWaalsContact O-N 3.12Å; P27-F276 HydrophobicContact CB-CB 4.39Å; P27-F276 HydrophobicContact CB-CD2 4.21Å; P27-F276 HydrophobicContact CG-CB 4.25Å; P27-F276 HydrophobicContact CG-CD2 3.29Å; P27-F276 HydrophobicContact CG-CE2 3.99Å; P27-F276 HydrophobicContact CG-CG 4.19Å
28	L	86.3	Confident	74.3	Confident	77 Å²	77	85.8 Å²	85.8	40%	0.403	47%	0.468	S	S	.	.			trans	-63.9	114.5	179.9	-177.9	70	0	0	0	110.3	L30 L33 S274 I387	L28-L30 HydrophobicContact CD1-CD2 4.45Å; L28-L30 HydrophobicContact CD2-CD2 4.23Å; L28-L30 HydrophobicContact CG-CD2 4.33Å; L28-L33 HydrophobicContact CD1-CD1 3.45Å; L28-L33 VanDerWaalsContact CD1-CD1 3.45Å; L28-S274 PolarHBondContact O-OG 3.02Å; L28-I387 HydrophobicContact CD2-CD1 4.06Å
29	D	89.6	Confident	75.3	Confident	13 Å²	13	81.8 Å²	81.8	7%	0.07	45%	0.452	C	S	.	.			trans	-118.1	96	173.7	-171.2	-13.7	0	0	0	109	P27 V31 M32 L33 Y248 R267 L271	P27-D29 PolarHBondContact O-N 2.86Å; P27-D29 VanDerWaalsContact O-N 3.12Å; D29-V31 PolarHBondContact O-N 3Å; D29-V31 VanDerWaalsContact O-N 3.16Å; D29-V31 PolarHBondContact OD1-N 3.04Å; D29-M32 HydrophobicContact CB-CB 4.25Å; D29-M32 HydrophobicContact CB-CG 4.04Å; D29-M32 PolarHBondContact O-N 3Å; D29-M32 WeakPolarHBondContact OD2-CG 3.47Å; D29-L33 PolarHBondContact O-N 3.32Å; D29-Y248 PolarHBondContact OD2-OH 3.2Å; D29-R267 IonicContact OD1-CZ 3.56Å; D29-R267 IonicContact OD1-NE 2.98Å; D29-R267 PolarHBondContact OD1-NE 3.17Å; D29-R267 IonicContact OD1-NH2 3.33Å; D29-R267 PolarHBondContact OD1-NH2 3.14Å; D29-R267 IonicContact OD2-CZ 3.43Å; D29-R267 IonicContact OD2-NE 3.4Å; D29-R267 PolarHBondContact OD2-NE 3.15Å; D29-R267 IonicContact OD2-NH2 2.68Å; D29-R267 PolarHBondContact OD2-NH2 3.2Å; D29-L271 HydrophobicContact CB-CD2 3.65Å
30	L	84.5	Confident	76.3	Confident	44 Å²	44	78.2 Å²	78.2	23%	0.23	43%	0.43	C	S	.	.	H	α-helix	trans	-56.8	-34.5	-176	-67.5	172.4	0	0	0	111.6	L28 M32 L33 E34 I38	L28-L30 HydrophobicContact CD1-CD2 4.45Å; L28-L30 HydrophobicContact CD2-CD2 4.23Å; L28-L30 HydrophobicContact CG-CD2 4.33Å; L30-M32 PolarHBondContact O-N 3.16Å; L30-L33 PolarHBondContact O-N 3.12Å; L30-E34 CarbonylContact O-C 3.56Å; L30-E34 PolarHBondContact O-N 3.2Å; L30-I38 HydrophobicContact CB-CD1 3.26Å; L30-I38 HydrophobicContact CB-CG1 3.6Å; L30-I38 HydrophobicContact CD1-CG1 4.26Å; L30-I38 WeakPolarHBondContact O-CD1 3.44Å
31	V	85.9	Confident	76.8	Confident	12 Å²	12	80.9 Å²	80.9	7%	0.073	45%	0.447	C	S	.	.	H	α-helix	trans	-66.9	-29	-177.2	171.9	0	0	0	0	111.2	D29 I38 N253 P254 L259 R267	D29-V31 PolarHBondContact O-N 3Å; D29-V31 VanDerWaalsContact O-N 3.16Å; D29-V31 PolarHBondContact OD1-N 3.04Å; V31-I38 VanDerWaalsContact CA-CD1 3.41Å; V31-I38 HydrophobicContact CB-CD1 4.01Å; V31-I38 HydrophobicContact CG2-CD1 3.38Å; V31-N253 HydrophobicContact CG1-CB 3.82Å; V31-P254 WeakPolarHBondContact O-CD 3.4Å; V31-L259 HydrophobicContact CG1-CD1 4.1Å; V31-L259 HydrophobicContact CG2-CD1 4.49Å; V31-R267 HydrophobicContact CB-CG 4.42Å; V31-R267 HydrophobicContact CG2-CB 4.16Å; V31-R267 HydrophobicContact CG2-CG 3.74Å
32	M	86.7	Confident	76.9	Confident	66 Å²	66	80 Å²	80	33%	0.325	44%	0.436	S	S	.	.	H	α-helix	trans	-77.5	-32.6	176.5	-66.9	-58.2	-158.4	0	0	112.8	D29 L30 N252 P254	D29-M32 HydrophobicContact CB-CB 4.25Å; D29-M32 HydrophobicContact CB-CG 4.04Å; D29-M32 PolarHBondContact O-N 3Å; D29-M32 WeakPolarHBondContact OD2-CG 3.47Å; L30-M32 PolarHBondContact O-N 3.16Å; M32-N252 HydrophobicContact CE-CB 4.16Å; M32-N252 WeakPolarHBondContact CE-ND2 3.46Å; M32-N252 WeakPolarHBondContact CE-O 3.48Å; M32-N252 WeakPolarHBondContact CE-OD1 3.08Å; M32-P254 HydrophobicContact SD-CG 4.18Å
33	L	84.3	Confident	77.4	Confident	112 Å²	112	75.4 Å²	75.4	59%	0.586	42%	0.416	S	S	*	.	H	α-helix	trans	-90.3	-50.2	-174.8	-64.6	171.3	0	0	0	112.1	L28 D29 L30	L28-L33 HydrophobicContact CD1-CD1 3.45Å; L28-L33 VanDerWaalsContact CD1-CD1 3.45Å; D29-L33 PolarHBondContact O-N 3.32Å; L30-L33 PolarHBondContact O-N 3.12Å
34	E	78.4	Confident	78	Confident	103 Å²	103	76.5 Å²	76.5	48%	0.481	41%	0.414	S	S	.	.			trans	-144	74.7	-168.6	-72.6	-64.3	166.4	0	0	110.3	L30 N36 L37	L30-E34 CarbonylContact O-C 3.56Å; L30-E34 PolarHBondContact O-N 3.2Å; E34-N36 PolarHBondContact O-N 3.3Å; E34-L37 HydrophobicContact CB-CB 4.21Å; E34-L37 HydrophobicContact CB-CD1 3.58Å; E34-L37 HydrophobicContact CB-CG 3.89Å; E34-L37 HydrophobicContact CG-CD1 3.84Å; E34-L37 PolarHBondContact O-N 2.8Å; E34-L37 VanDerWaalsContact O-N 3.1Å
35	P	68.9	Low	78.6	Confident	57 Å²	57	80.6 Å²	80.6	37%	0.37	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.9	-174.3	22.1	-32.6	0	0	0	113.3	I39	P35-I39 WeakPolarHBondContact O-CG1 3.41Å
36	N	70.9	Confident	79	Confident	132 Å²	132	75.7 Å²	75.7	71%	0.706	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-75.9	-23.7	-179.2	-64.3	-28.6	0	0	0	113.5	E34 I38	E34-N36 PolarHBondContact O-N 3.3Å; N36-I38 VanDerWaalsContact C-N 3.3Å; N36-I38 PolarHBondContact O-N 3.26Å
37	L	68	Low	79.6	Confident	124 Å²	124	69.6 Å²	69.6	65%	0.649	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-77.8	-13.9	-176.1	-70.2	180	0	0	0	113.8	E34	E34-L37 HydrophobicContact CB-CB 4.21Å; E34-L37 HydrophobicContact CB-CD1 3.58Å; E34-L37 HydrophobicContact CB-CG 3.89Å; E34-L37 HydrophobicContact CG-CD1 3.84Å; E34-L37 PolarHBondContact O-N 2.8Å; E34-L37 VanDerWaalsContact O-N 3.1Å
38	I	62.2	Low	80.3	Confident	18 Å²	18	73.3 Å²	73.3	9%	0.092	39%	0.392	C	S	.	.	S	Bend	trans	-100	-16.4	-169.5	-57.4	155.1	0	0	0	111.8	L30 V31 N36 P40	L30-I38 HydrophobicContact CB-CD1 3.26Å; L30-I38 HydrophobicContact CB-CG1 3.6Å; L30-I38 HydrophobicContact CD1-CG1 4.26Å; L30-I38 WeakPolarHBondContact O-CD1 3.44Å; V31-I38 VanDerWaalsContact CA-CD1 3.41Å; V31-I38 HydrophobicContact CB-CD1 4.01Å; V31-I38 HydrophobicContact CG2-CD1 3.38Å; N36-I38 VanDerWaalsContact C-N 3.3Å; N36-I38 PolarHBondContact O-N 3.26Å; I38-P40 WeakPolarHBondContact O-CD 3.29Å
39	I	65.2	Low	80.7	Confident	84 Å²	84	70.9 Å²	70.9	43%	0.431	38%	0.381	S	S	.	.			trans	-86.2	105	-173.3	-50.4	-179.3	0	0	0	108	P35 H263	P35-I39 WeakPolarHBondContact O-CG1 3.41Å; I39-H263 WeakPolarHBondContact CG1-CE1 3.45Å; I39-H263 VanDerWaalsContact CG2-CE1 3.41Å; I39-H263 WeakPolarHBondContact CG2-CE1 3.47Å
40	P	68.9	Low	81.1	Confident	47 Å²	47	70.2 Å²	70.2	31%	0.305	38%	0.377	S	S	.	.			trans	-65.6	139.9	170.7	-9.4	28.1	0	0	0	108	I38 D42 D43	I38-P40 WeakPolarHBondContact O-CD 3.29Å; P40-D42 PolarHBondContact O-N 3.43Å; P40-D42 VanDerWaalsContact O-N 3.09Å; P40-D43 HydrophobicContact CB-CB 4.29Å; P40-D43 HydrophobicContact CG-CB 4.08Å
41	A	65.5	Low	81.7	Confident	116 Å²	116	71.8 Å²	71.8	96%	0.959	39%	0.385	S	S	*	.	S	Bend	trans	-57.6	-27.7	-175.7	0	0	0	0	0	113.7
42	D	72.5	Confident	82.1	Confident	103 Å²	103	75.3 Å²	75.3	55%	0.551	40%	0.404	S	S	*	.			trans	-136.6	101.7	170	178.5	17.5	0	0	0	110.4	P40 Q44	P40-D42 PolarHBondContact O-N 3.43Å; P40-D42 VanDerWaalsContact O-N 3.09Å; D42-Q44 WeakPolarHBondContact OD1-CB 3.47Å; D42-Q44 PolarHBondContact OD1-N 2.84Å
43	D	84.3	Confident	82.6	Confident	7 Å²	7	73 Å²	73	4%	0.037	39%	0.393	C	S	.	.			trans	-115.1	17.9	177.8	-155.2	27	0	0	0	112.2	P40 K45 L46 L47 N262 R266	P40-D43 HydrophobicContact CB-CB 4.29Å; P40-D43 HydrophobicContact CG-CB 4.08Å; D43-K45 VanDerWaalsContact C-N 3.29Å; D43-K45 PolarHBondContact O-N 3.1Å; D43-L46 PolarHBondContact O-N 3.07Å; D43-L46 VanDerWaalsContact OD1-CB 3.24Å; D43-L46 WeakPolarHBondContact OD1-CB 3.36Å; D43-L47 PolarHBondContact O-N 3.26Å; D43-L47 VanDerWaalsContact O-N 3.14Å; D43-N262 WeakPolarHBondContact CB-ND2 3.39Å; D43-N262 PolarHBondContact OD2-ND2 3.48Å; D43-R266 IonicContact OD1-CZ 3.42Å; D43-R266 IonicContact OD1-NE 3.3Å; D43-R266 PolarHBondContact OD1-NE 3Å; D43-R266 IonicContact OD1-NH2 2.7Å; D43-R266 PolarHBondContact OD1-NH2 2.93Å; D43-R266 IonicContact OD2-CZ 3.79Å; D43-R266 IonicContact OD2-NE 2.87Å; D43-R266 PolarHBondContact OD2-NE 2.96Å; D43-R266 IonicContact OD2-NH2 3.81Å
44	Q	90.6	Very high	83.1	Confident	126 Å²	126	69.3 Å²	69.3	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-65	-33.8	-178.9	-68.7	-64	-19.9	0	0	112.2	D42 L46 L47 Q48	D42-Q44 WeakPolarHBondContact OD1-CB 3.47Å; D42-Q44 PolarHBondContact OD1-N 2.84Å; Q44-L46 VanDerWaalsContact C-N 3.33Å; Q44-L46 PolarHBondContact O-N 2.88Å; Q44-L47 PolarHBondContact O-N 3.25Å; Q44-Q48 PolarHBondContact O-N 3.49Å
45	K	91.6	Very high	84	Confident	153 Å²	153	66.7 Å²	66.7	67%	0.665	37%	0.373	S	S	*	.	H	α-helix	trans	-61.6	-41.2	176.2	-66.8	-179.5	-175.6	174.1	0	112.1	D43 C49 Y323	D43-K45 VanDerWaalsContact C-N 3.29Å; D43-K45 PolarHBondContact O-N 3.1Å; K45-C49 WeakPolarHBondContact O-CB 3.41Å; K45-C49 PolarHBondContact O-N 2.92Å; K45-C49 VanDerWaalsContact O-N 3.08Å; K45-Y323 HydrophobicContact CB-CD2 4.32Å; K45-Y323 HydrophobicContact CB-CE2 3.99Å
46	L	93.2	Very high	85.2	Confident	0 Å²	0	71 Å²	71	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-66.3	-45.4	175.3	175.4	59.6	0	0	0	110.2	D43 Q44 Q48 C49 L50 N262 F265 R266 L318 Y323	D43-L46 PolarHBondContact O-N 3.07Å; D43-L46 VanDerWaalsContact OD1-CB 3.24Å; D43-L46 WeakPolarHBondContact OD1-CB 3.36Å; Q44-L46 VanDerWaalsContact C-N 3.33Å; Q44-L46 PolarHBondContact O-N 2.88Å; L46-Q48 PolarHBondContact O-N 3.01Å; L46-C49 PolarHBondContact O-N 3.45Å; L46-L50 HydrophobicContact CD1-CD1 3.9Å; L46-L50 HydrophobicContact CD1-CG 3.99Å; L46-L50 HydrophobicContact CD2-CD1 4.44Å; L46-L50 HydrophobicContact CG-CD1 3.76Å; L46-L50 HydrophobicContact CG-CG 4.31Å; L46-L50 VanDerWaalsContact O-CG 3.26Å; L46-L50 WeakPolarHBondContact O-CG 3.26Å; L46-L50 PolarHBondContact O-N 2.81Å; L46-N262 HydrophobicContact CB-CB 4.47Å; L46-N262 HydrophobicContact CD2-CB 4.02Å; L46-N262 HydrophobicContact CG-CB 4.09Å; L46-F265 HydrophobicContact CD1-CD1 4.1Å; L46-F265 HydrophobicContact CD1-CE1 4.21Å; L46-F265 HydrophobicContact CD2-CD1 4.35Å; L46-R266 HydrophobicContact CD2-CG 3.97Å; L46-L318 HydrophobicContact CD1-CD1 3.78Å; L46-L318 HydrophobicContact CD2-CD1 3.81Å; L46-L318 HydrophobicContact CG-CD1 4.45Å; L46-Y323 HydrophobicContact CB-CD1 4.4Å; L46-Y323 HydrophobicContact CB-CD2 4.31Å; L46-Y323 HydrophobicContact CB-CE1 4.1Å; L46-Y323 HydrophobicContact CB-CE2 4.01Å; L46-Y323 HydrophobicContact CB-CG 4.5Å; L46-Y323 HydrophobicContact CD1-CD1 3.75Å; L46-Y323 HydrophobicContact CD1-CE1 4.07Å; L46-Y323 HydrophobicContact CD1-CG 4.09Å; L46-Y323 HydrophobicContact CD2-CE1 4.49Å; L46-Y323 HydrophobicContact CG-CE1 4.44Å
47	L	94.9	Very high	86.4	Confident	40 Å²	40	65.5 Å²	65.5	21%	0.209	36%	0.356	C	S	.	.	H	α-helix	trans	-57.3	-48.8	178.3	-178.7	59.6	0	0	0	111.7	D43 Q44 C49 L50 L51 L261 N262	D43-L47 PolarHBondContact O-N 3.26Å; D43-L47 VanDerWaalsContact O-N 3.14Å; Q44-L47 PolarHBondContact O-N 3.25Å; L47-C49 VanDerWaalsContact C-N 3.35Å; L47-C49 PolarHBondContact O-N 3.11Å; L47-L50 PolarHBondContact O-N 3.28Å; L47-L51 HydrophobicContact CD1-CD1 4.23Å; L47-L51 HydrophobicContact CD1-CG 4.28Å; L47-L51 HydrophobicContact CG-CD1 4.12Å; L47-L51 WeakPolarHBondContact O-CG 3.15Å; L47-L51 PolarHBondContact O-N 3.22Å; L47-L261 HydrophobicContact CD1-CB 3.91Å; L47-L261 HydrophobicContact CD1-CD2 4.33Å; L47-N262 HydrophobicContact CB-CB 4.14Å; L47-N262 HydrophobicContact CD1-CB 4.5Å
48	Q	94.8	Very high	87.8	Confident	105 Å²	105	61.5 Å²	61.5	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-60.6	-44.9	178	-170.9	61.6	46.8	0	0	111.4	Q44 L46 L50 L51 D52	Q44-Q48 PolarHBondContact O-N 3.49Å; L46-Q48 PolarHBondContact O-N 3.01Å; Q48-L50 VanDerWaalsContact C-N 3.32Å; Q48-L50 PolarHBondContact O-N 3.37Å; Q48-L51 PolarHBondContact O-N 2.93Å; Q48-D52 PolarHBondContact NE2-OD1 2.68Å; Q48-D52 WeakPolarHBondContact O-CB 3.37Å; Q48-D52 PolarHBondContact O-N 3.07Å
49	C	94.7	Very high	89.4	Confident	26 Å²	26	60.8 Å²	60.8	18%	0.176	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-41.8	177.3	-171.7	0	0	0	0	112.2	K45 L46 L47 H53 F327	K45-C49 WeakPolarHBondContact O-CB 3.41Å; K45-C49 PolarHBondContact O-N 2.92Å; K45-C49 VanDerWaalsContact O-N 3.08Å; L46-C49 PolarHBondContact O-N 3.45Å; L47-C49 VanDerWaalsContact C-N 3.35Å; L47-C49 PolarHBondContact O-N 3.11Å; C49-H53 VanDerWaalsContact O-CB 3.32Å; C49-H53 WeakPolarHBondContact O-CB 3.39Å; C49-H53 PolarHBondContact O-N 3.45Å; C49-F327 VanDerWaalsContact SG-CD2 3.52Å; C49-F327 VanDerWaalsContact SG-CE2 3.51Å
50	L	96.8	Very high	90.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-41	177.1	-69.9	166.2	0	0	0	112.1	L46 L47 Q48 H54 I223 L261 N262 F265 F327	L46-L50 HydrophobicContact CD1-CD1 3.9Å; L46-L50 HydrophobicContact CD1-CG 3.99Å; L46-L50 HydrophobicContact CD2-CD1 4.44Å; L46-L50 HydrophobicContact CG-CD1 3.76Å; L46-L50 HydrophobicContact CG-CG 4.31Å; L46-L50 VanDerWaalsContact O-CG 3.26Å; L46-L50 WeakPolarHBondContact O-CG 3.26Å; L46-L50 PolarHBondContact O-N 2.81Å; L47-L50 PolarHBondContact O-N 3.28Å; Q48-L50 VanDerWaalsContact C-N 3.32Å; Q48-L50 PolarHBondContact O-N 3.37Å; L50-H54 VanDerWaalsContact O-CB 3.26Å; L50-H54 WeakPolarHBondContact O-CB 3.19Å; L50-H54 PolarHBondContact O-N 3.5Å; L50-I223 HydrophobicContact CB-CD1 4.25Å; L50-I223 HydrophobicContact CD2-CD1 3.81Å; L50-L261 HydrophobicContact CB-CD2 3.81Å; L50-L261 HydrophobicContact CB-CG 4.29Å; L50-L261 HydrophobicContact CD1-CG 4.11Å; L50-N262 HydrophobicContact CD1-CB 4.22Å; L50-F265 HydrophobicContact CD1-CB 3.75Å; L50-F265 HydrophobicContact CD1-CD1 4.1Å; L50-F265 HydrophobicContact CD1-CG 3.9Å; L50-F265 HydrophobicContact CD2-CB 4.3Å; L50-F265 HydrophobicContact CD2-CD1 3.88Å; L50-F265 HydrophobicContact CD2-CD2 3.57Å; L50-F265 HydrophobicContact CD2-CE1 3.99Å; L50-F265 HydrophobicContact CD2-CE2 3.7Å; L50-F265 HydrophobicContact CD2-CG 3.65Å; L50-F265 HydrophobicContact CD2-CZ 3.89Å; L50-F265 HydrophobicContact CG-CG 4.44Å; L50-F327 HydrophobicContact CD2-CE1 4.33Å; L50-F327 HydrophobicContact CD2-CZ 3.64Å
51	L	96.8	Very high	92	Very high	76 Å²	76	61.1 Å²	61.1	40%	0.398	34%	0.342	S	S	.	.	H	α-helix	trans	-68.8	-44.7	178.3	-68.3	174.7	0	0	0	111.8	L47 Q48 H53 H54 G55 L261	L47-L51 HydrophobicContact CD1-CD1 4.23Å; L47-L51 HydrophobicContact CD1-CG 4.28Å; L47-L51 HydrophobicContact CG-CD1 4.12Å; L47-L51 WeakPolarHBondContact O-CG 3.15Å; L47-L51 PolarHBondContact O-N 3.22Å; Q48-L51 PolarHBondContact O-N 2.93Å; L51-H53 VanDerWaalsContact C-N 3.3Å; L51-H53 PolarHBondContact O-N 3.14Å; L51-H54 WeakPolarHBondContact O-CB 3.29Å; L51-H54 PolarHBondContact O-N 3.49Å; L51-G55 PolarHBondContact O-N 2.84Å; L51-L261 HydrophobicContact CD2-CD2 3.99Å
52	D	95.7	Very high	93.3	Very high	87 Å²	87	61.6 Å²	61.6	47%	0.465	33%	0.329	S	S	.	.	H	α-helix	trans	-60.9	-42.5	176.2	-68.7	-14.8	0	0	0	111	Q48 G55 K56	Q48-D52 PolarHBondContact NE2-OD1 2.68Å; Q48-D52 WeakPolarHBondContact O-CB 3.37Å; Q48-D52 PolarHBondContact O-N 3.07Å; D52-G55 PolarHBondContact O-N 3.48Å; D52-K56 PolarHBondContact O-N 3.05Å
53	H	95.7	Very high	94.3	Very high	18 Å²	18	57.2 Å²	57.2	8%	0.083	31%	0.306	C	S	.	.	H	α-helix	trans	-67.1	-43.7	176.2	-166.1	72.5	0	0	0	111.7	C49 L51 G55 K56 L57 D226 R230 F327	C49-H53 VanDerWaalsContact O-CB 3.32Å; C49-H53 WeakPolarHBondContact O-CB 3.39Å; C49-H53 PolarHBondContact O-N 3.45Å; L51-H53 VanDerWaalsContact C-N 3.3Å; L51-H53 PolarHBondContact O-N 3.14Å; H53-G55 VanDerWaalsContact C-N 3.26Å; H53-G55 PolarHBondContact O-N 3.02Å; H53-K56 WeakPolarHBondContact O-CB 3.28Å; H53-K56 PolarHBondContact O-N 2.88Å; H53-K56 VanDerWaalsContact O-N 3.09Å; H53-L57 WeakPolarHBondContact O-CG 3.09Å; H53-L57 PolarHBondContact O-N 2.98Å; H53-D226 IonicContact CD2-OD1 3.71Å; H53-D226 IonicContact CE1-OD1 3.59Å; H53-D226 IonicContact NE2-OD1 3.95Å; H53-D226 PolarHBondContact NE2-OD1 2.61Å; H53-R230 PolarHBondContact CE1-NH2 3.32Å; H53-R230 PolarHBondContact NE2-NH2 2.82Å; H53-F327 HydrophobicContact CB-CD1 3.89Å; H53-F327 HydrophobicContact CB-CE1 4.08Å; H53-F327 HydrophobicContact CB-CG 4.3Å; H53-F327 AromaticContact CD2-CD1 3.49Å; H53-F327 VanDerWaalsContact CD2-CD1 3.49Å; H53-F327 WeakPolarHBondContact CD2-CD1 3.41Å; H53-F327 AromaticContact CD2-CE1 3.85Å; H53-F327 AromaticContact CE1-CD1 3.85Å; H53-F327 AromaticContact CG-CD1 3.29Å; H53-F327 AromaticContact CG-CE1 3.82Å; H53-F327 AromaticContact CG-CG 3.89Å; H53-F327 AromaticContact ND1-CD1 3.56Å; H53-F327 AromaticContact ND1-CG 3.84Å; H53-F327 AromaticContact NE2-CD1 3.85Å
54	H	96.5	Very high	94.8	Very high	33 Å²	33	59.6 Å²	59.6	15%	0.153	32%	0.317	C	S	.	.	H	α-helix	trans	-56.4	-40.4	175.2	171.1	40.3	0	0	0	112.3	L50 L51 K56 L57 T58 V219 R222	L50-H54 VanDerWaalsContact O-CB 3.26Å; L50-H54 WeakPolarHBondContact O-CB 3.19Å; L50-H54 PolarHBondContact O-N 3.5Å; L51-H54 WeakPolarHBondContact O-CB 3.29Å; L51-H54 PolarHBondContact O-N 3.49Å; H54-K56 VanDerWaalsContact C-N 3.29Å; H54-K56 PolarHBondContact O-N 3.23Å; H54-L57 PolarHBondContact O-N 2.68Å; H54-L57 VanDerWaalsContact O-N 3.08Å; H54-T58 PolarHBondContact CE1-OG1 3.37Å; H54-T58 PolarHBondContact O-N 3.39Å; H54-T58 VanDerWaalsContact O-N 3.15Å; H54-T58 PolarHBondContact O-OG1 3.42Å; H54-V219 HydrophobicContact CB-CG1 3.91Å; H54-R222 PolarHBondContact CE1-NH1 3.25Å
55	G	96.2	Very high	94.9	Very high	48 Å²	48	59.3 Å²	59.3	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-55.1	-43.5	175.3	0	0	0	0	0	112.5	L51 D52 H53 L57 T58	L51-G55 PolarHBondContact O-N 2.84Å; D52-G55 PolarHBondContact O-N 3.48Å; H53-G55 VanDerWaalsContact C-N 3.26Å; H53-G55 PolarHBondContact O-N 3.02Å; G55-L57 VanDerWaalsContact C-N 3.29Å; G55-L57 PolarHBondContact O-N 3.33Å; G55-T58 PolarHBondContact O-N 2.74Å
56	K	95.4	Very high	95	Very high	148 Å²	148	53.7 Å²	53.7	64%	0.643	30%	0.297	S	S	*	.	H	α-helix	trans	-66.9	-28.8	177.9	-61.2	171.8	-173.2	173.5	0	113.3	D52 H53 H54 N109	D52-K56 PolarHBondContact O-N 3.05Å; H53-K56 WeakPolarHBondContact O-CB 3.28Å; H53-K56 PolarHBondContact O-N 2.88Å; H53-K56 VanDerWaalsContact O-N 3.09Å; H54-K56 VanDerWaalsContact C-N 3.29Å; H54-K56 PolarHBondContact O-N 3.23Å; K56-N109 WeakPolarHBondContact O-CB 3.44Å; K56-N109 PolarHBondContact O-ND2 2.76Å
57	L	96.1	Very high	95.1	Very high	17 Å²	17	53.7 Å²	53.7	9%	0.089	30%	0.298	C	S	.	.	H	α-helix	trans	-85.1	-13.4	-179.7	-60.3	-177.9	0	0	0	114.5	H53 H54 G55 L108 N109 I223 D226	H53-L57 WeakPolarHBondContact O-CG 3.09Å; H53-L57 PolarHBondContact O-N 2.98Å; H54-L57 PolarHBondContact O-N 2.68Å; H54-L57 VanDerWaalsContact O-N 3.08Å; G55-L57 VanDerWaalsContact C-N 3.29Å; G55-L57 PolarHBondContact O-N 3.33Å; L57-L108 HydrophobicContact CB-CD2 4.18Å; L57-L108 HydrophobicContact CD1-CD2 4.35Å; L57-L108 CarbonylContact O-C 3.6Å; L57-L108 WeakPolarHBondContact O-CA 3.48Å; L57-N109 PolarHBondContact O-N 2.91Å; L57-I223 HydrophobicContact CD1-CG1 4.4Å; L57-D226 HydrophobicContact CD1-CB 3.69Å; L57-D226 HydrophobicContact CD2-CB 4.01Å; L57-D226 WeakPolarHBondContact CD2-OD1 3.37Å
58	T	95.8	Very high	95	Very high	40 Å²	40	53.6 Å²	53.6	25%	0.245	30%	0.3	C	S	.	.	S	Bend	trans	-81.2	126.4	179.2	-57.5	0	0	0	0	108.7	H54 G55	H54-T58 PolarHBondContact CE1-OG1 3.37Å; H54-T58 PolarHBondContact O-N 3.39Å; H54-T58 VanDerWaalsContact O-N 3.15Å; H54-T58 PolarHBondContact O-OG1 3.42Å; G55-T58 PolarHBondContact O-N 2.74Å
59	P	95.5	Very high	95	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.019	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-62.1	151.6	176.6	-30.2	41.7	0	0	0	112.5	Q64 W107 N109	P59-Q64 HydrophobicContact CB-CG 4.13Å; P59-Q64 PolarHBondContact O-NE2 2.82Å; P59-W107 HydrophobicContact CG-CG 4.21Å; P59-N109 HydrophobicContact CG-CB 4.49Å
60	S	95	Very high	94.9	Very high	54 Å²	54	53.1 Å²	53.1	38%	0.378	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-59.9	150.2	176.3	63.8	0	0	0	0	111.3	D62 S63 Q64	S60-D62 PolarHBondContact O-N 3.4Å; S60-S63 WeakPolarHBondContact O-CB 2.97Å; S60-S63 PolarHBondContact O-N 2.98Å; S60-S63 WeakPolarHBondContact OG-CB 3.33Å; S60-S63 PolarHBondContact OG-N 3.03Å; S60-Q64 WeakPolarHBondContact O-CG 3.29Å; S60-Q64 PolarHBondContact O-N 3.49Å
61	P	94.5	Very high	94.9	Very high	84 Å²	84	53.2 Å²	53.2	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-50.9	-42.2	176.3	-28	35.6	0	0	0	112.8	S63 Q64 H65	P61-S63 VanDerWaalsContact C-N 3.34Å; P61-S63 PolarHBondContact O-N 3.02Å; P61-Q64 WeakPolarHBondContact O-CB 3.4Å; P61-Q64 PolarHBondContact O-N 2.82Å; P61-H65 PolarHBondContact O-CD2 3.09Å; P61-H65 PolarHBondContact O-N 3.12Å
62	D	93.6	Very high	94.8	Very high	125 Å²	125	52.8 Å²	52.8	67%	0.668	30%	0.298	S	S	*	.	H	α-helix	trans	-60.5	-42.1	178.4	-58.1	-27.6	0	0	0	112.4	S60 H65 A66	S60-D62 PolarHBondContact O-N 3.4Å; D62-H65 PolarHBondContact O-N 2.58Å; D62-A66 WeakPolarHBondContact O-CB 3.02Å; D62-A66 PolarHBondContact O-N 3.16Å
63	S	92.7	Very high	94.7	Very high	11 Å²	11	51.3 Å²	51.3	8%	0.077	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-41.6	176.3	176.7	0	0	0	0	111.8	S60 P61 L67 Y168	S60-S63 WeakPolarHBondContact O-CB 2.97Å; S60-S63 PolarHBondContact O-N 2.98Å; S60-S63 WeakPolarHBondContact OG-CB 3.33Å; S60-S63 PolarHBondContact OG-N 3.03Å; P61-S63 VanDerWaalsContact C-N 3.34Å; P61-S63 PolarHBondContact O-N 3.02Å; S63-L67 WeakPolarHBondContact O-CB 3.31Å; S63-L67 PolarHBondContact O-N 3.32Å; S63-L67 VanDerWaalsContact O-N 3.09Å; S63-Y168 WeakPolarHBondContact CA-OH 3.13Å
64	Q	94.5	Very high	94.7	Very high	58 Å²	58	50.4 Å²	50.4	27%	0.271	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-43.9	175.5	-58.5	-176.7	20.4	0	0	111.2	P59 S60 P61 S68 W107	P59-Q64 HydrophobicContact CB-CG 4.13Å; P59-Q64 PolarHBondContact O-NE2 2.82Å; S60-Q64 WeakPolarHBondContact O-CG 3.29Å; S60-Q64 PolarHBondContact O-N 3.49Å; P61-Q64 WeakPolarHBondContact O-CB 3.4Å; P61-Q64 PolarHBondContact O-N 2.82Å; Q64-S68 WeakPolarHBondContact O-CB 3.41Å; Q64-S68 PolarHBondContact O-N 2.92Å; Q64-W107 HydrophobicContact CB-CZ2 4.14Å; Q64-W107 HydrophobicContact CG-CZ2 3.89Å
65	H	93.9	Very high	94.7	Very high	119 Å²	119	49.9 Å²	49.9	55%	0.551	28%	0.282	S	S	*	.	H	α-helix	trans	-64.9	-47.7	178.1	-74.8	-58.8	0	0	0	112.2	P61 D62 S68 N69	P61-H65 PolarHBondContact O-CD2 3.09Å; P61-H65 PolarHBondContact O-N 3.12Å; D62-H65 PolarHBondContact O-N 2.58Å; H65-S68 PolarHBondContact O-N 3.28Å; H65-N69 WeakPolarHBondContact O-CB 3.34Å; H65-N69 PolarHBondContact O-N 3.06Å; H65-N69 PolarHBondContact O-ND2 3.21Å; H65-N69 PolarHBondContact O-OD1 3.13Å
66	A	92.8	Very high	94.7	Very high	35 Å²	35	53.9 Å²	53.9	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-47.6	-179	0	0	0	0	0	112.4	D62 N69 L70 Y168	D62-A66 WeakPolarHBondContact O-CB 3.02Å; D62-A66 PolarHBondContact O-N 3.16Å; A66-N69 PolarHBondContact O-N 3Å; A66-L70 PolarHBondContact O-N 3.11Å; A66-L70 VanDerWaalsContact O-N 3.13Å; A66-Y168 HydrophobicContact CB-CD1 4.46Å; A66-Y168 HydrophobicContact CB-CD2 3.9Å; A66-Y168 HydrophobicContact CB-CE1 4.03Å; A66-Y168 HydrophobicContact CB-CE2 3.42Å; A66-Y168 VanDerWaalsContact CB-CE2 3.42Å; A66-Y168 HydrophobicContact CB-CG 4.4Å; A66-Y168 VanDerWaalsContact CB-CZ 3.5Å
67	L	94.4	Very high	94.7	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-38.8	178.9	-172.3	59.2	0	0	0	111.9	S63 L70 N71 F102 W107 Y168	S63-L67 WeakPolarHBondContact O-CB 3.31Å; S63-L67 PolarHBondContact O-N 3.32Å; S63-L67 VanDerWaalsContact O-N 3.09Å; L67-L70 PolarHBondContact O-N 2.88Å; L67-N71 WeakPolarHBondContact O-CB 3.38Å; L67-N71 PolarHBondContact O-N 3.27Å; L67-F102 HydrophobicContact CB-CE2 4.37Å; L67-F102 HydrophobicContact CD2-CD2 3.69Å; L67-F102 HydrophobicContact CD2-CE2 4.14Å; L67-F102 HydrophobicContact CG-CD2 3.75Å; L67-F102 HydrophobicContact CG-CE2 3.76Å; L67-W107 HydrophobicContact CD2-CE3 3.94Å; L67-W107 HydrophobicContact CD2-CZ3 4.18Å; L67-Y168 HydrophobicContact CB-CD1 3.87Å; L67-Y168 HydrophobicContact CB-CE1 4.39Å; L67-Y168 HydrophobicContact CD1-CD1 4.26Å
68	S	94.8	Very high	94.7	Very high	37 Å²	37	46.7 Å²	46.7	26%	0.259	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-45	176	-174.9	0	0	0	0	111.8	Q64 H65 L70 N71 N72	Q64-S68 WeakPolarHBondContact O-CB 3.41Å; Q64-S68 PolarHBondContact O-N 2.92Å; H65-S68 PolarHBondContact O-N 3.28Å; S68-L70 PolarHBondContact O-N 3.21Å; S68-N71 PolarHBondContact O-N 3.41Å; S68-N72 WeakPolarHBondContact O-CB 3.29Å; S68-N72 PolarHBondContact O-N 3.15Å; S68-N72 PolarHBondContact O-ND2 3.11Å; S68-N72 PolarHBondContact OG-ND2 2.72Å
69	N	93.4	Very high	94.8	Very high	106 Å²	106	47.7 Å²	47.7	57%	0.567	26%	0.259	S	S	*	.	H	α-helix	trans	-60.2	-45.1	177.4	-71.7	-11.7	0	0	0	111.5	H65 A66 R73	H65-N69 WeakPolarHBondContact O-CB 3.34Å; H65-N69 PolarHBondContact O-N 3.06Å; H65-N69 PolarHBondContact O-ND2 3.21Å; H65-N69 PolarHBondContact O-OD1 3.13Å; A66-N69 PolarHBondContact O-N 3Å; N69-R73 VanDerWaalsContact O-CB 3.31Å; N69-R73 WeakPolarHBondContact O-CB 3.34Å; N69-R73 PolarHBondContact O-N 3.3Å
70	L	93.8	Very high	94.8	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-47.2	177.7	-173.4	65.4	0	0	0	111.9	A66 L67 S68 N72 R73 I74 V170	A66-L70 PolarHBondContact O-N 3.11Å; A66-L70 VanDerWaalsContact O-N 3.13Å; L67-L70 PolarHBondContact O-N 2.88Å; S68-L70 PolarHBondContact O-N 3.21Å; L70-N72 PolarHBondContact O-N 3.46Å; L70-R73 PolarHBondContact O-N 3.1Å; L70-I74 HydrophobicContact CD1-CD1 4.31Å; L70-I74 HydrophobicContact CG-CD1 4.16Å; L70-I74 WeakPolarHBondContact O-CG1 3.44Å; L70-I74 PolarHBondContact O-N 3.13Å; L70-I74 VanDerWaalsContact O-N 3.15Å; L70-V170 HydrophobicContact CB-CG2 4.26Å; L70-V170 HydrophobicContact CD2-CG2 3.75Å; L70-V170 HydrophobicContact CG-CG2 3.73Å
71	N	95.8	Very high	94.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-47.6	177.8	171.6	91.2	0	0	0	111.7	L67 S68 R73 I74 C75 S98 F102 L116 V170	L67-N71 WeakPolarHBondContact O-CB 3.38Å; L67-N71 PolarHBondContact O-N 3.27Å; S68-N71 PolarHBondContact O-N 3.41Å; N71-R73 PolarHBondContact O-N 3.37Å; N71-I74 PolarHBondContact O-N 2.98Å; N71-C75 WeakPolarHBondContact O-CB 3.3Å; N71-C75 PolarHBondContact O-N 3.15Å; N71-S98 PolarHBondContact ND2-OG 3.23Å; N71-S98 PolarHBondContact OD1-OG 3.05Å; N71-F102 HydrophobicContact CB-CE1 4.03Å; N71-F102 HydrophobicContact CB-CE2 4.08Å; N71-F102 HydrophobicContact CB-CZ 3.68Å; N71-F102 VanDerWaalsContact CG-CE1 3.47Å; N71-F102 WeakPolarHBondContact ND2-CE1 3.24Å; N71-L116 WeakPolarHBondContact OD1-CD2 3.47Å; N71-L116 WeakPolarHBondContact OD1-CG 3.34Å; N71-V170 HydrophobicContact CB-CG2 4.23Å
72	N	95.2	Very high	94.9	Very high	68 Å²	68	46.4 Å²	46.4	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-41.2	-177.4	-65.6	-18.1	0	0	0	111.3	S68 L70 I74 C75 E76	S68-N72 WeakPolarHBondContact O-CB 3.29Å; S68-N72 PolarHBondContact O-N 3.15Å; S68-N72 PolarHBondContact O-ND2 3.11Å; S68-N72 PolarHBondContact OG-ND2 2.72Å; L70-N72 PolarHBondContact O-N 3.46Å; N72-I74 VanDerWaalsContact C-N 3.35Å; N72-I74 PolarHBondContact O-N 3.36Å; N72-C75 WeakPolarHBondContact O-CB 3.37Å; N72-C75 PolarHBondContact O-N 3.27Å; N72-E76 WeakPolarHBondContact O-CG 3.44Å; N72-E76 PolarHBondContact O-N 3.32Å
73	R	93.8	Very high	95	Very high	55 Å²	55	46.4 Å²	46.4	21%	0.208	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-41.9	176.7	-174.8	174.6	-179.9	152.7	3.7	112.8	N69 L70 N71 I77 L140 N144 E148	N69-R73 VanDerWaalsContact O-CB 3.31Å; N69-R73 WeakPolarHBondContact O-CB 3.34Å; N69-R73 PolarHBondContact O-N 3.3Å; L70-R73 PolarHBondContact O-N 3.1Å; N71-R73 PolarHBondContact O-N 3.37Å; R73-I77 WeakPolarHBondContact O-CG1 3.27Å; R73-I77 PolarHBondContact O-N 3.17Å; R73-I77 VanDerWaalsContact O-N 3.16Å; R73-L140 HydrophobicContact CG-CD2 3.94Å; R73-L140 PolarHBondContact NH2-O 3.14Å; R73-N144 VanDerWaalsContact NH1-CG 3.29Å; R73-N144 PolarHBondContact NH1-ND2 3.39Å; R73-N144 PolarHBondContact NH1-OD1 3.1Å; R73-N144 PolarHBondContact NH2-ND2 3.3Å; R73-N144 PolarHBondContact NH2-OD1 3.21Å; R73-E148 IonicContact NH1-OE2 3.24Å; R73-E148 PolarHBondContact NH1-OE2 3.16Å
74	I	95.7	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-39.5	176.2	-63.3	163.5	0	0	0	110.4	L70 N71 N72 E76 I77 L78 L116 V163 V170 V172	L70-I74 HydrophobicContact CD1-CD1 4.31Å; L70-I74 HydrophobicContact CG-CD1 4.16Å; L70-I74 WeakPolarHBondContact O-CG1 3.44Å; L70-I74 PolarHBondContact O-N 3.13Å; L70-I74 VanDerWaalsContact O-N 3.15Å; N71-I74 PolarHBondContact O-N 2.98Å; N72-I74 VanDerWaalsContact C-N 3.35Å; N72-I74 PolarHBondContact O-N 3.36Å; I74-E76 PolarHBondContact O-N 2.89Å; I74-I77 PolarHBondContact O-N 2.79Å; I74-L78 HydrophobicContact CG2-CD1 4.06Å; I74-L78 HydrophobicContact CG2-CG 4.47Å; I74-L78 WeakPolarHBondContact O-CG 3.5Å; I74-L78 PolarHBondContact O-N 2.9Å; I74-L116 HydrophobicContact CB-CD1 3.89Å; I74-L116 HydrophobicContact CG2-CD1 3.56Å; I74-V163 HydrophobicContact CD1-CB 3.58Å; I74-V163 HydrophobicContact CD1-CG1 3.75Å; I74-V163 HydrophobicContact CD1-CG2 3.8Å; I74-V163 HydrophobicContact CG1-CG1 4.49Å; I74-V163 HydrophobicContact CG1-CG2 4.5Å; I74-V170 HydrophobicContact CD1-CB 3.53Å; I74-V170 HydrophobicContact CD1-CG1 3.71Å; I74-V170 HydrophobicContact CD1-CG2 3.74Å; I74-V172 HydrophobicContact CG2-CG2 4.12Å
75	C	96.2	Very high	95	Very high	22 Å²	22	49.3 Å²	49.3	15%	0.149	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-46.9	174.6	-162.6	0	0	0	0	111.3	N71 N72 I77 L78 D79 L116	N71-C75 WeakPolarHBondContact O-CB 3.3Å; N71-C75 PolarHBondContact O-N 3.15Å; N72-C75 WeakPolarHBondContact O-CB 3.37Å; N72-C75 PolarHBondContact O-N 3.27Å; C75-I77 PolarHBondContact O-N 3.32Å; C75-L78 PolarHBondContact O-N 3.39Å; C75-L78 VanDerWaalsContact O-N 3.13Å; C75-D79 WeakPolarHBondContact O-CB 3.38Å; C75-D79 PolarHBondContact O-N 3.48Å; C75-D79 PolarHBondContact SG-OD2 3.25Å; C75-D79 VanDerWaalsContact SG-OD2 3.36Å; C75-L116 HydrophobicContact CB-CD2 4.33Å
76	E	95.8	Very high	94.9	Very high	131 Å²	131	47.7 Å²	47.7	61%	0.612	27%	0.27	S	S	*	.	H	α-helix	trans	-59.4	-42	177.3	-74.3	169.8	-167.7	0	0	112.6	N72 I74 L78 D79 N80	N72-E76 WeakPolarHBondContact O-CG 3.44Å; N72-E76 PolarHBondContact O-N 3.32Å; I74-E76 PolarHBondContact O-N 2.89Å; E76-L78 VanDerWaalsContact C-N 3.34Å; E76-L78 PolarHBondContact O-N 3.02Å; E76-D79 PolarHBondContact O-N 3.01Å; E76-N80 WeakPolarHBondContact O-CB 3.01Å; E76-N80 PolarHBondContact O-N 3.48Å
77	I	95.3	Very high	94.8	Very high	14 Å²	14	48.6 Å²	48.6	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-61	-45.1	175.4	-68.2	164.4	0	0	0	110.5	R73 I74 C75 N80 I81 F135 V136 Q139 L140	R73-I77 WeakPolarHBondContact O-CG1 3.27Å; R73-I77 PolarHBondContact O-N 3.17Å; R73-I77 VanDerWaalsContact O-N 3.16Å; I74-I77 PolarHBondContact O-N 2.79Å; C75-I77 PolarHBondContact O-N 3.32Å; I77-N80 PolarHBondContact O-N 3.32Å; I77-I81 WeakPolarHBondContact O-CG1 3.21Å; I77-I81 PolarHBondContact O-N 3.44Å; I77-F135 HydrophobicContact CG2-CD1 4.33Å; I77-F135 HydrophobicContact CG2-CE1 4.18Å; I77-V136 HydrophobicContact CG2-CG2 4.11Å; I77-Q139 HydrophobicContact CD1-CB 3.81Å; I77-Q139 HydrophobicContact CG1-CB 4.05Å; I77-Q139 HydrophobicContact CG2-CB 4.1Å; I77-Q139 HydrophobicContact CG2-CG 4.16Å; I77-L140 HydrophobicContact CD1-CD2 3.62Å; I77-L140 HydrophobicContact CD1-CG 3.89Å
78	L	96.9	Very high	94.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-70.8	-38.8	-179.3	-66.5	174.8	0	0	0	112	I74 C75 E76 N80 I81 I82 L93 V96 L132 V136 V172	I74-L78 HydrophobicContact CG2-CD1 4.06Å; I74-L78 HydrophobicContact CG2-CG 4.47Å; I74-L78 WeakPolarHBondContact O-CG 3.5Å; I74-L78 PolarHBondContact O-N 2.9Å; C75-L78 PolarHBondContact O-N 3.39Å; C75-L78 VanDerWaalsContact O-N 3.13Å; E76-L78 VanDerWaalsContact C-N 3.34Å; E76-L78 PolarHBondContact O-N 3.02Å; L78-N80 VanDerWaalsContact C-N 3.33Å; L78-N80 PolarHBondContact O-N 3.39Å; L78-I81 HydrophobicContact CD2-CD1 4.29Å; L78-I81 WeakPolarHBondContact O-CB 3.03Å; L78-I81 PolarHBondContact O-N 2.84Å; L78-I82 WeakPolarHBondContact O-CD1 3.47Å; L78-I82 WeakPolarHBondContact O-CG1 3.5Å; L78-I82 PolarHBondContact O-N 3.15Å; L78-I82 VanDerWaalsContact O-N 3.08Å; L78-L93 HydrophobicContact CD2-CD1 4.17Å; L78-V96 HydrophobicContact CB-CB 4.2Å; L78-V96 HydrophobicContact CB-CG1 3.97Å; L78-V96 HydrophobicContact CB-CG2 4.29Å; L78-V96 HydrophobicContact CD1-CB 4.45Å; L78-V96 HydrophobicContact CD1-CG2 3.75Å; L78-L132 HydrophobicContact CD2-CD1 3.88Å; L78-L132 HydrophobicContact CD2-CD2 4.27Å; L78-L132 HydrophobicContact CD2-CG 4.33Å; L78-V136 HydrophobicContact CD2-CG2 4.15Å; L78-V172 HydrophobicContact CD1-CG1 4.18Å
79	D	96.7	Very high	94.4	Very high	61 Å²	61	56 Å²	56	33%	0.326	30%	0.299	S	S	.	.	H	α-helix	trans	-63.4	-38.3	174.4	-78.6	-40.5	0	0	0	111.5	C75 E76 I81 I82 V83 V96	C75-D79 WeakPolarHBondContact O-CB 3.38Å; C75-D79 PolarHBondContact O-N 3.48Å; C75-D79 PolarHBondContact SG-OD2 3.25Å; C75-D79 VanDerWaalsContact SG-OD2 3.36Å; E76-D79 PolarHBondContact O-N 3.01Å; D79-I81 VanDerWaalsContact C-N 3.31Å; D79-I81 PolarHBondContact O-N 2.83Å; D79-I82 WeakPolarHBondContact O-CB 3.48Å; D79-I82 PolarHBondContact O-N 3.38Å; D79-I82 VanDerWaalsContact O-N 3.14Å; D79-V83 WeakPolarHBondContact O-CG2 3.17Å; D79-V83 PolarHBondContact O-N 3.2Å; D79-V96 VanDerWaalsContact OD1-CG1 3.23Å; D79-V96 WeakPolarHBondContact OD1-CG1 3.31Å
80	N	96	Very high	94.2	Very high	79 Å²	79	53.5 Å²	53.5	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-38.2	174	-174.1	32.3	0	0	0	112.2	E76 I77 L78 I82 V83 N84	E76-N80 WeakPolarHBondContact O-CB 3.01Å; E76-N80 PolarHBondContact O-N 3.48Å; I77-N80 PolarHBondContact O-N 3.32Å; L78-N80 VanDerWaalsContact C-N 3.33Å; L78-N80 PolarHBondContact O-N 3.39Å; N80-I82 VanDerWaalsContact C-N 3.34Å; N80-V83 PolarHBondContact O-N 2.91Å; N80-N84 PolarHBondContact O-N 3.31Å
81	I	96.1	Very high	93.9	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-39.9	174	-64	167.9	0	0	0	111.1	I77 L78 D79 N84 P85 I87 F88 L93 L132 F135	I77-I81 WeakPolarHBondContact O-CG1 3.21Å; I77-I81 PolarHBondContact O-N 3.44Å; L78-I81 HydrophobicContact CD2-CD1 4.29Å; L78-I81 WeakPolarHBondContact O-CB 3.03Å; L78-I81 PolarHBondContact O-N 2.84Å; D79-I81 VanDerWaalsContact C-N 3.31Å; D79-I81 PolarHBondContact O-N 2.83Å; I81-N84 CarbonylContact O-C 3.44Å; I81-N84 VanDerWaalsContact O-C 3.29Å; I81-P85 WeakPolarHBondContact O-CA 3.13Å; I81-I87 HydrophobicContact CB-CD1 4.42Å; I81-I87 HydrophobicContact CG1-CD1 3.87Å; I81-I87 HydrophobicContact CG1-CG1 4.06Å; I81-F88 HydrophobicContact CG1-CB 4.4Å; I81-F88 HydrophobicContact CG2-CB 3.68Å; I81-F88 HydrophobicContact CG2-CD1 3.96Å; I81-F88 HydrophobicContact CG2-CG 4.11Å; I81-L93 HydrophobicContact CB-CD1 3.96Å; I81-L93 HydrophobicContact CD1-CD1 4.3Å; I81-L93 HydrophobicContact CG2-CD1 3.59Å; I81-L93 HydrophobicContact CG2-CG 3.9Å; I81-L132 HydrophobicContact CD1-CD1 3.54Å; I81-F135 HydrophobicContact CD1-CD1 3.66Å; I81-F135 HydrophobicContact CD1-CE1 3.7Å; I81-F135 HydrophobicContact CG1-CD1 4.26Å; I81-F135 HydrophobicContact CG1-CE1 3.78Å; I81-F135 HydrophobicContact CG1-CZ 4.34Å
82	I	96.1	Very high	93.8	Very high	32 Å²	32	57.3 Å²	57.3	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-42.8	179.3	-67.7	156.2	0	0	0	110.9	L78 D79 N80 L93 D94 V96	L78-I82 WeakPolarHBondContact O-CD1 3.47Å; L78-I82 WeakPolarHBondContact O-CG1 3.5Å; L78-I82 PolarHBondContact O-N 3.15Å; L78-I82 VanDerWaalsContact O-N 3.08Å; D79-I82 WeakPolarHBondContact O-CB 3.48Å; D79-I82 PolarHBondContact O-N 3.38Å; D79-I82 VanDerWaalsContact O-N 3.14Å; N80-I82 VanDerWaalsContact C-N 3.34Å; I82-L93 HydrophobicContact CD1-CB 4.44Å; I82-L93 HydrophobicContact CG1-CB 3.56Å; I82-L93 HydrophobicContact CG1-CD1 4.41Å; I82-D94 WeakPolarHBondContact CG2-O 3.23Å; I82-V96 HydrophobicContact CD1-CB 4.27Å; I82-V96 HydrophobicContact CD1-CG1 3.89Å
83	V	95.8	Very high	93.8	Very high	125 Å²	125	54.3 Å²	54.3	76%	0.758	30%	0.296	S	S	*	.	H	α-helix	trans	-76.1	-35	-179.7	177.2	0	0	0	0	112.2	D79 N80 P85	D79-V83 WeakPolarHBondContact O-CG2 3.17Å; D79-V83 PolarHBondContact O-N 3.2Å; N80-V83 PolarHBondContact O-N 2.91Å; V83-P85 WeakPolarHBondContact O-CD 3.45Å
84	N	94.9	Very high	93.9	Very high	66 Å²	66	54.1 Å²	54.1	35%	0.353	30%	0.299	S	S	.	.			trans	-122.8	81.5	177.7	-173.3	2.5	0	0	0	111.9	N80 I81 S86 I87	N80-N84 PolarHBondContact O-N 3.31Å; I81-N84 CarbonylContact O-C 3.44Å; I81-N84 VanDerWaalsContact O-C 3.29Å; N84-S86 PolarHBondContact O-N 3.08Å; N84-S86 PolarHBondContact OD1-N 3.28Å; N84-S86 PolarHBondContact OD1-OG 3.49Å; N84-I87 HydrophobicContact CB-CG2 4.42Å; N84-I87 WeakPolarHBondContact ND2-CG2 3.37Å; N84-I87 VanDerWaalsContact O-CG1 3.31Å; N84-I87 WeakPolarHBondContact O-CG1 2.97Å; N84-I87 PolarHBondContact O-N 3.4Å
85	P	91.3	Very high	94	Very high	64 Å²	64	56.2 Å²	56.2	42%	0.416	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.4	-21.6	-176.6	-25	34.6	0	0	0	114.5	I81 V83 I87 F88	I81-P85 WeakPolarHBondContact O-CA 3.13Å; V83-P85 WeakPolarHBondContact O-CD 3.45Å; P85-I87 PolarHBondContact O-N 3.08Å; P85-F88 CarbonylContact O-C 3.51Å; P85-F88 PolarHBondContact O-N 3.44Å; P85-F88 VanDerWaalsContact O-O 3.09Å
86	S	91.9	Very high	94	Very high	85 Å²	85	55.2 Å²	55.2	59%	0.594	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-64.1	-20.7	-178	70.7	0	0	0	0	113.8	N84 F88	N84-S86 PolarHBondContact O-N 3.08Å; N84-S86 PolarHBondContact OD1-N 3.28Å; N84-S86 PolarHBondContact OD1-OG 3.49Å; S86-F88 VanDerWaalsContact C-N 3.27Å; S86-F88 PolarHBondContact O-N 2.97Å
87	I	91.8	Very high	94.1	Very high	55 Å²	55	55.3 Å²	55.3	28%	0.282	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-78.3	-12.9	179.8	75.4	-168.8	0	0	0	113	I81 N84 P85 F135	I81-I87 HydrophobicContact CB-CD1 4.42Å; I81-I87 HydrophobicContact CG1-CD1 3.87Å; I81-I87 HydrophobicContact CG1-CG1 4.06Å; N84-I87 HydrophobicContact CB-CG2 4.42Å; N84-I87 WeakPolarHBondContact ND2-CG2 3.37Å; N84-I87 VanDerWaalsContact O-CG1 3.31Å; N84-I87 WeakPolarHBondContact O-CG1 2.97Å; N84-I87 PolarHBondContact O-N 3.4Å; P85-I87 PolarHBondContact O-N 3.08Å; I87-F135 HydrophobicContact CB-CE2 4.33Å; I87-F135 HydrophobicContact CB-CZ 4.22Å; I87-F135 HydrophobicContact CD1-CE1 4.46Å; I87-F135 HydrophobicContact CD1-CZ 3.88Å; I87-F135 HydrophobicContact CG1-CE2 4.27Å; I87-F135 HydrophobicContact CG1-CZ 3.82Å; I87-F135 VanDerWaalsContact O-CE2 3.24Å; I87-F135 WeakPolarHBondContact O-CE2 3.48Å
88	F	90.8	Very high	94.2	Very high	11 Å²	11	55.4 Å²	55.4	5%	0.048	30%	0.299	C	S	.	.			trans	-141.5	98.3	-177.9	177.7	-108.3	0	0	0	110.8	I81 P85 S86 G91 F120 N131 L132	I81-F88 HydrophobicContact CG1-CB 4.4Å; I81-F88 HydrophobicContact CG2-CB 3.68Å; I81-F88 HydrophobicContact CG2-CD1 3.96Å; I81-F88 HydrophobicContact CG2-CG 4.11Å; P85-F88 CarbonylContact O-C 3.51Å; P85-F88 PolarHBondContact O-N 3.44Å; P85-F88 VanDerWaalsContact O-O 3.09Å; S86-F88 VanDerWaalsContact C-N 3.27Å; S86-F88 PolarHBondContact O-N 2.97Å; F88-G91 WeakPolarHBondContact CD1-O 3.29Å; F88-G91 VanDerWaalsContact CE1-O 3.29Å; F88-G91 WeakPolarHBondContact CE1-O 3.26Å; F88-F120 HydrophobicContact CE1-CE1 4.37Å; F88-N131 HydrophobicContact CE2-CB 4.05Å; F88-L132 HydrophobicContact CE1-CD1 4.49Å; F88-L132 HydrophobicContact CE2-CB 3.99Å; F88-L132 HydrophobicContact CE2-CD1 4.32Å; F88-L132 HydrophobicContact CZ-CB 3.87Å; F88-L132 HydrophobicContact CZ-CD1 4.29Å
89	E	88.8	Confident	94.3	Very high	182 Å²	182	55.4 Å²	55.4	85%	0.85	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-15.7	-173	-61	-179.9	166.4	0	0	113.8	G91	E89-G91 PolarHBondContact O-N 3.4Å
90	S	88.7	Confident	94.2	Very high	54 Å²	54	53.5 Å²	53.5	38%	0.378	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.2	-173.7	-50.4	0	0	0	0	114.6	A128 N131	S90-A128 WeakPolarHBondContact O-CB 3.32Å; S90-N131 WeakPolarHBondContact OG-CB 3.17Å; S90-N131 PolarHBondContact OG-ND2 3.24Å
91	G	88.2	Confident	94.2	Very high	17 Å²	17	51.1 Å²	51.1	18%	0.175	28%	0.283	C	S	.	.			trans	177.1	164.7	177.1	0	0	0	0	0	111.9	F88 E89	F88-G91 WeakPolarHBondContact CD1-O 3.29Å; F88-G91 VanDerWaalsContact CE1-O 3.29Å; F88-G91 WeakPolarHBondContact CE1-O 3.26Å; E89-G91 PolarHBondContact O-N 3.4Å
92	Q	93.3	Very high	94.2	Very high	79 Å²	79	52 Å²	52	37%	0.369	29%	0.287	S	S	.	.			trans	-108.4	116.8	178.6	-168.5	176.1	33.1	0	0	110.1	F120 R121	Q92-F120 CarbonylContact O-C 3.58Å; Q92-F120 WeakPolarHBondContact O-CA 3.37Å; Q92-R121 HydrophobicContact CB-CB 4.31Å; Q92-R121 HydrophobicContact CG-CB 4.39Å; Q92-R121 HydrophobicContact CG-CG 4.34Å; Q92-R121 PolarHBondContact O-N 3.28Å
93	L	96.2	Very high	94.2	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	140.3	173	-55.9	-170.8	0	0	0	110	L78 I81 I82 F120 L132	L78-L93 HydrophobicContact CD2-CD1 4.17Å; I81-L93 HydrophobicContact CB-CD1 3.96Å; I81-L93 HydrophobicContact CD1-CD1 4.3Å; I81-L93 HydrophobicContact CG2-CD1 3.59Å; I81-L93 HydrophobicContact CG2-CG 3.9Å; I82-L93 HydrophobicContact CD1-CB 4.44Å; I82-L93 HydrophobicContact CG1-CB 3.56Å; I82-L93 HydrophobicContact CG1-CD1 4.41Å; L93-F120 HydrophobicContact CD2-CD1 4.06Å; L93-F120 HydrophobicContact CD2-CD2 3.58Å; L93-F120 HydrophobicContact CD2-CE1 3.82Å; L93-F120 HydrophobicContact CD2-CE2 3.29Å; L93-F120 HydrophobicContact CD2-CG 3.95Å; L93-F120 HydrophobicContact CD2-CZ 3.44Å; L93-F120 VanDerWaalsContact CD2-CZ 3.44Å; L93-L132 HydrophobicContact CD1-CD1 4.22Å; L93-L132 HydrophobicContact CD2-CD2 4.28Å
94	D	95.9	Very high	94.1	Very high	52 Å²	52	50.4 Å²	50.4	28%	0.278	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-57.8	175.9	-169.3	49.4	0	0	0	111.3	I82 V119 R121	I82-D94 WeakPolarHBondContact CG2-O 3.23Å; D94-V119 HydrophobicContact CB-CB 4.39Å; D94-V119 HydrophobicContact CB-CG1 4.31Å; D94-V119 WeakPolarHBondContact CB-O 3.33Å; D94-V119 PolarHBondContact N-O 3.01Å; D94-R121 HydrophobicContact CB-CG 3.57Å; D94-R121 IonicContact OD1-CZ 3.78Å; D94-R121 IonicContact OD1-NE 3.6Å; D94-R121 PolarHBondContact OD1-NE 3.48Å; D94-R121 IonicContact OD1-NH2 2.65Å
95	H	97	Very high	94.1	Very high	44 Å²	44	50.2 Å²	50.2	20%	0.204	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	160.4	177.4	62.8	-85.2	0	0	0	111.5	V119	H95-V119 WeakPolarHBondContact NE2-CG2 3.13Å; H95-V119 PolarHBondContact O-N 2.84Å
96	V	97.6	Very high	94.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145	171.6	61.5	0	0	0	0	110.5	L78 D79 I82 L116 A117 C118	L78-V96 HydrophobicContact CB-CB 4.2Å; L78-V96 HydrophobicContact CB-CG1 3.97Å; L78-V96 HydrophobicContact CB-CG2 4.29Å; L78-V96 HydrophobicContact CD1-CB 4.45Å; L78-V96 HydrophobicContact CD1-CG2 3.75Å; D79-V96 VanDerWaalsContact OD1-CG1 3.23Å; D79-V96 WeakPolarHBondContact OD1-CG1 3.31Å; I82-V96 HydrophobicContact CD1-CB 4.27Å; I82-V96 HydrophobicContact CD1-CG1 3.89Å; V96-L116 HydrophobicContact CG2-CB 4.46Å; V96-L116 HydrophobicContact CG2-CD2 4.08Å; V96-A117 WeakPolarHBondContact CA-O 3.42Å; V96-C118 HydrophobicContact CG2-CB 4.46Å
97	R	97.2	Very high	94.5	Very high	133 Å²	133	44 Å²	44	50%	0.502	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	133.5	176.4	-72	-65.2	-178.4	-104.2	8.1	111.6	V99 L116 A117	R97-V99 HydrophobicContact CB-CG1 4.41Å; R97-L116 CarbonylContact O-C 3.52Å; R97-L116 WeakPolarHBondContact O-CA 3.47Å; R97-A117 PolarHBondContact N-O 2.87Å; R97-A117 PolarHBondContact O-N 3.3Å
98	S	97.5	Very high	94.7	Very high	16 Å²	16	41.6 Å²	41.6	11%	0.112	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.3	163.3	-58	0	0	0	0	109.7	N71 K103 D115 L116 L205	N71-S98 PolarHBondContact ND2-OG 3.23Å; N71-S98 PolarHBondContact OD1-OG 3.05Å; S98-K103 WeakPolarHBondContact O-CB 3.4Å; S98-K103 WeakPolarHBondContact O-CG 3.31Å; S98-D115 CarbonylContact C-O 3.46Å; S98-D115 WeakPolarHBondContact CA-O 3.41Å; S98-L116 WeakPolarHBondContact OG-CD2 2.96Å; S98-L205 WeakPolarHBondContact O-CD2 3.32Å
99	V	97.8	Very high	94.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	-175.7	-175.9	-62.7	0	0	0	0	110.7	R97 K103 D115 A117 L173 I202 L205	R97-V99 HydrophobicContact CB-CG1 4.41Å; V99-K103 PolarHBondContact O-N 3.4Å; V99-D115 HydrophobicContact CG2-CB 3.64Å; V99-D115 PolarHBondContact N-O 3.34Å; V99-A117 HydrophobicContact CG1-CB 3.91Å; V99-A117 HydrophobicContact CG2-CB 4.12Å; V99-L173 HydrophobicContact CG2-CD1 4.33Å; V99-I202 HydrophobicContact CG1-CG1 4.1Å; V99-L205 HydrophobicContact CG1-CB 4.38Å; V99-L205 HydrophobicContact CG1-CD2 3.94Å
100	G	95.9	Very high	94.9	Very high	21 Å²	21	39.2 Å²	39.2	22%	0.216	22%	0.219	C	C	.	.	H	α-helix	trans	71	-162.1	170.9	0	0	0	0	0	114.5	F102 K103 L104	G100-F102 PolarHBondContact O-N 3.41Å; G100-F102 VanDerWaalsContact O-N 3.14Å; G100-K103 PolarHBondContact O-N 3.33Å; G100-L104 WeakPolarHBondContact O-CG 2.98Å; G100-L104 PolarHBondContact O-N 3.08Å
101	S	95.6	Very high	94.7	Very high	30 Å²	30	37.7 Å²	37.7	21%	0.21	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-26.6	-176.5	-56.6	0	0	0	0	112.3	N105 T106 W107 K225	S101-N105 PolarHBondContact O-N 3.28Å; S101-N105 VanDerWaalsContact O-N 3.16Å; S101-T106 PolarHBondContact O-N 3.43Å; S101-W107 PolarHBondContact O-N 3.43Å; S101-K225 PolarHBondContact OG-NZ 2.88Å
102	F	95.8	Very high	94.8	Very high	21 Å²	21	38.2 Å²	38.2	9%	0.092	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-58.3	176.3	170.8	-78.1	0	0	0	112.2	L67 N71 G100 L104 N105 W107	L67-F102 HydrophobicContact CB-CE2 4.37Å; L67-F102 HydrophobicContact CD2-CD2 3.69Å; L67-F102 HydrophobicContact CD2-CE2 4.14Å; L67-F102 HydrophobicContact CG-CD2 3.75Å; L67-F102 HydrophobicContact CG-CE2 3.76Å; N71-F102 HydrophobicContact CB-CE1 4.03Å; N71-F102 HydrophobicContact CB-CE2 4.08Å; N71-F102 HydrophobicContact CB-CZ 3.68Å; N71-F102 VanDerWaalsContact CG-CE1 3.47Å; N71-F102 WeakPolarHBondContact ND2-CE1 3.24Å; G100-F102 PolarHBondContact O-N 3.41Å; G100-F102 VanDerWaalsContact O-N 3.14Å; F102-L104 PolarHBondContact O-N 2.93Å; F102-N105 PolarHBondContact O-N 3.03Å; F102-W107 HydrophobicContact CB-CE3 3.56Å; F102-W107 HydrophobicContact CB-CZ3 3.53Å; F102-W107 HydrophobicContact CD1-CZ3 4.23Å; F102-W107 AromaticContact CD2-CE3 3.47Å; F102-W107 HydrophobicContact CD2-CE3 3.47Å; F102-W107 VanDerWaalsContact CD2-CE3 3.47Å; F102-W107 AromaticContact CD2-CH2 3.59Å; F102-W107 HydrophobicContact CD2-CH2 3.59Å; F102-W107 AromaticContact CD2-CZ3 2.8Å; F102-W107 HydrophobicContact CD2-CZ3 2.8Å; F102-W107 HydrophobicContact CE2-CE3 4.32Å; F102-W107 AromaticContact CE2-CH2 3.58Å; F102-W107 HydrophobicContact CE2-CH2 3.58Å; F102-W107 AromaticContact CE2-CZ3 3.31Å; F102-W107 HydrophobicContact CE2-CZ3 3.31Å; F102-W107 AromaticContact CG-CE3 3.83Å; F102-W107 HydrophobicContact CG-CE3 3.83Å; F102-W107 HydrophobicContact CG-CH2 4.31Å; F102-W107 AromaticContact CG-CZ3 3.27Å; F102-W107 HydrophobicContact CG-CZ3 3.27Å; F102-W107 HydrophobicContact CZ-CH2 4.4Å; F102-W107 HydrophobicContact CZ-CZ3 4.21Å; F102-W107 WeakPolarHBondContact O-CZ3 3.46Å
103	K	95.9	Very high	94.9	Very high	101 Å²	101	38.4 Å²	38.4	44%	0.439	21%	0.212	S	C	.	.	H	α-helix	trans	-64	-34.1	-177.8	-177.2	60.4	175.5	178.9	0	112.4	S98 V99 G100 N105 L205 E209	S98-K103 WeakPolarHBondContact O-CB 3.4Å; S98-K103 WeakPolarHBondContact O-CG 3.31Å; V99-K103 PolarHBondContact O-N 3.4Å; G100-K103 PolarHBondContact O-N 3.33Å; K103-N105 VanDerWaalsContact C-N 3.26Å; K103-N105 PolarHBondContact O-N 3.42Å; K103-L205 HydrophobicContact CB-CD1 3.94Å; K103-L205 HydrophobicContact CG-CD1 3.35Å; K103-L205 HydrophobicContact CG-CD2 4.02Å; K103-L205 HydrophobicContact CG-CG 4.32Å; K103-E209 WeakPolarHBondContact CE-OE1 3Å; K103-E209 IonicContact NZ-OE1 3.53Å
104	L	95.2	Very high	94.9	Very high	22 Å²	22	38.1 Å²	38.1	12%	0.115	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-6.6	178.9	-62.5	-179.9	0	0	0	114.1	G100 F102 T106 L205 A208	G100-L104 WeakPolarHBondContact O-CG 2.98Å; G100-L104 PolarHBondContact O-N 3.08Å; F102-L104 PolarHBondContact O-N 2.93Å; L104-T106 VanDerWaalsContact C-N 3.29Å; L104-T106 HydrophobicContact CB-CG2 4.2Å; L104-T106 PolarHBondContact O-N 3.35Å; L104-L205 HydrophobicContact CD2-CD1 3.81Å; L104-L205 HydrophobicContact CG-CD1 4.38Å; L104-A208 HydrophobicContact CD1-CB 3.94Å; L104-A208 HydrophobicContact CD2-CB 3.6Å; L104-A208 HydrophobicContact CG-CB 4.44Å
105	N	94.8	Very high	95	Very high	62 Å²	62	37.3 Å²	37.3	33%	0.332	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	48.2	-170.7	-171	8.3	0	0	0	111.3	S101 F102 K103 R222	S101-N105 PolarHBondContact O-N 3.28Å; S101-N105 VanDerWaalsContact O-N 3.16Å; F102-N105 PolarHBondContact O-N 3.03Å; K103-N105 VanDerWaalsContact C-N 3.26Å; K103-N105 PolarHBondContact O-N 3.42Å; N105-R222 PolarHBondContact O-NE 2.92Å; N105-R222 PolarHBondContact O-NH2 3.39Å; N105-R222 PolarHBondContact OD1-NH2 3.14Å
106	T	96.2	Very high	95.1	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.197	C	C	.	.			trans	-125.9	16.8	176.8	62.8	0	0	0	0	112.5	S101 L104 K218 I221 K225	S101-T106 PolarHBondContact O-N 3.43Å; L104-T106 VanDerWaalsContact C-N 3.29Å; L104-T106 HydrophobicContact CB-CG2 4.2Å; L104-T106 PolarHBondContact O-N 3.35Å; T106-K218 HydrophobicContact CG2-CB 4.1Å; T106-K218 HydrophobicContact CG2-CG 4.13Å; T106-I221 HydrophobicContact CG2-CB 4.13Å; T106-I221 HydrophobicContact CG2-CD1 4.15Å; T106-I221 HydrophobicContact CG2-CG2 3.87Å; T106-K225 PolarHBondContact OG1-NZ 3.45Å
107	W	95.2	Very high	95.1	Very high	19 Å²	19	35.2 Å²	35.2	7%	0.072	20%	0.197	C	C	.	.			trans	-63.9	165	167.7	61.4	35.9	0	0	0	110.5	P59 Q64 L67 S101 F102	P59-W107 HydrophobicContact CG-CG 4.21Å; Q64-W107 HydrophobicContact CB-CZ2 4.14Å; Q64-W107 HydrophobicContact CG-CZ2 3.89Å; L67-W107 HydrophobicContact CD2-CE3 3.94Å; L67-W107 HydrophobicContact CD2-CZ3 4.18Å; S101-W107 PolarHBondContact O-N 3.43Å; F102-W107 HydrophobicContact CB-CE3 3.56Å; F102-W107 HydrophobicContact CB-CZ3 3.53Å; F102-W107 HydrophobicContact CD1-CZ3 4.23Å; F102-W107 AromaticContact CD2-CE3 3.47Å; F102-W107 HydrophobicContact CD2-CE3 3.47Å; F102-W107 VanDerWaalsContact CD2-CE3 3.47Å; F102-W107 AromaticContact CD2-CH2 3.59Å; F102-W107 HydrophobicContact CD2-CH2 3.59Å; F102-W107 AromaticContact CD2-CZ3 2.8Å; F102-W107 HydrophobicContact CD2-CZ3 2.8Å; F102-W107 HydrophobicContact CE2-CE3 4.32Å; F102-W107 AromaticContact CE2-CH2 3.58Å; F102-W107 HydrophobicContact CE2-CH2 3.58Å; F102-W107 AromaticContact CE2-CZ3 3.31Å; F102-W107 HydrophobicContact CE2-CZ3 3.31Å; F102-W107 AromaticContact CG-CE3 3.83Å; F102-W107 HydrophobicContact CG-CE3 3.83Å; F102-W107 HydrophobicContact CG-CH2 4.31Å; F102-W107 AromaticContact CG-CZ3 3.27Å; F102-W107 HydrophobicContact CG-CZ3 3.27Å; F102-W107 HydrophobicContact CZ-CH2 4.4Å; F102-W107 HydrophobicContact CZ-CZ3 4.21Å; F102-W107 WeakPolarHBondContact O-CZ3 3.46Å
108	L	95.8	Very high	95.1	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.021	17%	0.173	C	C	.	.			trans	-108.1	154	177.4	-58	180	0	0	0	110.6	L57 G110 S111 R222 K225 D226	L57-L108 HydrophobicContact CB-CD2 4.18Å; L57-L108 HydrophobicContact CD1-CD2 4.35Å; L57-L108 CarbonylContact O-C 3.6Å; L57-L108 WeakPolarHBondContact O-CA 3.48Å; L108-G110 PolarHBondContact O-N 3.35Å; L108-S111 WeakPolarHBondContact O-CA 3.42Å; L108-S111 WeakPolarHBondContact O-CB 3.41Å; L108-S111 PolarHBondContact O-N 3.48Å; L108-S111 PolarHBondContact O-OG 2.7Å; L108-R222 HydrophobicContact CD2-CB 3.75Å; L108-R222 HydrophobicContact CD2-CG 4.11Å; L108-R222 VanDerWaalsContact CD2-O 3.3Å; L108-R222 WeakPolarHBondContact CD2-O 3.41Å; L108-K225 HydrophobicContact CD1-CB 3.83Å; L108-K225 HydrophobicContact CD2-CB 4.29Å; L108-K225 HydrophobicContact CG-CB 4.25Å; L108-D226 HydrophobicContact CD1-CB 4.17Å
109	N	94.2	Very high	95.2	Very high	81 Å²	81	28.2 Å²	28.2	43%	0.433	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	138.1	168.7	-163.1	15.1	0	0	0	111.1	K56 L57 P59 S111	K56-N109 WeakPolarHBondContact O-CB 3.44Å; K56-N109 PolarHBondContact O-ND2 2.76Å; L57-N109 PolarHBondContact O-N 2.91Å; P59-N109 HydrophobicContact CG-CB 4.49Å; N109-S111 PolarHBondContact O-N 3.49Å
110	G	89	Confident	95.2	Very high	61 Å²	61	28.2 Å²	28.2	63%	0.629	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	-3.9	-169.1	0	0	0	0	0	115.7	L108 C112	L108-G110 PolarHBondContact O-N 3.35Å; G110-C112 PolarHBondContact O-N 3.01Å
111	S	85.2	Confident	95.1	Very high	23 Å²	23	32.3 Å²	32.3	16%	0.161	18%	0.177	C	C	.	.			trans	-88.7	104.6	171.8	-42.6	0	0	0	0	108.9	L108 N109 R229	L108-S111 WeakPolarHBondContact O-CA 3.42Å; L108-S111 WeakPolarHBondContact O-CB 3.41Å; L108-S111 PolarHBondContact O-N 3.48Å; L108-S111 PolarHBondContact O-OG 2.7Å; N109-S111 PolarHBondContact O-N 3.49Å; S111-R229 PolarHBondContact OG-NH2 3.3Å
112	C	89	Confident	95	Very high	28 Å²	28	33.9 Å²	33.9	19%	0.189	19%	0.186	C	C	.	.			trans	-101.7	29.3	-174.1	-56	0	0	0	0	112.5	G110 D167 Y168 M169	G110-C112 PolarHBondContact O-N 3.01Å; C112-D167 WeakPolarHBondContact CB-O 3.32Å; C112-Y168 HydrophobicContact CB-CD1 3.97Å; C112-Y168 HydrophobicContact CB-CE1 4.47Å; C112-Y168 CarbonylContact O-C 3.6Å; C112-Y168 WeakPolarHBondContact O-CA 3.38Å; C112-M169 PolarHBondContact O-N 3.13Å
113	I	95.5	Very high	95	Very high	82 Å²	82	34.8 Å²	34.8	42%	0.421	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.1	-173.1	-53.6	176.5	0	0	0	110.4	M169 Q171	I113-M169 CarbonylContact C-O 3.55Å; I113-M169 VanDerWaalsContact CA-O 3.32Å; I113-M169 WeakPolarHBondContact CA-O 3.49Å; I113-M169 HydrophobicContact CG1-CB 4.37Å; I113-Q171 HydrophobicContact CG2-CG 3.9Å
114	S	97	Very high	95	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.9	171.1	63.4	0	0	0	0	111.2	M169 V170 Q171	S114-M169 PolarHBondContact N-O 2.94Å; S114-M169 PolarHBondContact OG-O 3.26Å; S114-V170 CarbonylContact O-C 3.52Å; S114-V170 WeakPolarHBondContact O-CA 3.33Å; S114-V170 WeakPolarHBondContact OG-CG2 3.42Å; S114-Q171 PolarHBondContact O-N 3.38Å
115	D	97.9	Very high	95.1	Very high	34 Å²	34	30.9 Å²	30.9	18%	0.182	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130	-176.1	-56	-37.5	0	0	0	110	S98 V99 Q171 L173	S98-D115 CarbonylContact C-O 3.46Å; S98-D115 WeakPolarHBondContact CA-O 3.41Å; V99-D115 HydrophobicContact CG2-CB 3.64Å; V99-D115 PolarHBondContact N-O 3.34Å; D115-Q171 CarbonylContact C-O 3.41Å; D115-Q171 WeakPolarHBondContact CA-O 3.1Å; D115-Q171 PolarHBondContact OD1-OE1 3.09Å; D115-L173 HydrophobicContact CB-CD1 4.21Å
116	L	98.2	Very high	95.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.8	169.6	-77.8	171.2	0	0	0	108.4	N71 I74 C75 V96 R97 S98 V170 Q171 V172 L173	N71-L116 WeakPolarHBondContact OD1-CD2 3.47Å; N71-L116 WeakPolarHBondContact OD1-CG 3.34Å; I74-L116 HydrophobicContact CB-CD1 3.89Å; I74-L116 HydrophobicContact CG2-CD1 3.56Å; C75-L116 HydrophobicContact CB-CD2 4.33Å; V96-L116 HydrophobicContact CG2-CB 4.46Å; V96-L116 HydrophobicContact CG2-CD2 4.08Å; R97-L116 CarbonylContact O-C 3.52Å; R97-L116 WeakPolarHBondContact O-CA 3.47Å; S98-L116 WeakPolarHBondContact OG-CD2 2.96Å; L116-V170 HydrophobicContact CB-CG1 4.47Å; L116-V170 HydrophobicContact CD1-CG1 3.52Å; L116-V170 HydrophobicContact CG-CG1 3.92Å; L116-Q171 PolarHBondContact N-O 3.38Å; L116-V172 HydrophobicContact CB-CG2 4.34Å; L116-V172 HydrophobicContact CD1-CG2 4.38Å; L116-V172 CarbonylContact O-C 3.48Å; L116-V172 VanDerWaalsContact O-CA 3.32Å; L116-V172 WeakPolarHBondContact O-CA 3.25Å; L116-L173 PolarHBondContact O-N 2.82Å
117	A	98.3	Very high	95.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.3	169	0	0	0	0	0	109.7	V96 R97 V99 L173 I202	V96-A117 WeakPolarHBondContact CA-O 3.42Å; R97-A117 PolarHBondContact N-O 2.87Å; R97-A117 PolarHBondContact O-N 3.3Å; V99-A117 HydrophobicContact CG1-CB 3.91Å; V99-A117 HydrophobicContact CG2-CB 4.12Å; A117-L173 WeakPolarHBondContact CA-O 3.47Å; A117-I202 HydrophobicContact CB-CD1 3.7Å; A117-I202 HydrophobicContact CB-CG1 3.55Å
118	C	98.2	Very high	95.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.9	178.5	-178.9	0	0	0	0	109.7	V96 V172 L173 I174 T175	V96-C118 HydrophobicContact CG2-CB 4.46Å; C118-V172 HydrophobicContact CB-CG1 3.83Å; C118-L173 PolarHBondContact N-O 3.43Å; C118-I174 HydrophobicContact CB-CD1 3.99Å; C118-T175 PolarHBondContact O-N 3.45Å
119	V	98.1	Very high	95.3	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.2	-174.4	-173.5	0	0	0	0	109.8	D94 H95 T175 I202	D94-V119 HydrophobicContact CB-CB 4.39Å; D94-V119 HydrophobicContact CB-CG1 4.31Å; D94-V119 WeakPolarHBondContact CB-O 3.33Å; D94-V119 PolarHBondContact N-O 3.01Å; H95-V119 WeakPolarHBondContact NE2-CG2 3.13Å; H95-V119 PolarHBondContact O-N 2.84Å; V119-T175 CarbonylContact C-O 3.59Å; V119-T175 WeakPolarHBondContact CA-O 3.41Å; V119-T175 HydrophobicContact CB-CG2 4.37Å; V119-T175 HydrophobicContact CG1-CG2 4.46Å; V119-T175 HydrophobicContact CG2-CG2 3.79Å; V119-I202 HydrophobicContact CG2-CD1 3.62Å
120	F	97.4	Very high	95.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.5	170.8	-78.8	-120	0	0	0	110.6	F88 Q92 L93 T122 P124 A128 L132 I174 T175 T176 T177	F88-F120 HydrophobicContact CE1-CE1 4.37Å; Q92-F120 CarbonylContact O-C 3.58Å; Q92-F120 WeakPolarHBondContact O-CA 3.37Å; L93-F120 HydrophobicContact CD2-CD1 4.06Å; L93-F120 HydrophobicContact CD2-CD2 3.58Å; L93-F120 HydrophobicContact CD2-CE1 3.82Å; L93-F120 HydrophobicContact CD2-CE2 3.29Å; L93-F120 HydrophobicContact CD2-CG 3.95Å; L93-F120 HydrophobicContact CD2-CZ 3.44Å; L93-F120 VanDerWaalsContact CD2-CZ 3.44Å; F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 WeakPolarHBondContact CB-O 3.32Å; F120-P124 HydrophobicContact CD1-CB 4.45Å; F120-P124 HydrophobicContact CD2-CB 4.28Å; F120-P124 HydrophobicContact CG-CB 4.2Å; F120-A128 HydrophobicContact CE1-CB 4.14Å; F120-L132 HydrophobicContact CE2-CD2 3.96Å; F120-L132 HydrophobicContact CZ-CD2 3.84Å; F120-I174 HydrophobicContact CD2-CG2 3.8Å; F120-I174 HydrophobicContact CE2-CD1 3.85Å; F120-I174 HydrophobicContact CE2-CG2 3.67Å; F120-T175 PolarHBondContact N-O 2.87Å; F120-T176 WeakPolarHBondContact O-CA 3.5Å; F120-T176 PolarHBondContact O-OG1 3.23Å; F120-T177 PolarHBondContact O-N 3.25Å
121	R	95.2	Very high	95.8	Very high	106 Å²	106	38.6 Å²	38.6	40%	0.4	20%	0.197	S	C	.	.	S	Bend	trans	-71.6	-32.1	166.7	-65.5	-169.5	-176.3	146.9	6.6	111.6	Q92 D94 N180	Q92-R121 HydrophobicContact CB-CB 4.31Å; Q92-R121 HydrophobicContact CG-CB 4.39Å; Q92-R121 HydrophobicContact CG-CG 4.34Å; Q92-R121 PolarHBondContact O-N 3.28Å; D94-R121 HydrophobicContact CB-CG 3.57Å; D94-R121 IonicContact OD1-CZ 3.78Å; D94-R121 IonicContact OD1-NE 3.6Å; D94-R121 PolarHBondContact OD1-NE 3.48Å; D94-R121 IonicContact OD1-NH2 2.65Å; R121-N180 PolarHBondContact O-ND2 3.26Å
122	T	93.2	Very high	96.4	Very high	63 Å²	63	37.5 Å²	37.5	39%	0.387	19%	0.19	S	C	.	.	S	Bend	trans	-96.1	175.8	175.8	56.7	0	0	0	0	111.3	F120 T176	F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 WeakPolarHBondContact CB-O 3.32Å; T122-T176 WeakPolarHBondContact O-CB 3.48Å; T122-T176 PolarHBondContact O-OG1 2.92Å
123	L	95.2	Very high	96.7	Very high	41 Å²	41	36.3 Å²	36.3	22%	0.215	18%	0.182	C	C	.	.			trans	-70	127.7	170.7	-73.5	163.3	0	0	0	109.7	T125 T176 N180 R183 H189	L123-T125 PolarHBondContact O-N 2.92Å; L123-T176 HydrophobicContact CD2-CG2 4.49Å; L123-N180 HydrophobicContact CD2-CB 3.93Å; L123-N180 WeakPolarHBondContact CD2-O 3.47Å; L123-N180 HydrophobicContact CG-CB 4.36Å; L123-R183 HydrophobicContact CD1-CB 3.96Å; L123-R183 HydrophobicContact CD2-CB 4.39Å; L123-H189 WeakPolarHBondContact CB-NE2 3.39Å
124	P	96.4	Very high	96.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.			trans	-75.2	96.9	-177.9	28.2	-35.4	0	0	0	109.8	F120 V129 I174 H189 I190	F120-P124 HydrophobicContact CD1-CB 4.45Å; F120-P124 HydrophobicContact CD2-CB 4.28Å; F120-P124 HydrophobicContact CG-CB 4.2Å; P124-V129 HydrophobicContact CB-CG2 4.31Å; P124-I174 HydrophobicContact CB-CG2 3.54Å; P124-I174 HydrophobicContact CG-CG2 4.14Å; P124-H189 WeakPolarHBondContact O-CA 3.33Å; P124-I190 PolarHBondContact O-N 3.34Å
125	T	96.6	Very high	96.6	Very high	40 Å²	40	35 Å²	35	25%	0.245	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-70.3	150.7	173.6	66	0	0	0	0	110.3	L123 E127 A128 V129 I188	L123-T125 PolarHBondContact O-N 2.92Å; T125-E127 PolarHBondContact O-N 3.1Å; T125-A128 PolarHBondContact O-N 3.14Å; T125-A128 VanDerWaalsContact O-N 3.12Å; T125-A128 WeakPolarHBondContact OG1-CB 3.3Å; T125-A128 PolarHBondContact OG1-N 3.26Å; T125-V129 VanDerWaalsContact O-CG2 3.26Å; T125-V129 WeakPolarHBondContact O-CG2 3.31Å; T125-V129 PolarHBondContact O-N 3.26Å; T125-I188 CarbonylContact C-O 3.38Å; T125-I188 WeakPolarHBondContact CA-O 3.4Å; T125-I188 HydrophobicContact CG2-CG2 3.95Å
126	L	96.4	Very high	96.5	Very high	88 Å²	88	33.3 Å²	33.3	46%	0.461	17%	0.169	S	C	.	.	H	α-helix	trans	-57	-38.2	176.6	-64.8	174.1	0	0	0	111.1	V129 Q130 I188 I190	L126-V129 PolarHBondContact O-N 3.2Å; L126-Q130 WeakPolarHBondContact O-CB 3.33Å; L126-Q130 PolarHBondContact O-N 2.97Å; L126-I188 PolarHBondContact N-O 3.34Å; L126-I190 HydrophobicContact CD2-CG1 4.16Å
127	E	96	Very high	96.3	Very high	139 Å²	139	38.4 Å²	38.4	65%	0.65	19%	0.188	S	C	*	.	H	α-helix	trans	-64.2	-46.1	174.7	-171.6	-176.7	175.7	0	0	112.3	T125 V129 Q130 N131	T125-E127 PolarHBondContact O-N 3.1Å; E127-V129 VanDerWaalsContact C-N 3.26Å; E127-V129 PolarHBondContact O-N 3.12Å; E127-Q130 PolarHBondContact O-N 3.17Å; E127-N131 WeakPolarHBondContact O-CB 3.37Å; E127-N131 VanDerWaalsContact O-CG 3.28Å; E127-N131 PolarHBondContact O-N 3.26Å; E127-N131 PolarHBondContact O-ND2 2.89Å
128	A	96.9	Very high	96	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-38	177.9	0	0	0	0	0	111.7	S90 F120 T125 N131 L132	S90-A128 WeakPolarHBondContact O-CB 3.32Å; F120-A128 HydrophobicContact CE1-CB 4.14Å; T125-A128 PolarHBondContact O-N 3.14Å; T125-A128 VanDerWaalsContact O-N 3.12Å; T125-A128 WeakPolarHBondContact OG1-CB 3.3Å; T125-A128 PolarHBondContact OG1-N 3.26Å; A128-N131 PolarHBondContact O-N 3.39Å; A128-L132 WeakPolarHBondContact O-CB 3.27Å; A128-L132 PolarHBondContact O-N 3.28Å
129	V	97.3	Very high	95.6	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-67.9	-43	177.3	174.7	0	0	0	0	111	P124 T125 L126 E127 N131 L132 A133 L156 F161 I174 I190	P124-V129 HydrophobicContact CB-CG2 4.31Å; T125-V129 VanDerWaalsContact O-CG2 3.26Å; T125-V129 WeakPolarHBondContact O-CG2 3.31Å; T125-V129 PolarHBondContact O-N 3.26Å; L126-V129 PolarHBondContact O-N 3.2Å; E127-V129 VanDerWaalsContact C-N 3.26Å; E127-V129 PolarHBondContact O-N 3.12Å; V129-N131 VanDerWaalsContact C-N 3.34Å; V129-N131 PolarHBondContact O-N 3.37Å; V129-L132 PolarHBondContact O-N 2.94Å; V129-A133 WeakPolarHBondContact O-CB 3.41Å; V129-A133 PolarHBondContact O-N 3.23Å; V129-L156 HydrophobicContact CG1-CD2 4.17Å; V129-F161 HydrophobicContact CG1-CD1 4.39Å; V129-I174 HydrophobicContact CG1-CG1 4.38Å; V129-I174 HydrophobicContact CG2-CG1 4.42Å; V129-I174 HydrophobicContact CG2-CG2 4.06Å; V129-I190 HydrophobicContact CB-CD1 4.17Å; V129-I190 HydrophobicContact CG1-CD1 3.97Å; V129-I190 HydrophobicContact CG2-CD1 3.31Å; V129-I190 HydrophobicContact CG2-CG1 3.93Å
130	Q	97	Very high	95.2	Very high	102 Å²	102	48.9 Å²	48.9	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-40.5	174.7	177.6	167.7	1.3	0	0	112.6	L126 E127 S134 L156	L126-Q130 WeakPolarHBondContact O-CB 3.33Å; L126-Q130 PolarHBondContact O-N 2.97Å; E127-Q130 PolarHBondContact O-N 3.17Å; Q130-S134 WeakPolarHBondContact O-CB 3.16Å; Q130-S134 PolarHBondContact O-N 3.42Å; Q130-S134 PolarHBondContact O-OG 3.2Å; Q130-L156 HydrophobicContact CB-CD1 3.97Å; Q130-L156 HydrophobicContact CB-CD2 4.49Å; Q130-L156 HydrophobicContact CG-CD1 3.91Å
131	N	96.8	Very high	94.6	Very high	55 Å²	55	52 Å²	52	29%	0.294	25%	0.25	S	C	.	.	H	α-helix	trans	-67.8	-39.2	175.8	-69.1	-17.9	0	0	0	111.3	F88 S90 E127 A128 V129 S134 F135	F88-N131 HydrophobicContact CE2-CB 4.05Å; S90-N131 WeakPolarHBondContact OG-CB 3.17Å; S90-N131 PolarHBondContact OG-ND2 3.24Å; E127-N131 WeakPolarHBondContact O-CB 3.37Å; E127-N131 VanDerWaalsContact O-CG 3.28Å; E127-N131 PolarHBondContact O-N 3.26Å; E127-N131 PolarHBondContact O-ND2 2.89Å; A128-N131 PolarHBondContact O-N 3.39Å; V129-N131 VanDerWaalsContact C-N 3.34Å; V129-N131 PolarHBondContact O-N 3.37Å; N131-S134 PolarHBondContact O-N 3.29Å; N131-F135 WeakPolarHBondContact O-CB 3.26Å; N131-F135 PolarHBondContact O-N 2.71Å
132	L	97.3	Very high	93.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-47.6	175	-176.3	61.8	0	0	0	111.4	L78 I81 F88 L93 F120 A128 V129 S134 F135 V136 F161 I174	L78-L132 HydrophobicContact CD2-CD1 3.88Å; L78-L132 HydrophobicContact CD2-CD2 4.27Å; L78-L132 HydrophobicContact CD2-CG 4.33Å; I81-L132 HydrophobicContact CD1-CD1 3.54Å; F88-L132 HydrophobicContact CE1-CD1 4.49Å; F88-L132 HydrophobicContact CE2-CB 3.99Å; F88-L132 HydrophobicContact CE2-CD1 4.32Å; F88-L132 HydrophobicContact CZ-CB 3.87Å; F88-L132 HydrophobicContact CZ-CD1 4.29Å; L93-L132 HydrophobicContact CD1-CD1 4.22Å; L93-L132 HydrophobicContact CD2-CD2 4.28Å; F120-L132 HydrophobicContact CE2-CD2 3.96Å; F120-L132 HydrophobicContact CZ-CD2 3.84Å; A128-L132 WeakPolarHBondContact O-CB 3.27Å; A128-L132 PolarHBondContact O-N 3.28Å; V129-L132 PolarHBondContact O-N 2.94Å; L132-S134 VanDerWaalsContact C-N 3.3Å; L132-S134 PolarHBondContact O-N 3.19Å; L132-F135 WeakPolarHBondContact O-CB 3.25Å; L132-F135 PolarHBondContact O-N 3.45Å; L132-F135 VanDerWaalsContact O-N 3.14Å; L132-V136 WeakPolarHBondContact O-CG2 3.33Å; L132-V136 PolarHBondContact O-N 3.37Å; L132-F161 HydrophobicContact CD2-CE1 3.9Å; L132-F161 HydrophobicContact CD2-CZ 4.41Å; L132-F161 HydrophobicContact CG-CE1 4Å; L132-F161 HydrophobicContact CG-CZ 4.3Å; L132-I174 HydrophobicContact CD2-CD1 3.9Å
133	A	97	Very high	92.5	Very high	2 Å²	2	52.7 Å²	52.7	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-41.4	176.5	0	0	0	0	0	111.8	V129 V136 R137 V154 L156 F161	V129-A133 WeakPolarHBondContact O-CB 3.41Å; V129-A133 PolarHBondContact O-N 3.23Å; A133-V136 PolarHBondContact O-N 3.04Å; A133-R137 WeakPolarHBondContact O-CB 3.45Å; A133-R137 PolarHBondContact O-N 3.03Å; A133-V154 HydrophobicContact CB-CG1 4Å; A133-L156 HydrophobicContact CB-CD2 3.92Å; A133-F161 HydrophobicContact CB-CB 3.91Å; A133-F161 HydrophobicContact CB-CD1 3.99Å; A133-F161 HydrophobicContact CB-CD2 4.26Å; A133-F161 HydrophobicContact CB-CG 3.81Å
134	S	95.2	Very high	90.7	Very high	40 Å²	40	52.2 Å²	52.2	28%	0.28	26%	0.262	S	S	.	.	H	α-helix	trans	-67.7	-35.9	176.3	-58.7	0	0	0	0	112.3	Q130 N131 L132 R138	Q130-S134 WeakPolarHBondContact O-CB 3.16Å; Q130-S134 PolarHBondContact O-N 3.42Å; Q130-S134 PolarHBondContact O-OG 3.2Å; N131-S134 PolarHBondContact O-N 3.29Å; L132-S134 VanDerWaalsContact C-N 3.3Å; L132-S134 PolarHBondContact O-N 3.19Å; S134-R138 WeakPolarHBondContact O-CG 3.49Å; S134-R138 PolarHBondContact O-N 2.74Å; S134-R138 VanDerWaalsContact O-N 3.12Å
135	F	94.7	Very high	88.6	Confident	14 Å²	14	56.4 Å²	56.4	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-48.7	173.7	-175.2	-84.7	0	0	0	111.4	I77 I81 I87 N131 L132 R137 R138 Q139	I77-F135 HydrophobicContact CG2-CD1 4.33Å; I77-F135 HydrophobicContact CG2-CE1 4.18Å; I81-F135 HydrophobicContact CD1-CD1 3.66Å; I81-F135 HydrophobicContact CD1-CE1 3.7Å; I81-F135 HydrophobicContact CG1-CD1 4.26Å; I81-F135 HydrophobicContact CG1-CE1 3.78Å; I81-F135 HydrophobicContact CG1-CZ 4.34Å; I87-F135 HydrophobicContact CB-CE2 4.33Å; I87-F135 HydrophobicContact CB-CZ 4.22Å; I87-F135 HydrophobicContact CD1-CE1 4.46Å; I87-F135 HydrophobicContact CD1-CZ 3.88Å; I87-F135 HydrophobicContact CG1-CE2 4.27Å; I87-F135 HydrophobicContact CG1-CZ 3.82Å; I87-F135 VanDerWaalsContact O-CE2 3.24Å; I87-F135 WeakPolarHBondContact O-CE2 3.48Å; N131-F135 WeakPolarHBondContact O-CB 3.26Å; N131-F135 PolarHBondContact O-N 2.71Å; L132-F135 WeakPolarHBondContact O-CB 3.25Å; L132-F135 PolarHBondContact O-N 3.45Å; L132-F135 VanDerWaalsContact O-N 3.14Å; F135-R137 VanDerWaalsContact C-N 3.32Å; F135-R137 PolarHBondContact O-N 3.36Å; F135-R138 PolarHBondContact O-N 3.04Å; F135-R138 VanDerWaalsContact O-N 3.17Å; F135-Q139 HydrophobicContact CD1-CG 3.95Å; F135-Q139 HydrophobicContact CE1-CG 3.55Å; F135-Q139 HydrophobicContact CZ-CG 4.01Å; F135-Q139 WeakPolarHBondContact O-CG 3.27Å; F135-Q139 PolarHBondContact O-N 3.03Å
136	V	94.8	Very high	86.5	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.3	-45.3	176.5	172.7	0	0	0	0	110.6	I77 L78 L132 A133 R138 Q139 L140 F161 V163	I77-V136 HydrophobicContact CG2-CG2 4.11Å; L78-V136 HydrophobicContact CD2-CG2 4.15Å; L132-V136 WeakPolarHBondContact O-CG2 3.33Å; L132-V136 PolarHBondContact O-N 3.37Å; A133-V136 PolarHBondContact O-N 3.04Å; V136-R138 VanDerWaalsContact C-N 3.34Å; V136-R138 PolarHBondContact O-N 3.32Å; V136-Q139 PolarHBondContact O-N 2.92Å; V136-L140 HydrophobicContact CG1-CD1 3.82Å; V136-L140 HydrophobicContact CG1-CG 4.28Å; V136-L140 VanDerWaalsContact O-CG 3.31Å; V136-L140 WeakPolarHBondContact O-CG 3.24Å; V136-L140 PolarHBondContact O-N 3.07Å; V136-F161 HydrophobicContact CB-CE2 4.38Å; V136-F161 HydrophobicContact CG1-CE2 4.36Å; V136-F161 HydrophobicContact CG2-CE2 4.22Å; V136-F161 HydrophobicContact CG2-CZ 4.04Å; V136-V163 HydrophobicContact CG1-CG2 4.23Å
137	R	93.8	Very high	84.3	Confident	107 Å²	107	60.7 Å²	60.7	40%	0.404	33%	0.334	S	S	.	.	H	α-helix	trans	-54.9	-48.5	175.7	-171.4	-176	-67.4	137.9	-3.3	111.8	A133 F135 Q139 L140 T141 V154	A133-R137 WeakPolarHBondContact O-CB 3.45Å; A133-R137 PolarHBondContact O-N 3.03Å; F135-R137 VanDerWaalsContact C-N 3.32Å; F135-R137 PolarHBondContact O-N 3.36Å; R137-Q139 PolarHBondContact O-N 3.34Å; R137-L140 PolarHBondContact O-N 2.91Å; R137-T141 PolarHBondContact O-N 3.37Å; R137-T141 VanDerWaalsContact O-N 3.15Å; R137-T141 PolarHBondContact O-OG1 3.18Å; R137-T141 VanDerWaalsContact O-OG1 3.08Å; R137-V154 HydrophobicContact CB-CB 4.24Å; R137-V154 HydrophobicContact CB-CG2 3.75Å; R137-V154 HydrophobicContact CG-CG2 4.05Å; R137-V154 PolarHBondContact NH2-O 3.41Å
138	R	91.8	Very high	82.1	Confident	164 Å²	164	59.9 Å²	59.9	62%	0.619	33%	0.33	S	S	*	.	H	α-helix	trans	-61.2	-44.4	179.8	-74.2	-174.8	-64.9	168.8	0.5	112.5	S134 F135 V136 L140 T141 S142	S134-R138 WeakPolarHBondContact O-CG 3.49Å; S134-R138 PolarHBondContact O-N 2.74Å; S134-R138 VanDerWaalsContact O-N 3.12Å; F135-R138 PolarHBondContact O-N 3.04Å; F135-R138 VanDerWaalsContact O-N 3.17Å; V136-R138 VanDerWaalsContact C-N 3.34Å; V136-R138 PolarHBondContact O-N 3.32Å; R138-L140 VanDerWaalsContact C-N 3.34Å; R138-L140 PolarHBondContact O-N 3.05Å; R138-T141 PolarHBondContact O-N 3.17Å; R138-S142 WeakPolarHBondContact O-CB 3.48Å; R138-S142 PolarHBondContact O-N 2.78Å; R138-S142 PolarHBondContact O-OG 3.47Å
139	Q	90.8	Very high	79.8	Confident	53 Å²	53	63.4 Å²	63.4	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-66.6	-34.7	179.6	-69.9	-65.5	-23.2	0	0	112.8	I77 F135 V136 R137 T141 S142	I77-Q139 HydrophobicContact CD1-CB 3.81Å; I77-Q139 HydrophobicContact CG1-CB 4.05Å; I77-Q139 HydrophobicContact CG2-CB 4.1Å; I77-Q139 HydrophobicContact CG2-CG 4.16Å; F135-Q139 HydrophobicContact CD1-CG 3.95Å; F135-Q139 HydrophobicContact CE1-CG 3.55Å; F135-Q139 HydrophobicContact CZ-CG 4.01Å; F135-Q139 WeakPolarHBondContact O-CG 3.27Å; F135-Q139 PolarHBondContact O-N 3.03Å; V136-Q139 PolarHBondContact O-N 2.92Å; R137-Q139 PolarHBondContact O-N 3.34Å; Q139-T141 VanDerWaalsContact C-N 3.34Å; Q139-S142 PolarHBondContact O-OG 3.49Å
140	L	89.2	Confident	77.7	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-67.6	-35.7	174.9	-69.2	173	0	0	0	111.7	R73 I77 V136 R137 R138 V163	R73-L140 HydrophobicContact CG-CD2 3.94Å; R73-L140 PolarHBondContact NH2-O 3.14Å; I77-L140 HydrophobicContact CD1-CD2 3.62Å; I77-L140 HydrophobicContact CD1-CG 3.89Å; V136-L140 HydrophobicContact CG1-CD1 3.82Å; V136-L140 HydrophobicContact CG1-CG 4.28Å; V136-L140 VanDerWaalsContact O-CG 3.31Å; V136-L140 WeakPolarHBondContact O-CG 3.24Å; V136-L140 PolarHBondContact O-N 3.07Å; R137-L140 PolarHBondContact O-N 2.91Å; R138-L140 VanDerWaalsContact C-N 3.34Å; R138-L140 PolarHBondContact O-N 3.05Å; L140-V163 HydrophobicContact CD1-CG1 3.59Å
141	T	84.9	Confident	76.3	Confident	67 Å²	67	69 Å²	69	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-78.5	-33.4	177.9	-48.1	0	0	0	0	113.3	R137 R138 Q139 H149	R137-T141 PolarHBondContact O-N 3.37Å; R137-T141 VanDerWaalsContact O-N 3.15Å; R137-T141 PolarHBondContact O-OG1 3.18Å; R137-T141 VanDerWaalsContact O-OG1 3.08Å; R138-T141 PolarHBondContact O-N 3.17Å; Q139-T141 VanDerWaalsContact C-N 3.34Å; T141-H149 PolarHBondContact O-CD2 3.02Å
142	S	79.5	Confident	75.6	Confident	75 Å²	75	68.1 Å²	68.1	52%	0.524	38%	0.381	S	S	.	.	H	α-helix	trans	-76.5	-28.4	-173	61.8	0	0	0	0	115.1	R138 Q139	R138-S142 WeakPolarHBondContact O-CB 3.48Å; R138-S142 PolarHBondContact O-N 2.78Å; R138-S142 PolarHBondContact O-OG 3.47Å; Q139-S142 PolarHBondContact O-OG 3.49Å
143	N	64.8	Low	75.3	Confident	107 Å²	107	73.8 Å²	73.8	57%	0.572	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	9.1	-168	-68.5	-3.6	0	0	0	114.3
144	N	58.3	Low	75.2	Confident	31 Å²	31	74 Å²	74	17%	0.166	41%	0.407	C	S	.	.	S	Bend	trans	-110.8	156.7	-172.5	-84.4	-7.4	0	0	0	114.5	R73 E148 H149	R73-N144 VanDerWaalsContact NH1-CG 3.29Å; R73-N144 PolarHBondContact NH1-ND2 3.39Å; R73-N144 PolarHBondContact NH1-OD1 3.1Å; R73-N144 PolarHBondContact NH2-ND2 3.3Å; R73-N144 PolarHBondContact NH2-OD1 3.21Å; N144-E148 HydrophobicContact CB-CB 4.12Å; N144-E148 PolarHBondContact ND2-OE2 2.92Å; N144-E148 PolarHBondContact OD1-OE2 3.02Å; N144-E148 VanDerWaalsContact OD1-OE2 3.06Å; N144-H149 VanDerWaalsContact C-CE1 3.43Å; N144-H149 PolarHBondContact O-CE1 3.19Å; N144-H149 PolarHBondContact O-NE2 3.46Å
145	S	51.4	Low	75.2	Confident	89 Å²	89	75.6 Å²	75.6	62%	0.622	41%	0.41	S	S	*	.			trans	-74.5	151.3	168.1	-52.9	0	0	0	0	110	A147 E148 H149	S145-A147 PolarHBondContact O-N 3.42Å; S145-E148 PolarHBondContact O-N 2.61Å; S145-H149 PolarHBondContact O-CE1 3.42Å; S145-H149 PolarHBondContact O-ND1 3.01Å
146	P	53.1	Low	75.3	Confident	116 Å²	116	79.1 Å²	79.1	75%	0.753	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-26.4	-173.1	-29.4	34.3	0	0	0	116.2	H149	P146-H149 WeakPolarHBondContact CA-ND1 3.45Å
147	A	50.8	Low	75.4	Confident	102 Å²	102	83 Å²	83	84%	0.843	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.2	-179.7	0	0	0	0	0	115.2	S145	S145-A147 PolarHBondContact O-N 3.42Å
148	E	49.3	Very low	75.5	Confident	121 Å²	121	82.2 Å²	82.2	57%	0.565	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-1.1	-175.4	-139.2	-176	-149.8	0	0	113	R73 N144 S145 V150	R73-E148 IonicContact NH1-OE2 3.24Å; R73-E148 PolarHBondContact NH1-OE2 3.16Å; N144-E148 HydrophobicContact CB-CB 4.12Å; N144-E148 PolarHBondContact ND2-OE2 2.92Å; N144-E148 PolarHBondContact OD1-OE2 3.02Å; N144-E148 VanDerWaalsContact OD1-OE2 3.06Å; S145-E148 PolarHBondContact O-N 2.61Å; E148-V150 PolarHBondContact O-N 2.68Å; E148-V150 VanDerWaalsContact O-N 3.15Å
149	H	48.1	Very low	75.7	Confident	77 Å²	77	76.3 Å²	76.3	36%	0.356	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-11.6	-172.4	-81.2	78	0	0	0	115.2	T141 N144 S145 P146	T141-H149 PolarHBondContact O-CD2 3.02Å; N144-H149 VanDerWaalsContact C-CE1 3.43Å; N144-H149 PolarHBondContact O-CE1 3.19Å; N144-H149 PolarHBondContact O-NE2 3.46Å; S145-H149 PolarHBondContact O-CE1 3.42Å; S145-H149 PolarHBondContact O-ND1 3.01Å; P146-H149 WeakPolarHBondContact CA-ND1 3.45Å
150	V	52.8	Low	76	Confident	116 Å²	116	73.8 Å²	73.8	70%	0.703	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-20.5	-155.4	-174.8	0	0	0	0	114.5	E148	E148-V150 PolarHBondContact O-N 2.68Å; E148-V150 VanDerWaalsContact O-N 3.15Å
151	N	68.6	Low	76.4	Confident	109 Å²	109	73.6 Å²	73.6	58%	0.583	42%	0.423	S	S	*	.			trans	-121.4	2.3	-160.2	-72.9	-8.4	0	0	0	117.3	K153 A164	N151-K153 PolarHBondContact O-N 2.84Å; N151-A164 VanDerWaalsContact O-O 3.11Å
152	S	81	Confident	77	Confident	36 Å²	36	70.4 Å²	70.4	25%	0.252	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	99	176.2	-70.1	0	0	0	0	111.8	A164	S152-A164 CarbonylContact C-O 3.55Å; S152-A164 WeakPolarHBondContact CA-O 2.93Å
153	K	91	Very high	77.8	Confident	119 Å²	119	66.9 Å²	66.9	52%	0.517	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.3	175.4	-169.8	-176	-179.7	-160.6	0	109.6	N151 E155 V163 A164	N151-K153 PolarHBondContact O-N 2.84Å; K153-E155 HydrophobicContact CD-CG 4.22Å; K153-E155 WeakPolarHBondContact CE-OE1 3.34Å; K153-E155 HydrophobicContact CG-CG 4.15Å; K153-E155 IonicContact NZ-OE1 3.44Å; K153-E155 PolarHBondContact NZ-OE1 3.23Å; K153-E155 IonicContact NZ-OE2 2.58Å; K153-V163 CarbonylContact O-C 3.47Å; K153-V163 WeakPolarHBondContact O-CA 3.42Å; K153-A164 PolarHBondContact N-O 2.86Å; K153-A164 PolarHBondContact O-N 3.3Å
154	V	95.2	Very high	79.2	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.03	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.7	174.1	-175.2	0	0	0	0	108.6	A133 R137 F161 S162 V163	A133-V154 HydrophobicContact CB-CG1 4Å; R137-V154 HydrophobicContact CB-CB 4.24Å; R137-V154 HydrophobicContact CB-CG2 3.75Å; R137-V154 HydrophobicContact CG-CG2 4.05Å; R137-V154 PolarHBondContact NH2-O 3.41Å; V154-F161 HydrophobicContact CG1-CB 4.49Å; V154-F161 HydrophobicContact CG1-CD2 4Å; V154-S162 CarbonylContact C-O 3.54Å; V154-S162 VanDerWaalsContact CA-O 3.25Å; V154-S162 WeakPolarHBondContact CA-O 3.32Å; V154-V163 HydrophobicContact CG1-CG2 4.34Å; V154-V163 HydrophobicContact CG2-CG1 4.28Å; V154-V163 HydrophobicContact CG2-CG2 4.11Å
155	E	96	Very high	80.8	Confident	75 Å²	75	63.2 Å²	63.2	35%	0.35	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.1	178.9	-60.9	-169.7	120.3	0	0	111	K153 F161 S162	K153-E155 HydrophobicContact CD-CG 4.22Å; K153-E155 WeakPolarHBondContact CE-OE1 3.34Å; K153-E155 HydrophobicContact CG-CG 4.15Å; K153-E155 IonicContact NZ-OE1 3.44Å; K153-E155 PolarHBondContact NZ-OE1 3.23Å; K153-E155 IonicContact NZ-OE2 2.58Å; E155-F161 CarbonylContact O-C 3.59Å; E155-F161 WeakPolarHBondContact O-CA 3.4Å; E155-F161 WeakPolarHBondContact O-CB 3.16Å; E155-S162 PolarHBondContact N-O 2.92Å; E155-S162 PolarHBondContact O-N 3.27Å
156	L	97.1	Very high	82.5	Confident	87 Å²	87	61.7 Å²	61.7	46%	0.455	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138.3	175.3	-78.7	177.2	0	0	0	110.1	V129 Q130 A133 F161	V129-L156 HydrophobicContact CG1-CD2 4.17Å; Q130-L156 HydrophobicContact CB-CD1 3.97Å; Q130-L156 HydrophobicContact CB-CD2 4.49Å; Q130-L156 HydrophobicContact CG-CD1 3.91Å; A133-L156 HydrophobicContact CB-CD2 3.92Å; L156-F161 HydrophobicContact CD2-CB 4.28Å
157	E	96.5	Very high	84.3	Confident	82 Å²	82	62.9 Å²	62.9	38%	0.383	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	160.3	-173.4	-69.6	-70.5	-177.3	0	0	110.9	Y159 G160	E157-Y159 HydrophobicContact CB-CD1 4.06Å; E157-Y159 HydrophobicContact CB-CD2 4.13Å; E157-Y159 HydrophobicContact CB-CE1 3.68Å; E157-Y159 HydrophobicContact CB-CE2 3.77Å; E157-Y159 HydrophobicContact CB-CG 4.28Å; E157-Y159 HydrophobicContact CG-CE1 4.08Å; E157-Y159 HydrophobicContact CG-CE2 4.21Å; E157-Y159 PolarHBondContact O-N 2.88Å; E157-G160 PolarHBondContact N-O 3.39Å; E157-G160 CarbonylContact O-C 3.58Å; E157-G160 PolarHBondContact O-N 3.18Å
158	S	94.9	Very high	86.3	Confident	90 Å²	90	60.6 Å²	60.6	63%	0.629	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.3	-179.6	63.2	0	0	0	0	114.4
159	Y	96.2	Very high	88.5	Confident	40 Å²	40	57.4 Å²	57.4	16%	0.157	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-2.8	177.9	55.2	-103.5	0	0	0	114.2	E157 Q171 L173 I174	E157-Y159 HydrophobicContact CB-CD1 4.06Å; E157-Y159 HydrophobicContact CB-CD2 4.13Å; E157-Y159 HydrophobicContact CB-CE1 3.68Å; E157-Y159 HydrophobicContact CB-CE2 3.77Å; E157-Y159 HydrophobicContact CB-CG 4.28Å; E157-Y159 HydrophobicContact CG-CE1 4.08Å; E157-Y159 HydrophobicContact CG-CE2 4.21Å; E157-Y159 PolarHBondContact O-N 2.88Å; Y159-Q171 HydrophobicContact CE2-CB 3.88Å; Y159-Q171 HydrophobicContact CE2-CG 4.24Å; Y159-Q171 WeakPolarHBondContact OH-CG 3.41Å; Y159-Q171 PolarHBondContact OH-NE2 3.16Å; Y159-L173 HydrophobicContact CD2-CD2 3.61Å; Y159-L173 HydrophobicContact CE2-CD2 4.16Å; Y159-L173 HydrophobicContact CG-CD2 3.95Å; Y159-I174 PolarHBondContact O-N 2.92Å
160	G	97.3	Very high	90.8	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141.3	-108.4	-171.1	0	0	0	0	0	111.2	E157	E157-G160 PolarHBondContact N-O 3.39Å; E157-G160 CarbonylContact O-C 3.58Å; E157-G160 PolarHBondContact O-N 3.18Å
161	F	98	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	158.5	176.6	59.9	-87.6	0	0	0	111.6	V129 L132 A133 V136 V154 E155 L156 V163 V172 I174	V129-F161 HydrophobicContact CG1-CD1 4.39Å; L132-F161 HydrophobicContact CD2-CE1 3.9Å; L132-F161 HydrophobicContact CD2-CZ 4.41Å; L132-F161 HydrophobicContact CG-CE1 4Å; L132-F161 HydrophobicContact CG-CZ 4.3Å; A133-F161 HydrophobicContact CB-CB 3.91Å; A133-F161 HydrophobicContact CB-CD1 3.99Å; A133-F161 HydrophobicContact CB-CD2 4.26Å; A133-F161 HydrophobicContact CB-CG 3.81Å; V136-F161 HydrophobicContact CB-CE2 4.38Å; V136-F161 HydrophobicContact CG1-CE2 4.36Å; V136-F161 HydrophobicContact CG2-CE2 4.22Å; V136-F161 HydrophobicContact CG2-CZ 4.04Å; V154-F161 HydrophobicContact CG1-CB 4.49Å; V154-F161 HydrophobicContact CG1-CD2 4Å; E155-F161 CarbonylContact O-C 3.59Å; E155-F161 WeakPolarHBondContact O-CA 3.4Å; E155-F161 WeakPolarHBondContact O-CB 3.16Å; L156-F161 HydrophobicContact CD2-CB 4.28Å; F161-V163 HydrophobicContact CD2-CG2 4.02Å; F161-V163 HydrophobicContact CE2-CG2 4Å; F161-V172 HydrophobicContact CD1-CB 4.16Å; F161-V172 HydrophobicContact CD1-CG1 4.49Å; F161-V172 HydrophobicContact CD2-CB 4.05Å; F161-V172 HydrophobicContact CD2-CG2 3.98Å; F161-V172 HydrophobicContact CE1-CB 3.8Å; F161-V172 HydrophobicContact CE1-CG1 3.75Å; F161-V172 HydrophobicContact CE1-CG2 4.35Å; F161-V172 HydrophobicContact CE2-CB 3.69Å; F161-V172 HydrophobicContact CE2-CG1 4.28Å; F161-V172 HydrophobicContact CE2-CG2 3.37Å; F161-V172 HydrophobicContact CG-CB 4.28Å; F161-V172 HydrophobicContact CZ-CB 3.55Å; F161-V172 HydrophobicContact CZ-CG1 3.63Å; F161-V172 HydrophobicContact CZ-CG2 3.59Å; F161-V172 PolarHBondContact N-O 2.83Å; F161-V172 PolarHBondContact O-N 3.14Å; F161-I174 HydrophobicContact CD1-CD1 4.47Å; F161-I174 HydrophobicContact CE1-CD1 4Å
162	S	97.4	Very high	94.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.007	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145.5	174.3	62.5	0	0	0	0	110.1	V154 E155 V170	V154-S162 CarbonylContact C-O 3.54Å; V154-S162 VanDerWaalsContact CA-O 3.25Å; V154-S162 WeakPolarHBondContact CA-O 3.32Å; E155-S162 PolarHBondContact N-O 2.92Å; E155-S162 PolarHBondContact O-N 3.27Å; S162-V170 CarbonylContact C-O 3.51Å; S162-V170 WeakPolarHBondContact CA-O 3.24Å
163	V	96.5	Very high	95.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.9	172.9	-175.8	0	0	0	0	107.7	I74 V136 L140 K153 V154 F161 M169 V170	I74-V163 HydrophobicContact CD1-CB 3.58Å; I74-V163 HydrophobicContact CD1-CG1 3.75Å; I74-V163 HydrophobicContact CD1-CG2 3.8Å; I74-V163 HydrophobicContact CG1-CG1 4.49Å; I74-V163 HydrophobicContact CG1-CG2 4.5Å; V136-V163 HydrophobicContact CG1-CG2 4.23Å; L140-V163 HydrophobicContact CD1-CG1 3.59Å; K153-V163 CarbonylContact O-C 3.47Å; K153-V163 WeakPolarHBondContact O-CA 3.42Å; V154-V163 HydrophobicContact CG1-CG2 4.34Å; V154-V163 HydrophobicContact CG2-CG1 4.28Å; V154-V163 HydrophobicContact CG2-CG2 4.11Å; F161-V163 HydrophobicContact CD2-CG2 4.02Å; F161-V163 HydrophobicContact CE2-CG2 4Å; V163-M169 CarbonylContact O-C 3.56Å; V163-M169 WeakPolarHBondContact O-CA 3.44Å; V163-V170 PolarHBondContact N-O 2.82Å; V163-V170 PolarHBondContact O-N 3.44Å
164	A	94	Very high	95.6	Very high	20 Å²	20	38.5 Å²	38.5	17%	0.165	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.7	177.4	0	0	0	0	0	110.6	N151 S152 K153 Y168	N151-A164 VanDerWaalsContact O-O 3.11Å; S152-A164 CarbonylContact C-O 3.55Å; S152-A164 WeakPolarHBondContact CA-O 2.93Å; K153-A164 PolarHBondContact N-O 2.86Å; K153-A164 PolarHBondContact O-N 3.3Å; A164-Y168 CarbonylContact C-O 3.29Å; A164-Y168 VanDerWaalsContact CA-O 3.25Å; A164-Y168 WeakPolarHBondContact CA-O 3.33Å
165	S	91.4	Very high	95.7	Very high	42 Å²	42	38.2 Å²	38.2	29%	0.294	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	101.6	171.6	-178.3	0	0	0	0	109.3	D167 Y168	S165-D167 PolarHBondContact O-N 3.39Å; S165-Y168 PolarHBondContact N-O 2.88Å; S165-Y168 PolarHBondContact O-N 2.85Å
166	G	87.7	Confident	95.8	Very high	56 Å²	56	34.7 Å²	34.7	58%	0.577	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	-129	-168.2	0	0	0	0	0	110.7	Y168	G166-Y168 VanDerWaalsContact C-N 3.29Å; G166-Y168 PolarHBondContact O-N 3.43Å
167	D	89.6	Confident	95.7	Very high	141 Å²	141	32.2 Å²	32.2	75%	0.754	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.1	177.9	-60.8	-38.8	0	0	0	113.5	C112 S165	C112-D167 WeakPolarHBondContact CB-O 3.32Å; S165-D167 PolarHBondContact O-N 3.39Å
168	Y	93.1	Very high	95.5	Very high	55 Å²	55	32.8 Å²	32.8	22%	0.216	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.7	-175.3	-56.4	-76.3	0	0	0	111.8	S63 A66 L67 C112 A164 S165 G166	S63-Y168 WeakPolarHBondContact CA-OH 3.13Å; A66-Y168 HydrophobicContact CB-CD1 4.46Å; A66-Y168 HydrophobicContact CB-CD2 3.9Å; A66-Y168 HydrophobicContact CB-CE1 4.03Å; A66-Y168 HydrophobicContact CB-CE2 3.42Å; A66-Y168 VanDerWaalsContact CB-CE2 3.42Å; A66-Y168 HydrophobicContact CB-CG 4.4Å; A66-Y168 VanDerWaalsContact CB-CZ 3.5Å; L67-Y168 HydrophobicContact CB-CD1 3.87Å; L67-Y168 HydrophobicContact CB-CE1 4.39Å; L67-Y168 HydrophobicContact CD1-CD1 4.26Å; C112-Y168 HydrophobicContact CB-CD1 3.97Å; C112-Y168 HydrophobicContact CB-CE1 4.47Å; C112-Y168 CarbonylContact O-C 3.6Å; C112-Y168 WeakPolarHBondContact O-CA 3.38Å; A164-Y168 CarbonylContact C-O 3.29Å; A164-Y168 VanDerWaalsContact CA-O 3.25Å; A164-Y168 WeakPolarHBondContact CA-O 3.33Å; S165-Y168 PolarHBondContact N-O 2.88Å; S165-Y168 PolarHBondContact O-N 2.85Å; G166-Y168 VanDerWaalsContact C-N 3.29Å; G166-Y168 PolarHBondContact O-N 3.43Å
169	M	95.4	Very high	95.4	Very high	53 Å²	53	36 Å²	36	26%	0.261	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	137.3	-179.5	-174.9	-177.9	-71.5	0	0	111.1	C112 I113 S114 V163 Q171	C112-M169 PolarHBondContact O-N 3.13Å; I113-M169 CarbonylContact C-O 3.55Å; I113-M169 VanDerWaalsContact CA-O 3.32Å; I113-M169 WeakPolarHBondContact CA-O 3.49Å; I113-M169 HydrophobicContact CG1-CB 4.37Å; S114-M169 PolarHBondContact N-O 2.94Å; S114-M169 PolarHBondContact OG-O 3.26Å; V163-M169 CarbonylContact O-C 3.56Å; V163-M169 WeakPolarHBondContact O-CA 3.44Å; M169-Q171 HydrophobicContact CG-CG 4.41Å; M169-Q171 HydrophobicContact SD-CG 4.24Å
170	V	97.6	Very high	95.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.7	169.4	177.2	0	0	0	0	108.1	L70 N71 I74 S114 L116 S162 V163 V172	L70-V170 HydrophobicContact CB-CG2 4.26Å; L70-V170 HydrophobicContact CD2-CG2 3.75Å; L70-V170 HydrophobicContact CG-CG2 3.73Å; N71-V170 HydrophobicContact CB-CG2 4.23Å; I74-V170 HydrophobicContact CD1-CB 3.53Å; I74-V170 HydrophobicContact CD1-CG1 3.71Å; I74-V170 HydrophobicContact CD1-CG2 3.74Å; S114-V170 CarbonylContact O-C 3.52Å; S114-V170 WeakPolarHBondContact O-CA 3.33Å; S114-V170 WeakPolarHBondContact OG-CG2 3.42Å; L116-V170 HydrophobicContact CB-CG1 4.47Å; L116-V170 HydrophobicContact CD1-CG1 3.52Å; L116-V170 HydrophobicContact CG-CG1 3.92Å; S162-V170 CarbonylContact C-O 3.51Å; S162-V170 WeakPolarHBondContact CA-O 3.24Å; V163-V170 PolarHBondContact N-O 2.82Å; V163-V170 PolarHBondContact O-N 3.44Å; V170-V172 HydrophobicContact CG1-CG2 4.5Å
171	Q	98.1	Very high	95.1	Very high	44 Å²	44	36.9 Å²	36.9	21%	0.206	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.8	176	-62.7	-172.7	-23.1	0	0	109.2	I113 S114 D115 L116 Y159 M169 L173	I113-Q171 HydrophobicContact CG2-CG 3.9Å; S114-Q171 PolarHBondContact O-N 3.38Å; D115-Q171 CarbonylContact C-O 3.41Å; D115-Q171 WeakPolarHBondContact CA-O 3.1Å; D115-Q171 PolarHBondContact OD1-OE1 3.09Å; L116-Q171 PolarHBondContact N-O 3.38Å; Y159-Q171 HydrophobicContact CE2-CB 3.88Å; Y159-Q171 HydrophobicContact CE2-CG 4.24Å; Y159-Q171 WeakPolarHBondContact OH-CG 3.41Å; Y159-Q171 PolarHBondContact OH-NE2 3.16Å; M169-Q171 HydrophobicContact CG-CG 4.41Å; M169-Q171 HydrophobicContact SD-CG 4.24Å; Q171-L173 HydrophobicContact CB-CD2 4.22Å
172	V	98.4	Very high	94.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	100.4	174.9	-172.1	0	0	0	0	108.6	I74 L78 L116 C118 F161 V170 I174	I74-V172 HydrophobicContact CG2-CG2 4.12Å; L78-V172 HydrophobicContact CD1-CG1 4.18Å; L116-V172 HydrophobicContact CB-CG2 4.34Å; L116-V172 HydrophobicContact CD1-CG2 4.38Å; L116-V172 CarbonylContact O-C 3.48Å; L116-V172 VanDerWaalsContact O-CA 3.32Å; L116-V172 WeakPolarHBondContact O-CA 3.25Å; C118-V172 HydrophobicContact CB-CG1 3.83Å; F161-V172 HydrophobicContact CD1-CB 4.16Å; F161-V172 HydrophobicContact CD1-CG1 4.49Å; F161-V172 HydrophobicContact CD2-CB 4.05Å; F161-V172 HydrophobicContact CD2-CG2 3.98Å; F161-V172 HydrophobicContact CE1-CB 3.8Å; F161-V172 HydrophobicContact CE1-CG1 3.75Å; F161-V172 HydrophobicContact CE1-CG2 4.35Å; F161-V172 HydrophobicContact CE2-CB 3.69Å; F161-V172 HydrophobicContact CE2-CG1 4.28Å; F161-V172 HydrophobicContact CE2-CG2 3.37Å; F161-V172 HydrophobicContact CG-CB 4.28Å; F161-V172 HydrophobicContact CZ-CB 3.55Å; F161-V172 HydrophobicContact CZ-CG1 3.63Å; F161-V172 HydrophobicContact CZ-CG2 3.59Å; F161-V172 PolarHBondContact N-O 2.83Å; F161-V172 PolarHBondContact O-N 3.14Å; V170-V172 HydrophobicContact CG1-CG2 4.5Å; V172-I174 HydrophobicContact CG1-CD1 3.97Å; V172-I174 PolarHBondContact O-N 3.28Å
173	L	98.5	Very high	94.5	Very high	16 Å²	16	51.4 Å²	51.4	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	109.8	178.5	-46.3	-179.3	0	0	0	109.3	V99 D115 L116 A117 C118 Y159 Q171 A198	V99-L173 HydrophobicContact CG2-CD1 4.33Å; D115-L173 HydrophobicContact CB-CD1 4.21Å; L116-L173 PolarHBondContact O-N 2.82Å; A117-L173 WeakPolarHBondContact CA-O 3.47Å; C118-L173 PolarHBondContact N-O 3.43Å; Y159-L173 HydrophobicContact CD2-CD2 3.61Å; Y159-L173 HydrophobicContact CE2-CD2 4.16Å; Y159-L173 HydrophobicContact CG-CD2 3.95Å; Q171-L173 HydrophobicContact CB-CD2 4.22Å; L173-A198 HydrophobicContact CB-CB 3.74Å
174	I	98.2	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135.8	-175.5	-57.1	-75.1	0	0	0	110.3	C118 F120 P124 V129 L132 Y159 F161 V172 I190	C118-I174 HydrophobicContact CB-CD1 3.99Å; F120-I174 HydrophobicContact CD2-CG2 3.8Å; F120-I174 HydrophobicContact CE2-CD1 3.85Å; F120-I174 HydrophobicContact CE2-CG2 3.67Å; P124-I174 HydrophobicContact CB-CG2 3.54Å; P124-I174 HydrophobicContact CG-CG2 4.14Å; V129-I174 HydrophobicContact CG1-CG1 4.38Å; V129-I174 HydrophobicContact CG2-CG1 4.42Å; V129-I174 HydrophobicContact CG2-CG2 4.06Å; L132-I174 HydrophobicContact CD2-CD1 3.9Å; Y159-I174 PolarHBondContact O-N 2.92Å; F161-I174 HydrophobicContact CD1-CD1 4.47Å; F161-I174 HydrophobicContact CE1-CD1 4Å; V172-I174 HydrophobicContact CG1-CD1 3.97Å; V172-I174 PolarHBondContact O-N 3.28Å; I174-I190 HydrophobicContact CB-CD1 3.51Å; I174-I190 HydrophobicContact CG1-CD1 4.05Å; I174-I190 HydrophobicContact CG2-CD1 3.73Å
175	T	98.1	Very high	94.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	-178.6	174.9	-165	0	0	0	0	111.9	C118 V119 F120 Q195 A198 L199	C118-T175 PolarHBondContact O-N 3.45Å; V119-T175 CarbonylContact C-O 3.59Å; V119-T175 WeakPolarHBondContact CA-O 3.41Å; V119-T175 HydrophobicContact CB-CG2 4.37Å; V119-T175 HydrophobicContact CG1-CG2 4.46Å; V119-T175 HydrophobicContact CG2-CG2 3.79Å; F120-T175 PolarHBondContact N-O 2.87Å; T175-Q195 WeakPolarHBondContact OG1-CA 3.49Å; T175-Q195 WeakPolarHBondContact OG1-CB 3.34Å; T175-Q195 PolarHBondContact OG1-O 3.18Å; T175-A198 HydrophobicContact CG2-CB 3.95Å; T175-L199 HydrophobicContact CG2-CD2 3.96Å; T175-L199 HydrophobicContact CG2-CG 3.85Å; T175-L199 WeakPolarHBondContact OG1-CG 3.45Å
176	T	97.5	Very high	94.3	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	176.9	176.3	-167.2	0	0	0	0	110.6	F120 T122 L123 N180 L181 Q195	F120-T176 WeakPolarHBondContact O-CA 3.5Å; F120-T176 PolarHBondContact O-OG1 3.23Å; T122-T176 WeakPolarHBondContact O-CB 3.48Å; T122-T176 PolarHBondContact O-OG1 2.92Å; L123-T176 HydrophobicContact CD2-CG2 4.49Å; T176-N180 HydrophobicContact CG2-CB 3.59Å; T176-N180 PolarHBondContact OG1-ND2 2.83Å; T176-L181 HydrophobicContact CG2-CD2 4.33Å; T176-L181 HydrophobicContact CG2-CG 4.47Å; T176-Q195 VanDerWaalsContact CG2-OE1 3.25Å
177	T	95.3	Very high	94.5	Very high	36 Å²	36	61.1 Å²	61.1	22%	0.221	32%	0.321	C	S	.	.			trans	-62	146.6	173.6	67.8	0	0	0	0	111.5	F120 M179 N180	F120-T177 PolarHBondContact O-N 3.25Å; T177-M179 PolarHBondContact O-N 3.2Å; T177-N180 PolarHBondContact O-N 3.21Å; T177-N180 PolarHBondContact OG1-ND2 3.44Å
178	P	92.8	Very high	94.8	Very high	93 Å²	93	58.9 Å²	58.9	60%	0.604	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.2	-178.2	-29.2	35.7	0	0	0	114.7	N180 L181	P178-N180 VanDerWaalsContact C-N 3.26Å; P178-N180 PolarHBondContact O-N 3.08Å; P178-L181 PolarHBondContact O-N 2.84Å
179	M	92.1	Very high	94.9	Very high	159 Å²	159	57.1 Å²	57.1	78%	0.783	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.8	178.5	-66.3	-176.6	67.5	0	0	113.7	T177 N182	T177-M179 PolarHBondContact O-N 3.2Å; M179-N182 PolarHBondContact O-OD1 2.91Å; M179-N182 VanDerWaalsContact O-OD1 3.11Å
180	N	94	Very high	94.9	Very high	27 Å²	27	54.8 Å²	54.8	14%	0.144	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-18.2	-178	-72	-24.3	0	0	0	112.9	R121 L123 T176 T177 P178 N182 R183	R121-N180 PolarHBondContact O-ND2 3.26Å; L123-N180 HydrophobicContact CD2-CB 3.93Å; L123-N180 WeakPolarHBondContact CD2-O 3.47Å; L123-N180 HydrophobicContact CG-CB 4.36Å; T176-N180 HydrophobicContact CG2-CB 3.59Å; T176-N180 PolarHBondContact OG1-ND2 2.83Å; T177-N180 PolarHBondContact O-N 3.21Å; T177-N180 PolarHBondContact OG1-ND2 3.44Å; P178-N180 VanDerWaalsContact C-N 3.26Å; P178-N180 PolarHBondContact O-N 3.08Å; N180-N182 PolarHBondContact O-N 3.42Å; N180-N182 VanDerWaalsContact O-N 3.08Å; N180-R183 WeakPolarHBondContact O-CB 3.39Å; N180-R183 PolarHBondContact O-N 2.76Å
181	L	92.6	Very high	94.8	Very high	31 Å²	31	57.3 Å²	57.3	16%	0.162	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-56.2	-31.7	-173.3	-75.8	169.5	0	0	0	114.1	T176 P178 R183 T184 L192 Q195 L199	T176-L181 HydrophobicContact CG2-CD2 4.33Å; T176-L181 HydrophobicContact CG2-CG 4.47Å; P178-L181 PolarHBondContact O-N 2.84Å; L181-R183 PolarHBondContact O-N 3.1Å; L181-T184 PolarHBondContact O-OG1 3.17Å; L181-L192 HydrophobicContact CB-CD1 4.22Å; L181-L192 HydrophobicContact CD2-CD1 3.82Å; L181-L192 WeakPolarHBondContact O-CD1 3.44Å; L181-Q195 HydrophobicContact CD2-CB 3.84Å; L181-L199 HydrophobicContact CD1-CD1 3.63Å; L181-L199 HydrophobicContact CD2-CD1 4.12Å; L181-L199 HydrophobicContact CG-CD1 4.15Å
182	N	90.5	Very high	94.6	Very high	135 Å²	135	58.4 Å²	58.4	72%	0.722	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-76.5	-5	179.4	62.8	-6.9	0	0	0	113.7	M179 N180	M179-N182 PolarHBondContact O-OD1 2.91Å; M179-N182 VanDerWaalsContact O-OD1 3.11Å; N180-N182 PolarHBondContact O-N 3.42Å; N180-N182 VanDerWaalsContact O-N 3.08Å
183	R	93.8	Very high	94.5	Very high	172 Å²	172	62.9 Å²	62.9	65%	0.649	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-106.9	4.1	179	-60.1	175.1	-173.4	-179	-0.7	113	L123 N180 L181 S185	L123-R183 HydrophobicContact CD1-CB 3.96Å; L123-R183 HydrophobicContact CD2-CB 4.39Å; N180-R183 WeakPolarHBondContact O-CB 3.39Å; N180-R183 PolarHBondContact O-N 2.76Å; L181-R183 PolarHBondContact O-N 3.1Å; R183-S185 PolarHBondContact O-N 3.31Å
184	T	92.4	Very high	94.4	Very high	28 Å²	28	62.7 Å²	62.7	17%	0.172	34%	0.343	C	S	.	.			trans	-69.1	121.6	-179.7	-57.8	0	0	0	0	111.3	L181 H189 L192 Q195	L181-T184 PolarHBondContact O-OG1 3.17Å; T184-H189 HydrophobicContact CG2-CB 3.78Å; T184-L192 HydrophobicContact CG2-CB 4.3Å; T184-Q195 VanDerWaalsContact CG2-NE2 3.33Å
185	S	93.9	Very high	94.4	Very high	36 Å²	36	62.7 Å²	62.7	25%	0.252	34%	0.343	S	S	.	.			trans	-100.5	132.5	168.9	56.9	0	0	0	0	112.3	R183 D187 I188 H189	R183-S185 PolarHBondContact O-N 3.31Å; S185-D187 VanDerWaalsContact C-N 3.32Å; S185-D187 PolarHBondContact O-N 3Å; S185-I188 PolarHBondContact O-N 3.27Å; S185-H189 PolarHBondContact N-ND1 3.33Å; S185-H189 WeakPolarHBondContact O-CB 3.33Å; S185-H189 PolarHBondContact O-N 3.48Å; S185-H189 PolarHBondContact O-ND1 2.87Å; S185-H189 PolarHBondContact OG-CE1 3.33Å; S185-H189 PolarHBondContact OG-ND1 3.3Å
186	P	90.8	Very high	94.3	Very high	111 Å²	111	68.2 Å²	68.2	72%	0.721	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-30	-175.8	-25.2	34.6	0	0	0	115.9
187	D	91.8	Very high	94.2	Very high	147 Å²	147	72.9 Å²	72.9	79%	0.786	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-19	-174.7	-54.2	-46.8	0	0	0	113.2	S185	S185-D187 VanDerWaalsContact C-N 3.32Å; S185-D187 PolarHBondContact O-N 3Å
188	I	95	Very high	94.3	Very high	94 Å²	94	71.2 Å²	71.2	48%	0.482	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-31.7	-171.6	-54.1	174.8	0	0	0	111	T125 L126 S185	T125-I188 CarbonylContact C-O 3.38Å; T125-I188 WeakPolarHBondContact CA-O 3.4Å; T125-I188 HydrophobicContact CG2-CG2 3.95Å; L126-I188 PolarHBondContact N-O 3.34Å; S185-I188 PolarHBondContact O-N 3.27Å
189	H	96.1	Very high	94.5	Very high	18 Å²	18	67.5 Å²	67.5	8%	0.083	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-116	159.9	-170.1	-53.2	107.7	0	0	0	112.2	L123 P124 T184 S185	L123-H189 WeakPolarHBondContact CB-NE2 3.39Å; P124-H189 WeakPolarHBondContact O-CA 3.33Å; T184-H189 HydrophobicContact CG2-CB 3.78Å; S185-H189 PolarHBondContact N-ND1 3.33Å; S185-H189 WeakPolarHBondContact O-CB 3.33Å; S185-H189 PolarHBondContact O-N 3.48Å; S185-H189 PolarHBondContact O-ND1 2.87Å; S185-H189 PolarHBondContact OG-CE1 3.33Å; S185-H189 PolarHBondContact OG-ND1 3.3Å
190	I	95.1	Very high	94.7	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.324	C	S	.	.			trans	-54.5	144.7	168.1	-77.2	-179.3	0	0	0	110.7	P124 L126 V129 I174 L192 A194 Q195	P124-I190 PolarHBondContact O-N 3.34Å; L126-I190 HydrophobicContact CD2-CG1 4.16Å; V129-I190 HydrophobicContact CB-CD1 4.17Å; V129-I190 HydrophobicContact CG1-CD1 3.97Å; V129-I190 HydrophobicContact CG2-CD1 3.31Å; V129-I190 HydrophobicContact CG2-CG1 3.93Å; I174-I190 HydrophobicContact CB-CD1 3.51Å; I174-I190 HydrophobicContact CG1-CD1 4.05Å; I174-I190 HydrophobicContact CG2-CD1 3.73Å; I190-L192 PolarHBondContact O-N 3.42Å; I190-A194 HydrophobicContact CG2-CB 3.99Å; I190-Q195 HydrophobicContact CB-CG 4.43Å; I190-Q195 HydrophobicContact CG2-CG 3.93Å; I190-Q195 PolarHBondContact O-NE2 2.98Å
191	S	94.7	Very high	94.9	Very high	53 Å²	53	60.5 Å²	60.5	37%	0.371	33%	0.325	S	S	.	.			trans	-38.8	124.8	173.7	164.1	0	0	0	0	112.8	T193 A194 Q195	S191-T193 PolarHBondContact O-N 3.15Å; S191-T193 PolarHBondContact OG-N 3.01Å; S191-A194 PolarHBondContact O-N 3.26Å; S191-A194 PolarHBondContact OG-N 3.21Å; S191-Q195 WeakPolarHBondContact O-CG 3.35Å; S191-Q195 PolarHBondContact O-N 3.23Å
192	L	95.7	Very high	95.2	Very high	66 Å²	66	59.4 Å²	59.4	35%	0.346	32%	0.32	S	S	.	.	H	α-helix	trans	-55.3	-35.2	174.6	179.2	61.4	0	0	0	111.7	L181 T184 I190 Q195 K196	L181-L192 HydrophobicContact CB-CD1 4.22Å; L181-L192 HydrophobicContact CD2-CD1 3.82Å; L181-L192 WeakPolarHBondContact O-CD1 3.44Å; T184-L192 HydrophobicContact CG2-CB 4.3Å; I190-L192 PolarHBondContact O-N 3.42Å; L192-Q195 PolarHBondContact O-N 2.99Å; L192-K196 HydrophobicContact CD1-CG 4.49Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CB 3.23Å; L192-K196 WeakPolarHBondContact O-CG 3.17Å; L192-K196 PolarHBondContact O-N 3.17Å
193	T	95.5	Very high	95.5	Very high	94 Å²	94	56.8 Å²	56.8	58%	0.577	30%	0.3	S	S	*	.	H	α-helix	trans	-64	-45.3	176.8	-55.5	0	0	0	0	111.2	S191 K196 I197	S191-T193 PolarHBondContact O-N 3.15Å; S191-T193 PolarHBondContact OG-N 3.01Å; T193-K196 PolarHBondContact O-N 2.75Å; T193-I197 HydrophobicContact CG2-CD1 4.04Å; T193-I197 VanDerWaalsContact O-CG1 3.32Å; T193-I197 WeakPolarHBondContact O-CG1 3.26Å; T193-I197 PolarHBondContact O-N 2.83Å
194	A	96.5	Very high	95.7	Very high	13 Å²	13	50.1 Å²	50.1	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-42.7	177.9	0	0	0	0	0	112	I190 S191 K196 I197 A198	I190-A194 HydrophobicContact CG2-CB 3.99Å; S191-A194 PolarHBondContact O-N 3.26Å; S191-A194 PolarHBondContact OG-N 3.21Å; A194-K196 VanDerWaalsContact C-N 3.31Å; A194-K196 PolarHBondContact O-N 2.92Å; A194-I197 PolarHBondContact O-N 3.28Å; A194-A198 PolarHBondContact O-N 2.89Å
195	Q	97.7	Very high	96	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-40.4	176.5	-64.1	-171.6	52.1	0	0	112.1	T175 T176 L181 T184 I190 S191 L192 L199	T175-Q195 WeakPolarHBondContact OG1-CA 3.49Å; T175-Q195 WeakPolarHBondContact OG1-CB 3.34Å; T175-Q195 PolarHBondContact OG1-O 3.18Å; T176-Q195 VanDerWaalsContact CG2-OE1 3.25Å; L181-Q195 HydrophobicContact CD2-CB 3.84Å; T184-Q195 VanDerWaalsContact CG2-NE2 3.33Å; I190-Q195 HydrophobicContact CB-CG 4.43Å; I190-Q195 HydrophobicContact CG2-CG 3.93Å; I190-Q195 PolarHBondContact O-NE2 2.98Å; S191-Q195 WeakPolarHBondContact O-CG 3.35Å; S191-Q195 PolarHBondContact O-N 3.23Å; L192-Q195 PolarHBondContact O-N 2.99Å; Q195-L199 PolarHBondContact O-N 3.44Å; Q195-L199 VanDerWaalsContact O-N 3.12Å
196	K	96	Very high	96.1	Very high	115 Å²	115	54.2 Å²	54.2	50%	0.5	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-42.9	175.4	-76.8	178.7	177.2	-176.5	0	112.2	L192 T193 A194 L199 A200	L192-K196 HydrophobicContact CD1-CG 4.49Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CB 3.23Å; L192-K196 WeakPolarHBondContact O-CG 3.17Å; L192-K196 PolarHBondContact O-N 3.17Å; T193-K196 PolarHBondContact O-N 2.75Å; A194-K196 VanDerWaalsContact C-N 3.31Å; A194-K196 PolarHBondContact O-N 2.92Å; K196-L199 PolarHBondContact O-N 2.9Å; K196-A200 WeakPolarHBondContact O-CB 3.31Å; K196-A200 PolarHBondContact O-N 3.12Å
197	I	96.1	Very high	96.5	Very high	98 Å²	98	50.6 Å²	50.6	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-47.1	176.7	-70.1	165.9	0	0	0	110.4	T193 A194 L199 A200 S201	T193-I197 HydrophobicContact CG2-CD1 4.04Å; T193-I197 VanDerWaalsContact O-CG1 3.32Å; T193-I197 WeakPolarHBondContact O-CG1 3.26Å; T193-I197 PolarHBondContact O-N 2.83Å; A194-I197 PolarHBondContact O-N 3.28Å; I197-L199 PolarHBondContact O-N 2.88Å; I197-A200 WeakPolarHBondContact O-CB 3.26Å; I197-A200 PolarHBondContact O-N 3.27Å; I197-S201 PolarHBondContact O-N 3.15Å; I197-S201 PolarHBondContact O-OG 3.29Å
198	A	97.7	Very high	96.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-43.3	178.1	0	0	0	0	0	112.5	L173 T175 A194 S201 I202	L173-A198 HydrophobicContact CB-CB 3.74Å; T175-A198 HydrophobicContact CG2-CB 3.95Å; A194-A198 PolarHBondContact O-N 2.89Å; A198-S201 PolarHBondContact O-N 3.33Å; A198-I202 WeakPolarHBondContact O-CG1 3.29Å; A198-I202 PolarHBondContact O-N 3.19Å
199	L	97.1	Very high	96.8	Very high	16 Å²	16	43.7 Å²	43.7	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-38.1	175.9	-76.5	168.1	0	0	0	112.6	T175 L181 Q195 K196 I197 I202 R203	T175-L199 HydrophobicContact CG2-CD2 3.96Å; T175-L199 HydrophobicContact CG2-CG 3.85Å; T175-L199 WeakPolarHBondContact OG1-CG 3.45Å; L181-L199 HydrophobicContact CD1-CD1 3.63Å; L181-L199 HydrophobicContact CD2-CD1 4.12Å; L181-L199 HydrophobicContact CG-CD1 4.15Å; Q195-L199 PolarHBondContact O-N 3.44Å; Q195-L199 VanDerWaalsContact O-N 3.12Å; K196-L199 PolarHBondContact O-N 2.9Å; I197-L199 PolarHBondContact O-N 2.88Å; L199-I202 PolarHBondContact O-N 3.23Å; L199-R203 PolarHBondContact O-N 3.37Å; L199-R203 VanDerWaalsContact O-N 3.13Å; L199-R203 PolarHBondContact O-NH1 3.47Å
200	A	96.5	Very high	96.8	Very high	15 Å²	15	50.1 Å²	50.1	12%	0.124	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-45.5	174.1	0	0	0	0	0	110.4	K196 I197 I202 R203 H204	K196-A200 WeakPolarHBondContact O-CB 3.31Å; K196-A200 PolarHBondContact O-N 3.12Å; I197-A200 WeakPolarHBondContact O-CB 3.26Å; I197-A200 PolarHBondContact O-N 3.27Å; A200-I202 VanDerWaalsContact C-N 3.26Å; A200-I202 PolarHBondContact O-N 3Å; A200-R203 PolarHBondContact O-N 2.65Å; A200-H204 WeakPolarHBondContact O-CB 3.32Å; A200-H204 PolarHBondContact O-CD2 3.23Å; A200-H204 PolarHBondContact O-N 3.1Å
201	S	97.7	Very high	96.9	Very high	23 Å²	23	53 Å²	53	16%	0.161	26%	0.262	C	S	.	.	H	α-helix	trans	-57	-36.2	175.6	-63.6	0	0	0	0	113.3	I197 A198 L205	I197-S201 PolarHBondContact O-N 3.15Å; I197-S201 PolarHBondContact O-OG 3.29Å; A198-S201 PolarHBondContact O-N 3.33Å; S201-L205 WeakPolarHBondContact O-CB 3.35Å; S201-L205 PolarHBondContact O-N 3.48Å
202	I	97.9	Very high	96.9	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.046	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-44.1	173.4	-64.9	168.8	0	0	0	111.1	V99 A117 V119 A198 L199 A200 L205 R206	V99-I202 HydrophobicContact CG1-CG1 4.1Å; A117-I202 HydrophobicContact CB-CD1 3.7Å; A117-I202 HydrophobicContact CB-CG1 3.55Å; V119-I202 HydrophobicContact CG2-CD1 3.62Å; A198-I202 WeakPolarHBondContact O-CG1 3.29Å; A198-I202 PolarHBondContact O-N 3.19Å; L199-I202 PolarHBondContact O-N 3.23Å; A200-I202 VanDerWaalsContact C-N 3.26Å; A200-I202 PolarHBondContact O-N 3Å; I202-L205 PolarHBondContact O-N 3.21Å; I202-R206 WeakPolarHBondContact O-CG 3.42Å; I202-R206 PolarHBondContact O-N 2.92Å; I202-R206 VanDerWaalsContact O-N 3.12Å
203	R	97.6	Very high	96.9	Very high	80 Å²	80	51.5 Å²	51.5	30%	0.302	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-46.4	177.9	-68.2	-168.3	-63	-74.5	3	111.6	L199 A200 L205 R206 W207 C288 E289	L199-R203 PolarHBondContact O-N 3.37Å; L199-R203 VanDerWaalsContact O-N 3.13Å; L199-R203 PolarHBondContact O-NH1 3.47Å; A200-R203 PolarHBondContact O-N 2.65Å; R203-L205 VanDerWaalsContact C-N 3.29Å; R203-L205 PolarHBondContact O-N 3.23Å; R203-R206 PolarHBondContact O-N 3.41Å; R203-W207 PolarHBondContact O-N 2.99Å; R203-C288 HydrophobicContact CB-CB 3.88Å; R203-C288 WeakPolarHBondContact CD-O 3.37Å; R203-C288 PolarHBondContact NE-O 2.97Å; R203-E289 IonicContact CZ-OE1 3.35Å; R203-E289 IonicContact NE-OE1 2.91Å; R203-E289 IonicContact NH2-OE1 3.5Å; R203-E289 PolarHBondContact NH2-OE1 2.92Å; R203-E289 IonicContact NH2-OE2 3.96Å
204	H	98	Very high	96.9	Very high	32 Å²	32	50.4 Å²	50.4	15%	0.148	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-44.2	177	-63	172.2	0	0	0	111.3	A200 W207 A208 W240	A200-H204 WeakPolarHBondContact O-CB 3.32Å; A200-H204 PolarHBondContact O-CD2 3.23Å; A200-H204 PolarHBondContact O-N 3.1Å; H204-W207 PolarHBondContact O-N 3.29Å; H204-A208 VanDerWaalsContact O-CB 3.23Å; H204-A208 WeakPolarHBondContact O-CB 3.36Å; H204-A208 PolarHBondContact O-N 3.41Å; H204-W240 HydrophobicContact CB-CD2 4.11Å; H204-W240 HydrophobicContact CB-CE3 3.72Å; H204-W240 HydrophobicContact CB-CH2 3.8Å; H204-W240 HydrophobicContact CB-CZ2 4.2Å; H204-W240 HydrophobicContact CB-CZ3 3.56Å; H204-W240 AromaticContact CD2-CD2 3.73Å; H204-W240 AromaticContact CD2-CE2 3.34Å; H204-W240 AromaticContact CD2-CZ2 3.55Å; H204-W240 AromaticContact CD2-NE1 3.56Å; H204-W240 AromaticContact CE1-CD1 3.48Å; H204-W240 VanDerWaalsContact CE1-CD1 3.48Å; H204-W240 AromaticContact CE1-CD2 3.81Å; H204-W240 AromaticContact CE1-CE2 3.99Å; H204-W240 AromaticContact CE1-CG 3.48Å; H204-W240 VanDerWaalsContact CE1-CG 3.48Å; H204-W240 AromaticContact CE1-NE1 3.77Å; H204-W240 AromaticContact CG-CD2 3.55Å; H204-W240 AromaticContact CG-CE2 3.65Å; H204-W240 AromaticContact CG-CE3 3.69Å; H204-W240 AromaticContact CG-CZ2 3.91Å; H204-W240 AromaticContact CG-CZ3 3.93Å; H204-W240 AromaticContact ND1-CD2 3.6Å; H204-W240 AromaticContact ND1-CE3 3.93Å; H204-W240 AromaticContact ND1-CG 3.63Å; H204-W240 AromaticContact NE2-CD1 3.51Å; H204-W240 AromaticContact NE2-CD2 3.93Å; H204-W240 AromaticContact NE2-CE2 3.63Å; H204-W240 AromaticContact NE2-CG 3.86Å; H204-W240 AromaticContact NE2-NE1 3.33Å; H204-W240 PolarHBondContact NE2-NE1 3.12Å
205	L	97.7	Very high	97	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-52.9	175.9	172.9	65.9	0	0	0	111.5	S98 V99 K103 L104 S201 I202 R203 W207 A208 E209	S98-L205 WeakPolarHBondContact O-CD2 3.32Å; V99-L205 HydrophobicContact CG1-CB 4.38Å; V99-L205 HydrophobicContact CG1-CD2 3.94Å; K103-L205 HydrophobicContact CB-CD1 3.94Å; K103-L205 HydrophobicContact CG-CD1 3.35Å; K103-L205 HydrophobicContact CG-CD2 4.02Å; K103-L205 HydrophobicContact CG-CG 4.32Å; L104-L205 HydrophobicContact CD2-CD1 3.81Å; L104-L205 HydrophobicContact CG-CD1 4.38Å; S201-L205 WeakPolarHBondContact O-CB 3.35Å; S201-L205 PolarHBondContact O-N 3.48Å; I202-L205 PolarHBondContact O-N 3.21Å; R203-L205 VanDerWaalsContact C-N 3.29Å; R203-L205 PolarHBondContact O-N 3.23Å; L205-W207 VanDerWaalsContact C-N 3.31Å; L205-W207 PolarHBondContact O-N 2.88Å; L205-A208 PolarHBondContact O-N 3.41Å; L205-A208 VanDerWaalsContact O-N 3.09Å; L205-E209 HydrophobicContact CD1-CG 3.79Å; L205-E209 HydrophobicContact CG-CG 4.28Å; L205-E209 WeakPolarHBondContact O-CG 3.34Å; L205-E209 PolarHBondContact O-N 3.32Å
206	R	97.5	Very high	97	Very high	142 Å²	142	55.8 Å²	55.8	54%	0.536	27%	0.274	S	S	.	.	H	α-helix	trans	-56.4	-48.5	-178.7	-71.9	177.2	-174.5	-177.5	1.5	110.9	I202 R203 A208 E209 E210	I202-R206 WeakPolarHBondContact O-CG 3.42Å; I202-R206 PolarHBondContact O-N 2.92Å; I202-R206 VanDerWaalsContact O-N 3.12Å; R203-R206 PolarHBondContact O-N 3.41Å; R206-A208 VanDerWaalsContact C-N 3.32Å; R206-A208 PolarHBondContact O-N 3.18Å; R206-E209 PolarHBondContact O-N 3.21Å; R206-E210 WeakPolarHBondContact O-CG 3.26Å; R206-E210 PolarHBondContact O-N 3.28Å
207	W	97.8	Very high	97.1	Very high	34 Å²	34	50.3 Å²	50.3	13%	0.129	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-43.9	176.8	179.9	89.7	0	0	0	111.8	R203 H204 L205 E210 N211 A212 W240 L244 H247 P287 C288	R203-W207 PolarHBondContact O-N 2.99Å; H204-W207 PolarHBondContact O-N 3.29Å; L205-W207 VanDerWaalsContact C-N 3.31Å; L205-W207 PolarHBondContact O-N 2.88Å; W207-E210 PolarHBondContact O-N 3.32Å; W207-N211 HydrophobicContact CD2-CB 4.2Å; W207-N211 HydrophobicContact CE3-CB 4.48Å; W207-N211 HydrophobicContact CH2-CB 4.15Å; W207-N211 HydrophobicContact CZ2-CB 3.82Å; W207-N211 HydrophobicContact CZ3-CB 4.48Å; W207-N211 PolarHBondContact NE1-ND2 2.75Å; W207-N211 WeakPolarHBondContact O-CB 3.37Å; W207-N211 PolarHBondContact O-N 2.99Å; W207-N211 PolarHBondContact O-ND2 3.39Å; W207-A212 HydrophobicContact CZ3-CB 4Å; W207-W240 HydrophobicContact CB-CH2 4.34Å; W207-W240 AromaticContact CD2-CH2 3.9Å; W207-W240 HydrophobicContact CD2-CH2 3.9Å; W207-W240 AromaticContact CE3-CH2 3.35Å; W207-W240 HydrophobicContact CE3-CH2 3.35Å; W207-W240 HydrophobicContact CE3-CZ2 4.3Å; W207-W240 AromaticContact CE3-CZ3 3.96Å; W207-W240 HydrophobicContact CE3-CZ3 3.96Å; W207-W240 HydrophobicContact CG-CH2 4.32Å; W207-W240 AromaticContact CZ3-CH2 3.96Å; W207-W240 HydrophobicContact CZ3-CH2 3.96Å; W207-W240 HydrophobicContact CZ3-CZ3 4.31Å; W207-L244 HydrophobicContact CD2-CD2 4.45Å; W207-L244 HydrophobicContact CE3-CD2 4.18Å; W207-L244 HydrophobicContact CH2-CD2 3.28Å; W207-L244 HydrophobicContact CH2-CG 4.49Å; W207-L244 HydrophobicContact CZ2-CD2 3.61Å; W207-L244 HydrophobicContact CZ3-CD2 3.59Å; W207-L244 HydrophobicContact CZ3-CG 4.49Å; W207-H247 HydrophobicContact CH2-CB 3.86Å; W207-H247 AromaticContact CH2-CD2 3.88Å; W207-H247 AromaticContact CH2-CE1 3.96Å; W207-H247 AromaticContact CH2-CG 3.47Å; W207-H247 VanDerWaalsContact CH2-CG 3.47Å; W207-H247 AromaticContact CH2-ND1 3.53Å; W207-H247 AromaticContact CZ2-CE1 3.89Å; W207-H247 AromaticContact CZ2-ND1 3.83Å; W207-H247 HydrophobicContact CZ3-CB 4.48Å; W207-P287 HydrophobicContact CD2-CG 3.9Å; W207-P287 VanDerWaalsContact CE2-CG 3.5Å; W207-P287 HydrophobicContact CG-CB 4.48Å; W207-P287 HydrophobicContact CG-CG 3.95Å; W207-P287 HydrophobicContact CZ2-CG 4.08Å; W207-P287 VanDerWaalsContact NE1-CG 3.29Å; W207-C288 VanDerWaalsContact CB-SG 3.57Å
208	A	97.4	Very high	97.1	Very high	4 Å²	4	48.5 Å²	48.5	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-70.9	-34.2	-177.4	0	0	0	0	0	113	L104 H204 L205 R206 E210 A212	L104-A208 HydrophobicContact CD1-CB 3.94Å; L104-A208 HydrophobicContact CD2-CB 3.6Å; L104-A208 HydrophobicContact CG-CB 4.44Å; H204-A208 VanDerWaalsContact O-CB 3.23Å; H204-A208 WeakPolarHBondContact O-CB 3.36Å; H204-A208 PolarHBondContact O-N 3.41Å; L205-A208 PolarHBondContact O-N 3.41Å; L205-A208 VanDerWaalsContact O-N 3.09Å; R206-A208 VanDerWaalsContact C-N 3.32Å; R206-A208 PolarHBondContact O-N 3.18Å; A208-E210 VanDerWaalsContact C-N 3.26Å; A208-E210 PolarHBondContact O-N 3.27Å; A208-A212 HydrophobicContact CB-CB 4.19Å; A208-A212 CarbonylContact O-C 3.57Å; A208-A212 WeakPolarHBondContact O-CA 3.44Å; A208-A212 PolarHBondContact O-N 3.43Å
209	E	96	Very high	97.2	Very high	92 Å²	92	48.8 Å²	48.8	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-66.1	-29.3	173.2	-73.9	-177.5	144.7	0	0	112.2	K103 L205 R206 T213	K103-E209 WeakPolarHBondContact CE-OE1 3Å; K103-E209 IonicContact NZ-OE1 3.53Å; L205-E209 HydrophobicContact CD1-CG 3.79Å; L205-E209 HydrophobicContact CG-CG 4.28Å; L205-E209 WeakPolarHBondContact O-CG 3.34Å; L205-E209 PolarHBondContact O-N 3.32Å; R206-E209 PolarHBondContact O-N 3.21Å; E209-T213 WeakPolarHBondContact O-CG2 3.45Å
210	E	96.5	Very high	97.2	Very high	154 Å²	154	48 Å²	48	72%	0.72	24%	0.237	S	C	*	.	H	α-helix	trans	-86.4	-34.4	177.6	-69.4	171.4	-172.7	0	0	112.8	R206 W207 A208	R206-E210 WeakPolarHBondContact O-CG 3.26Å; R206-E210 PolarHBondContact O-N 3.28Å; W207-E210 PolarHBondContact O-N 3.32Å; A208-E210 VanDerWaalsContact C-N 3.26Å; A208-E210 PolarHBondContact O-N 3.27Å
211	N	96.3	Very high	97.3	Very high	63 Å²	63	47.5 Å²	47.5	34%	0.337	23%	0.232	S	C	.	.	H	α-helix	trans	-116.9	-31	-166.6	-61	-86.5	0	0	0	114.4	W207 H247	W207-N211 HydrophobicContact CD2-CB 4.2Å; W207-N211 HydrophobicContact CE3-CB 4.48Å; W207-N211 HydrophobicContact CH2-CB 4.15Å; W207-N211 HydrophobicContact CZ2-CB 3.82Å; W207-N211 HydrophobicContact CZ3-CB 4.48Å; W207-N211 PolarHBondContact NE1-ND2 2.75Å; W207-N211 WeakPolarHBondContact O-CB 3.37Å; W207-N211 PolarHBondContact O-N 2.99Å; W207-N211 PolarHBondContact O-ND2 3.39Å; N211-H247 PolarHBondContact O-CD2 2.89Å; N211-H247 VanDerWaalsContact O-CD2 3.28Å; N211-H247 PolarHBondContact O-NE2 3.5Å
212	A	95.1	Very high	97.3	Very high	9 Å²	9	47.1 Å²	47.1	7%	0.074	23%	0.227	C	C	.	.			trans	-113.6	32.9	-167.6	0	0	0	0	0	113.7	W207 A208 V217 H247	W207-A212 HydrophobicContact CZ3-CB 4Å; A208-A212 HydrophobicContact CB-CB 4.19Å; A208-A212 CarbonylContact O-C 3.57Å; A208-A212 WeakPolarHBondContact O-CA 3.44Å; A208-A212 PolarHBondContact O-N 3.43Å; A212-V217 HydrophobicContact CB-CG1 4.16Å; A212-H247 HydrophobicContact CB-CB 4.46Å
213	T	95.4	Very high	97.3	Very high	79 Å²	79	46.7 Å²	46.7	49%	0.485	23%	0.225	S	C	.	.			trans	-80.9	-20.1	-176.1	55.2	0	0	0	0	114.2	E209 K218	E209-T213 WeakPolarHBondContact O-CG2 3.45Å; T213-K218 WeakPolarHBondContact O-CE 3.19Å; T213-K218 PolarHBondContact O-NZ 2.86Å
214	H	97.3	Very high	97.3	Very high	71 Å²	71	42.9 Å²	42.9	33%	0.329	21%	0.211	S	C	.	.	S	Bend	trans	-61.2	136.8	-174.9	-168.7	-92.2	0	0	0	112.6	T216 V217 K218 M251 P258	H214-T216 VanDerWaalsContact C-N 3.35Å; H214-T216 PolarHBondContact CE1-OG1 3.23Å; H214-T216 WeakPolarHBondContact ND1-CB 3.36Å; H214-T216 PolarHBondContact ND1-N 3.41Å; H214-T216 PolarHBondContact ND1-OG1 3.13Å; H214-T216 PolarHBondContact O-N 3.23Å; H214-V217 HydrophobicContact CB-CG2 4.17Å; H214-V217 WeakPolarHBondContact O-CB 3.18Å; H214-V217 PolarHBondContact O-N 2.97Å; H214-K218 PolarHBondContact O-N 2.85Å; H214-M251 HydrophobicContact CB-SD 4.37Å; H214-P258 VanDerWaalsContact CE1-CB 3.45Å; H214-P258 WeakPolarHBondContact CE1-CB 3.42Å
215	T	96.9	Very high	97.2	Very high	102 Å²	102	42 Å²	42	63%	0.626	21%	0.206	S	C	*	.	H	α-helix	trans	-57.4	-43.7	-174.8	-54.9	0	0	0	0	112.6	V217 K218 V219	T215-V217 PolarHBondContact O-N 3.38Å; T215-K218 PolarHBondContact O-N 3.39Å; T215-K218 VanDerWaalsContact O-N 3.1Å; T215-V219 HydrophobicContact CG2-CG2 4.14Å; T215-V219 WeakPolarHBondContact O-CG2 3.41Å; T215-V219 PolarHBondContact O-N 3.09Å
216	T	97.9	Very high	97.1	Very high	24 Å²	24	42.5 Å²	42.5	15%	0.147	21%	0.209	C	C	.	.	H	α-helix	trans	-58	-37.2	177.9	-51.7	0	0	0	0	112.5	H214 V219 L220 V250 L261	H214-T216 VanDerWaalsContact C-N 3.35Å; H214-T216 PolarHBondContact CE1-OG1 3.23Å; H214-T216 WeakPolarHBondContact ND1-CB 3.36Å; H214-T216 PolarHBondContact ND1-N 3.41Å; H214-T216 PolarHBondContact ND1-OG1 3.13Å; H214-T216 PolarHBondContact O-N 3.23Å; T216-V219 PolarHBondContact O-N 3.27Å; T216-L220 VanDerWaalsContact O-CB 3.29Å; T216-L220 WeakPolarHBondContact O-CB 3.01Å; T216-L220 PolarHBondContact O-N 3.46Å; T216-V250 HydrophobicContact CG2-CG1 4.24Å; T216-V250 HydrophobicContact CG2-CG2 3.97Å; T216-L261 HydrophobicContact CG2-CB 4Å; T216-L261 HydrophobicContact CG2-CD1 4.05Å
217	V	98.3	Very high	97	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-50.6	176.4	177.7	0	0	0	0	109.3	A212 H214 T215 V219 L220 I221 A246 H247 V250 M251	A212-V217 HydrophobicContact CB-CG1 4.16Å; H214-V217 HydrophobicContact CB-CG2 4.17Å; H214-V217 WeakPolarHBondContact O-CB 3.18Å; H214-V217 PolarHBondContact O-N 2.97Å; T215-V217 PolarHBondContact O-N 3.38Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 2.9Å; V217-L220 PolarHBondContact O-N 3.38Å; V217-I221 HydrophobicContact CG1-CD1 3.81Å; V217-I221 HydrophobicContact CG1-CG1 4.35Å; V217-I221 VanDerWaalsContact O-CG1 3.26Å; V217-I221 WeakPolarHBondContact O-CG1 3.39Å; V217-I221 PolarHBondContact O-N 3.21Å; V217-A246 HydrophobicContact CG1-CB 4.32Å; V217-H247 HydrophobicContact CG1-CB 4.23Å; V217-V250 HydrophobicContact CG2-CB 3.77Å; V217-V250 HydrophobicContact CG2-CG1 3.82Å; V217-V250 HydrophobicContact CG2-CG2 4.06Å; V217-M251 HydrophobicContact CG2-CG 4.17Å; V217-M251 HydrophobicContact CG2-SD 4.41Å
218	K	97.6	Very high	96.8	Very high	60 Å²	60	38.4 Å²	38.4	26%	0.261	19%	0.193	S	C	.	.	H	α-helix	trans	-61.7	-39.9	180	-64.5	-179.6	178.7	173.3	0	113	T106 T213 H214 T215 R222	T106-K218 HydrophobicContact CG2-CB 4.1Å; T106-K218 HydrophobicContact CG2-CG 4.13Å; T213-K218 WeakPolarHBondContact O-CE 3.19Å; T213-K218 PolarHBondContact O-NZ 2.86Å; H214-K218 PolarHBondContact O-N 2.85Å; T215-K218 PolarHBondContact O-N 3.39Å; T215-K218 VanDerWaalsContact O-N 3.1Å; K218-R222 PolarHBondContact O-N 3.04Å
219	V	98.2	Very high	96.5	Very high	8 Å²	8	44.3 Å²	44.3	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-48.8	175.4	175.5	0	0	0	0	110.3	H54 T215 T216 V217 I221 R222 I223 L261	H54-V219 HydrophobicContact CB-CG1 3.91Å; T215-V219 HydrophobicContact CG2-CG2 4.14Å; T215-V219 WeakPolarHBondContact O-CG2 3.41Å; T215-V219 PolarHBondContact O-N 3.09Å; T216-V219 PolarHBondContact O-N 3.27Å; V217-V219 VanDerWaalsContact C-N 3.34Å; V217-V219 PolarHBondContact O-N 2.9Å; V219-I221 VanDerWaalsContact C-N 3.35Å; V219-I221 PolarHBondContact O-N 3.38Å; V219-R222 PolarHBondContact O-N 3.19Å; V219-I223 HydrophobicContact CG1-CD1 4.02Å; V219-I223 WeakPolarHBondContact O-CG1 3.33Å; V219-I223 PolarHBondContact O-N 2.85Å; V219-I223 VanDerWaalsContact O-N 3.13Å; V219-L261 HydrophobicContact CB-CD1 4.31Å; V219-L261 HydrophobicContact CG1-CD1 3.85Å; V219-L261 HydrophobicContact CG1-CD2 3.58Å; V219-L261 HydrophobicContact CG1-CG 4.38Å
220	L	98.4	Very high	96.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-41.1	179.2	-175.4	59.6	0	0	0	111.9	T216 V217 R222 I223 L224 A246 V249 V250 L261 A264 F265 V268	T216-L220 VanDerWaalsContact O-CB 3.29Å; T216-L220 WeakPolarHBondContact O-CB 3.01Å; T216-L220 PolarHBondContact O-N 3.46Å; V217-L220 PolarHBondContact O-N 3.38Å; L220-R222 VanDerWaalsContact C-N 3.35Å; L220-R222 PolarHBondContact O-N 3.26Å; L220-I223 PolarHBondContact O-N 3.1Å; L220-L224 HydrophobicContact CD1-CD1 4.37Å; L220-L224 HydrophobicContact CD1-CG 4.19Å; L220-L224 HydrophobicContact CG-CD1 4.08Å; L220-L224 HydrophobicContact CG-CG 4.31Å; L220-L224 WeakPolarHBondContact O-CG 3.36Å; L220-L224 PolarHBondContact O-N 3.5Å; L220-A246 HydrophobicContact CB-CB 4.27Å; L220-A246 HydrophobicContact CD2-CB 4.04Å; L220-A246 HydrophobicContact CG-CB 4.05Å; L220-V249 HydrophobicContact CD2-CG1 4.22Å; L220-V250 HydrophobicContact CD2-CG2 3.92Å; L220-L261 HydrophobicContact CB-CD1 4.24Å; L220-A264 HydrophobicContact CD2-CB 4.03Å; L220-F265 HydrophobicContact CD1-CB 4.42Å; L220-F265 HydrophobicContact CD1-CD2 4Å; L220-V268 HydrophobicContact CD1-CG2 4.3Å; L220-V268 HydrophobicContact CD2-CG2 4.04Å
221	I	98.2	Very high	96	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-55.7	-48.6	174.8	-71.1	170.3	0	0	0	111	T106 V217 V219 I223 L224 K225 I242 D243 A246	T106-I221 HydrophobicContact CG2-CB 4.13Å; T106-I221 HydrophobicContact CG2-CD1 4.15Å; T106-I221 HydrophobicContact CG2-CG2 3.87Å; V217-I221 HydrophobicContact CG1-CD1 3.81Å; V217-I221 HydrophobicContact CG1-CG1 4.35Å; V217-I221 VanDerWaalsContact O-CG1 3.26Å; V217-I221 WeakPolarHBondContact O-CG1 3.39Å; V217-I221 PolarHBondContact O-N 3.21Å; V219-I221 VanDerWaalsContact C-N 3.35Å; V219-I221 PolarHBondContact O-N 3.38Å; I221-I223 VanDerWaalsContact C-N 3.32Å; I221-I223 PolarHBondContact O-N 2.94Å; I221-L224 PolarHBondContact O-N 2.9Å; I221-K225 HydrophobicContact CG2-CD 3.85Å; I221-K225 VanDerWaalsContact CG2-CE 3.49Å; I221-K225 HydrophobicContact CG2-CG 4.27Å; I221-K225 WeakPolarHBondContact O-CB 3.3Å; I221-K225 WeakPolarHBondContact O-CG 3.45Å; I221-K225 PolarHBondContact O-N 3.37Å; I221-I242 HydrophobicContact CG2-CG2 4.41Å; I221-D243 HydrophobicContact CD1-CB 4.17Å; I221-D243 WeakPolarHBondContact CG2-OD1 3.41Å; I221-A246 HydrophobicContact CD1-CB 4.33Å; I221-A246 HydrophobicContact CG1-CB 3.43Å; I221-A246 VanDerWaalsContact CG1-CB 3.43Å
222	R	97.5	Very high	95.6	Very high	15 Å²	15	35.9 Å²	35.9	6%	0.057	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-44.3	179.8	-69.8	-171.5	-165.2	105.3	-18.4	111.2	H54 N105 L108 K218 V219 L220 L224 K225 D226	H54-R222 PolarHBondContact CE1-NH1 3.25Å; N105-R222 PolarHBondContact O-NE 2.92Å; N105-R222 PolarHBondContact O-NH2 3.39Å; N105-R222 PolarHBondContact OD1-NH2 3.14Å; L108-R222 HydrophobicContact CD2-CB 3.75Å; L108-R222 HydrophobicContact CD2-CG 4.11Å; L108-R222 VanDerWaalsContact CD2-O 3.3Å; L108-R222 WeakPolarHBondContact CD2-O 3.41Å; K218-R222 PolarHBondContact O-N 3.04Å; V219-R222 PolarHBondContact O-N 3.19Å; L220-R222 VanDerWaalsContact C-N 3.35Å; L220-R222 PolarHBondContact O-N 3.26Å; R222-L224 PolarHBondContact O-N 3.22Å; R222-K225 PolarHBondContact O-N 3.24Å; R222-D226 PolarHBondContact O-N 3.29Å
223	I	97.6	Very high	95.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-45.7	178	-64.3	171.4	0	0	0	110.6	L50 L57 V219 L220 I221 D226 F227 F265 F327	L50-I223 HydrophobicContact CB-CD1 4.25Å; L50-I223 HydrophobicContact CD2-CD1 3.81Å; L57-I223 HydrophobicContact CD1-CG1 4.4Å; V219-I223 HydrophobicContact CG1-CD1 4.02Å; V219-I223 WeakPolarHBondContact O-CG1 3.33Å; V219-I223 PolarHBondContact O-N 2.85Å; V219-I223 VanDerWaalsContact O-N 3.13Å; L220-I223 PolarHBondContact O-N 3.1Å; I221-I223 VanDerWaalsContact C-N 3.32Å; I221-I223 PolarHBondContact O-N 2.94Å; I223-D226 WeakPolarHBondContact O-CB 3.28Å; I223-D226 PolarHBondContact O-N 3.48Å; I223-F227 HydrophobicContact CG2-CD2 4Å; I223-F227 HydrophobicContact CG2-CE2 3.83Å; I223-F227 VanDerWaalsContact O-CD2 3.23Å; I223-F227 WeakPolarHBondContact O-CD2 3.43Å; I223-F227 PolarHBondContact O-N 3.21Å; I223-F265 HydrophobicContact CG2-CD2 4.23Å; I223-F265 HydrophobicContact CG2-CE2 3.68Å; I223-F327 HydrophobicContact CG2-CE1 4.14Å
224	L	97.7	Very high	95.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.6	-36.3	179	-66.9	179.9	0	0	0	113	L220 I221 R222 D226 F227 R228 I242 A246 V268	L220-L224 HydrophobicContact CD1-CD1 4.37Å; L220-L224 HydrophobicContact CD1-CG 4.19Å; L220-L224 HydrophobicContact CG-CD1 4.08Å; L220-L224 HydrophobicContact CG-CG 4.31Å; L220-L224 WeakPolarHBondContact O-CG 3.36Å; L220-L224 PolarHBondContact O-N 3.5Å; I221-L224 PolarHBondContact O-N 2.9Å; R222-L224 PolarHBondContact O-N 3.22Å; L224-D226 VanDerWaalsContact C-N 3.25Å; L224-D226 PolarHBondContact O-N 2.98Å; L224-F227 PolarHBondContact O-N 2.87Å; L224-R228 PolarHBondContact O-N 2.79Å; L224-I242 HydrophobicContact CB-CG2 3.56Å; L224-I242 HydrophobicContact CD1-CG2 4.23Å; L224-A246 HydrophobicContact CD1-CB 4.31Å; L224-V268 HydrophobicContact CD1-CG2 4.2Å; L224-V268 HydrophobicContact CD2-CG1 3.93Å; L224-V268 HydrophobicContact CD2-CG2 4.47Å
225	K	96.4	Very high	95.1	Very high	14 Å²	14	30.8 Å²	30.8	6%	0.061	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-33.5	172.8	-77.3	178.9	179.5	170.6	0	112.1	S101 T106 L108 I221 R222 R228 S239 I242 D243	S101-K225 PolarHBondContact OG-NZ 2.88Å; T106-K225 PolarHBondContact OG1-NZ 3.45Å; L108-K225 HydrophobicContact CD1-CB 3.83Å; L108-K225 HydrophobicContact CD2-CB 4.29Å; L108-K225 HydrophobicContact CG-CB 4.25Å; I221-K225 HydrophobicContact CG2-CD 3.85Å; I221-K225 VanDerWaalsContact CG2-CE 3.49Å; I221-K225 HydrophobicContact CG2-CG 4.27Å; I221-K225 WeakPolarHBondContact O-CB 3.3Å; I221-K225 WeakPolarHBondContact O-CG 3.45Å; I221-K225 PolarHBondContact O-N 3.37Å; R222-K225 PolarHBondContact O-N 3.24Å; K225-R228 WeakPolarHBondContact O-CB 2.91Å; K225-S239 VanDerWaalsContact CE-OG 3.28Å; K225-S239 WeakPolarHBondContact CE-OG 3.46Å; K225-S239 PolarHBondContact NZ-OG 3.05Å; K225-I242 HydrophobicContact CG-CD1 4.34Å; K225-I242 HydrophobicContact CG-CG2 4.16Å; K225-D243 WeakPolarHBondContact CE-OD1 3.49Å; K225-D243 IonicContact NZ-OD1 2.92Å; K225-D243 PolarHBondContact NZ-OD1 3.44Å
226	D	95.2	Very high	95	Very high	18 Å²	18	29.1 Å²	29.1	10%	0.096	13%	0.128	C	C	.	.	H	α-helix	trans	-73.1	-43.1	173	-174.8	-179.9	0	0	0	111	H53 L57 L108 R222 I223 L224 R228 R229 R230	H53-D226 IonicContact CD2-OD1 3.71Å; H53-D226 IonicContact CE1-OD1 3.59Å; H53-D226 IonicContact NE2-OD1 3.95Å; H53-D226 PolarHBondContact NE2-OD1 2.61Å; L57-D226 HydrophobicContact CD1-CB 3.69Å; L57-D226 HydrophobicContact CD2-CB 4.01Å; L57-D226 WeakPolarHBondContact CD2-OD1 3.37Å; L108-D226 HydrophobicContact CD1-CB 4.17Å; R222-D226 PolarHBondContact O-N 3.29Å; I223-D226 WeakPolarHBondContact O-CB 3.28Å; I223-D226 PolarHBondContact O-N 3.48Å; L224-D226 VanDerWaalsContact C-N 3.25Å; L224-D226 PolarHBondContact O-N 2.98Å; D226-R228 PolarHBondContact O-N 3.09Å; D226-R229 WeakPolarHBondContact O-CA 3.48Å; D226-R229 WeakPolarHBondContact O-CB 3.49Å; D226-R229 PolarHBondContact O-N 3.36Å; D226-R230 VanDerWaalsContact CG-NE 3.33Å; D226-R230 PolarHBondContact O-N 2.89Å; D226-R230 IonicContact OD1-CZ 3.82Å; D226-R230 IonicContact OD1-NE 3.93Å; D226-R230 PolarHBondContact OD1-NE 2.9Å; D226-R230 IonicContact OD1-NH2 3.1Å; D226-R230 PolarHBondContact OD1-NH2 2.87Å; D226-R230 IonicContact OD2-CZ 3.77Å; D226-R230 VanDerWaalsContact OD2-CZ 3.24Å; D226-R230 IonicContact OD2-NE 3.6Å; D226-R230 PolarHBondContact OD2-NE 3.26Å; D226-R230 IonicContact OD2-NH2 2.76Å; D226-R230 PolarHBondContact OD2-NH2 3.17Å; D226-R230 VanDerWaalsContact OD2-NH2 3.12Å
227	F	95.1	Very high	94.8	Very high	0 Å²	0	28 Å²	28	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-34.5	173.1	-85.7	-125.9	0	0	0	112.3	I223 L224 R229 R230 F231 F234 F265 F269 L314 L326 F327	I223-F227 HydrophobicContact CG2-CD2 4Å; I223-F227 HydrophobicContact CG2-CE2 3.83Å; I223-F227 VanDerWaalsContact O-CD2 3.23Å; I223-F227 WeakPolarHBondContact O-CD2 3.43Å; I223-F227 PolarHBondContact O-N 3.21Å; L224-F227 PolarHBondContact O-N 2.87Å; F227-R229 PolarHBondContact O-N 3.26Å; F227-R230 PolarHBondContact O-N 2.64Å; F227-F231 HydrophobicContact CB-CD2 4.03Å; F227-F231 HydrophobicContact CB-CE2 4.47Å; F227-F231 AromaticContact CD1-CD2 3.55Å; F227-F231 HydrophobicContact CD1-CD2 3.55Å; F227-F231 AromaticContact CD1-CE2 3.4Å; F227-F231 HydrophobicContact CD1-CE2 3.4Å; F227-F231 VanDerWaalsContact CD1-CE2 3.4Å; F227-F231 HydrophobicContact CD2-CE2 4.45Å; F227-F231 HydrophobicContact CE1-CD2 4.18Å; F227-F231 AromaticContact CE1-CE2 3.56Å; F227-F231 HydrophobicContact CE1-CE2 3.56Å; F227-F231 HydrophobicContact CE1-CZ 4.39Å; F227-F231 AromaticContact CG-CD2 3.92Å; F227-F231 HydrophobicContact CG-CD2 3.92Å; F227-F231 AromaticContact CG-CE2 3.88Å; F227-F231 HydrophobicContact CG-CE2 3.88Å; F227-F231 HydrophobicContact CZ-CE2 4.19Å; F227-F231 PolarHBondContact O-N 2.8Å; F227-F234 HydrophobicContact CB-CD2 3.79Å; F227-F234 HydrophobicContact CB-CE2 4.33Å; F227-F234 HydrophobicContact CD1-CD2 4.25Å; F227-F234 HydrophobicContact CD1-CE2 4.03Å; F227-F265 HydrophobicContact CE1-CZ 4.23Å; F227-F265 HydrophobicContact CE2-CE2 4.35Å; F227-F265 HydrophobicContact CE2-CZ 4.33Å; F227-F265 HydrophobicContact CZ-CE2 4.1Å; F227-F265 AromaticContact CZ-CZ 3.71Å; F227-F265 HydrophobicContact CZ-CZ 3.71Å; F227-F269 HydrophobicContact CD1-CE1 4.36Å; F227-F269 AromaticContact CD1-CZ 3.92Å; F227-F269 HydrophobicContact CD1-CZ 3.92Å; F227-F269 HydrophobicContact CE1-CE1 4.21Å; F227-F269 AromaticContact CE1-CZ 3.54Å; F227-F269 HydrophobicContact CE1-CZ 3.54Å; F227-F269 HydrophobicContact CZ-CZ 4.38Å; F227-L314 HydrophobicContact CD1-CD1 4.25Å; F227-L314 HydrophobicContact CE1-CD1 4.27Å; F227-L326 HydrophobicContact CZ-CB 4.06Å; F227-F327 AromaticContact CE2-CD1 3.88Å; F227-F327 HydrophobicContact CE2-CD1 3.88Å; F227-F327 AromaticContact CE2-CE1 3.53Å; F227-F327 HydrophobicContact CE2-CE1 3.53Å; F227-F327 HydrophobicContact CE2-CZ 4.32Å; F227-F327 HydrophobicContact CZ-CD1 4.38Å; F227-F327 AromaticContact CZ-CE1 3.96Å; F227-F327 HydrophobicContact CZ-CE1 3.96Å; F227-F327 HydrophobicContact CZ-CZ 4.34Å
228	R	93.8	Very high	94.6	Very high	89 Å²	89	31 Å²	31	34%	0.336	14%	0.137	S	C	.	.	H	α-helix	trans	-57.5	-35.6	171.4	-174.7	175.9	91.9	172.3	9.6	113	L224 K225 D226 F234 M237 I242	L224-R228 PolarHBondContact O-N 2.79Å; K225-R228 WeakPolarHBondContact O-CB 2.91Å; D226-R228 PolarHBondContact O-N 3.09Å; R228-F234 WeakPolarHBondContact CG-O 3.15Å; R228-M237 WeakPolarHBondContact CD-O 3.46Å; R228-M237 PolarHBondContact NH1-O 2.8Å; R228-I242 HydrophobicContact CB-CD1 4.02Å; R228-I242 HydrophobicContact CG-CD1 4.41Å
229	R	90.9	Very high	94.5	Very high	129 Å²	129	30 Å²	30	49%	0.487	14%	0.138	S	C	.	.	H	α-helix	trans	-79.2	-32.8	176.7	-63.1	177.6	179.4	177.2	-0.3	111.9	S111 D226 F227	S111-R229 PolarHBondContact OG-NH2 3.3Å; D226-R229 WeakPolarHBondContact O-CA 3.48Å; D226-R229 WeakPolarHBondContact O-CB 3.49Å; D226-R229 PolarHBondContact O-N 3.36Å; F227-R229 PolarHBondContact O-N 3.26Å
230	R	90.2	Very high	94.4	Very high	14 Å²	14	30.2 Å²	30.2	5%	0.053	14%	0.138	C	C	.	.	H	α-helix	trans	-85.6	-33.4	-176.1	-80.8	-172.2	-95.3	125.4	-3.9	114.3	H53 D226 F227 L326 H329 S330 D331	H53-R230 PolarHBondContact CE1-NH2 3.32Å; H53-R230 PolarHBondContact NE2-NH2 2.82Å; D226-R230 VanDerWaalsContact CG-NE 3.33Å; D226-R230 PolarHBondContact O-N 2.89Å; D226-R230 IonicContact OD1-CZ 3.82Å; D226-R230 IonicContact OD1-NE 3.93Å; D226-R230 PolarHBondContact OD1-NE 2.9Å; D226-R230 IonicContact OD1-NH2 3.1Å; D226-R230 PolarHBondContact OD1-NH2 2.87Å; D226-R230 IonicContact OD2-CZ 3.77Å; D226-R230 VanDerWaalsContact OD2-CZ 3.24Å; D226-R230 IonicContact OD2-NE 3.6Å; D226-R230 PolarHBondContact OD2-NE 3.26Å; D226-R230 IonicContact OD2-NH2 2.76Å; D226-R230 PolarHBondContact OD2-NH2 3.17Å; D226-R230 VanDerWaalsContact OD2-NH2 3.12Å; F227-R230 PolarHBondContact O-N 2.64Å; R230-L326 PolarHBondContact NH1-O 2.88Å; R230-H329 VanDerWaalsContact CD-O 3.3Å; R230-H329 WeakPolarHBondContact CD-O 3.25Å; R230-S330 CarbonylContact O-C 3.59Å; R230-D331 CarbonylContact O-C 3.46Å; R230-D331 WeakPolarHBondContact O-CA 3.43Å; R230-D331 PolarHBondContact O-N 3.36Å
231	F	91.4	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-118.9	118.5	-174.4	-60.3	-78.3	0	0	0	110.3	F227 G233 F234 A235 T310 L314 D331 L340	F227-F231 HydrophobicContact CB-CD2 4.03Å; F227-F231 HydrophobicContact CB-CE2 4.47Å; F227-F231 AromaticContact CD1-CD2 3.55Å; F227-F231 HydrophobicContact CD1-CD2 3.55Å; F227-F231 AromaticContact CD1-CE2 3.4Å; F227-F231 HydrophobicContact CD1-CE2 3.4Å; F227-F231 VanDerWaalsContact CD1-CE2 3.4Å; F227-F231 HydrophobicContact CD2-CE2 4.45Å; F227-F231 HydrophobicContact CE1-CD2 4.18Å; F227-F231 AromaticContact CE1-CE2 3.56Å; F227-F231 HydrophobicContact CE1-CE2 3.56Å; F227-F231 HydrophobicContact CE1-CZ 4.39Å; F227-F231 AromaticContact CG-CD2 3.92Å; F227-F231 HydrophobicContact CG-CD2 3.92Å; F227-F231 AromaticContact CG-CE2 3.88Å; F227-F231 HydrophobicContact CG-CE2 3.88Å; F227-F231 HydrophobicContact CZ-CE2 4.19Å; F227-F231 PolarHBondContact O-N 2.8Å; F231-G233 VanDerWaalsContact C-N 3.25Å; F231-G233 PolarHBondContact O-N 3.18Å; F231-F234 HydrophobicContact CB-CB 4.44Å; F231-F234 PolarHBondContact O-N 2.94Å; F231-A235 PolarHBondContact O-N 3Å; F231-T310 HydrophobicContact CB-CG2 4.12Å; F231-L314 HydrophobicContact CD1-CD1 4.25Å; F231-L314 HydrophobicContact CD1-CD2 4.14Å; F231-L314 HydrophobicContact CD2-CD1 4.12Å; F231-L314 HydrophobicContact CE1-CD1 4.36Å; F231-L314 HydrophobicContact CE1-CD2 3.61Å; F231-L314 HydrophobicContact CE2-CD1 4.21Å; F231-L314 HydrophobicContact CE2-CD2 4.45Å; F231-L314 HydrophobicContact CG-CD1 4.14Å; F231-L314 HydrophobicContact CZ-CD1 4.33Å; F231-L314 HydrophobicContact CZ-CD2 3.78Å; F231-D331 HydrophobicContact CD1-CB 3.83Å; F231-D331 HydrophobicContact CE1-CB 4.41Å; F231-L340 HydrophobicContact CE1-CD2 3.85Å
232	R	89.2	Confident	94.3	Very high	118 Å²	118	30.1 Å²	30.1	45%	0.445	14%	0.137	S	C	.	.	H	α-helix	trans	-49.9	-44.2	179.8	178.5	-177.9	153.2	156.9	1	112.8	F234 A235 E306 D331	R232-F234 PolarHBondContact O-N 2.75Å; R232-A235 WeakPolarHBondContact O-CB 3.33Å; R232-A235 PolarHBondContact O-N 3.36Å; R232-E306 WeakPolarHBondContact CD-OE1 3.41Å; R232-E306 WeakPolarHBondContact CG-OE1 3.23Å; R232-E306 IonicContact CZ-OE1 2.67Å; R232-E306 IonicContact NE-OE1 2.68Å; R232-E306 PolarHBondContact NE-OE1 3.2Å; R232-E306 IonicContact NE-OE2 3.12Å; R232-E306 IonicContact NH2-OE2 3.61Å; R232-D331 WeakPolarHBondContact CB-O 3.23Å; R232-D331 PolarHBondContact N-O 3.45Å
233	G	89.4	Confident	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-27.5	179.8	0	0	0	0	0	113.5	F231 Y236 I307 T310	F231-G233 VanDerWaalsContact C-N 3.25Å; F231-G233 PolarHBondContact O-N 3.18Å; G233-Y236 WeakPolarHBondContact O-CD2 3.3Å; G233-I307 WeakPolarHBondContact O-CG1 3.36Å; G233-T310 WeakPolarHBondContact CA-OG1 3.38Å
234	F	94.2	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-84.4	-13.6	176.5	-73.7	12.2	0	0	0	112.6	F227 R228 F231 R232 Y236 M237 F269 L272 I307 T310 A311 L314	F227-F234 HydrophobicContact CB-CD2 3.79Å; F227-F234 HydrophobicContact CB-CE2 4.33Å; F227-F234 HydrophobicContact CD1-CD2 4.25Å; F227-F234 HydrophobicContact CD1-CE2 4.03Å; R228-F234 WeakPolarHBondContact CG-O 3.15Å; F231-F234 HydrophobicContact CB-CB 4.44Å; F231-F234 PolarHBondContact O-N 2.94Å; R232-F234 PolarHBondContact O-N 2.75Å; F234-Y236 PolarHBondContact O-N 3.2Å; F234-Y236 VanDerWaalsContact O-N 3.15Å; F234-M237 HydrophobicContact CB-CE 3.58Å; F234-M237 HydrophobicContact CD1-CE 3.82Å; F234-M237 HydrophobicContact CD2-CE 3.57Å; F234-M237 HydrophobicContact CE1-CE 4.39Å; F234-M237 HydrophobicContact CE2-CE 4.19Å; F234-M237 HydrophobicContact CG-CE 3.39Å; F234-M237 WeakPolarHBondContact O-CB 3.45Å; F234-M237 PolarHBondContact O-N 2.89Å; F234-F269 AromaticContact CE2-CE1 3.78Å; F234-F269 HydrophobicContact CE2-CE1 3.78Å; F234-F269 HydrophobicContact CE2-CZ 4.4Å; F234-F269 HydrophobicContact CZ-CD1 4.2Å; F234-F269 AromaticContact CZ-CE1 3.71Å; F234-F269 HydrophobicContact CZ-CE1 3.71Å; F234-L272 HydrophobicContact CE1-CD1 4.14Å; F234-L272 HydrophobicContact CZ-CD1 3.87Å; F234-I307 HydrophobicContact CD1-CG2 4.34Å; F234-I307 HydrophobicContact CE1-CG2 4.25Å; F234-T310 HydrophobicContact CD1-CG2 4.01Å; F234-T310 HydrophobicContact CE1-CG2 3.93Å; F234-A311 HydrophobicContact CE1-CB 4.22Å; F234-A311 HydrophobicContact CZ-CB 4.3Å; F234-L314 HydrophobicContact CE2-CD1 4.24Å; F234-L314 HydrophobicContact CZ-CD1 4.07Å
235	A	92.9	Very high	94.3	Very high	51 Å²	51	30.4 Å²	30.4	42%	0.421	14%	0.14	S	C	.	.	H	α-helix	trans	-56	-30.2	178.4	0	0	0	0	0	113.1	F231 R232 M237	F231-A235 PolarHBondContact O-N 3Å; R232-A235 WeakPolarHBondContact O-CB 3.33Å; R232-A235 PolarHBondContact O-N 3.36Å; A235-M237 VanDerWaalsContact C-N 3.28Å; A235-M237 PolarHBondContact O-N 3.23Å
236	Y	94	Very high	94.4	Very high	67 Å²	67	29.7 Å²	29.7	26%	0.263	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-17.3	178.9	-53	-64.4	0	0	0	113.7	G233 F234 N238 E303 E306	G233-Y236 WeakPolarHBondContact O-CD2 3.3Å; F234-Y236 PolarHBondContact O-N 3.2Å; F234-Y236 VanDerWaalsContact O-N 3.15Å; Y236-N238 PolarHBondContact O-N 3.36Å; Y236-N238 VanDerWaalsContact O-N 3.17Å; Y236-E303 HydrophobicContact CD1-CB 4.09Å; Y236-E303 HydrophobicContact CD1-CG 3.47Å; Y236-E303 VanDerWaalsContact CD1-CG 3.47Å; Y236-E303 WeakPolarHBondContact CD1-OE1 3.47Å; Y236-E303 HydrophobicContact CD2-CB 4.06Å; Y236-E303 HydrophobicContact CD2-CG 4.15Å; Y236-E303 HydrophobicContact CE1-CG 3.7Å; Y236-E303 HydrophobicContact CE2-CG 4.36Å; Y236-E303 HydrophobicContact CG-CB 3.79Å; Y236-E303 HydrophobicContact CG-CG 3.71Å; Y236-E306 HydrophobicContact CE2-CB 4.22Å; Y236-E306 HydrophobicContact CE2-CG 4.24Å; Y236-E306 WeakPolarHBondContact CE2-OE2 3.43Å; Y236-E306 PolarHBondContact OH-OE2 3.36Å
237	M	95.4	Very high	94.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-74.4	109.1	175.8	-64.3	-168.1	-72.3	0	0	110.6	R228 F234 A235 L241 I242 L245 L272 L277 I307	R228-M237 WeakPolarHBondContact CD-O 3.46Å; R228-M237 PolarHBondContact NH1-O 2.8Å; F234-M237 HydrophobicContact CB-CE 3.58Å; F234-M237 HydrophobicContact CD1-CE 3.82Å; F234-M237 HydrophobicContact CD2-CE 3.57Å; F234-M237 HydrophobicContact CE1-CE 4.39Å; F234-M237 HydrophobicContact CE2-CE 4.19Å; F234-M237 HydrophobicContact CG-CE 3.39Å; F234-M237 WeakPolarHBondContact O-CB 3.45Å; F234-M237 PolarHBondContact O-N 2.89Å; A235-M237 VanDerWaalsContact C-N 3.28Å; A235-M237 PolarHBondContact O-N 3.23Å; M237-L241 HydrophobicContact CB-CD2 4.08Å; M237-L241 HydrophobicContact CG-CD2 3.89Å; M237-I242 HydrophobicContact CB-CD1 4.24Å; M237-I242 HydrophobicContact CB-CG1 3.95Å; M237-L245 HydrophobicContact SD-CD2 4.38Å; M237-L272 HydrophobicContact SD-CD1 4.46Å; M237-L277 HydrophobicContact SD-CD1 4.38Å; M237-I307 HydrophobicContact CG-CD1 3.92Å; M237-I307 HydrophobicContact CG-CG1 4.39Å
238	N	94	Very high	94.6	Very high	63 Å²	63	32.7 Å²	32.7	34%	0.337	15%	0.149	S	C	.	.			trans	-62.5	163.1	173.7	72.3	50.3	0	0	0	111.3	Y236 W240 L241 I242	Y236-N238 PolarHBondContact O-N 3.36Å; Y236-N238 VanDerWaalsContact O-N 3.17Å; N238-W240 VanDerWaalsContact C-N 3.26Å; N238-W240 PolarHBondContact O-N 2.99Å; N238-W240 PolarHBondContact OD1-N 3.13Å; N238-W240 VanDerWaalsContact OD1-N 3.12Å; N238-L241 PolarHBondContact O-N 3.2Å; N238-L241 WeakPolarHBondContact OD1-CB 3.5Å; N238-L241 PolarHBondContact OD1-N 3.48Å; N238-I242 PolarHBondContact O-N 3.33Å
239	S	94.4	Very high	94.7	Very high	39 Å²	39	28.4 Å²	28.4	27%	0.273	13%	0.133	S	C	.	.	H	α-helix	trans	-60.9	-37.8	-174	-171.1	0	0	0	0	112.3	K225 I242 D243	K225-S239 VanDerWaalsContact CE-OG 3.28Å; K225-S239 WeakPolarHBondContact CE-OG 3.46Å; K225-S239 PolarHBondContact NZ-OG 3.05Å; S239-I242 PolarHBondContact O-N 2.68Å; S239-D243 PolarHBondContact O-N 2.67Å
240	W	96.7	Very high	95	Very high	14 Å²	14	22.3 Å²	22.3	5%	0.053	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-39.1	-178.2	-178.8	-132	0	0	0	112.3	H204 W207 N238 I242 D243 L244 D286 P287 C288	H204-W240 HydrophobicContact CB-CD2 4.11Å; H204-W240 HydrophobicContact CB-CE3 3.72Å; H204-W240 HydrophobicContact CB-CH2 3.8Å; H204-W240 HydrophobicContact CB-CZ2 4.2Å; H204-W240 HydrophobicContact CB-CZ3 3.56Å; H204-W240 AromaticContact CD2-CD2 3.73Å; H204-W240 AromaticContact CD2-CE2 3.34Å; H204-W240 AromaticContact CD2-CZ2 3.55Å; H204-W240 AromaticContact CD2-NE1 3.56Å; H204-W240 AromaticContact CE1-CD1 3.48Å; H204-W240 VanDerWaalsContact CE1-CD1 3.48Å; H204-W240 AromaticContact CE1-CD2 3.81Å; H204-W240 AromaticContact CE1-CE2 3.99Å; H204-W240 AromaticContact CE1-CG 3.48Å; H204-W240 VanDerWaalsContact CE1-CG 3.48Å; H204-W240 AromaticContact CE1-NE1 3.77Å; H204-W240 AromaticContact CG-CD2 3.55Å; H204-W240 AromaticContact CG-CE2 3.65Å; H204-W240 AromaticContact CG-CE3 3.69Å; H204-W240 AromaticContact CG-CZ2 3.91Å; H204-W240 AromaticContact CG-CZ3 3.93Å; H204-W240 AromaticContact ND1-CD2 3.6Å; H204-W240 AromaticContact ND1-CE3 3.93Å; H204-W240 AromaticContact ND1-CG 3.63Å; H204-W240 AromaticContact NE2-CD1 3.51Å; H204-W240 AromaticContact NE2-CD2 3.93Å; H204-W240 AromaticContact NE2-CE2 3.63Å; H204-W240 AromaticContact NE2-CG 3.86Å; H204-W240 AromaticContact NE2-NE1 3.33Å; H204-W240 PolarHBondContact NE2-NE1 3.12Å; W207-W240 HydrophobicContact CB-CH2 4.34Å; W207-W240 AromaticContact CD2-CH2 3.9Å; W207-W240 HydrophobicContact CD2-CH2 3.9Å; W207-W240 AromaticContact CE3-CH2 3.35Å; W207-W240 HydrophobicContact CE3-CH2 3.35Å; W207-W240 HydrophobicContact CE3-CZ2 4.3Å; W207-W240 AromaticContact CE3-CZ3 3.96Å; W207-W240 HydrophobicContact CE3-CZ3 3.96Å; W207-W240 HydrophobicContact CG-CH2 4.32Å; W207-W240 AromaticContact CZ3-CH2 3.96Å; W207-W240 HydrophobicContact CZ3-CH2 3.96Å; W207-W240 HydrophobicContact CZ3-CZ3 4.31Å; N238-W240 VanDerWaalsContact C-N 3.26Å; N238-W240 PolarHBondContact O-N 2.99Å; N238-W240 PolarHBondContact OD1-N 3.13Å; N238-W240 VanDerWaalsContact OD1-N 3.12Å; W240-I242 VanDerWaalsContact C-N 3.29Å; W240-I242 PolarHBondContact O-N 3.21Å; W240-D243 HydrophobicContact CE3-CB 4.03Å; W240-D243 HydrophobicContact CZ3-CB 4.38Å; W240-D243 PolarHBondContact O-N 3.36Å; W240-L244 HydrophobicContact CD2-CD1 3.89Å; W240-L244 HydrophobicContact CD2-CG 4.11Å; W240-L244 HydrophobicContact CE3-CG 4.37Å; W240-L244 HydrophobicContact CG-CD1 4.25Å; W240-L244 HydrophobicContact CH2-CD1 4.38Å; W240-L244 HydrophobicContact CH2-CD2 4.17Å; W240-L244 HydrophobicContact CH2-CG 4.13Å; W240-L244 HydrophobicContact CZ2-CD1 3.6Å; W240-L244 HydrophobicContact CZ2-CD2 4Å; W240-L244 HydrophobicContact CZ2-CG 3.83Å; W240-L244 HydrophobicContact CZ3-CG 4.37Å; W240-L244 VanDerWaalsContact NE1-CD1 3.34Å; W240-L244 PolarHBondContact O-N 2.85Å; W240-D286 VanDerWaalsContact NE1-CG 3.34Å; W240-D286 PolarHBondContact NE1-OD1 3.29Å; W240-D286 VanDerWaalsContact NE1-OD1 3.15Å; W240-D286 PolarHBondContact NE1-OD2 3.47Å; W240-D286 VanDerWaalsContact NE1-OD2 3.1Å; W240-P287 HydrophobicContact CZ2-CG 4.22Å; W240-C288 HydrophobicContact CZ2-CB 4.4Å
241	L	97	Very high	95.3	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-40.8	173.1	177.6	58.8	0	0	0	111.4	M237 N238 L245 L277 L284 L295 M299	M237-L241 HydrophobicContact CB-CD2 4.08Å; M237-L241 HydrophobicContact CG-CD2 3.89Å; N238-L241 PolarHBondContact O-N 3.2Å; N238-L241 WeakPolarHBondContact OD1-CB 3.5Å; N238-L241 PolarHBondContact OD1-N 3.48Å; L241-L245 WeakPolarHBondContact O-CB 3.34Å; L241-L245 PolarHBondContact O-N 2.8Å; L241-L277 HydrophobicContact CD1-CD2 4.37Å; L241-L277 HydrophobicContact CD2-CD1 4.13Å; L241-L284 HydrophobicContact CD1-CD1 3.63Å; L241-L295 HydrophobicContact CD1-CB 3.96Å; L241-L295 HydrophobicContact CD1-CD1 4.23Å; L241-M299 HydrophobicContact CD2-CE 3.93Å; L241-M299 HydrophobicContact CD2-SD 4.41Å
242	I	97.8	Very high	95.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-45.9	175.3	-68.6	173.2	0	0	0	111.1	I221 L224 K225 R228 M237 N238 S239 W240 L244 L245 A246	I221-I242 HydrophobicContact CG2-CG2 4.41Å; L224-I242 HydrophobicContact CB-CG2 3.56Å; L224-I242 HydrophobicContact CD1-CG2 4.23Å; K225-I242 HydrophobicContact CG-CD1 4.34Å; K225-I242 HydrophobicContact CG-CG2 4.16Å; R228-I242 HydrophobicContact CB-CD1 4.02Å; R228-I242 HydrophobicContact CG-CD1 4.41Å; M237-I242 HydrophobicContact CB-CD1 4.24Å; M237-I242 HydrophobicContact CB-CG1 3.95Å; N238-I242 PolarHBondContact O-N 3.33Å; S239-I242 PolarHBondContact O-N 2.68Å; W240-I242 VanDerWaalsContact C-N 3.29Å; W240-I242 PolarHBondContact O-N 3.21Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 2.87Å; I242-L245 PolarHBondContact O-N 3.12Å; I242-A246 WeakPolarHBondContact O-CB 3.07Å; I242-A246 PolarHBondContact O-N 3.41Å
243	D	97.6	Very high	95.5	Very high	13 Å²	13	23.1 Å²	23.1	7%	0.07	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-45.8	-179.6	-64	-19	0	0	0	110.8	I221 K225 S239 W240 H247	I221-D243 HydrophobicContact CD1-CB 4.17Å; I221-D243 WeakPolarHBondContact CG2-OD1 3.41Å; K225-D243 WeakPolarHBondContact CE-OD1 3.49Å; K225-D243 IonicContact NZ-OD1 2.92Å; K225-D243 PolarHBondContact NZ-OD1 3.44Å; S239-D243 PolarHBondContact O-N 2.67Å; W240-D243 HydrophobicContact CE3-CB 4.03Å; W240-D243 HydrophobicContact CZ3-CB 4.38Å; W240-D243 PolarHBondContact O-N 3.36Å; D243-H247 PolarHBondContact O-N 3Å; D243-H247 VanDerWaalsContact O-N 3.09Å
244	L	97.5	Very high	95.6	Very high	8 Å²	8	26.5 Å²	26.5	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-70.3	-38.9	177.7	-78.4	170.4	0	0	0	113.7	W207 W240 I242 A246 H247 Y248 L284 P287 L295	W207-L244 HydrophobicContact CD2-CD2 4.45Å; W207-L244 HydrophobicContact CE3-CD2 4.18Å; W207-L244 HydrophobicContact CH2-CD2 3.28Å; W207-L244 HydrophobicContact CH2-CG 4.49Å; W207-L244 HydrophobicContact CZ2-CD2 3.61Å; W207-L244 HydrophobicContact CZ3-CD2 3.59Å; W207-L244 HydrophobicContact CZ3-CG 4.49Å; W240-L244 HydrophobicContact CD2-CD1 3.89Å; W240-L244 HydrophobicContact CD2-CG 4.11Å; W240-L244 HydrophobicContact CE3-CG 4.37Å; W240-L244 HydrophobicContact CG-CD1 4.25Å; W240-L244 HydrophobicContact CH2-CD1 4.38Å; W240-L244 HydrophobicContact CH2-CD2 4.17Å; W240-L244 HydrophobicContact CH2-CG 4.13Å; W240-L244 HydrophobicContact CZ2-CD1 3.6Å; W240-L244 HydrophobicContact CZ2-CD2 4Å; W240-L244 HydrophobicContact CZ2-CG 3.83Å; W240-L244 HydrophobicContact CZ3-CG 4.37Å; W240-L244 VanDerWaalsContact NE1-CD1 3.34Å; W240-L244 PolarHBondContact O-N 2.85Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 2.87Å; L244-A246 VanDerWaalsContact C-N 3.35Å; L244-H247 PolarHBondContact O-N 2.92Å; L244-Y248 VanDerWaalsContact O-CB 3.29Å; L244-Y248 WeakPolarHBondContact O-CB 3.47Å; L244-Y248 PolarHBondContact O-N 3.35Å; L244-L284 HydrophobicContact CB-CD1 4.3Å; L244-P287 HydrophobicContact CD2-CG 3.82Å; L244-L295 HydrophobicContact CB-CD1 4.44Å; L244-L295 HydrophobicContact CD1-CD1 3.22Å; L244-L295 HydrophobicContact CG-CD1 4.45Å
245	L	97.8	Very high	95.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-45	176.3	179.7	62.8	0	0	0	110.8	M237 L241 I242 Y248 V249 V268 L272 F276 L284	M237-L245 HydrophobicContact SD-CD2 4.38Å; L241-L245 WeakPolarHBondContact O-CB 3.34Å; L241-L245 PolarHBondContact O-N 2.8Å; I242-L245 PolarHBondContact O-N 3.12Å; L245-Y248 PolarHBondContact O-N 2.97Å; L245-V249 HydrophobicContact CD1-CG2 4.03Å; L245-V249 HydrophobicContact CG-CG2 4.46Å; L245-V249 VanDerWaalsContact O-CB 3.31Å; L245-V249 WeakPolarHBondContact O-CB 3.4Å; L245-V249 VanDerWaalsContact O-CG2 3.26Å; L245-V249 WeakPolarHBondContact O-CG2 3.32Å; L245-V249 PolarHBondContact O-N 3.26Å; L245-V268 HydrophobicContact CD2-CG1 4.11Å; L245-L272 HydrophobicContact CD2-CD1 4.13Å; L245-L272 HydrophobicContact CD2-CD2 4.17Å; L245-L272 HydrophobicContact CD2-CG 4.36Å; L245-F276 HydrophobicContact CD1-CD1 4.28Å; L245-F276 HydrophobicContact CD1-CE1 4.01Å; L245-L284 HydrophobicContact CB-CD1 3.85Å; L245-L284 HydrophobicContact CD1-CD1 4.18Å
246	A	98.1	Very high	95.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-44.9	177.4	0	0	0	0	0	111.7	V217 L220 I221 L224 I242 L244 V250	V217-A246 HydrophobicContact CG1-CB 4.32Å; L220-A246 HydrophobicContact CB-CB 4.27Å; L220-A246 HydrophobicContact CD2-CB 4.04Å; L220-A246 HydrophobicContact CG-CB 4.05Å; I221-A246 HydrophobicContact CD1-CB 4.33Å; I221-A246 HydrophobicContact CG1-CB 3.43Å; I221-A246 VanDerWaalsContact CG1-CB 3.43Å; L224-A246 HydrophobicContact CD1-CB 4.31Å; I242-A246 WeakPolarHBondContact O-CB 3.07Å; I242-A246 PolarHBondContact O-N 3.41Å; L244-A246 VanDerWaalsContact C-N 3.35Å; A246-V250 VanDerWaalsContact O-CG2 3.27Å; A246-V250 WeakPolarHBondContact O-CG2 3.5Å; A246-V250 PolarHBondContact O-N 3.47Å; A246-V250 VanDerWaalsContact O-N 3.14Å
247	H	97.9	Very high	95	Very high	34 Å²	34	40.9 Å²	40.9	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-51.4	174.5	168.4	-89.6	0	0	0	111.7	W207 N211 A212 V217 D243 L244 V249 V250 M251	W207-H247 HydrophobicContact CH2-CB 3.86Å; W207-H247 AromaticContact CH2-CD2 3.88Å; W207-H247 AromaticContact CH2-CE1 3.96Å; W207-H247 AromaticContact CH2-CG 3.47Å; W207-H247 VanDerWaalsContact CH2-CG 3.47Å; W207-H247 AromaticContact CH2-ND1 3.53Å; W207-H247 AromaticContact CZ2-CE1 3.89Å; W207-H247 AromaticContact CZ2-ND1 3.83Å; W207-H247 HydrophobicContact CZ3-CB 4.48Å; N211-H247 PolarHBondContact O-CD2 2.89Å; N211-H247 VanDerWaalsContact O-CD2 3.28Å; N211-H247 PolarHBondContact O-NE2 3.5Å; A212-H247 HydrophobicContact CB-CB 4.46Å; V217-H247 HydrophobicContact CG1-CB 4.23Å; D243-H247 PolarHBondContact O-N 3Å; D243-H247 VanDerWaalsContact O-N 3.09Å; L244-H247 PolarHBondContact O-N 2.92Å; H247-V249 VanDerWaalsContact C-N 3.31Å; H247-V249 PolarHBondContact O-N 3.31Å; H247-V250 PolarHBondContact O-N 3.45Å; H247-M251 VanDerWaalsContact O-CB 3.31Å; H247-M251 WeakPolarHBondContact O-CB 3.4Å; H247-M251 WeakPolarHBondContact O-CG 3.5Å; H247-M251 PolarHBondContact O-N 3.03Å
248	Y	97.1	Very high	95	Very high	46 Å²	46	42.7 Å²	42.7	18%	0.18	22%	0.215	C	C	.	.	H	α-helix	trans	-54.8	-49.5	-179.7	175.9	-85.3	0	0	0	110.8	D29 L244 L245 V250 N252 L271 F276 L284	D29-Y248 PolarHBondContact OD2-OH 3.2Å; L244-Y248 VanDerWaalsContact O-CB 3.29Å; L244-Y248 WeakPolarHBondContact O-CB 3.47Å; L244-Y248 PolarHBondContact O-N 3.35Å; L245-Y248 PolarHBondContact O-N 2.97Å; Y248-V250 VanDerWaalsContact C-N 3.34Å; Y248-V250 PolarHBondContact O-N 2.82Å; Y248-N252 HydrophobicContact CD2-CB 4.02Å; Y248-N252 HydrophobicContact CE2-CB 4.17Å; Y248-N252 WeakPolarHBondContact CE2-ND2 3.45Å; Y248-N252 HydrophobicContact CG-CB 4.32Å; Y248-N252 VanDerWaalsContact CZ-ND2 3.31Å; Y248-N252 WeakPolarHBondContact O-CA 3.41Å; Y248-N252 WeakPolarHBondContact O-CB 3.47Å; Y248-N252 PolarHBondContact O-N 3.43Å; Y248-N252 PolarHBondContact OH-ND2 3.09Å; Y248-L271 HydrophobicContact CD1-CD1 4Å; Y248-L271 HydrophobicContact CE1-CD1 3.71Å; Y248-F276 HydrophobicContact CD1-CZ 4.26Å; Y248-F276 HydrophobicContact CE1-CE2 4.22Å; Y248-F276 HydrophobicContact CE1-CZ 4.02Å; Y248-F276 HydrophobicContact CE2-CZ 4.39Å; Y248-L284 HydrophobicContact CD2-CD2 3.75Å; Y248-L284 HydrophobicContact CG-CD2 3.75Å
249	V	95.9	Very high	95	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-39.9	-176	163.3	0	0	0	0	112.1	L220 L245 H247 L259 A264 R267 V268 L271	L220-V249 HydrophobicContact CD2-CG1 4.22Å; L245-V249 HydrophobicContact CD1-CG2 4.03Å; L245-V249 HydrophobicContact CG-CG2 4.46Å; L245-V249 VanDerWaalsContact O-CB 3.31Å; L245-V249 WeakPolarHBondContact O-CB 3.4Å; L245-V249 VanDerWaalsContact O-CG2 3.26Å; L245-V249 WeakPolarHBondContact O-CG2 3.32Å; L245-V249 PolarHBondContact O-N 3.26Å; H247-V249 VanDerWaalsContact C-N 3.31Å; H247-V249 PolarHBondContact O-N 3.31Å; V249-L259 VanDerWaalsContact O-CD1 3.23Å; V249-L259 WeakPolarHBondContact O-CD1 3.38Å; V249-A264 HydrophobicContact CG1-CB 3.88Å; V249-A264 WeakPolarHBondContact CG1-O 3.34Å; V249-R267 HydrophobicContact CG1-CB 3.8Å; V249-R267 HydrophobicContact CG1-CG 4.17Å; V249-R267 PolarHBondContact O-NH1 2.85Å; V249-V268 HydrophobicContact CB-CG2 4.26Å; V249-V268 HydrophobicContact CG1-CG2 3.92Å; V249-V268 HydrophobicContact CG2-CG2 3.98Å; V249-L271 HydrophobicContact CG2-CD1 3.67Å
250	V	97	Very high	95	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-78.3	-44.8	-179.3	176.1	0	0	0	0	111.8	T216 V217 L220 A246 H247 Y248 N253 P258 L259 A264	T216-V250 HydrophobicContact CG2-CG1 4.24Å; T216-V250 HydrophobicContact CG2-CG2 3.97Å; V217-V250 HydrophobicContact CG2-CB 3.77Å; V217-V250 HydrophobicContact CG2-CG1 3.82Å; V217-V250 HydrophobicContact CG2-CG2 4.06Å; L220-V250 HydrophobicContact CD2-CG2 3.92Å; A246-V250 VanDerWaalsContact O-CG2 3.27Å; A246-V250 WeakPolarHBondContact O-CG2 3.5Å; A246-V250 PolarHBondContact O-N 3.47Å; A246-V250 VanDerWaalsContact O-N 3.14Å; H247-V250 PolarHBondContact O-N 3.45Å; Y248-V250 VanDerWaalsContact C-N 3.34Å; Y248-V250 PolarHBondContact O-N 2.82Å; V250-N253 PolarHBondContact O-ND2 3.15Å; V250-P258 HydrophobicContact CG1-CB 3.86Å; V250-L259 PolarHBondContact O-N 3.08Å; V250-A264 HydrophobicContact CG2-CB 3.68Å
251	M	96.1	Very high	95	Very high	67 Å²	67	41.7 Å²	41.7	33%	0.33	21%	0.212	S	C	.	.	H	α-helix	trans	-98.5	-31.5	-164.8	-57.6	-59.8	-74.8	0	0	113.5	H214 V217 H247 N253 P258	H214-M251 HydrophobicContact CB-SD 4.37Å; V217-M251 HydrophobicContact CG2-CG 4.17Å; V217-M251 HydrophobicContact CG2-SD 4.41Å; H247-M251 VanDerWaalsContact O-CB 3.31Å; H247-M251 WeakPolarHBondContact O-CB 3.4Å; H247-M251 WeakPolarHBondContact O-CG 3.5Å; H247-M251 PolarHBondContact O-N 3.03Å; M251-N253 PolarHBondContact O-N 3.43Å; M251-N253 VanDerWaalsContact O-N 3.13Å; M251-P258 HydrophobicContact CE-CG 4.27Å; M251-P258 HydrophobicContact SD-CB 4Å; M251-P258 HydrophobicContact SD-CG 3.89Å
252	N	93.9	Very high	94.8	Very high	70 Å²	70	42.2 Å²	42.2	37%	0.374	21%	0.214	S	C	.	.	S	Bend	trans	-87.4	82.2	-177.3	-170.5	34.7	0	0	0	110.2	M32 Y248 R267	M32-N252 HydrophobicContact CE-CB 4.16Å; M32-N252 WeakPolarHBondContact CE-ND2 3.46Å; M32-N252 WeakPolarHBondContact CE-O 3.48Å; M32-N252 WeakPolarHBondContact CE-OD1 3.08Å; Y248-N252 HydrophobicContact CD2-CB 4.02Å; Y248-N252 HydrophobicContact CE2-CB 4.17Å; Y248-N252 WeakPolarHBondContact CE2-ND2 3.45Å; Y248-N252 HydrophobicContact CG-CB 4.32Å; Y248-N252 VanDerWaalsContact CZ-ND2 3.31Å; Y248-N252 WeakPolarHBondContact O-CA 3.41Å; Y248-N252 WeakPolarHBondContact O-CB 3.47Å; Y248-N252 PolarHBondContact O-N 3.43Å; Y248-N252 PolarHBondContact OH-ND2 3.09Å; N252-R267 PolarHBondContact O-NH1 2.81Å; N252-R267 PolarHBondContact O-NH2 3.28Å
253	N	91.6	Very high	94.6	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.064	22%	0.222	C	C	.	.	S	Bend	trans	-148.8	160.4	179.3	72.7	81	0	0	0	111.9	V31 V250 M251 S255 R256 Q257 L259	V31-N253 HydrophobicContact CG1-CB 3.82Å; V250-N253 PolarHBondContact O-ND2 3.15Å; M251-N253 PolarHBondContact O-N 3.43Å; M251-N253 VanDerWaalsContact O-N 3.13Å; N253-S255 VanDerWaalsContact C-N 3.27Å; N253-S255 PolarHBondContact O-N 2.95Å; N253-S255 WeakPolarHBondContact OD1-CB 3.32Å; N253-S255 PolarHBondContact OD1-N 3.25Å; N253-S255 PolarHBondContact OD1-OG 3.43Å; N253-R256 PolarHBondContact O-N 3.01Å; N253-R256 VanDerWaalsContact O-N 3.12Å; N253-Q257 PolarHBondContact ND2-O 3.36Å; N253-Q257 PolarHBondContact OD1-O 3.47Å; N253-L259 HydrophobicContact CB-CD1 4.44Å; N253-L259 HydrophobicContact CB-CD2 4.23Å; N253-L259 HydrophobicContact CB-CG 4.3Å
254	P	90.3	Very high	94.5	Very high	72 Å²	72	43.2 Å²	43.2	47%	0.468	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.6	-173.9	-24.9	35.5	0	0	0	114.8	V31 M32 R256	V31-P254 WeakPolarHBondContact O-CD 3.4Å; M32-P254 HydrophobicContact SD-CG 4.18Å; P254-R256 PolarHBondContact O-N 2.81Å
255	S	88.7	Confident	94.4	Very high	70 Å²	70	42.8 Å²	42.8	49%	0.49	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.9	-179.6	80.5	0	0	0	0	113	N253 Q257	N253-S255 VanDerWaalsContact C-N 3.27Å; N253-S255 PolarHBondContact O-N 2.95Å; N253-S255 WeakPolarHBondContact OD1-CB 3.32Å; N253-S255 PolarHBondContact OD1-N 3.25Å; N253-S255 PolarHBondContact OD1-OG 3.43Å; S255-Q257 PolarHBondContact O-N 3.35Å; S255-Q257 PolarHBondContact OG-N 3.22Å; S255-Q257 VanDerWaalsContact OG-N 3.16Å; S255-Q257 PolarHBondContact OG-O 2.9Å
256	R	87.6	Confident	94.2	Very high	220 Å²	220	43.3 Å²	43.3	83%	0.83	22%	0.218	S	C	*	.			trans	55	15	-172	-53.1	-177.3	-179.9	-172.2	-0.9	113.8	N253 P254	N253-R256 PolarHBondContact O-N 3.01Å; N253-R256 VanDerWaalsContact O-N 3.12Å; P254-R256 PolarHBondContact O-N 2.81Å
257	Q	93.3	Very high	94	Very high	130 Å²	130	43.4 Å²	43.4	61%	0.607	22%	0.219	S	C	*	.	S	Bend	trans	-108.2	148.3	170.5	-62.5	-56.3	-43.3	0	0	108.8	N253 S255 L259	N253-Q257 PolarHBondContact ND2-O 3.36Å; N253-Q257 PolarHBondContact OD1-O 3.47Å; S255-Q257 PolarHBondContact O-N 3.35Å; S255-Q257 PolarHBondContact OG-N 3.22Å; S255-Q257 VanDerWaalsContact OG-N 3.16Å; S255-Q257 PolarHBondContact OG-O 2.9Å; Q257-L259 PolarHBondContact O-N 3.18Å
258	P	95.2	Very high	94	Very high	37 Å²	37	41.8 Å²	41.8	24%	0.24	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-56.2	127.1	174.5	-23.8	34	0	0	0	110.8	H214 V250 M251	H214-P258 VanDerWaalsContact CE1-CB 3.45Å; H214-P258 WeakPolarHBondContact CE1-CB 3.42Å; V250-P258 HydrophobicContact CG1-CB 3.86Å; M251-P258 HydrophobicContact CE-CG 4.27Å; M251-P258 HydrophobicContact SD-CB 4Å; M251-P258 HydrophobicContact SD-CG 3.89Å
259	L	94	Very high	93.9	Very high	18 Å²	18	39.6 Å²	39.6	9%	0.094	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-62.2	146	175.6	-68	-177.4	0	0	0	111.1	V31 V249 V250 N253 Q257 H263 A264	V31-L259 HydrophobicContact CG1-CD1 4.1Å; V31-L259 HydrophobicContact CG2-CD1 4.49Å; V249-L259 VanDerWaalsContact O-CD1 3.23Å; V249-L259 WeakPolarHBondContact O-CD1 3.38Å; V250-L259 PolarHBondContact O-N 3.08Å; N253-L259 HydrophobicContact CB-CD1 4.44Å; N253-L259 HydrophobicContact CB-CD2 4.23Å; N253-L259 HydrophobicContact CB-CG 4.3Å; Q257-L259 PolarHBondContact O-N 3.18Å; L259-H263 HydrophobicContact CB-CB 4.44Å; L259-A264 HydrophobicContact CB-CB 4.26Å
260	P	94	Very high	93.7	Very high	65 Å²	65	40.6 Å²	40.6	42%	0.422	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-57.5	151.2	168	-21.4	32.1	0	0	0	111.7	N262 H263 A264	P260-N262 VanDerWaalsContact C-N 3.33Å; P260-N262 PolarHBondContact O-N 3.25Å; P260-H263 PolarHBondContact O-N 3.28Å; P260-H263 VanDerWaalsContact O-N 3.1Å; P260-A264 WeakPolarHBondContact O-CB 3.4Å; P260-A264 PolarHBondContact O-N 3.11Å
261	L	96.1	Very high	93.6	Very high	13 Å²	13	40.6 Å²	40.6	7%	0.068	21%	0.207	C	C	.	.	H	α-helix	trans	-56.8	-42.5	-172.4	178.4	61.6	0	0	0	113.4	L47 L50 L51 T216 V219 L220 A264 F265	L47-L261 HydrophobicContact CD1-CB 3.91Å; L47-L261 HydrophobicContact CD1-CD2 4.33Å; L50-L261 HydrophobicContact CB-CD2 3.81Å; L50-L261 HydrophobicContact CB-CG 4.29Å; L50-L261 HydrophobicContact CD1-CG 4.11Å; L51-L261 HydrophobicContact CD2-CD2 3.99Å; T216-L261 HydrophobicContact CG2-CB 4Å; T216-L261 HydrophobicContact CG2-CD1 4.05Å; V219-L261 HydrophobicContact CB-CD1 4.31Å; V219-L261 HydrophobicContact CG1-CD1 3.85Å; V219-L261 HydrophobicContact CG1-CD2 3.58Å; V219-L261 HydrophobicContact CG1-CG 4.38Å; L220-L261 HydrophobicContact CB-CD1 4.24Å; L261-A264 PolarHBondContact O-N 3.08Å; L261-F265 VanDerWaalsContact O-CB 3.24Å; L261-F265 WeakPolarHBondContact O-CB 3.21Å; L261-F265 PolarHBondContact O-N 3.32Å
262	N	93.8	Very high	93.6	Very high	11 Å²	11	37.5 Å²	37.5	6%	0.059	19%	0.192	C	C	.	.	H	α-helix	trans	-67	-37.2	179.4	59.2	-58.6	0	0	0	112.4	D43 L46 L47 L50 P260 F265 R266	D43-N262 WeakPolarHBondContact CB-ND2 3.39Å; D43-N262 PolarHBondContact OD2-ND2 3.48Å; L46-N262 HydrophobicContact CB-CB 4.47Å; L46-N262 HydrophobicContact CD2-CB 4.02Å; L46-N262 HydrophobicContact CG-CB 4.09Å; L47-N262 HydrophobicContact CB-CB 4.14Å; L47-N262 HydrophobicContact CD1-CB 4.5Å; L50-N262 HydrophobicContact CD1-CB 4.22Å; P260-N262 VanDerWaalsContact C-N 3.33Å; P260-N262 PolarHBondContact O-N 3.25Å; N262-F265 PolarHBondContact O-N 3.02Å; N262-R266 WeakPolarHBondContact O-CG 3.49Å; N262-R266 PolarHBondContact O-N 3.12Å
263	H	92.7	Very high	93.6	Very high	34 Å²	34	34.2 Å²	34.2	16%	0.157	17%	0.174	C	C	.	.	H	α-helix	trans	-69.5	-45.8	176	-66.5	-131.6	0	0	0	110.7	I39 L259 P260 F265 R266 R267	I39-H263 WeakPolarHBondContact CG1-CE1 3.45Å; I39-H263 VanDerWaalsContact CG2-CE1 3.41Å; I39-H263 WeakPolarHBondContact CG2-CE1 3.47Å; L259-H263 HydrophobicContact CB-CB 4.44Å; P260-H263 PolarHBondContact O-N 3.28Å; P260-H263 VanDerWaalsContact O-N 3.1Å; H263-F265 VanDerWaalsContact C-N 3.33Å; H263-F265 PolarHBondContact O-N 3.04Å; H263-R266 PolarHBondContact O-N 3.22Å; H263-R267 WeakPolarHBondContact O-CB 3.4Å; H263-R267 PolarHBondContact O-N 3.35Å
264	A	95.2	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-46.8	175.4	0	0	0	0	0	110.5	L220 V249 V250 L259 P260 L261 R266 R267 V268	L220-A264 HydrophobicContact CD2-CB 4.03Å; V249-A264 HydrophobicContact CG1-CB 3.88Å; V249-A264 WeakPolarHBondContact CG1-O 3.34Å; V250-A264 HydrophobicContact CG2-CB 3.68Å; L259-A264 HydrophobicContact CB-CB 4.26Å; P260-A264 WeakPolarHBondContact O-CB 3.4Å; P260-A264 PolarHBondContact O-N 3.11Å; L261-A264 PolarHBondContact O-N 3.08Å; A264-R266 PolarHBondContact O-N 3.45Å; A264-R267 PolarHBondContact O-N 3.39Å; A264-R267 VanDerWaalsContact O-N 3.14Å; A264-V268 PolarHBondContact O-N 3.47Å
265	F	95.9	Very high	93.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.9	-46.8	177.5	-173.2	-102.8	0	0	0	112.4	L46 L50 L220 I223 F227 L261 N262 H263 R267 V268 F269 L318 L326 F327	L46-F265 HydrophobicContact CD1-CD1 4.1Å; L46-F265 HydrophobicContact CD1-CE1 4.21Å; L46-F265 HydrophobicContact CD2-CD1 4.35Å; L50-F265 HydrophobicContact CD1-CB 3.75Å; L50-F265 HydrophobicContact CD1-CD1 4.1Å; L50-F265 HydrophobicContact CD1-CG 3.9Å; L50-F265 HydrophobicContact CD2-CB 4.3Å; L50-F265 HydrophobicContact CD2-CD1 3.88Å; L50-F265 HydrophobicContact CD2-CD2 3.57Å; L50-F265 HydrophobicContact CD2-CE1 3.99Å; L50-F265 HydrophobicContact CD2-CE2 3.7Å; L50-F265 HydrophobicContact CD2-CG 3.65Å; L50-F265 HydrophobicContact CD2-CZ 3.89Å; L50-F265 HydrophobicContact CG-CG 4.44Å; L220-F265 HydrophobicContact CD1-CB 4.42Å; L220-F265 HydrophobicContact CD1-CD2 4Å; I223-F265 HydrophobicContact CG2-CD2 4.23Å; I223-F265 HydrophobicContact CG2-CE2 3.68Å; F227-F265 HydrophobicContact CE1-CZ 4.23Å; F227-F265 HydrophobicContact CE2-CE2 4.35Å; F227-F265 HydrophobicContact CE2-CZ 4.33Å; F227-F265 HydrophobicContact CZ-CE2 4.1Å; F227-F265 AromaticContact CZ-CZ 3.71Å; F227-F265 HydrophobicContact CZ-CZ 3.71Å; L261-F265 VanDerWaalsContact O-CB 3.24Å; L261-F265 WeakPolarHBondContact O-CB 3.21Å; L261-F265 PolarHBondContact O-N 3.32Å; N262-F265 PolarHBondContact O-N 3.02Å; H263-F265 VanDerWaalsContact C-N 3.33Å; H263-F265 PolarHBondContact O-N 3.04Å; F265-R267 VanDerWaalsContact C-N 3.33Å; F265-R267 PolarHBondContact O-N 2.77Å; F265-V268 WeakPolarHBondContact O-CB 3.32Å; F265-V268 PolarHBondContact O-N 3.31Å; F265-F269 HydrophobicContact CD1-CD2 4.45Å; F265-F269 AromaticContact CD1-CE2 3.98Å; F265-F269 HydrophobicContact CD1-CE2 3.98Å; F265-F269 HydrophobicContact CD2-CE2 4.16Å; F265-F269 HydrophobicContact CE1-CD2 4.29Å; F265-F269 AromaticContact CE1-CE2 3.53Å; F265-F269 HydrophobicContact CE1-CE2 3.53Å; F265-F269 HydrophobicContact CE1-CZ 4.41Å; F265-F269 AromaticContact CE2-CE2 3.72Å; F265-F269 HydrophobicContact CE2-CE2 3.72Å; F265-F269 HydrophobicContact CE2-CZ 4.18Å; F265-F269 HydrophobicContact CG-CE2 4.29Å; F265-F269 AromaticContact CZ-CE2 3.4Å; F265-F269 HydrophobicContact CZ-CE2 3.4Å; F265-F269 VanDerWaalsContact CZ-CE2 3.4Å; F265-F269 AromaticContact CZ-CZ 3.91Å; F265-F269 HydrophobicContact CZ-CZ 3.91Å; F265-F269 VanDerWaalsContact O-CD2 3.25Å; F265-F269 WeakPolarHBondContact O-CD2 3.39Å; F265-L318 HydrophobicContact CD1-CD1 4.26Å; F265-L318 HydrophobicContact CD1-CD2 4.27Å; F265-L318 HydrophobicContact CE1-CD1 4.04Å; F265-L318 HydrophobicContact CE1-CD2 4.35Å; F265-L326 HydrophobicContact CE1-CD1 4.16Å; F265-L326 HydrophobicContact CZ-CD1 4.43Å; F265-F327 HydrophobicContact CZ-CZ 4.01Å
266	R	93.8	Very high	94.1	Very high	11 Å²	11	27.7 Å²	27.7	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-58.8	-43.7	173.6	-76.5	178.5	-176.7	-74.4	-4.1	112.2	D43 L46 N262 H263 A264 V268 F269 H270 L318 Y323	D43-R266 IonicContact OD1-CZ 3.42Å; D43-R266 IonicContact OD1-NE 3.3Å; D43-R266 PolarHBondContact OD1-NE 3Å; D43-R266 IonicContact OD1-NH2 2.7Å; D43-R266 PolarHBondContact OD1-NH2 2.93Å; D43-R266 IonicContact OD2-CZ 3.79Å; D43-R266 IonicContact OD2-NE 2.87Å; D43-R266 PolarHBondContact OD2-NE 2.96Å; D43-R266 IonicContact OD2-NH2 3.81Å; L46-R266 HydrophobicContact CD2-CG 3.97Å; N262-R266 WeakPolarHBondContact O-CG 3.49Å; N262-R266 PolarHBondContact O-N 3.12Å; H263-R266 PolarHBondContact O-N 3.22Å; A264-R266 PolarHBondContact O-N 3.45Å; R266-V268 VanDerWaalsContact C-N 3.3Å; R266-V268 PolarHBondContact O-N 2.87Å; R266-F269 PolarHBondContact O-N 3.16Å; R266-H270 PolarHBondContact O-N 3.08Å; R266-H270 VanDerWaalsContact O-N 3.08Å; R266-H270 PolarHBondContact O-ND1 3.35Å; R266-L318 HydrophobicContact CB-CD2 4.31Å; R266-L318 HydrophobicContact CG-CD2 3.71Å; R266-L318 HydrophobicContact CG-CG 4.33Å; R266-Y323 PolarHBondContact NH2-OH 3.27Å
267	R	94.3	Very high	94.4	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-34.7	-178	-171.4	-168.8	-169.2	-179.6	0.2	112.3	D29 V31 V249 N252 H263 A264 F265 F269 H270 L271	D29-R267 IonicContact OD1-CZ 3.56Å; D29-R267 IonicContact OD1-NE 2.98Å; D29-R267 PolarHBondContact OD1-NE 3.17Å; D29-R267 IonicContact OD1-NH2 3.33Å; D29-R267 PolarHBondContact OD1-NH2 3.14Å; D29-R267 IonicContact OD2-CZ 3.43Å; D29-R267 IonicContact OD2-NE 3.4Å; D29-R267 PolarHBondContact OD2-NE 3.15Å; D29-R267 IonicContact OD2-NH2 2.68Å; D29-R267 PolarHBondContact OD2-NH2 3.2Å; V31-R267 HydrophobicContact CB-CG 4.42Å; V31-R267 HydrophobicContact CG2-CB 4.16Å; V31-R267 HydrophobicContact CG2-CG 3.74Å; V249-R267 HydrophobicContact CG1-CB 3.8Å; V249-R267 HydrophobicContact CG1-CG 4.17Å; V249-R267 PolarHBondContact O-NH1 2.85Å; N252-R267 PolarHBondContact O-NH1 2.81Å; N252-R267 PolarHBondContact O-NH2 3.28Å; H263-R267 WeakPolarHBondContact O-CB 3.4Å; H263-R267 PolarHBondContact O-N 3.35Å; A264-R267 PolarHBondContact O-N 3.39Å; A264-R267 VanDerWaalsContact O-N 3.14Å; F265-R267 VanDerWaalsContact C-N 3.33Å; F265-R267 PolarHBondContact O-N 2.77Å; R267-F269 VanDerWaalsContact C-N 3.32Å; R267-F269 PolarHBondContact O-N 2.79Å; R267-H270 PolarHBondContact O-N 3.41Å; R267-L271 HydrophobicContact CG-CD1 4.11Å; R267-L271 HydrophobicContact CG-CG 4.31Å; R267-L271 WeakPolarHBondContact O-CB 3.45Å; R267-L271 WeakPolarHBondContact O-CG 3.44Å; R267-L271 PolarHBondContact O-N 3.28Å
268	V	96.6	Very high	94.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-52.5	-52.8	173.1	172.1	0	0	0	0	110.3	L220 L224 L245 V249 A264 F265 R266 L271 L272	L220-V268 HydrophobicContact CD1-CG2 4.3Å; L220-V268 HydrophobicContact CD2-CG2 4.04Å; L224-V268 HydrophobicContact CD1-CG2 4.2Å; L224-V268 HydrophobicContact CD2-CG1 3.93Å; L224-V268 HydrophobicContact CD2-CG2 4.47Å; L245-V268 HydrophobicContact CD2-CG1 4.11Å; V249-V268 HydrophobicContact CB-CG2 4.26Å; V249-V268 HydrophobicContact CG1-CG2 3.92Å; V249-V268 HydrophobicContact CG2-CG2 3.98Å; A264-V268 PolarHBondContact O-N 3.47Å; F265-V268 WeakPolarHBondContact O-CB 3.32Å; F265-V268 PolarHBondContact O-N 3.31Å; R266-V268 VanDerWaalsContact C-N 3.3Å; R266-V268 PolarHBondContact O-N 2.87Å; V268-L271 PolarHBondContact O-N 3.4Å; V268-L272 HydrophobicContact CG1-CD1 3.83Å; V268-L272 HydrophobicContact CG1-CG 4.39Å; V268-L272 WeakPolarHBondContact O-CB 3.48Å; V268-L272 VanDerWaalsContact O-CG 3.32Å; V268-L272 WeakPolarHBondContact O-CG 3.4Å; V268-L272 PolarHBondContact O-N 3.06Å
269	F	95	Very high	94.2	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-69.9	-37.8	-177.2	-64.7	-73.8	0	0	0	112.6	F227 F234 F265 R266 R267 L271 L272 A273 L314 L315 L318	F227-F269 HydrophobicContact CD1-CE1 4.36Å; F227-F269 AromaticContact CD1-CZ 3.92Å; F227-F269 HydrophobicContact CD1-CZ 3.92Å; F227-F269 HydrophobicContact CE1-CE1 4.21Å; F227-F269 AromaticContact CE1-CZ 3.54Å; F227-F269 HydrophobicContact CE1-CZ 3.54Å; F227-F269 HydrophobicContact CZ-CZ 4.38Å; F234-F269 AromaticContact CE2-CE1 3.78Å; F234-F269 HydrophobicContact CE2-CE1 3.78Å; F234-F269 HydrophobicContact CE2-CZ 4.4Å; F234-F269 HydrophobicContact CZ-CD1 4.2Å; F234-F269 AromaticContact CZ-CE1 3.71Å; F234-F269 HydrophobicContact CZ-CE1 3.71Å; F265-F269 HydrophobicContact CD1-CD2 4.45Å; F265-F269 AromaticContact CD1-CE2 3.98Å; F265-F269 HydrophobicContact CD1-CE2 3.98Å; F265-F269 HydrophobicContact CD2-CE2 4.16Å; F265-F269 HydrophobicContact CE1-CD2 4.29Å; F265-F269 AromaticContact CE1-CE2 3.53Å; F265-F269 HydrophobicContact CE1-CE2 3.53Å; F265-F269 HydrophobicContact CE1-CZ 4.41Å; F265-F269 AromaticContact CE2-CE2 3.72Å; F265-F269 HydrophobicContact CE2-CE2 3.72Å; F265-F269 HydrophobicContact CE2-CZ 4.18Å; F265-F269 HydrophobicContact CG-CE2 4.29Å; F265-F269 AromaticContact CZ-CE2 3.4Å; F265-F269 HydrophobicContact CZ-CE2 3.4Å; F265-F269 VanDerWaalsContact CZ-CE2 3.4Å; F265-F269 AromaticContact CZ-CZ 3.91Å; F265-F269 HydrophobicContact CZ-CZ 3.91Å; F265-F269 VanDerWaalsContact O-CD2 3.25Å; F265-F269 WeakPolarHBondContact O-CD2 3.39Å; R266-F269 PolarHBondContact O-N 3.16Å; R267-F269 VanDerWaalsContact C-N 3.32Å; R267-F269 PolarHBondContact O-N 2.79Å; F269-L271 PolarHBondContact O-N 3.38Å; F269-L272 PolarHBondContact O-N 3.06Å; F269-A273 WeakPolarHBondContact O-CB 3.06Å; F269-A273 PolarHBondContact O-N 2.73Å; F269-L314 HydrophobicContact CD1-CB 3.8Å; F269-L314 HydrophobicContact CD1-CD1 4.43Å; F269-L314 HydrophobicContact CE1-CB 3.71Å; F269-L314 HydrophobicContact CE1-CD1 3.66Å; F269-L314 HydrophobicContact CE1-CG 4.35Å; F269-L314 HydrophobicContact CZ-CD1 4.47Å; F269-L315 HydrophobicContact CB-CB 4Å; F269-L315 HydrophobicContact CB-CD1 3.91Å; F269-L315 HydrophobicContact CB-CG 4.47Å; F269-L318 HydrophobicContact CD2-CD2 3.81Å; F269-L318 HydrophobicContact CE2-CD2 4.49Å
270	H	93.1	Very high	93.9	Very high	20 Å²	20	13 Å²	13	9%	0.093	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-47.1	174.9	-75	97.5	0	0	0	112.1	R266 R267 S274	R266-H270 PolarHBondContact O-N 3.08Å; R266-H270 VanDerWaalsContact O-N 3.08Å; R266-H270 PolarHBondContact O-ND1 3.35Å; R267-H270 PolarHBondContact O-N 3.41Å; H270-S274 VanDerWaalsContact O-CB 3.28Å; H270-S274 WeakPolarHBondContact O-CB 3.45Å; H270-S274 PolarHBondContact O-N 2.89Å; H270-S274 PolarHBondContact O-OG 3.01Å
271	L	94.7	Very high	93.8	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-62.7	-52.4	177.7	-76	172.9	0	0	0	111.6	D29 Y248 V249 R267 V268 F269 A273 S274 G275 F276	D29-L271 HydrophobicContact CB-CD2 3.65Å; Y248-L271 HydrophobicContact CD1-CD1 4Å; Y248-L271 HydrophobicContact CE1-CD1 3.71Å; V249-L271 HydrophobicContact CG2-CD1 3.67Å; R267-L271 HydrophobicContact CG-CD1 4.11Å; R267-L271 HydrophobicContact CG-CG 4.31Å; R267-L271 WeakPolarHBondContact O-CB 3.45Å; R267-L271 WeakPolarHBondContact O-CG 3.44Å; R267-L271 PolarHBondContact O-N 3.28Å; V268-L271 PolarHBondContact O-N 3.4Å; F269-L271 PolarHBondContact O-N 3.38Å; L271-A273 VanDerWaalsContact C-N 3.31Å; L271-A273 PolarHBondContact O-N 3.3Å; L271-S274 PolarHBondContact O-N 3.38Å; L271-S274 PolarHBondContact O-OG 3.39Å; L271-G275 PolarHBondContact O-N 3.28Å; L271-F276 HydrophobicContact CB-CB 3.96Å; L271-F276 HydrophobicContact CB-CD1 4.48Å; L271-F276 HydrophobicContact CB-CD2 4.43Å; L271-F276 HydrophobicContact CB-CG 4.1Å; L271-F276 HydrophobicContact CD2-CD2 3.83Å; L271-F276 HydrophobicContact CD2-CE2 4.3Å; L271-F276 HydrophobicContact CD2-CG 4.33Å; L271-F276 WeakPolarHBondContact O-CB 3.34Å; L271-F276 PolarHBondContact O-N 2.7Å
272	L	95.9	Very high	93.6	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-40	-177.6	-66.2	-179.3	0	0	0	111.5	F234 M237 L245 V268 F269 S274 G275 L277 I307 C308 A311	F234-L272 HydrophobicContact CE1-CD1 4.14Å; F234-L272 HydrophobicContact CZ-CD1 3.87Å; M237-L272 HydrophobicContact SD-CD1 4.46Å; L245-L272 HydrophobicContact CD2-CD1 4.13Å; L245-L272 HydrophobicContact CD2-CD2 4.17Å; L245-L272 HydrophobicContact CD2-CG 4.36Å; V268-L272 HydrophobicContact CG1-CD1 3.83Å; V268-L272 HydrophobicContact CG1-CG 4.39Å; V268-L272 WeakPolarHBondContact O-CB 3.48Å; V268-L272 VanDerWaalsContact O-CG 3.32Å; V268-L272 WeakPolarHBondContact O-CG 3.4Å; V268-L272 PolarHBondContact O-N 3.06Å; F269-L272 PolarHBondContact O-N 3.06Å; L272-S274 VanDerWaalsContact C-N 3.34Å; L272-S274 PolarHBondContact O-N 3.24Å; L272-G275 PolarHBondContact O-N 3.04Å; L272-L277 HydrophobicContact CD2-CD1 3.49Å; L272-L277 VanDerWaalsContact CD2-CD1 3.49Å; L272-L277 HydrophobicContact CD2-CG 3.7Å; L272-I307 HydrophobicContact CD1-CG2 4.39Å; L272-I307 HydrophobicContact CD2-CG2 4.25Å; L272-C308 PolarHBondContact O-SG 3.34Å; L272-A311 HydrophobicContact CB-CB 3.36Å; L272-A311 HydrophobicContact CD1-CB 4.45Å
273	A	93.7	Very high	93.5	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.008	7%	0.066	C	C	.	.	H	α-helix	trans	-69.2	-29.1	177.9	0	0	0	0	0	113.5	F269 L271 G275 C308 A311 Q312 L315	F269-A273 WeakPolarHBondContact O-CB 3.06Å; F269-A273 PolarHBondContact O-N 2.73Å; L271-A273 VanDerWaalsContact C-N 3.31Å; L271-A273 PolarHBondContact O-N 3.3Å; A273-G275 PolarHBondContact O-N 2.79Å; A273-C308 PolarHBondContact O-SG 3.36Å; A273-A311 HydrophobicContact CB-CB 4.31Å; A273-Q312 HydrophobicContact CB-CB 4.35Å; A273-Q312 HydrophobicContact CB-CG 3.69Å; A273-Q312 PolarHBondContact O-NE2 3.17Å; A273-L315 HydrophobicContact CB-CB 4.46Å; A273-L315 HydrophobicContact CB-CD2 3.77Å
274	S	92.3	Very high	93.6	Very high	8 Å²	8	9.6 Å²	9.6	6%	0.056	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	3.8	176.2	72.9	0	0	0	0	113.7	L28 H270 L271 L272 I385	L28-S274 PolarHBondContact O-OG 3.02Å; H270-S274 VanDerWaalsContact O-CB 3.28Å; H270-S274 WeakPolarHBondContact O-CB 3.45Å; H270-S274 PolarHBondContact O-N 2.89Å; H270-S274 PolarHBondContact O-OG 3.01Å; L271-S274 PolarHBondContact O-N 3.38Å; L271-S274 PolarHBondContact O-OG 3.39Å; L272-S274 VanDerWaalsContact C-N 3.34Å; L272-S274 PolarHBondContact O-N 3.24Å; S274-I385 WeakPolarHBondContact O-CD1 3.48Å
275	G	92.9	Very high	93.6	Very high	7 Å²	7	13 Å²	13	7%	0.072	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	25.7	175.1	0	0	0	0	0	114.8	L271 L272 A273 L277 L278	L271-G275 PolarHBondContact O-N 3.28Å; L272-G275 PolarHBondContact O-N 3.04Å; A273-G275 PolarHBondContact O-N 2.79Å; G275-L277 PolarHBondContact O-N 2.91Å; G275-L278 WeakPolarHBondContact O-CB 3.37Å; G275-L278 PolarHBondContact O-N 3.06Å
276	F	95.1	Very high	93.6	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.013	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.5	-178.7	-174.5	-110.6	0	0	0	114.5	P27 L245 Y248 L271 S281 G283 L284	P27-F276 HydrophobicContact CB-CB 4.39Å; P27-F276 HydrophobicContact CB-CD2 4.21Å; P27-F276 HydrophobicContact CG-CB 4.25Å; P27-F276 HydrophobicContact CG-CD2 3.29Å; P27-F276 HydrophobicContact CG-CE2 3.99Å; P27-F276 HydrophobicContact CG-CG 4.19Å; L245-F276 HydrophobicContact CD1-CD1 4.28Å; L245-F276 HydrophobicContact CD1-CE1 4.01Å; Y248-F276 HydrophobicContact CD1-CZ 4.26Å; Y248-F276 HydrophobicContact CE1-CE2 4.22Å; Y248-F276 HydrophobicContact CE1-CZ 4.02Å; Y248-F276 HydrophobicContact CE2-CZ 4.39Å; L271-F276 HydrophobicContact CB-CB 3.96Å; L271-F276 HydrophobicContact CB-CD1 4.48Å; L271-F276 HydrophobicContact CB-CD2 4.43Å; L271-F276 HydrophobicContact CB-CG 4.1Å; L271-F276 HydrophobicContact CD2-CD2 3.83Å; L271-F276 HydrophobicContact CD2-CE2 4.3Å; L271-F276 HydrophobicContact CD2-CG 4.33Å; L271-F276 WeakPolarHBondContact O-CB 3.34Å; L271-F276 PolarHBondContact O-N 2.7Å; F276-S281 WeakPolarHBondContact O-CB 3.45Å; F276-S281 PolarHBondContact O-OG 2.72Å; F276-G283 VanDerWaalsContact O-CA 3.27Å; F276-G283 WeakPolarHBondContact O-CA 3.5Å; F276-L284 HydrophobicContact CE1-CD1 4.01Å; F276-L284 HydrophobicContact CE1-CD2 4.05Å; F276-L284 HydrophobicContact CE1-CG 3.6Å; F276-L284 HydrophobicContact CZ-CD2 3.96Å; F276-L284 HydrophobicContact CZ-CG 3.89Å
277	L	95.6	Very high	93.7	Very high	3 Å²	3	16 Å²	16	2%	0.016	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	16.2	179	-54.7	-177.6	0	0	0	113.7	M237 L241 L272 G275 H296 M299 Q304 I307	M237-L277 HydrophobicContact SD-CD1 4.38Å; L241-L277 HydrophobicContact CD1-CD2 4.37Å; L241-L277 HydrophobicContact CD2-CD1 4.13Å; L272-L277 HydrophobicContact CD2-CD1 3.49Å; L272-L277 VanDerWaalsContact CD2-CD1 3.49Å; L272-L277 HydrophobicContact CD2-CG 3.7Å; G275-L277 PolarHBondContact O-N 2.91Å; L277-H296 HydrophobicContact CB-CB 3.89Å; L277-H296 HydrophobicContact CD2-CB 4.03Å; L277-H296 HydrophobicContact CG-CB 4.45Å; L277-H296 PolarHBondContact O-CD2 2.92Å; L277-H296 VanDerWaalsContact O-CD2 3.3Å; L277-M299 HydrophobicContact CD1-CE 4.26Å; L277-Q304 WeakPolarHBondContact O-CB 3.45Å; L277-Q304 VanDerWaalsContact O-CG 3.29Å; L277-Q304 WeakPolarHBondContact O-CG 3.45Å; L277-Q304 PolarHBondContact O-OE1 2.83Å; L277-Q304 VanDerWaalsContact O-OE1 3.1Å; L277-I307 HydrophobicContact CD1-CD1 4.4Å; L277-I307 HydrophobicContact CD1-CG2 4.26Å
278	L	93.6	Very high	93.8	Very high	7 Å²	7	16.8 Å²	16.8	4%	0.037	10%	0.104	C	C	.	.	S	Bend	trans	-90.2	166.7	-179	-67	-179.3	0	0	0	112.5	G275 S280 S281 Q304 C308 L383	G275-L278 WeakPolarHBondContact O-CB 3.37Å; G275-L278 PolarHBondContact O-N 3.06Å; L278-S280 PolarHBondContact O-N 3.18Å; L278-S281 WeakPolarHBondContact O-CB 3.38Å; L278-S281 PolarHBondContact O-N 2.8Å; L278-S281 VanDerWaalsContact O-N 3.11Å; L278-Q304 HydrophobicContact CD2-CB 4.1Å; L278-Q304 WeakPolarHBondContact CD2-O 3.19Å; L278-C308 HydrophobicContact CD1-CB 4.07Å; L278-C308 HydrophobicContact CD2-CB 3.92Å; L278-C308 HydrophobicContact CG-CB 4.17Å; L278-L383 HydrophobicContact CB-CD1 4.34Å; L278-L383 HydrophobicContact CD1-CB 4.44Å; L278-L383 HydrophobicContact CD1-CD1 3.29Å; L278-L383 HydrophobicContact CD1-CD2 3.38Å; L278-L383 HydrophobicContact CD1-CG 3.8Å; L278-L383 HydrophobicContact CD2-CD2 4.47Å; L278-L383 HydrophobicContact CG-CD1 4.37Å
279	P	90.3	Very high	93.6	Very high	59 Å²	59	20.5 Å²	20.5	38%	0.383	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	142.9	179.6	-27.8	38.4	0	0	0	112.1	S281 L301 Q304	P279-S281 PolarHBondContact O-N 2.96Å; P279-L301 HydrophobicContact CB-CD2 4.42Å; P279-L301 HydrophobicContact CG-CD2 3.47Å; P279-L301 VanDerWaalsContact CG-CD2 3.47Å; P279-Q304 VanDerWaalsContact CD-OE1 3.3Å
280	S	87.5	Confident	93.2	Very high	26 Å²	26	29.4 Å²	29.4	18%	0.182	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	-14	-175.4	-42.7	0	0	0	0	116.3	Q25 L278 H380	Q25-S280 PolarHBondContact N-O 2.86Å; L278-S280 PolarHBondContact O-N 3.18Å; S280-H380 PolarHBondContact OG-CE1 3.15Å
281	S	92.6	Very high	92.9	Very high	5 Å²	5	31.1 Å²	31.1	4%	0.035	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-62.7	143.5	172.3	-179.3	0	0	0	0	111.5	Q25 F276 L278 P279 G283 R294 H296	Q25-S281 CarbonylContact O-C 3.47Å; Q25-S281 WeakPolarHBondContact O-CA 3.48Å; F276-S281 WeakPolarHBondContact O-CB 3.45Å; F276-S281 PolarHBondContact O-OG 2.72Å; L278-S281 WeakPolarHBondContact O-CB 3.38Å; L278-S281 PolarHBondContact O-N 2.8Å; L278-S281 VanDerWaalsContact O-N 3.11Å; P279-S281 PolarHBondContact O-N 2.96Å; S281-G283 VanDerWaalsContact C-N 3.26Å; S281-G283 PolarHBondContact OG-N 3.34Å; S281-R294 WeakPolarHBondContact O-CD 3.44Å; S281-R294 PolarHBondContact O-NH1 3.46Å; S281-H296 PolarHBondContact O-CE1 2.86Å
282	T	91	Very high	92.6	Very high	27 Å²	27	37.9 Å²	37.9	17%	0.166	22%	0.222	C	C	.	.			trans	-63.4	-35.5	166.7	50.6	0	0	0	0	111.5	P24 Q25 F26 R294	P24-T282 HydrophobicContact CB-CG2 3.56Å; Q25-T282 PolarHBondContact O-N 2.89Å; F26-T282 HydrophobicContact CD1-CG2 3.99Å; F26-T282 HydrophobicContact CE1-CG2 3.81Å; F26-T282 HydrophobicContact CE2-CG2 4.45Å; F26-T282 HydrophobicContact CG-CG2 4.4Å; F26-T282 HydrophobicContact CZ-CG2 4.06Å; T282-R294 VanDerWaalsContact O-CD 3.3Å; T282-R294 WeakPolarHBondContact O-CD 3.32Å; T282-R294 WeakPolarHBondContact O-CG 3.45Å
283	G	92.1	Very high	92.4	Very high	10 Å²	10	40.3 Å²	40.3	10%	0.103	24%	0.237	C	C	.	.			trans	50.1	-143.3	178.3	0	0	0	0	0	113.6	F276 S281	F276-G283 VanDerWaalsContact O-CA 3.27Å; F276-G283 WeakPolarHBondContact O-CA 3.5Å; S281-G283 VanDerWaalsContact C-N 3.26Å; S281-G283 PolarHBondContact OG-N 3.34Å
284	L	94.4	Very high	92.3	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.052	25%	0.246	C	C	.	.			trans	-99.3	122.8	175.3	-68.1	163.2	0	0	0	110.6	L241 L244 L245 Y248 F276 R294 L295	L241-L284 HydrophobicContact CD1-CD1 3.63Å; L244-L284 HydrophobicContact CB-CD1 4.3Å; L245-L284 HydrophobicContact CB-CD1 3.85Å; L245-L284 HydrophobicContact CD1-CD1 4.18Å; Y248-L284 HydrophobicContact CD2-CD2 3.75Å; Y248-L284 HydrophobicContact CG-CD2 3.75Å; F276-L284 HydrophobicContact CE1-CD1 4.01Å; F276-L284 HydrophobicContact CE1-CD2 4.05Å; F276-L284 HydrophobicContact CE1-CG 3.6Å; F276-L284 HydrophobicContact CZ-CD2 3.96Å; F276-L284 HydrophobicContact CZ-CG 3.89Å; L284-R294 CarbonylContact O-C 3.35Å; L284-R294 WeakPolarHBondContact O-CA 3.26Å; L284-L295 HydrophobicContact CB-CD1 4.2Å; L284-L295 PolarHBondContact O-N 2.82Å
285	I	94.5	Very high	92.4	Very high	72 Å²	72	42.5 Å²	42.5	37%	0.369	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-82.2	132.4	168.2	-54.9	-58.6	0	0	0	108.4	P287 N292 V293 R294	I285-P287 VanDerWaalsContact O-CD 3.27Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å; I285-N292 HydrophobicContact CD1-CB 4.19Å; I285-N292 HydrophobicContact CG2-CB 4.43Å; I285-V293 CarbonylContact C-O 3.58Å; I285-V293 WeakPolarHBondContact CA-O 3.2Å; I285-R294 HydrophobicContact CD1-CG 3.57Å
286	D	95.7	Very high	92.4	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.053	24%	0.241	C	C	.	.			trans	-72	113.6	174.9	-165.3	-26.2	0	0	0	110.1	W240 C288 E289 V293 L295	W240-D286 VanDerWaalsContact NE1-CG 3.34Å; W240-D286 PolarHBondContact NE1-OD1 3.29Å; W240-D286 VanDerWaalsContact NE1-OD1 3.15Å; W240-D286 PolarHBondContact NE1-OD2 3.47Å; W240-D286 VanDerWaalsContact NE1-OD2 3.1Å; D286-C288 PolarHBondContact O-N 2.81Å; D286-C288 WeakPolarHBondContact OD1-CB 3.32Å; D286-C288 PolarHBondContact OD1-N 2.76Å; D286-E289 HydrophobicContact CB-CB 4.24Å; D286-E289 HydrophobicContact CB-CG 4.28Å; D286-V293 PolarHBondContact N-O 2.91Å; D286-L295 HydrophobicContact CB-CD2 4.01Å; D286-L295 HydrophobicContact CB-CG 4.1Å; D286-L295 WeakPolarHBondContact OD2-CD2 3.48Å
287	P	96.8	Very high	92.3	Very high	64 Å²	64	45.1 Å²	45.1	42%	0.416	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.3	179.6	32.7	-35	0	0	0	112.9	W207 W240 L244 I285	W207-P287 HydrophobicContact CD2-CG 3.9Å; W207-P287 VanDerWaalsContact CE2-CG 3.5Å; W207-P287 HydrophobicContact CG-CB 4.48Å; W207-P287 HydrophobicContact CG-CG 3.95Å; W207-P287 HydrophobicContact CZ2-CG 4.08Å; W207-P287 VanDerWaalsContact NE1-CG 3.29Å; W240-P287 HydrophobicContact CZ2-CG 4.22Å; L244-P287 HydrophobicContact CD2-CG 3.82Å; I285-P287 VanDerWaalsContact O-CD 3.27Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å
288	C	96	Very high	91.9	Very high	18 Å²	18	51.1 Å²	51.1	12%	0.122	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-4.5	-177.5	-68	0	0	0	0	113.8	R203 W207 W240 D286	R203-C288 HydrophobicContact CB-CB 3.88Å; R203-C288 WeakPolarHBondContact CD-O 3.37Å; R203-C288 PolarHBondContact NE-O 2.97Å; W207-C288 VanDerWaalsContact CB-SG 3.57Å; W240-C288 HydrophobicContact CZ2-CB 4.4Å; D286-C288 PolarHBondContact O-N 2.81Å; D286-C288 WeakPolarHBondContact OD1-CB 3.32Å; D286-C288 PolarHBondContact OD1-N 2.76Å
289	E	92.8	Very high	92	Very high	79 Å²	79	51.7 Å²	51.7	37%	0.369	30%	0.295	S	S	.	.	S	Bend	trans	-112.9	153	-179.9	-67.9	-59.5	151.3	0	0	111.7	R203 D286 V293	R203-E289 IonicContact CZ-OE1 3.35Å; R203-E289 IonicContact NE-OE1 2.91Å; R203-E289 IonicContact NH2-OE1 3.5Å; R203-E289 PolarHBondContact NH2-OE1 2.92Å; R203-E289 IonicContact NH2-OE2 3.96Å; D286-E289 HydrophobicContact CB-CB 4.24Å; D286-E289 HydrophobicContact CB-CG 4.28Å; E289-V293 HydrophobicContact CB-CB 4.42Å; E289-V293 HydrophobicContact CB-CG2 4.19Å
290	Q	87.4	Confident	92.2	Very high	187 Å²	187	51.5 Å²	51.5	87%	0.874	30%	0.296	S	S	*	.	S	Bend	trans	-79.9	137.8	173.5	-67.1	-173.8	2.9	0	0	110.6
291	G	85.9	Confident	92.5	Very high	55 Å²	55	55.1 Å²	55.1	57%	0.567	31%	0.312	S	S	*	.	S	Bend	trans	84.5	160.3	-172.9	0	0	0	0	0	111.8	V293	G291-V293 PolarHBondContact O-N 2.77Å
292	N	87.9	Confident	92.6	Very high	143 Å²	143	57 Å²	57	77%	0.765	33%	0.328	S	S	*	.			trans	-76.7	63.1	-179.3	-68.4	-29.5	0	0	0	110.9	I285 R294	I285-N292 HydrophobicContact CD1-CB 4.19Å; I285-N292 HydrophobicContact CG2-CB 4.43Å; N292-R294 PolarHBondContact O-N 2.92Å
293	V	91.5	Very high	92.8	Very high	52 Å²	52	58.5 Å²	58.5	32%	0.315	33%	0.333	S	S	.	.			trans	-72.2	116.1	-178.2	-179	0	0	0	0	109.1	I285 D286 E289 G291	I285-V293 CarbonylContact C-O 3.58Å; I285-V293 WeakPolarHBondContact CA-O 3.2Å; D286-V293 PolarHBondContact N-O 2.91Å; E289-V293 HydrophobicContact CB-CB 4.42Å; E289-V293 HydrophobicContact CB-CG2 4.19Å; G291-V293 PolarHBondContact O-N 2.77Å
294	R	92.9	Very high	92.9	Very high	51 Å²	51	58.4 Å²	58.4	19%	0.192	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-82.7	122.1	175.6	-69.8	-179.9	-67.4	149.2	2.8	109.6	F22 S281 T282 L284 I285 N292 H296 S297	F22-R294 VanDerWaalsContact CE2-NH2 3.32Å; S281-R294 WeakPolarHBondContact O-CD 3.44Å; S281-R294 PolarHBondContact O-NH1 3.46Å; T282-R294 VanDerWaalsContact O-CD 3.3Å; T282-R294 WeakPolarHBondContact O-CD 3.32Å; T282-R294 WeakPolarHBondContact O-CG 3.45Å; L284-R294 CarbonylContact O-C 3.35Å; L284-R294 WeakPolarHBondContact O-CA 3.26Å; I285-R294 HydrophobicContact CD1-CG 3.57Å; N292-R294 PolarHBondContact O-N 2.92Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.48Å; R294-S297 PolarHBondContact O-N 2.97Å; R294-S297 PolarHBondContact O-OG 3.01Å
295	L	93.5	Very high	92.9	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-61.8	-35.2	-174.8	-76.4	167.1	0	0	0	114	L241 L244 L284 D286 S297 L298	L241-L295 HydrophobicContact CD1-CB 3.96Å; L241-L295 HydrophobicContact CD1-CD1 4.23Å; L244-L295 HydrophobicContact CB-CD1 4.44Å; L244-L295 HydrophobicContact CD1-CD1 3.22Å; L244-L295 HydrophobicContact CG-CD1 4.45Å; L284-L295 HydrophobicContact CB-CD1 4.2Å; L284-L295 PolarHBondContact O-N 2.82Å; D286-L295 HydrophobicContact CB-CD2 4.01Å; D286-L295 HydrophobicContact CB-CG 4.1Å; D286-L295 WeakPolarHBondContact OD2-CD2 3.48Å; L295-S297 PolarHBondContact O-N 2.9Å; L295-L298 PolarHBondContact O-N 3.03Å
296	H	93.5	Very high	92.9	Very high	2 Å²	2	56 Å²	56	1%	0.009	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-71.7	-16.5	179.4	67.2	-89.1	0	0	0	113.5	L277 S281 R294 L298 M299 Q304	L277-H296 HydrophobicContact CB-CB 3.89Å; L277-H296 HydrophobicContact CD2-CB 4.03Å; L277-H296 HydrophobicContact CG-CB 4.45Å; L277-H296 PolarHBondContact O-CD2 2.92Å; L277-H296 VanDerWaalsContact O-CD2 3.3Å; S281-H296 PolarHBondContact O-CE1 2.86Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.48Å; H296-L298 PolarHBondContact O-N 3.2Å; H296-L298 VanDerWaalsContact O-N 3.17Å; H296-M299 HydrophobicContact CB-CE 3.53Å; H296-M299 WeakPolarHBondContact O-CB 3.43Å; H296-M299 PolarHBondContact O-N 2.82Å; H296-Q304 PolarHBondContact O-NE2 2.8Å
297	S	92	Very high	92.8	Very high	64 Å²	64	55.7 Å²	55.7	45%	0.448	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-70.5	-8.8	177	70.1	0	0	0	0	113.3	R294 L295 M299	R294-S297 PolarHBondContact O-N 2.97Å; R294-S297 PolarHBondContact O-OG 3.01Å; L295-S297 PolarHBondContact O-N 2.9Å; S297-M299 VanDerWaalsContact C-N 3.31Å
298	L	88.8	Confident	92.8	Very high	129 Å²	129	52.7 Å²	52.7	68%	0.675	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-80.9	-13.5	171.3	-58.8	176.6	0	0	0	112.7	L295 H296	L295-L298 PolarHBondContact O-N 3.03Å; H296-L298 PolarHBondContact O-N 3.2Å; H296-L298 VanDerWaalsContact O-N 3.17Å
299	M	94	Very high	92.6	Very high	18 Å²	18	52.2 Å²	52.2	9%	0.089	29%	0.293	C	S	.	.	S	Bend	trans	-94.5	147.2	176.7	-60	-175.4	-71.6	0	0	110.2	L241 L277 H296 S297 E303 Q304 I307	L241-M299 HydrophobicContact CD2-CE 3.93Å; L241-M299 HydrophobicContact CD2-SD 4.41Å; L277-M299 HydrophobicContact CD1-CE 4.26Å; H296-M299 HydrophobicContact CB-CE 3.53Å; H296-M299 WeakPolarHBondContact O-CB 3.43Å; H296-M299 PolarHBondContact O-N 2.82Å; S297-M299 VanDerWaalsContact C-N 3.31Å; M299-E303 HydrophobicContact CB-CB 4.18Å; M299-Q304 HydrophobicContact CB-CG 4.04Å; M299-Q304 HydrophobicContact CE-CG 4.29Å; M299-Q304 PolarHBondContact O-NE2 2.78Å; M299-I307 HydrophobicContact CE-CD1 3.63Å; M299-I307 HydrophobicContact SD-CD1 3.5Å; M299-I307 VanDerWaalsContact SD-CD1 3.5Å
300	S	95	Very high	92.7	Very high	56 Å²	56	48.5 Å²	48.5	39%	0.392	28%	0.276	S	S	.	.			trans	-65.2	159.7	171.1	70.3	0	0	0	0	111.7	A302 E303 Q304	S300-A302 PolarHBondContact O-N 3.03Å; S300-E303 WeakPolarHBondContact CB-OE2 3.48Å; S300-E303 PolarHBondContact N-OE2 3.31Å; S300-E303 PolarHBondContact O-N 2.82Å; S300-E303 WeakPolarHBondContact OG-CG 3.35Å; S300-E303 PolarHBondContact OG-N 2.98Å; S300-E303 PolarHBondContact OG-OE2 3.29Å; S300-Q304 WeakPolarHBondContact O-CG 3.35Å; S300-Q304 PolarHBondContact O-N 3.18Å
301	L	94.6	Very high	93	Very high	101 Å²	101	39.6 Å²	39.6	53%	0.529	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-34.5	178.4	-58.8	-176.2	0	0	0	112.4	P279 D305	P279-L301 HydrophobicContact CB-CD2 4.42Å; P279-L301 HydrophobicContact CG-CD2 3.47Å; P279-L301 VanDerWaalsContact CG-CD2 3.47Å; L301-D305 WeakPolarHBondContact O-CB 3.37Å; L301-D305 PolarHBondContact O-N 2.82Å
302	A	94.2	Very high	93.3	Very high	44 Å²	44	37.8 Å²	37.8	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-68.3	-40.1	177.5	0	0	0	0	0	112.3	S300 D305 E306 A361	S300-A302 PolarHBondContact O-N 3.03Å; A302-D305 PolarHBondContact O-N 3.4Å; A302-E306 WeakPolarHBondContact O-CB 3.49Å; A302-E306 PolarHBondContact O-N 2.96Å; A302-A361 VanDerWaalsContact CA-CB 3.47Å; A302-A361 HydrophobicContact CB-CB 3.91Å
303	E	94.7	Very high	93.5	Very high	59 Å²	59	31 Å²	31	28%	0.276	18%	0.175	S	C	.	.	H	α-helix	trans	-67.6	-40.9	176.6	-67.3	166.1	143.3	0	0	111.5	Y236 M299 S300 E306 I307	Y236-E303 HydrophobicContact CD1-CB 4.09Å; Y236-E303 HydrophobicContact CD1-CG 3.47Å; Y236-E303 VanDerWaalsContact CD1-CG 3.47Å; Y236-E303 WeakPolarHBondContact CD1-OE1 3.47Å; Y236-E303 HydrophobicContact CD2-CB 4.06Å; Y236-E303 HydrophobicContact CD2-CG 4.15Å; Y236-E303 HydrophobicContact CE1-CG 3.7Å; Y236-E303 HydrophobicContact CE2-CG 4.36Å; Y236-E303 HydrophobicContact CG-CB 3.79Å; Y236-E303 HydrophobicContact CG-CG 3.71Å; M299-E303 HydrophobicContact CB-CB 4.18Å; S300-E303 WeakPolarHBondContact CB-OE2 3.48Å; S300-E303 PolarHBondContact N-OE2 3.31Å; S300-E303 PolarHBondContact O-N 2.82Å; S300-E303 WeakPolarHBondContact OG-CG 3.35Å; S300-E303 PolarHBondContact OG-N 2.98Å; S300-E303 PolarHBondContact OG-OE2 3.29Å; E303-E306 PolarHBondContact O-N 2.85Å; E303-I307 WeakPolarHBondContact O-CG1 3.07Å; E303-I307 PolarHBondContact O-N 3.05Å
304	Q	95.6	Very high	93.5	Very high	9 Å²	9	28.6 Å²	28.6	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-45	175.3	-68.6	175.5	31.9	0	0	111.7	L277 L278 P279 H296 M299 S300 I307 C308	L277-Q304 WeakPolarHBondContact O-CB 3.45Å; L277-Q304 VanDerWaalsContact O-CG 3.29Å; L277-Q304 WeakPolarHBondContact O-CG 3.45Å; L277-Q304 PolarHBondContact O-OE1 2.83Å; L277-Q304 VanDerWaalsContact O-OE1 3.1Å; L278-Q304 HydrophobicContact CD2-CB 4.1Å; L278-Q304 WeakPolarHBondContact CD2-O 3.19Å; P279-Q304 VanDerWaalsContact CD-OE1 3.3Å; H296-Q304 PolarHBondContact O-NE2 2.8Å; M299-Q304 HydrophobicContact CB-CG 4.04Å; M299-Q304 HydrophobicContact CE-CG 4.29Å; M299-Q304 PolarHBondContact O-NE2 2.78Å; S300-Q304 WeakPolarHBondContact O-CG 3.35Å; S300-Q304 PolarHBondContact O-N 3.18Å; Q304-I307 PolarHBondContact O-N 3.34Å; Q304-C308 PolarHBondContact O-N 2.82Å
305	D	94.5	Very high	93.5	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-45.6	176.7	-169.1	40.5	0	0	0	111.2	L301 A302 I307 C308 C309 P359 V360 A361	L301-D305 WeakPolarHBondContact O-CB 3.37Å; L301-D305 PolarHBondContact O-N 2.82Å; A302-D305 PolarHBondContact O-N 3.4Å; D305-I307 VanDerWaalsContact C-N 3.34Å; D305-I307 PolarHBondContact O-N 2.79Å; D305-C308 PolarHBondContact O-N 3.14Å; D305-C308 VanDerWaalsContact O-N 3.07Å; D305-C309 PolarHBondContact O-N 3.08Å; D305-C309 PolarHBondContact O-SG 3.49Å; D305-C309 VanDerWaalsContact O-SG 3.39Å; D305-P359 VanDerWaalsContact OD2-C 3.32Å; D305-P359 VanDerWaalsContact OD2-CA 3.29Å; D305-P359 WeakPolarHBondContact OD2-CA 3.48Å; D305-V360 PolarHBondContact OD2-N 3.37Å; D305-A361 HydrophobicContact CB-CB 4.13Å; D305-A361 PolarHBondContact OD2-N 2.89Å; D305-A361 VanDerWaalsContact OD2-N 3.11Å
306	E	93.1	Very high	93.3	Very high	25 Å²	25	28.5 Å²	28.5	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-61.7	-39.9	178.9	-165	170.6	174.4	0	0	112.2	R232 Y236 A302 E303 C308 T310 R337	R232-E306 WeakPolarHBondContact CD-OE1 3.41Å; R232-E306 WeakPolarHBondContact CG-OE1 3.23Å; R232-E306 IonicContact CZ-OE1 2.67Å; R232-E306 IonicContact NE-OE1 2.68Å; R232-E306 PolarHBondContact NE-OE1 3.2Å; R232-E306 IonicContact NE-OE2 3.12Å; R232-E306 IonicContact NH2-OE2 3.61Å; Y236-E306 HydrophobicContact CE2-CB 4.22Å; Y236-E306 HydrophobicContact CE2-CG 4.24Å; Y236-E306 WeakPolarHBondContact CE2-OE2 3.43Å; Y236-E306 PolarHBondContact OH-OE2 3.36Å; A302-E306 WeakPolarHBondContact O-CB 3.49Å; A302-E306 PolarHBondContact O-N 2.96Å; E303-E306 PolarHBondContact O-N 2.85Å; E306-C308 PolarHBondContact O-N 2.93Å; E306-T310 WeakPolarHBondContact O-CB 3.45Å; E306-T310 PolarHBondContact O-N 3.47Å; E306-T310 PolarHBondContact O-OG1 2.78Å; E306-R337 IonicContact OE1-CZ 3.44Å; E306-R337 IonicContact OE1-NH2 2.8Å; E306-R337 PolarHBondContact OE1-NH2 3.49Å
307	I	95.2	Very high	93.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-47.6	172.6	-67.4	160.3	0	0	0	110.7	G233 F234 M237 L272 L277 M299 E303 Q304 D305 T310 A311	G233-I307 WeakPolarHBondContact O-CG1 3.36Å; F234-I307 HydrophobicContact CD1-CG2 4.34Å; F234-I307 HydrophobicContact CE1-CG2 4.25Å; M237-I307 HydrophobicContact CG-CD1 3.92Å; M237-I307 HydrophobicContact CG-CG1 4.39Å; L272-I307 HydrophobicContact CD1-CG2 4.39Å; L272-I307 HydrophobicContact CD2-CG2 4.25Å; L277-I307 HydrophobicContact CD1-CD1 4.4Å; L277-I307 HydrophobicContact CD1-CG2 4.26Å; M299-I307 HydrophobicContact CE-CD1 3.63Å; M299-I307 HydrophobicContact SD-CD1 3.5Å; M299-I307 VanDerWaalsContact SD-CD1 3.5Å; E303-I307 WeakPolarHBondContact O-CG1 3.07Å; E303-I307 PolarHBondContact O-N 3.05Å; Q304-I307 PolarHBondContact O-N 3.34Å; D305-I307 VanDerWaalsContact C-N 3.34Å; D305-I307 PolarHBondContact O-N 2.79Å; I307-T310 PolarHBondContact O-N 3.13Å; I307-A311 WeakPolarHBondContact O-CB 3.38Å; I307-A311 PolarHBondContact O-N 3.41Å
308	C	95	Very high	93	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-49.5	-176.7	-171.4	0	0	0	0	111.7	L272 A273 L278 Q304 D305 E306 T310 A311 Q312	L272-C308 PolarHBondContact O-SG 3.34Å; A273-C308 PolarHBondContact O-SG 3.36Å; L278-C308 HydrophobicContact CD1-CB 4.07Å; L278-C308 HydrophobicContact CD2-CB 3.92Å; L278-C308 HydrophobicContact CG-CB 4.17Å; Q304-C308 PolarHBondContact O-N 2.82Å; D305-C308 PolarHBondContact O-N 3.14Å; D305-C308 VanDerWaalsContact O-N 3.07Å; E306-C308 PolarHBondContact O-N 2.93Å; C308-T310 VanDerWaalsContact C-N 3.29Å; C308-T310 PolarHBondContact O-N 3.17Å; C308-A311 PolarHBondContact O-N 3.5Å; C308-A311 VanDerWaalsContact O-N 3.13Å; C308-Q312 WeakPolarHBondContact O-CG 3.47Å; C308-Q312 PolarHBondContact O-N 2.88Å
309	C	92.9	Very high	92.9	Very high	8 Å²	8	22.3 Å²	22.3	5%	0.054	12%	0.123	C	C	.	.	H	α-helix	trans	-58.6	-42.5	177.3	-65.3	0	0	0	0	111.7	D305 Q312 V313 W356 P357	D305-C309 PolarHBondContact O-N 3.08Å; D305-C309 PolarHBondContact O-SG 3.49Å; D305-C309 VanDerWaalsContact O-SG 3.39Å; C309-Q312 PolarHBondContact O-N 3Å; C309-V313 PolarHBondContact O-N 2.9Å; C309-V313 VanDerWaalsContact O-N 3.15Å; C309-W356 HydrophobicContact CB-CE3 4.34Å; C309-W356 HydrophobicContact CB-CZ3 4.17Å; C309-P357 HydrophobicContact CB-CB 4.31Å; C309-P357 HydrophobicContact CB-CG 4.13Å
310	T	93.5	Very high	92.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.3	-49.1	174.8	-52.9	0	0	0	0	110.9	F231 G233 F234 E306 I307 C308 Q312 V313 L314 W356	F231-T310 HydrophobicContact CB-CG2 4.12Å; G233-T310 WeakPolarHBondContact CA-OG1 3.38Å; F234-T310 HydrophobicContact CD1-CG2 4.01Å; F234-T310 HydrophobicContact CE1-CG2 3.93Å; E306-T310 WeakPolarHBondContact O-CB 3.45Å; E306-T310 PolarHBondContact O-N 3.47Å; E306-T310 PolarHBondContact O-OG1 2.78Å; I307-T310 PolarHBondContact O-N 3.13Å; C308-T310 VanDerWaalsContact C-N 3.29Å; C308-T310 PolarHBondContact O-N 3.17Å; T310-Q312 VanDerWaalsContact C-N 3.31Å; T310-Q312 PolarHBondContact O-N 3.38Å; T310-V313 PolarHBondContact O-N 3.19Å; T310-L314 HydrophobicContact CG2-CD1 3.92Å; T310-L314 HydrophobicContact CG2-CG 4.35Å; T310-L314 WeakPolarHBondContact O-CG 3.1Å; T310-L314 PolarHBondContact O-N 2.94Å; T310-W356 VanDerWaalsContact CA-CH2 3.45Å; T310-W356 HydrophobicContact CG2-CH2 3.81Å; T310-W356 HydrophobicContact CG2-CZ2 4.35Å; T310-W356 WeakPolarHBondContact OG1-CH2 3.31Å
311	A	94.9	Very high	91.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.6	-37.3	179.8	0	0	0	0	0	112.6	F234 L272 A273 I307 C308 L314 L315	F234-A311 HydrophobicContact CE1-CB 4.22Å; F234-A311 HydrophobicContact CZ-CB 4.3Å; L272-A311 HydrophobicContact CB-CB 3.36Å; L272-A311 HydrophobicContact CD1-CB 4.45Å; A273-A311 HydrophobicContact CB-CB 4.31Å; I307-A311 WeakPolarHBondContact O-CB 3.38Å; I307-A311 PolarHBondContact O-N 3.41Å; C308-A311 PolarHBondContact O-N 3.5Å; C308-A311 VanDerWaalsContact O-N 3.13Å; A311-L314 PolarHBondContact O-N 3.36Å; A311-L315 WeakPolarHBondContact O-CB 3.34Å; A311-L315 PolarHBondContact O-N 3.42Å
312	Q	92.8	Very high	91.5	Very high	18 Å²	18	18.6 Å²	18.6	8%	0.084	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-43.7	176.1	-72.1	171.9	-5.5	0	0	112.1	A273 C308 C309 T310 R316	A273-Q312 HydrophobicContact CB-CB 4.35Å; A273-Q312 HydrophobicContact CB-CG 3.69Å; A273-Q312 PolarHBondContact O-NE2 3.17Å; C308-Q312 WeakPolarHBondContact O-CG 3.47Å; C308-Q312 PolarHBondContact O-N 2.88Å; C309-Q312 PolarHBondContact O-N 3Å; T310-Q312 VanDerWaalsContact C-N 3.31Å; T310-Q312 PolarHBondContact O-N 3.38Å; Q312-R316 WeakPolarHBondContact O-CG 3.38Å; Q312-R316 PolarHBondContact O-N 3.09Å
313	V	90.9	Very high	91.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.4	-49.7	176.3	170	0	0	0	0	110.7	C309 T310 L315 R316 I317 L341 L354 W356	C309-V313 PolarHBondContact O-N 2.9Å; C309-V313 VanDerWaalsContact O-N 3.15Å; T310-V313 PolarHBondContact O-N 3.19Å; V313-L315 VanDerWaalsContact C-N 3.31Å; V313-L315 PolarHBondContact O-N 3.36Å; V313-R316 PolarHBondContact O-N 2.96Å; V313-I317 HydrophobicContact CG1-CD1 4.15Å; V313-I317 WeakPolarHBondContact O-CG1 3.36Å; V313-I317 PolarHBondContact O-N 2.9Å; V313-I317 VanDerWaalsContact O-N 3.15Å; V313-L341 HydrophobicContact CG1-CD2 4.04Å; V313-L354 HydrophobicContact CG1-CD2 3.74Å; V313-W356 HydrophobicContact CG2-CD2 3.92Å; V313-W356 HydrophobicContact CG2-CE3 4.32Å; V313-W356 HydrophobicContact CG2-CG 4.13Å
314	L	92.4	Very high	90.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-35.1	-179.2	-63.3	179.4	0	0	0	112.4	F227 F231 F234 F269 T310 A311 I317 L318 L326 L340	F227-L314 HydrophobicContact CD1-CD1 4.25Å; F227-L314 HydrophobicContact CE1-CD1 4.27Å; F231-L314 HydrophobicContact CD1-CD1 4.25Å; F231-L314 HydrophobicContact CD1-CD2 4.14Å; F231-L314 HydrophobicContact CD2-CD1 4.12Å; F231-L314 HydrophobicContact CE1-CD1 4.36Å; F231-L314 HydrophobicContact CE1-CD2 3.61Å; F231-L314 HydrophobicContact CE2-CD1 4.21Å; F231-L314 HydrophobicContact CE2-CD2 4.45Å; F231-L314 HydrophobicContact CG-CD1 4.14Å; F231-L314 HydrophobicContact CZ-CD1 4.33Å; F231-L314 HydrophobicContact CZ-CD2 3.78Å; F234-L314 HydrophobicContact CE2-CD1 4.24Å; F234-L314 HydrophobicContact CZ-CD1 4.07Å; F269-L314 HydrophobicContact CD1-CB 3.8Å; F269-L314 HydrophobicContact CD1-CD1 4.43Å; F269-L314 HydrophobicContact CE1-CB 3.71Å; F269-L314 HydrophobicContact CE1-CD1 3.66Å; F269-L314 HydrophobicContact CE1-CG 4.35Å; F269-L314 HydrophobicContact CZ-CD1 4.47Å; T310-L314 HydrophobicContact CG2-CD1 3.92Å; T310-L314 HydrophobicContact CG2-CG 4.35Å; T310-L314 WeakPolarHBondContact O-CG 3.1Å; T310-L314 PolarHBondContact O-N 2.94Å; A311-L314 PolarHBondContact O-N 3.36Å; L314-I317 HydrophobicContact CD2-CD1 4.34Å; L314-I317 PolarHBondContact O-N 3.41Å; L314-L318 VanDerWaalsContact O-CB 3.31Å; L314-L318 WeakPolarHBondContact O-CB 3.42Å; L314-L318 PolarHBondContact O-N 3.4Å; L314-L326 HydrophobicContact CB-CD2 4.33Å; L314-L326 HydrophobicContact CD2-CD2 3.77Å; L314-L340 HydrophobicContact CD2-CD2 4.24Å
315	L	91.6	Very high	90.2	Very high	10 Å²	10	19.5 Å²	19.5	5%	0.052	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-42.6	174.6	-179.2	57.7	0	0	0	111.8	F269 A273 A311 V313 L318 N319	F269-L315 HydrophobicContact CB-CB 4Å; F269-L315 HydrophobicContact CB-CD1 3.91Å; F269-L315 HydrophobicContact CB-CG 4.47Å; A273-L315 HydrophobicContact CB-CB 4.46Å; A273-L315 HydrophobicContact CB-CD2 3.77Å; A311-L315 WeakPolarHBondContact O-CB 3.34Å; A311-L315 PolarHBondContact O-N 3.42Å; V313-L315 VanDerWaalsContact C-N 3.31Å; V313-L315 PolarHBondContact O-N 3.36Å; L315-L318 WeakPolarHBondContact O-CB 3.35Å; L315-L318 PolarHBondContact O-N 3.38Å; L315-N319 WeakPolarHBondContact O-CB 3.37Å; L315-N319 VanDerWaalsContact O-CG 3.31Å; L315-N319 PolarHBondContact O-N 3.46Å
316	R	89.2	Confident	89.9	Confident	43 Å²	43	19.1 Å²	19.1	16%	0.162	11%	0.11	C	C	.	.	H	α-helix	trans	-62.8	-48.7	176.6	-68.7	179.1	-129.4	126.7	-1.9	110.7	Q312 V313 L318 N319 Y320 L354 E355	Q312-R316 WeakPolarHBondContact O-CG 3.38Å; Q312-R316 PolarHBondContact O-N 3.09Å; V313-R316 PolarHBondContact O-N 2.96Å; R316-L318 PolarHBondContact O-N 2.84Å; R316-N319 PolarHBondContact O-N 3.32Å; R316-N319 VanDerWaalsContact O-N 3.08Å; R316-Y320 HydrophobicContact CB-CE2 4.22Å; R316-Y320 WeakPolarHBondContact O-CD2 3.14Å; R316-Y320 PolarHBondContact O-N 3.17Å; R316-Y320 VanDerWaalsContact O-N 3.08Å; R316-L354 HydrophobicContact CB-CD1 3.83Å; R316-E355 PolarHBondContact NH1-O 3.27Å; R316-E355 VanDerWaalsContact NH1-O 3.1Å
317	I	89.2	Confident	89.8	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-54.7	-43.7	176.2	-63.9	171	0	0	0	110.8	V313 L314 Y320 G321 G322 S325 L326 L340 S344 L354	V313-I317 HydrophobicContact CG1-CD1 4.15Å; V313-I317 WeakPolarHBondContact O-CG1 3.36Å; V313-I317 PolarHBondContact O-N 2.9Å; V313-I317 VanDerWaalsContact O-N 3.15Å; L314-I317 HydrophobicContact CD2-CD1 4.34Å; L314-I317 PolarHBondContact O-N 3.41Å; I317-Y320 PolarHBondContact O-N 3.07Å; I317-G321 PolarHBondContact O-N 3.28Å; I317-G322 PolarHBondContact O-N 3.45Å; I317-S325 VanDerWaalsContact CG2-OG 3.26Å; I317-S325 WeakPolarHBondContact CG2-OG 3.21Å; I317-L326 HydrophobicContact CB-CD2 4.13Å; I317-L326 HydrophobicContact CG2-CD2 3.76Å; I317-L326 HydrophobicContact CG2-CG 4.11Å; I317-L340 HydrophobicContact CD1-CD1 4.25Å; I317-L340 HydrophobicContact CD1-CD2 4.18Å; I317-L340 HydrophobicContact CD1-CG 4.07Å; I317-S344 WeakPolarHBondContact CD1-OG 3.45Å; I317-L354 HydrophobicContact CD1-CD2 4.44Å; I317-L354 HydrophobicContact CG1-CD2 4.11Å
318	L	89.8	Confident	89.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177.9	-179.5	64.7	0	0	0	112.9	L46 F265 R266 F269 L314 L315 R316 Y320 G321 Y323 L326	L46-L318 HydrophobicContact CD1-CD1 3.78Å; L46-L318 HydrophobicContact CD2-CD1 3.81Å; L46-L318 HydrophobicContact CG-CD1 4.45Å; F265-L318 HydrophobicContact CD1-CD1 4.26Å; F265-L318 HydrophobicContact CD1-CD2 4.27Å; F265-L318 HydrophobicContact CE1-CD1 4.04Å; F265-L318 HydrophobicContact CE1-CD2 4.35Å; R266-L318 HydrophobicContact CB-CD2 4.31Å; R266-L318 HydrophobicContact CG-CD2 3.71Å; R266-L318 HydrophobicContact CG-CG 4.33Å; F269-L318 HydrophobicContact CD2-CD2 3.81Å; F269-L318 HydrophobicContact CE2-CD2 4.49Å; L314-L318 VanDerWaalsContact O-CB 3.31Å; L314-L318 WeakPolarHBondContact O-CB 3.42Å; L314-L318 PolarHBondContact O-N 3.4Å; L315-L318 WeakPolarHBondContact O-CB 3.35Å; L315-L318 PolarHBondContact O-N 3.38Å; R316-L318 PolarHBondContact O-N 2.84Å; L318-Y320 VanDerWaalsContact C-N 3.32Å; L318-G321 PolarHBondContact O-N 2.87Å; L318-Y323 HydrophobicContact CD1-CD1 3.73Å; L318-Y323 HydrophobicContact CD1-CE1 3.68Å; L318-Y323 WeakPolarHBondContact O-CE1 3.47Å; L318-L326 HydrophobicContact CB-CD1 4.36Å; L318-L326 HydrophobicContact CD1-CD1 4.07Å
319	N	86.7	Confident	88.4	Confident	66 Å²	66	25.1 Å²	25.1	35%	0.353	14%	0.144	S	C	.	.	H	α-helix	trans	-70.8	-28.7	179.5	-73.7	-11.1	0	0	0	112.8	L315 R316 G321	L315-N319 WeakPolarHBondContact O-CB 3.37Å; L315-N319 VanDerWaalsContact O-CG 3.31Å; L315-N319 PolarHBondContact O-N 3.46Å; R316-N319 PolarHBondContact O-N 3.32Å; R316-N319 VanDerWaalsContact O-N 3.08Å; N319-G321 VanDerWaalsContact C-N 3.28Å; N319-G321 PolarHBondContact O-N 3.01Å
320	Y	85	Confident	87.6	Confident	52 Å²	52	28 Å²	28	20%	0.204	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	7.5	174.3	-62.4	-61.9	0	0	0	114.4	R316 I317 L318 G322 I348 L351	R316-Y320 HydrophobicContact CB-CE2 4.22Å; R316-Y320 WeakPolarHBondContact O-CD2 3.14Å; R316-Y320 PolarHBondContact O-N 3.17Å; R316-Y320 VanDerWaalsContact O-N 3.08Å; I317-Y320 PolarHBondContact O-N 3.07Å; L318-Y320 VanDerWaalsContact C-N 3.32Å; Y320-G322 VanDerWaalsContact C-N 3.31Å; Y320-G322 PolarHBondContact O-N 3.12Å; Y320-I348 VanDerWaalsContact CB-CG1 3.46Å; Y320-I348 HydrophobicContact CD1-CG2 3.61Å; Y320-I348 HydrophobicContact CD2-CD1 3.68Å; Y320-I348 HydrophobicContact CD2-CG2 4.07Å; Y320-I348 HydrophobicContact CE1-CG2 4.35Å; Y320-I348 HydrophobicContact CG-CB 4.44Å; Y320-I348 HydrophobicContact CG-CD1 3.75Å; Y320-I348 HydrophobicContact CG-CG1 4.1Å; Y320-I348 HydrophobicContact CG-CG2 3.49Å; Y320-I348 VanDerWaalsContact CG-CG2 3.49Å; Y320-L351 HydrophobicContact CD1-CD1 3.75Å; Y320-L351 HydrophobicContact CD2-CD1 4.41Å; Y320-L351 HydrophobicContact CD2-CD2 4.28Å; Y320-L351 HydrophobicContact CE1-CD1 3.05Å; Y320-L351 HydrophobicContact CE1-CD2 4.23Å; Y320-L351 HydrophobicContact CE1-CG 4.18Å; Y320-L351 HydrophobicContact CE2-CD1 3.82Å; Y320-L351 HydrophobicContact CE2-CD2 3.34Å; Y320-L351 HydrophobicContact CE2-CG 4.14Å; Y320-L351 HydrophobicContact CG-CD1 4.41Å; Y320-L351 VanDerWaalsContact OH-CD1 3.29Å; Y320-L351 WeakPolarHBondContact OH-CD1 3.19Å; Y320-L351 WeakPolarHBondContact OH-CD2 3.2Å
321	G	84.7	Confident	86.5	Confident	34 Å²	34	28 Å²	28	35%	0.351	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	13.5	176.3	0	0	0	0	0	114.8	I317 L318 N319 Y323	I317-G321 PolarHBondContact O-N 3.28Å; L318-G321 PolarHBondContact O-N 2.87Å; N319-G321 VanDerWaalsContact C-N 3.28Å; N319-G321 PolarHBondContact O-N 3.01Å; G321-Y323 PolarHBondContact O-N 2.98Å
322	G	84.5	Confident	85.2	Confident	10 Å²	10	33.5 Å²	33.5	10%	0.103	19%	0.193	C	C	.	.			trans	-72.9	41.1	178.1	0	0	0	0	0	114.1	I317 Y320 S324 S325	I317-G322 PolarHBondContact O-N 3.45Å; Y320-G322 VanDerWaalsContact C-N 3.31Å; Y320-G322 PolarHBondContact O-N 3.12Å; G322-S324 VanDerWaalsContact C-N 3.33Å; G322-S324 PolarHBondContact O-N 3.03Å; G322-S325 PolarHBondContact O-N 3.21Å; G322-S325 VanDerWaalsContact O-N 3.13Å; G322-S325 PolarHBondContact O-OG 2.9Å
323	Y	88.1	Confident	84.4	Confident	36 Å²	36	36.8 Å²	36.8	14%	0.141	21%	0.212	C	C	.	.	H	α-helix	trans	-57.8	-42.9	-168.4	-49.7	-42	0	0	0	113	K45 L46 R266 L318 G321 S325 L326 F327	K45-Y323 HydrophobicContact CB-CD2 4.32Å; K45-Y323 HydrophobicContact CB-CE2 3.99Å; L46-Y323 HydrophobicContact CB-CD1 4.4Å; L46-Y323 HydrophobicContact CB-CD2 4.31Å; L46-Y323 HydrophobicContact CB-CE1 4.1Å; L46-Y323 HydrophobicContact CB-CE2 4.01Å; L46-Y323 HydrophobicContact CB-CG 4.5Å; L46-Y323 HydrophobicContact CD1-CD1 3.75Å; L46-Y323 HydrophobicContact CD1-CE1 4.07Å; L46-Y323 HydrophobicContact CD1-CG 4.09Å; L46-Y323 HydrophobicContact CD2-CE1 4.49Å; L46-Y323 HydrophobicContact CG-CE1 4.44Å; R266-Y323 PolarHBondContact NH2-OH 3.27Å; L318-Y323 HydrophobicContact CD1-CD1 3.73Å; L318-Y323 HydrophobicContact CD1-CE1 3.68Å; L318-Y323 WeakPolarHBondContact O-CE1 3.47Å; G321-Y323 PolarHBondContact O-N 2.98Å; Y323-S325 VanDerWaalsContact C-N 3.27Å; Y323-S325 PolarHBondContact O-N 3.42Å; Y323-L326 WeakPolarHBondContact O-CB 3.43Å; Y323-L326 PolarHBondContact O-N 3.23Å; Y323-F327 WeakPolarHBondContact O-CD2 3.25Å
324	S	84.7	Confident	83.6	Confident	87 Å²	87	40.5 Å²	40.5	61%	0.608	24%	0.242	S	C	*	.	H	α-helix	trans	-61.5	-32.6	-179.1	-56.7	0	0	0	0	113.1	G322 L326 F327 T328	G322-S324 VanDerWaalsContact C-N 3.33Å; G322-S324 PolarHBondContact O-N 3.03Å; S324-L326 VanDerWaalsContact C-N 3.27Å; S324-L326 PolarHBondContact O-N 3.28Å; S324-F327 PolarHBondContact O-N 3.49Å; S324-T328 VanDerWaalsContact O-CG2 3.31Å; S324-T328 WeakPolarHBondContact O-CG2 3.21Å; S324-T328 PolarHBondContact O-N 3.33Å; S324-T328 PolarHBondContact O-OG1 2.87Å
325	S	85.4	Confident	82.9	Confident	8 Å²	8	43.7 Å²	43.7	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-30.2	-179.3	70	0	0	0	0	111.8	I317 G322 Y323 F327 T328 H329 S344	I317-S325 VanDerWaalsContact CG2-OG 3.26Å; I317-S325 WeakPolarHBondContact CG2-OG 3.21Å; G322-S325 PolarHBondContact O-N 3.21Å; G322-S325 VanDerWaalsContact O-N 3.13Å; G322-S325 PolarHBondContact O-OG 2.9Å; Y323-S325 VanDerWaalsContact C-N 3.27Å; Y323-S325 PolarHBondContact O-N 3.42Å; S325-F327 PolarHBondContact O-N 2.88Å; S325-T328 WeakPolarHBondContact CA-OG1 3.35Å; S325-T328 PolarHBondContact O-OG1 3.46Å; S325-H329 PolarHBondContact O-ND1 2.85Å; S325-S344 PolarHBondContact OG-OG 2.91Å
326	L	88.8	Confident	82.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-29.4	177.2	-59.6	175.7	0	0	0	113.1	F227 R230 F265 L314 I317 L318 Y323 S324	F227-L326 HydrophobicContact CZ-CB 4.06Å; R230-L326 PolarHBondContact NH1-O 2.88Å; F265-L326 HydrophobicContact CE1-CD1 4.16Å; F265-L326 HydrophobicContact CZ-CD1 4.43Å; L314-L326 HydrophobicContact CB-CD2 4.33Å; L314-L326 HydrophobicContact CD2-CD2 3.77Å; I317-L326 HydrophobicContact CB-CD2 4.13Å; I317-L326 HydrophobicContact CG2-CD2 3.76Å; I317-L326 HydrophobicContact CG2-CG 4.11Å; L318-L326 HydrophobicContact CB-CD1 4.36Å; L318-L326 HydrophobicContact CD1-CD1 4.07Å; Y323-L326 WeakPolarHBondContact O-CB 3.43Å; Y323-L326 PolarHBondContact O-N 3.23Å; S324-L326 VanDerWaalsContact C-N 3.27Å; S324-L326 PolarHBondContact O-N 3.28Å
327	F	89.8	Confident	81.9	Confident	23 Å²	23	45 Å²	45	10%	0.101	28%	0.278	C	S	.	.	H	α-helix	trans	-106.9	-8.2	-173.5	-57.4	-76.5	0	0	0	115.1	C49 L50 H53 I223 F227 F265 Y323 S324 S325	C49-F327 VanDerWaalsContact SG-CD2 3.52Å; C49-F327 VanDerWaalsContact SG-CE2 3.51Å; L50-F327 HydrophobicContact CD2-CE1 4.33Å; L50-F327 HydrophobicContact CD2-CZ 3.64Å; H53-F327 HydrophobicContact CB-CD1 3.89Å; H53-F327 HydrophobicContact CB-CE1 4.08Å; H53-F327 HydrophobicContact CB-CG 4.3Å; H53-F327 AromaticContact CD2-CD1 3.49Å; H53-F327 VanDerWaalsContact CD2-CD1 3.49Å; H53-F327 WeakPolarHBondContact CD2-CD1 3.41Å; H53-F327 AromaticContact CD2-CE1 3.85Å; H53-F327 AromaticContact CE1-CD1 3.85Å; H53-F327 AromaticContact CG-CD1 3.29Å; H53-F327 AromaticContact CG-CE1 3.82Å; H53-F327 AromaticContact CG-CG 3.89Å; H53-F327 AromaticContact ND1-CD1 3.56Å; H53-F327 AromaticContact ND1-CG 3.84Å; H53-F327 AromaticContact NE2-CD1 3.85Å; I223-F327 HydrophobicContact CG2-CE1 4.14Å; F227-F327 AromaticContact CE2-CD1 3.88Å; F227-F327 HydrophobicContact CE2-CD1 3.88Å; F227-F327 AromaticContact CE2-CE1 3.53Å; F227-F327 HydrophobicContact CE2-CE1 3.53Å; F227-F327 HydrophobicContact CE2-CZ 4.32Å; F227-F327 HydrophobicContact CZ-CD1 4.38Å; F227-F327 AromaticContact CZ-CE1 3.96Å; F227-F327 HydrophobicContact CZ-CE1 3.96Å; F227-F327 HydrophobicContact CZ-CZ 4.34Å; F265-F327 HydrophobicContact CZ-CZ 4.01Å; Y323-F327 WeakPolarHBondContact O-CD2 3.25Å; S324-F327 PolarHBondContact O-N 3.49Å; S325-F327 PolarHBondContact O-N 2.88Å
328	T	84.1	Confident	81.5	Confident	98 Å²	98	50.4 Å²	50.4	60%	0.601	30%	0.303	S	S	*	.	H	α-helix	trans	-101.7	-25.5	-174.5	44.2	0	0	0	0	113.5	S324 S325	S324-T328 VanDerWaalsContact O-CG2 3.31Å; S324-T328 WeakPolarHBondContact O-CG2 3.21Å; S324-T328 PolarHBondContact O-N 3.33Å; S324-T328 PolarHBondContact O-OG1 2.87Å; S325-T328 WeakPolarHBondContact CA-OG1 3.35Å; S325-T328 PolarHBondContact O-OG1 3.46Å
329	H	76.3	Confident	81.1	Confident	34 Å²	34	55 Å²	55	16%	0.157	32%	0.324	C	S	.	.			trans	-98.6	151.6	-176.2	-65.5	74.6	0	0	0	112	R230 S325 L340 V343	R230-H329 VanDerWaalsContact CD-O 3.3Å; R230-H329 WeakPolarHBondContact CD-O 3.25Å; S325-H329 PolarHBondContact O-ND1 2.85Å; H329-L340 HydrophobicContact CB-CD1 3.98Å; H329-V343 WeakPolarHBondContact NE2-CG2 3.47Å
330	S	76.2	Confident	80.9	Confident	68 Å²	68	51.9 Å²	51.9	48%	0.476	31%	0.308	S	S	.	.			trans	-122.8	105.3	170.8	-54.6	0	0	0	0	108.3	R230 L332 S336	R230-S330 CarbonylContact O-C 3.59Å; S330-L332 PolarHBondContact O-N 2.79Å; S330-S336 WeakPolarHBondContact O-CB 2.93Å; S330-S336 PolarHBondContact O-OG 3.17Å
331	D	71.1	Confident	80.8	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-85.2	74.9	173.8	179.1	25.2	0	0	0	111.7	R230 F231 R232 D333 R337	R230-D331 CarbonylContact O-C 3.46Å; R230-D331 WeakPolarHBondContact O-CA 3.43Å; R230-D331 PolarHBondContact O-N 3.36Å; F231-D331 HydrophobicContact CD1-CB 3.83Å; F231-D331 HydrophobicContact CE1-CB 4.41Å; R232-D331 WeakPolarHBondContact CB-O 3.23Å; R232-D331 PolarHBondContact N-O 3.45Å; D331-D333 VanDerWaalsContact OD1-O 3.13Å; D331-R337 WeakPolarHBondContact OD1-CG 3.4Å; D331-R337 IonicContact OD1-NE 3.6Å; D331-R337 VanDerWaalsContact OD2-CG 3.32Å; D331-R337 WeakPolarHBondContact OD2-CG 3.45Å; D331-R337 IonicContact OD2-NE 2.83Å; D331-R337 PolarHBondContact OD2-NE 3.48Å; D331-R337 VanDerWaalsContact OD2-NE 3.1Å
332	L	68.7	Low	80.6	Confident	115 Å²	115	53.9 Å²	53.9	60%	0.602	31%	0.309	S	S	*	.	S	Bend	trans	-98.8	-14.2	170.7	-67.8	175.8	0	0	0	112.9	S330	S330-L332 PolarHBondContact O-N 2.79Å
333	D	74.9	Confident	80.4	Confident	87 Å²	87	55.5 Å²	55.5	47%	0.465	32%	0.317	S	S	.	.	S	Bend	trans	-139	164.3	179.3	64.3	29.9	0	0	0	112.8	D331 A335 S336 R337	D331-D333 VanDerWaalsContact OD1-O 3.13Å; D333-A335 PolarHBondContact O-N 3.24Å; D333-A335 PolarHBondContact OD1-N 3.45Å; D333-S336 WeakPolarHBondContact O-CB 3.29Å; D333-S336 PolarHBondContact O-N 3.47Å; D333-S336 VanDerWaalsContact O-N 3.09Å; D333-S336 WeakPolarHBondContact OD1-CB 3.13Å; D333-S336 PolarHBondContact OD1-N 3.04Å; D333-S336 PolarHBondContact OD1-OG 3.28Å; D333-R337 PolarHBondContact O-N 3.3Å
334	A	73.4	Confident	79.9	Confident	78 Å²	78	53.8 Å²	53.8	65%	0.645	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-31.4	-177.4	0	0	0	0	0	113.3	S336 R337 E338	A334-S336 VanDerWaalsContact C-N 3.3Å; A334-S336 PolarHBondContact O-N 3.5Å; A334-R337 WeakPolarHBondContact O-CB 3.4Å; A334-R337 PolarHBondContact O-N 3.41Å; A334-E338 PolarHBondContact O-N 2.79Å
335	A	77.9	Confident	79.5	Confident	68 Å²	68	51.7 Å²	51.7	56%	0.562	29%	0.294	S	S	*	.	H	α-helix	trans	-65.3	-37.7	176.5	0	0	0	0	0	111.2	D333 E338 Q339	D333-A335 PolarHBondContact O-N 3.24Å; D333-A335 PolarHBondContact OD1-N 3.45Å; A335-E338 PolarHBondContact O-N 3.31Å; A335-Q339 PolarHBondContact O-N 3.15Å
336	S	79.3	Confident	78.7	Confident	32 Å²	32	59.9 Å²	59.9	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-34.4	177	-60.3	0	0	0	0	112.2	S330 D333 A334 Q339 L340	S330-S336 WeakPolarHBondContact O-CB 2.93Å; S330-S336 PolarHBondContact O-OG 3.17Å; D333-S336 WeakPolarHBondContact O-CB 3.29Å; D333-S336 PolarHBondContact O-N 3.47Å; D333-S336 VanDerWaalsContact O-N 3.09Å; D333-S336 WeakPolarHBondContact OD1-CB 3.13Å; D333-S336 PolarHBondContact OD1-N 3.04Å; D333-S336 PolarHBondContact OD1-OG 3.28Å; A334-S336 VanDerWaalsContact C-N 3.3Å; A334-S336 PolarHBondContact O-N 3.5Å; S336-Q339 PolarHBondContact O-N 3.45Å; S336-L340 WeakPolarHBondContact O-CB 3.33Å; S336-L340 PolarHBondContact O-N 3.13Å
337	R	82	Confident	77.6	Confident	49 Å²	49	64.1 Å²	64.1	19%	0.185	36%	0.358	C	S	.	.	H	α-helix	trans	-57.6	-53.6	170.2	-67.3	-167.7	170.5	165.6	3.1	111.5	E306 D331 D333 A334 Q339 L340 L341 W356	E306-R337 IonicContact OE1-CZ 3.44Å; E306-R337 IonicContact OE1-NH2 2.8Å; E306-R337 PolarHBondContact OE1-NH2 3.49Å; D331-R337 WeakPolarHBondContact OD1-CG 3.4Å; D331-R337 IonicContact OD1-NE 3.6Å; D331-R337 VanDerWaalsContact OD2-CG 3.32Å; D331-R337 WeakPolarHBondContact OD2-CG 3.45Å; D331-R337 IonicContact OD2-NE 2.83Å; D331-R337 PolarHBondContact OD2-NE 3.48Å; D331-R337 VanDerWaalsContact OD2-NE 3.1Å; D333-R337 PolarHBondContact O-N 3.3Å; A334-R337 WeakPolarHBondContact O-CB 3.4Å; A334-R337 PolarHBondContact O-N 3.41Å; R337-Q339 VanDerWaalsContact C-N 3.25Å; R337-Q339 PolarHBondContact O-N 3.04Å; R337-L340 PolarHBondContact O-N 3.47Å; R337-L341 WeakPolarHBondContact O-CG 3.4Å; R337-L341 PolarHBondContact O-N 3.05Å; R337-W356 HydrophobicContact CG-CZ2 4.19Å
338	E	80.3	Confident	76.4	Confident	112 Å²	112	63.8 Å²	63.8	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-58.8	-40.4	179	-79.8	-167.4	-168	0	0	111.9	A334 A335 L341 K342	A334-E338 PolarHBondContact O-N 2.79Å; A335-E338 PolarHBondContact O-N 3.31Å; E338-L341 PolarHBondContact O-N 3.16Å; E338-K342 WeakPolarHBondContact O-CB 3.46Å; E338-K342 VanDerWaalsContact O-CG 3.24Å; E338-K342 WeakPolarHBondContact O-CG 3.31Å; E338-K342 PolarHBondContact O-N 3.49Å; E338-K342 IonicContact OE2-NZ 3.47Å; E338-K342 PolarHBondContact OE2-NZ 3.41Å
339	Q	81.1	Confident	75.1	Confident	96 Å²	96	66.2 Å²	66.2	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-44	178.7	-172.7	62.7	13.6	0	0	111.8	A335 S336 R337 L341 K342 V343	A335-Q339 PolarHBondContact O-N 3.15Å; S336-Q339 PolarHBondContact O-N 3.45Å; R337-Q339 VanDerWaalsContact C-N 3.25Å; R337-Q339 PolarHBondContact O-N 3.04Å; Q339-L341 VanDerWaalsContact C-N 3.31Å; Q339-L341 PolarHBondContact O-N 2.86Å; Q339-K342 PolarHBondContact O-N 2.94Å; Q339-V343 WeakPolarHBondContact O-CG2 3.46Å; Q339-V343 PolarHBondContact O-N 3.44Å
340	L	83.2	Confident	74.1	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-58.5	-44	174.3	177.2	68.6	0	0	0	111.4	F231 L314 I317 H329 S336 R337 S344	F231-L340 HydrophobicContact CE1-CD2 3.85Å; L314-L340 HydrophobicContact CD2-CD2 4.24Å; I317-L340 HydrophobicContact CD1-CD1 4.25Å; I317-L340 HydrophobicContact CD1-CD2 4.18Å; I317-L340 HydrophobicContact CD1-CG 4.07Å; H329-L340 HydrophobicContact CB-CD1 3.98Å; S336-L340 WeakPolarHBondContact O-CB 3.33Å; S336-L340 PolarHBondContact O-N 3.13Å; R337-L340 PolarHBondContact O-N 3.47Å; L340-S344 VanDerWaalsContact O-CB 3.25Å; L340-S344 WeakPolarHBondContact O-CB 3.31Å; L340-S344 PolarHBondContact O-N 2.68Å; L340-S344 PolarHBondContact O-OG 3.46Å
341	L	82	Confident	73.1	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.131	39%	0.388	C	S	.	.	H	α-helix	trans	-62.8	-45.8	176.7	-66.4	-179	0	0	0	111.4	V313 R337 E338 Q339 S344 T345 L354	V313-L341 HydrophobicContact CG1-CD2 4.04Å; R337-L341 WeakPolarHBondContact O-CG 3.4Å; R337-L341 PolarHBondContact O-N 3.05Å; E338-L341 PolarHBondContact O-N 3.16Å; Q339-L341 VanDerWaalsContact C-N 3.31Å; Q339-L341 PolarHBondContact O-N 2.86Å; L341-S344 PolarHBondContact O-N 2.58Å; L341-T345 VanDerWaalsContact O-CB 3.3Å; L341-T345 WeakPolarHBondContact O-CB 3.35Å; L341-T345 PolarHBondContact O-N 2.86Å; L341-T345 PolarHBondContact O-OG1 2.97Å; L341-L354 VanDerWaalsContact CD1-O 3.31Å; L341-L354 WeakPolarHBondContact CD1-O 3.24Å; L341-L354 HydrophobicContact CD2-CB 4.16Å; L341-L354 HydrophobicContact CD2-CD2 3.36Å; L341-L354 HydrophobicContact CD2-CG 4.3Å; L341-L354 WeakPolarHBondContact CD2-O 3.43Å
342	K	81.1	Confident	72.5	Confident	103 Å²	103	75.9 Å²	75.9	45%	0.448	42%	0.421	S	S	.	.	H	α-helix	trans	-61.4	-46.5	178.4	-74.4	166.1	-170	160.5	0	111.8	E338 Q339 K346	E338-K342 WeakPolarHBondContact O-CB 3.46Å; E338-K342 VanDerWaalsContact O-CG 3.24Å; E338-K342 WeakPolarHBondContact O-CG 3.31Å; E338-K342 PolarHBondContact O-N 3.49Å; E338-K342 IonicContact OE2-NZ 3.47Å; E338-K342 PolarHBondContact OE2-NZ 3.41Å; Q339-K342 PolarHBondContact O-N 2.94Å; K342-K346 WeakPolarHBondContact O-CG 2.94Å; K342-K346 PolarHBondContact O-N 3.38Å
343	V	80.3	Confident	72.4	Confident	44 Å²	44	76.5 Å²	76.5	27%	0.267	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-43.3	179	173.3	0	0	0	0	110.9	H329 Q339 K346 S347	H329-V343 WeakPolarHBondContact NE2-CG2 3.47Å; Q339-V343 WeakPolarHBondContact O-CG2 3.46Å; Q339-V343 PolarHBondContact O-N 3.44Å; V343-K346 PolarHBondContact O-N 2.95Å; V343-S347 PolarHBondContact O-N 2.81Å
344	S	78	Confident	72.3	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-68.9	-41	-178.7	-54.3	0	0	0	0	111.6	I317 S325 L340 L341 K346 S347 I348	I317-S344 WeakPolarHBondContact CD1-OG 3.45Å; S325-S344 PolarHBondContact OG-OG 2.91Å; L340-S344 VanDerWaalsContact O-CB 3.25Å; L340-S344 WeakPolarHBondContact O-CB 3.31Å; L340-S344 PolarHBondContact O-N 2.68Å; L340-S344 PolarHBondContact O-OG 3.46Å; L341-S344 PolarHBondContact O-N 2.58Å; S344-K346 VanDerWaalsContact C-N 3.34Å; S344-K346 PolarHBondContact O-N 3.46Å; S344-S347 PolarHBondContact O-N 3.27Å; S344-I348 WeakPolarHBondContact O-CD1 3.46Å; S344-I348 WeakPolarHBondContact O-CG1 3.37Å; S344-I348 PolarHBondContact O-N 3.44Å
345	T	74.9	Confident	72.6	Confident	43 Å²	43	75.2 Å²	75.2	26%	0.264	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-38.3	178.3	-51.7	0	0	0	0	111.8	L341 S347 I348	L341-T345 VanDerWaalsContact O-CB 3.3Å; L341-T345 WeakPolarHBondContact O-CB 3.35Å; L341-T345 PolarHBondContact O-N 2.86Å; L341-T345 PolarHBondContact O-OG1 2.97Å; T345-S347 PolarHBondContact O-N 3.4Å; T345-I348 PolarHBondContact O-N 2.81Å; T345-I348 VanDerWaalsContact O-N 3.17Å
346	K	70	Confident	72.7	Confident	180 Å²	180	74 Å²	74	78%	0.783	38%	0.383	S	S	*	.	H	α-helix	trans	-64.6	-26.8	176.4	-76.2	179.9	-178.4	-175.2	0	113.8	K342 V343 S344 I348	K342-K346 WeakPolarHBondContact O-CG 2.94Å; K342-K346 PolarHBondContact O-N 3.38Å; V343-K346 PolarHBondContact O-N 2.95Å; S344-K346 VanDerWaalsContact C-N 3.34Å; S344-K346 PolarHBondContact O-N 3.46Å; K346-I348 VanDerWaalsContact C-N 3.31Å
347	S	64.3	Low	72.8	Confident	89 Å²	89	74.2 Å²	74.2	62%	0.622	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-6.2	177.7	-76	0	0	0	0	113.5	V343 S344 T345	V343-S347 PolarHBondContact O-N 2.81Å; S344-S347 PolarHBondContact O-N 3.27Å; T345-S347 PolarHBondContact O-N 3.4Å
348	I	64.9	Low	72.5	Confident	16 Å²	16	79.3 Å²	79.3	8%	0.082	41%	0.41	C	S	.	.	S	Bend	trans	-121.2	94.6	-170.5	-55.5	165.5	0	0	0	108.1	Y320 S344 T345 K346 N350 L351	Y320-I348 VanDerWaalsContact CB-CG1 3.46Å; Y320-I348 HydrophobicContact CD1-CG2 3.61Å; Y320-I348 HydrophobicContact CD2-CD1 3.68Å; Y320-I348 HydrophobicContact CD2-CG2 4.07Å; Y320-I348 HydrophobicContact CE1-CG2 4.35Å; Y320-I348 HydrophobicContact CG-CB 4.44Å; Y320-I348 HydrophobicContact CG-CD1 3.75Å; Y320-I348 HydrophobicContact CG-CG1 4.1Å; Y320-I348 HydrophobicContact CG-CG2 3.49Å; Y320-I348 VanDerWaalsContact CG-CG2 3.49Å; S344-I348 WeakPolarHBondContact O-CD1 3.46Å; S344-I348 WeakPolarHBondContact O-CG1 3.37Å; S344-I348 PolarHBondContact O-N 3.44Å; T345-I348 PolarHBondContact O-N 2.81Å; T345-I348 VanDerWaalsContact O-N 3.17Å; K346-I348 VanDerWaalsContact C-N 3.31Å; I348-N350 PolarHBondContact O-N 3.17Å; I348-L351 HydrophobicContact CG2-CB 4.22Å; I348-L351 HydrophobicContact CG2-CD1 3.85Å
349	D	57.8	Low	72.1	Confident	149 Å²	149	76.2 Å²	76.2	80%	0.797	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	129.8	175.5	-70.3	-35.2	0	0	0	110
350	N	54.5	Low	71.8	Confident	161 Å²	161	74.8 Å²	74.8	86%	0.861	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	42.3	173.5	-61.9	-33.3	0	0	0	118.9	I348	I348-N350 PolarHBondContact O-N 3.17Å
351	L	54.8	Low	70.9	Confident	45 Å²	45	75.2 Å²	75.2	24%	0.236	40%	0.401	C	S	.	.			trans	-114.7	148.5	168.7	-119.2	94.7	0	0	0	117	Y320 I348	Y320-L351 HydrophobicContact CD1-CD1 3.75Å; Y320-L351 HydrophobicContact CD2-CD1 4.41Å; Y320-L351 HydrophobicContact CD2-CD2 4.28Å; Y320-L351 HydrophobicContact CE1-CD1 3.05Å; Y320-L351 HydrophobicContact CE1-CD2 4.23Å; Y320-L351 HydrophobicContact CE1-CG 4.18Å; Y320-L351 HydrophobicContact CE2-CD1 3.82Å; Y320-L351 HydrophobicContact CE2-CD2 3.34Å; Y320-L351 HydrophobicContact CE2-CG 4.14Å; Y320-L351 HydrophobicContact CG-CD1 4.41Å; Y320-L351 VanDerWaalsContact OH-CD1 3.29Å; Y320-L351 WeakPolarHBondContact OH-CD1 3.19Å; Y320-L351 WeakPolarHBondContact OH-CD2 3.2Å; I348-L351 HydrophobicContact CG2-CB 4.22Å; I348-L351 HydrophobicContact CG2-CD1 3.85Å
352	S	58.7	Low	69.6	Low	100 Å²	100	79 Å²	79	70%	0.699	42%	0.42	S	S	*	.			trans	-50.3	135.6	156.4	27.5	0	0	0	0	109.9	L354	S352-L354 PolarHBondContact O-N 3.14Å; S352-L354 VanDerWaalsContact O-N 3.14Å
353	I	67.1	Low	68.1	Low	128 Å²	128	78.4 Å²	78.4	66%	0.656	42%	0.419	S	S	*	.			trans	-46.7	121.6	-176.5	-62.1	170.3	0	0	0	109.1	E355	I353-E355 HydrophobicContact CG2-CG 4.07Å; I353-E355 PolarHBondContact O-N 3.41Å; I353-E355 VanDerWaalsContact O-N 3.16Å
354	L	73.8	Confident	66.4	Low	7 Å²	7	79.2 Å²	79.2	4%	0.037	43%	0.427	C	S	.	.			trans	-70.7	113.4	179.2	-149.8	121.6	0	0	0	107.4	V313 R316 I317 L341 S352	V313-L354 HydrophobicContact CG1-CD2 3.74Å; R316-L354 HydrophobicContact CB-CD1 3.83Å; I317-L354 HydrophobicContact CD1-CD2 4.44Å; I317-L354 HydrophobicContact CG1-CD2 4.11Å; L341-L354 VanDerWaalsContact CD1-O 3.31Å; L341-L354 WeakPolarHBondContact CD1-O 3.24Å; L341-L354 HydrophobicContact CD2-CB 4.16Å; L341-L354 HydrophobicContact CD2-CD2 3.36Å; L341-L354 HydrophobicContact CD2-CG 4.3Å; L341-L354 WeakPolarHBondContact CD2-O 3.43Å; S352-L354 PolarHBondContact O-N 3.14Å; S352-L354 VanDerWaalsContact O-N 3.14Å
355	E	79	Confident	64.5	Low	131 Å²	131	85.7 Å²	85.7	61%	0.612	46%	0.457	S	S	*	.			trans	-111.8	149.3	-178.9	-70.1	-179.9	-179	0	0	111.3	R316 I353	R316-E355 PolarHBondContact NH1-O 3.27Å; R316-E355 VanDerWaalsContact NH1-O 3.1Å; I353-E355 HydrophobicContact CG2-CG 4.07Å; I353-E355 PolarHBondContact O-N 3.41Å; I353-E355 VanDerWaalsContact O-N 3.16Å
356	W	80.7	Confident	62.5	Low	42 Å²	42	89.9 Å²	89.9	16%	0.159	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-77.2	126.8	168.7	-98	90.8	0	0	0	109	C309 T310 V313 R337	C309-W356 HydrophobicContact CB-CE3 4.34Å; C309-W356 HydrophobicContact CB-CZ3 4.17Å; T310-W356 VanDerWaalsContact CA-CH2 3.45Å; T310-W356 HydrophobicContact CG2-CH2 3.81Å; T310-W356 HydrophobicContact CG2-CZ2 4.35Å; T310-W356 WeakPolarHBondContact OG1-CH2 3.31Å; V313-W356 HydrophobicContact CG2-CD2 3.92Å; V313-W356 HydrophobicContact CG2-CE3 4.32Å; V313-W356 HydrophobicContact CG2-CG 4.13Å; R337-W356 HydrophobicContact CG-CZ2 4.19Å
357	P	79.6	Confident	60.9	Low	37 Å²	37	87.2 Å²	87.2	24%	0.24	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-61.1	142.2	176	-17.6	28.7	0	0	0	111.5	C309	C309-P357 HydrophobicContact CB-CB 4.31Å; C309-P357 HydrophobicContact CB-CG 4.13Å
358	E	76.2	Confident	59.6	Low	156 Å²	156	88.4 Å²	88.4	73%	0.729	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-64.2	127	168.5	-79.8	-95.3	142.2	0	0	110.2	V360	E358-V360 PolarHBondContact O-N 2.98Å
359	P	71.4	Confident	58	Low	48 Å²	48	95.5 Å²	95.5	31%	0.312	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-62.3	124.9	178	-21.1	31.7	0	0	0	111.9	D305 A361 L362	D305-P359 VanDerWaalsContact OD2-C 3.32Å; D305-P359 VanDerWaalsContact OD2-CA 3.29Å; D305-P359 WeakPolarHBondContact OD2-CA 3.48Å; P359-A361 VanDerWaalsContact C-N 3.35Å; P359-L362 HydrophobicContact CB-CD1 4.04Å; P359-L362 HydrophobicContact CB-CG 4.36Å; P359-L362 HydrophobicContact CG-CD1 4.11Å
360	V	74.9	Confident	56.7	Low	65 Å²	65	95 Å²	95	39%	0.394	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-34.3	178.5	-176.6	0	0	0	0	110.7	D305 E358 L362 H363	D305-V360 PolarHBondContact OD2-N 3.37Å; E358-V360 PolarHBondContact O-N 2.98Å; V360-L362 VanDerWaalsContact C-N 3.25Å; V360-L362 PolarHBondContact O-N 3.04Å; V360-H363 PolarHBondContact O-N 3.17Å; V360-H363 VanDerWaalsContact O-N 3.15Å
361	A	65.5	Low	55.5	Low	10 Å²	10	90.4 Å²	90.4	8%	0.083	49%	0.492	C	S	.	.	H	α-helix	trans	-66	-22.7	-174.7	0	0	0	0	0	114.4	A302 D305 P359 H363 S364	A302-A361 VanDerWaalsContact CA-CB 3.47Å; A302-A361 HydrophobicContact CB-CB 3.91Å; D305-A361 HydrophobicContact CB-CB 4.13Å; D305-A361 PolarHBondContact OD2-N 2.89Å; D305-A361 VanDerWaalsContact OD2-N 3.11Å; P359-A361 VanDerWaalsContact C-N 3.35Å; A361-H363 VanDerWaalsContact C-N 3.28Å; A361-H363 PolarHBondContact O-N 3.12Å; A361-S364 PolarHBondContact O-OG 2.66Å
362	L	54.5	Low	54.1	Low	104 Å²	104	96.3 Å²	96.3	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-30.8	175.9	-75.7	167.7	0	0	0	112	P359 V360	P359-L362 HydrophobicContact CB-CD1 4.04Å; P359-L362 HydrophobicContact CB-CG 4.36Å; P359-L362 HydrophobicContact CG-CD1 4.11Å; V360-L362 VanDerWaalsContact C-N 3.25Å; V360-L362 PolarHBondContact O-N 3.04Å
363	H	48.8	Very low	52.6	Low	91 Å²	91	95 Å²	95	42%	0.421	53%	0.525	S	S	.	.	H	α-helix	trans	-74.4	-30.2	-178.6	-76.3	56.1	0	0	0	112.5	V360 A361 I367	V360-H363 PolarHBondContact O-N 3.17Å; V360-H363 VanDerWaalsContact O-N 3.15Å; A361-H363 VanDerWaalsContact C-N 3.28Å; A361-H363 PolarHBondContact O-N 3.12Å; H363-I367 WeakPolarHBondContact O-CD1 3.46Å; H363-I367 VanDerWaalsContact O-CG1 3.29Å; H363-I367 WeakPolarHBondContact O-CG1 3.4Å; H363-I367 PolarHBondContact O-N 3.5Å
364	S	44.9	Very low	50.7	Low	62 Å²	62	96.1 Å²	96.1	43%	0.434	53%	0.532	S	S	.	.	H	α-helix	trans	-74.2	-26.9	-179.1	39.1	0	0	0	0	113.5	A361	A361-S364 PolarHBondContact O-OG 2.66Å
365	Q	37.5	Very low	48.7	Very low	136 Å²	136	101.1 Å²	101.1	64%	0.636	57%	0.565	S	S	*	*	H	α-helix	trans	-76.1	-36	173.5	-70	-171.7	-13.2	0	0	112.7	I367 T368	Q365-I367 VanDerWaalsContact C-N 3.31Å; Q365-I367 PolarHBondContact O-N 3.33Å; Q365-T368 PolarHBondContact O-N 3.21Å; Q365-T368 PolarHBondContact O-OG1 3.05Å
366	Q	33.1	Very low	46.2	Very low	131 Å²	131	101.7 Å²	101.7	61%	0.612	57%	0.572	S	S	*	*	H	α-helix	trans	-68.1	-29.4	177.2	-75.1	-174.2	-13.4	0	0	113.3	T368 E369	Q366-T368 PolarHBondContact O-N 2.72Å; Q366-E369 PolarHBondContact O-N 2.73Å
367	I	37.6	Very low	43.8	Very low	124 Å²	124	103.2 Å²	103.2	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-65	-24.3	176.2	-66.4	164.4	0	0	0	111.5	H363 Q365	H363-I367 WeakPolarHBondContact O-CD1 3.46Å; H363-I367 VanDerWaalsContact O-CG1 3.29Å; H363-I367 WeakPolarHBondContact O-CG1 3.4Å; H363-I367 PolarHBondContact O-N 3.5Å; Q365-I367 VanDerWaalsContact C-N 3.31Å; Q365-I367 PolarHBondContact O-N 3.33Å
368	T	35.7	Very low	41.4	Very low	114 Å²	114	108.7 Å²	108.7	70%	0.699	62%	0.617	S	S	*	*	H	α-helix	trans	-82.5	-20.4	177.7	44.3	0	0	0	0	115	Q365 Q366	Q365-T368 PolarHBondContact O-N 3.21Å; Q365-T368 PolarHBondContact O-OG1 3.05Å; Q366-T368 PolarHBondContact O-N 2.72Å
369	E	32.9	Very low	39.2	Very low	164 Å²	164	108.2 Å²	108.2	77%	0.766	61%	0.614	S	S	*	*	H	α-helix	trans	-86.8	-28.3	-179.4	-70.8	-171.5	156.1	0	0	113.2	Q366 G371	Q366-E369 PolarHBondContact O-N 2.73Å; E369-G371 PolarHBondContact O-N 3.44Å
370	N	29.9	Very low	37.4	Very low	138 Å²	138	111.4 Å²	111.4	74%	0.738	62%	0.624	S	S	*	*	S	Bend	trans	-94.5	79.8	174.1	-72.3	-28.3	0	0	0	110.2	N372	N370-N372 PolarHBondContact O-N 3.06Å
371	G	28.6	Very low	35.3	Very low	66 Å²	66	116.6 Å²	116.6	68%	0.68	64%	0.637	S	S	*	*			trans	-60	92.1	176.5	0	0	0	0	0	112.5	E369	E369-G371 PolarHBondContact O-N 3.44Å
372	N	26.5	Very low	33.7	Very low	169 Å²	169	123.6 Å²	123.6	90%	0.904	67%	0.672	S	S	*	*			trans	-175.4	88.7	148.6	-91.1	-22.3	0	0	0	109.1	N370	N370-N372 PolarHBondContact O-N 3.06Å
373	G	25.9	Very low	32.6	Very low	72 Å²	72	121.3 Å²	121.3	74%	0.742	66%	0.66	S	S	*	*			trans	172	86.5	172.8	0	0	0	0	0	113.3
374	L	27.4	Very low	31.9	Very low	152 Å²	152	126.9 Å²	126.9	80%	0.796	68%	0.678	S	S	*	*			trans	-95.4	137.9	143.4	-92	158.4	0	0	0	105.4
375	P	32.5	Very low	31.5	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	68%	0.675	S	S	*	*				-135.1	151.8	64.5	35.4	-20	0	0	0	114.3	S377	P375-S377 PolarHBondContact O-N 3.48Å
376	N	27	Very low	31.3	Very low	143 Å²	143	125.8 Å²	125.8	77%	0.765	67%	0.67	S	S	*	*			trans	-2.4	85.2	141.5	-68.1	-17.6	0	0	0	114.2
377	S	28.6	Very low	31.4	Very low	73 Å²	73	122.1 Å²	122.1	51%	0.51	66%	0.655	S	S	.	*			trans	-116.2	119.8	152.3	67.6	0	0	0	0	105.9	P375 H379	P375-S377 PolarHBondContact O-N 3.48Å; S377-H379 PolarHBondContact O-N 3.08Å
378	N	29.6	Very low	31.1	Very low	153 Å²	153	118.1 Å²	118.1	82%	0.818	64%	0.64	S	S	*	*			trans	-60.8	61.6	154.9	-77.6	-32.6	0	0	0	108.3	H380	N378-H380 PolarHBondContact O-N 3.15Å
379	H	30.6	Very low	30.8	Very low	146 Å²	146	122.3 Å²	122.3	68%	0.676	65%	0.648	S	S	*	*			trans	-79.1	70.3	160.2	-79.6	6.4	0	0	0	106.6	S377 R381	S377-H379 PolarHBondContact O-N 3.08Å; H379-R381 PolarHBondContact O-N 3.3Å
380	H	33	Very low	30.6	Very low	114 Å²	114	121.4 Å²	121.4	53%	0.528	64%	0.644	S	S	.	*				-52.9	83.6	123	-74	-76.7	0	0	0	105.5	S280 N378 L382	S280-H380 PolarHBondContact OG-CE1 3.15Å; N378-H380 PolarHBondContact O-N 3.15Å; H380-L382 PolarHBondContact O-N 3.35Å
381	R	30.5	Very low	30.8	Very low	174 Å²	174	121.6 Å²	121.6	66%	0.657	64%	0.64	S	S	*	*			trans	-55.3	98.5	148	-95.1	-176.4	175.8	179.7	-0.9	101.7	H379 L383	H379-R381 PolarHBondContact O-N 3.3Å; R381-L383 VanDerWaalsContact C-N 3.28Å; R381-L383 PolarHBondContact O-N 3.33Å
382	L	32.3	Very low	31	Very low	157 Å²	157	122.9 Å²	122.9	82%	0.822	63%	0.631	S	S	*	*			trans	-35.1	108.6	158.6	-91.3	143.3	0	0	0	103.6	H380 R384	H380-L382 PolarHBondContact O-N 3.35Å; L382-R384 PolarHBondContact O-N 2.96Å
383	L	32.5	Very low	31.2	Very low	57 Å²	57	120.1 Å²	120.1	30%	0.298	62%	0.615	S	S	.	*			trans	-46.9	120	168.9	-78.3	116.1	0	0	0	103.5	L278 R381 I385	L278-L383 HydrophobicContact CB-CD1 4.34Å; L278-L383 HydrophobicContact CD1-CB 4.44Å; L278-L383 HydrophobicContact CD1-CD1 3.29Å; L278-L383 HydrophobicContact CD1-CD2 3.38Å; L278-L383 HydrophobicContact CD1-CG 3.8Å; L278-L383 HydrophobicContact CD2-CD2 4.47Å; L278-L383 HydrophobicContact CG-CD1 4.37Å; R381-L383 VanDerWaalsContact C-N 3.28Å; R381-L383 PolarHBondContact O-N 3.33Å; L383-I385 HydrophobicContact CB-CG1 4.46Å; L383-I385 PolarHBondContact O-N 3.26Å
384	R	34.1	Very low	31.3	Very low	208 Å²	208	119.8 Å²	119.8	79%	0.785	61%	0.612	S	S	*	*			trans	-61	89.2	169	-91.7	-172.3	176.8	177.1	-1.9	104.2	L382 D386	L382-R384 PolarHBondContact O-N 2.96Å; R384-D386 PolarHBondContact O-N 3.48Å
385	I	35	Very low	31.1	Very low	72 Å²	72	119.5 Å²	119.5	37%	0.369	62%	0.617	S	S	.	*			trans	-70.2	78.8	158.8	-64.6	174.6	0	0	0	101.9	S274 L383 I387	S274-I385 WeakPolarHBondContact O-CD1 3.48Å; L383-I385 HydrophobicContact CB-CG1 4.46Å; L383-I385 PolarHBondContact O-N 3.26Å; I385-I387 HydrophobicContact CG2-CB 3.97Å; I385-I387 HydrophobicContact CG2-CD1 3.25Å; I385-I387 HydrophobicContact CG2-CG1 3.31Å; I385-I387 PolarHBondContact O-N 2.93Å
386	D	33.7	Very low	30.7	Very low	102 Å²	102	116.8 Å²	116.8	55%	0.545	60%	0.604	S	S	.	*			trans	-69.8	62.8	156.7	-80.5	-39.2	0	0	0	106.2	R384 A388	R384-D386 PolarHBondContact O-N 3.48Å; D386-A388 PolarHBondContact O-N 2.96Å
387	I	34.6	Very low	30.5	Very low	55 Å²	55	115.7 Å²	115.7	28%	0.282	61%	0.607	S	S	.	*			trans	-64	102.9	150.4	-74.8	163.6	0	0	0	102.1	L28 I385 K389 L392	L28-I387 HydrophobicContact CD2-CD1 4.06Å; I385-I387 HydrophobicContact CG2-CB 3.97Å; I385-I387 HydrophobicContact CG2-CD1 3.25Å; I385-I387 HydrophobicContact CG2-CG1 3.31Å; I385-I387 PolarHBondContact O-N 2.93Å; I387-K389 PolarHBondContact O-N 3.37Å; I387-L392 HydrophobicContact CG2-CD1 4.22Å
388	A	32.4	Very low	30.3	Very low	39 Å²	39	117.5 Å²	117.5	32%	0.322	62%	0.615	S	S	.	*			trans	-37.1	106.7	-176.7	0	0	0	0	0	110.2	D386 H390	D386-A388 PolarHBondContact O-N 2.96Å; A388-H390 PolarHBondContact O-N 3.42Å
389	K	29.8	Very low	29.8	Very low	202 Å²	202	119 Å²	119	88%	0.878	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-1.6	165.7	-89.6	-176.2	171.1	-177.4	0	112.2	I387	I387-K389 PolarHBondContact O-N 3.37Å
390	H	28.6	Very low	29.5	Very low	146 Å²	146	119.5 Å²	119.5	68%	0.676	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	113.5	172.9	-76.6	-88	0	0	0	109.4	A388	A388-H390 PolarHBondContact O-N 3.42Å
391	H	32.9	Very low	29.3	Very low	141 Å²	141	124.9 Å²	124.9	65%	0.653	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.2	0	163.6	-63	20.8	0	0	0	119.6
392	L	34.3	Very low	29.2	Very low	94 Å²	94	122.5 Å²	122.5	49%	0.492	65%	0.653	S	S	.	*	S	Bend	trans	-90.4	-6	163	-83.1	164.4	0	0	0	113.8	I387	I387-L392 HydrophobicContact CG2-CD1 4.22Å
393	L	30.6	Very low	29.1	Very low	110 Å²	110	120.6 Å²	120.6	58%	0.576	65%	0.645	S	S	*	*			trans	-106.7	78.3	174.3	-64	-179.6	0	0	0	110.1	T395 A396	L393-T395 PolarHBondContact O-N 2.76Å; L393-A396 WeakPolarHBondContact CD2-O 3.22Å
394	G	26.6	Very low	28.9	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	66%	0.664	S	S	*	*	S	Bend	trans	-61.8	98.3	142.8	0	0	0	0	0	106.7	A396	G394-A396 PolarHBondContact O-N 2.75Å
395	T	25	Very low	28.6	Very low	146 Å²	146	119.2 Å²	119.2	90%	0.896	66%	0.657	S	S	*	*	S	Bend	trans	45.9	64.5	166.1	58.3	0	0	0	0	115.8	L393	L393-T395 PolarHBondContact O-N 2.76Å
396	A	23.4	Very low	28.2	Very low	54 Å²	54	122.2 Å²	122.2	45%	0.446	68%	0.675	S	S	.	*			trans	-163.8	91.2	156.6	0	0	0	0	0	110.3	L393 G394 V398	L393-A396 WeakPolarHBondContact CD2-O 3.22Å; G394-A396 PolarHBondContact O-N 2.75Å; A396-V398 PolarHBondContact O-N 2.83Å
397	S	21.9	Very low	27.8	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	68%	0.683	S	S	*	*			trans	-58.5	107.7	166.1	-50.9	0	0	0	0	109.1
398	V	24	Very low	27.3	Very low	110 Å²	110	128.4 Å²	128.4	67%	0.667	71%	0.712	S	S	*	*			trans	-105.9	101.2	165.6	-178.9	0	0	0	0	107	A396 I400	A396-V398 PolarHBondContact O-N 2.83Å; V398-I400 HydrophobicContact CG1-CG1 4.28Å
399	E	19.9	Very low	26.9	Very low	184 Å²	184	135.3 Å²	135.3	86%	0.86	74%	0.742	S	S	*	*			trans	-68	124.4	159.6	-76.5	-178.4	148.8	0	0	108
400	I	24.7	Very low	26.7	Very low	157 Å²	157	129.8 Å²	129.8	81%	0.805	73%	0.731	S	S	*	*			trans	-97.6	116.5	167.9	-60.1	177.2	0	0	0	106.3	V398	V398-I400 HydrophobicContact CG1-CG1 4.28Å
401	I	28.8	Very low	26.5	Very low	228 Å²	228	128.3 Å²	128.3	100%	1.169	74%	0.735	S	S	*	*			trans	-70.6	0	171.6	-63.9	174.4	0	0	0	110.1

Retrieved 401 of 401 residues in 810.7 ms (Link to these results)

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