A0A096LQM1_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A096LQM1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 340 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	34	Very low	29.9	Very low	224 Å²	224	168.7 Å²	168.7	100%	1.103	79%	0.786	S	S	*	*				0	87.6	0	-60	-172.5	-164.8	0	0	111.2
2	D	32.3	Very low	29.6	Very low	148 Å²	148	164.4 Å²	164.4	79%	0.791	78%	0.781	S	S	*	*			cis	-148.6	158.1	-35	-90.7	-36.9	0	0	0	111.1
3	Q	27.2	Very low	29.6	Very low	166 Å²	166	163.2 Å²	163.2	78%	0.776	79%	0.791	S	S	*	*			trans	-56.4	155.6	-179.2	-54.2	170	8.2	0	0	113.9
4	Q	30.2	Very low	29.4	Very low	202 Å²	202	168.9 Å²	168.9	94%	0.944	80%	0.8	S	S	*	*				-147.5	145.2	120.8	-111.5	172.4	10.9	0	0	111.4
5	R	31.6	Very low	29.3	Very low	218 Å²	218	165.9 Å²	165.9	82%	0.823	80%	0.804	S	S	*	*			trans	-134.4	146.6	-179.5	-86.5	-179.7	166	-179.2	-2.1	109.6
6	E	30.4	Very low	29.2	Very low	123 Å²	123	162.9 Å²	162.9	58%	0.575	80%	0.799	S	S	*	*				173.3	155.2	116.4	-82.6	-55.4	73.2	0	0	106.6
7	K	31.2	Very low	29.4	Very low	140 Å²	140	165.2 Å²	165.2	61%	0.609	80%	0.804	S	S	*	*			cis	93.3	157.9	12.7	-162.1	-132.8	178.1	-174.3	0	114.7
8	Y	28.3	Very low	29.4	Very low	193 Å²	193	163.2 Å²	163.2	76%	0.757	80%	0.802	S	S	*	*			trans	72.5	140.7	-168.8	-69.2	-83.1	0	0	0	116.1
9	G	27.3	Very low	29.3	Very low	69 Å²	69	162.5 Å²	162.5	71%	0.711	80%	0.803	S	S	*	*			cis	-171.5	174.4	-0.9	0	0	0	0	0	113.5
10	E	27	Very low	29.4	Very low	169 Å²	169	164.2 Å²	164.2	79%	0.79	81%	0.808	S	S	*	*			trans	-67.9	176.8	-176.5	-43.4	179	128.9	0	0	113.5
11	R	29.3	Very low	29.3	Very low	204 Å²	204	159.9 Å²	159.9	77%	0.77	81%	0.806	S	S	*	*			cis	-177.7	147.9	47.1	-136.6	175.4	-156.9	-159.4	-1.2	115
12	T	26.4	Very low	29.2	Very low	117 Å²	117	157.2 Å²	157.2	72%	0.718	80%	0.796	S	S	*	*			trans	31.6	137.9	145.7	52.5	0	0	0	0	124.5
13	T	29.3	Very low	29.2	Very low	149 Å²	149	161.8 Å²	161.8	91%	0.914	80%	0.802	S	S	*	*				-150.4	151.2	117.2	22	0	0	0	0	112.7
14	R	27	Very low	29.4	Very low	243 Å²	243	159.6 Å²	159.6	92%	0.917	81%	0.805	S	S	*	*			trans	-93.4	158	175.9	-75.7	172.4	164.1	167.3	-6.5	111.7
15	S	28	Very low	29.4	Very low	124 Å²	124	153.5 Å²	153.5	87%	0.867	80%	0.797	S	S	*	*			trans	-151.1	156.3	142.2	-162.7	0	0	0	0	111.6
16	T	28	Very low	29.6	Very low	117 Å²	117	152.6 Å²	152.6	72%	0.718	80%	0.801	S	S	*	*			trans	-126.7	149.5	-166	40.4	0	0	0	0	113
17	K	31.8	Very low	29.6	Very low	202 Å²	202	157.7 Å²	157.7	88%	0.878	82%	0.816	S	S	*	*			trans	-179.4	107.8	154.2	-100	158.1	-174.9	-175.5	0	107.5
18	V	29.6	Very low	29.9	Very low	129 Å²	129	156.9 Å²	156.9	78%	0.782	83%	0.825	S	S	*	*				79.8	112.2	73.5	174.8	0	0	0	0	114.1
19	N	27.9	Very low	30.2	Very low	151 Å²	151	153 Å²	153	81%	0.807	83%	0.826	S	S	*	*			trans	26.2	128.7	156.6	-73.7	-3.5	0	0	0	121.6
20	Q	30.3	Very low	30.4	Very low	196 Å²	196	153 Å²	153	92%	0.916	83%	0.825	S	S	*	*				-158.8	148.8	97.9	-101.7	173.8	24	0	0	110.5
21	G	28.9	Very low	30.8	Very low	74 Å²	74	149.9 Å²	149.9	76%	0.763	82%	0.822	S	S	*	*			trans	-100.1	156	179.6	0	0	0	0	0	112.2
22	N	30.4	Very low	31.1	Very low	168 Å²	168	144.6 Å²	144.6	90%	0.898	82%	0.817	S	S	*	*			trans	-150.9	132.7	156.8	-135	-6.7	0	0	0	111.2
23	R	32.9	Very low	31.7	Very low	243 Å²	243	146.2 Å²	146.2	92%	0.917	82%	0.821	S	S	*	*			trans	-93.8	127.8	173.1	-79.4	179	168.8	-178.5	-3.2	109
24	S	31.7	Very low	32.3	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	81%	0.812	S	S	*	*			trans	-170.4	149.6	147.4	46.3	0	0	0	0	112.7
25	G	30.3	Very low	33.4	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	81%	0.805	S	S	*	*			trans	76.2	82.4	150.8	0	0	0	0	0	118.3	R27	G25-R27 PolarHBondContact O-N 2.81Å
26	H	34.8	Very low	35.1	Very low	199 Å²	199	135.4 Å²	135.4	92%	0.921	79%	0.793	S	S	*	*			trans	-60.5	117.2	149.8	-90.6	28.3	0	0	0	109.7
27	R	32.3	Very low	37.4	Very low	231 Å²	231	133.9 Å²	133.9	87%	0.872	78%	0.784	S	S	*	*			trans	-123.5	113.1	150.2	-84.1	-173.9	168.5	-166	-3	106.9	G25 S29	G25-R27 PolarHBondContact O-N 2.81Å; R27-S29 PolarHBondContact O-N 3.44Å
28	P	36.1	Very low	40.2	Very low	123 Å²	123	127.8 Å²	127.8	80%	0.799	76%	0.76	S	S	*	*			trans	-65.1	108.9	164.4	27.7	-30	0	0	0	106.4	G30	P28-G30 PolarHBondContact O-N 3.03Å
29	S	34.5	Very low	43.3	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	74%	0.738	S	S	*	*			trans	-62.5	96.7	163.2	53.1	0	0	0	0	106.2	R27 S31	R27-S29 PolarHBondContact O-N 3.44Å; S29-S31 VanDerWaalsContact C-N 3.26Å; S29-S31 PolarHBondContact O-N 2.65Å
30	G	32.7	Very low	46.5	Very low	68 Å²	68	117.5 Å²	117.5	70%	0.701	70%	0.7	S	S	*	*			trans	-61.3	93.6	175.8	0	0	0	0	0	108.5	P28 S32	P28-G30 PolarHBondContact O-N 3.03Å; G30-S32 PolarHBondContact O-N 2.55Å
31	S	35	Very low	49.5	Very low	104 Å²	104	109.4 Å²	109.4	73%	0.727	67%	0.669	S	S	*	*			trans	-61.1	93.9	157.3	54.6	0	0	0	0	105.3	S29 N33	S29-S31 VanDerWaalsContact C-N 3.26Å; S29-S31 PolarHBondContact O-N 2.65Å; S31-N33 PolarHBondContact O-N 2.66Å
32	S	35.2	Very low	52.5	Low	94 Å²	94	110.2 Å²	110.2	66%	0.657	66%	0.661	S	S	*	*			trans	-64	89.8	170.4	44.7	0	0	0	0	106.8	G30 T34	G30-S32 PolarHBondContact O-N 2.55Å; S32-T34 PolarHBondContact O-N 3.19Å
33	N	39.6	Very low	55.6	Low	151 Å²	151	102.9 Å²	102.9	81%	0.807	62%	0.622	S	S	*	*			trans	-62.5	70.7	153.8	-101.4	-1	0	0	0	106.9	S31 S35	S31-N33 PolarHBondContact O-N 2.66Å; N33-S35 PolarHBondContact O-N 3.46Å
34	T	41.2	Very low	58.7	Low	117 Å²	117	91.8 Å²	91.8	72%	0.718	58%	0.58	S	S	*	*			trans	-62	90.2	146.5	49.8	0	0	0	0	104.1	S32 G36	S32-T34 PolarHBondContact O-N 3.19Å; T34-G36 PolarHBondContact O-N 2.79Å
35	S	50	Low	61.8	Low	110 Å²	110	91.6 Å²	91.6	77%	0.769	56%	0.561	S	S	*	*			trans	-63.4	75.7	161.9	36.6	0	0	0	0	106.4	N33 V37	N33-S35 PolarHBondContact O-N 3.46Å; S35-V37 PolarHBondContact O-N 3.22Å; S35-V37 VanDerWaalsContact O-N 3.08Å
36	G	62.8	Low	65	Low	61 Å²	61	88.9 Å²	88.9	63%	0.629	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-54.3	118.2	-169.8	0	0	0	0	0	108.3	T34 L38	T34-G36 PolarHBondContact O-N 2.79Å; G36-L38 PolarHBondContact O-N 3.41Å
37	V	77.1	Confident	67.8	Low	85 Å²	85	81.4 Å²	81.4	52%	0.515	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-58	118.7	-178.9	-177.3	0	0	0	0	107.2	S35 M39 R45	S35-V37 PolarHBondContact O-N 3.22Å; S35-V37 VanDerWaalsContact O-N 3.08Å; V37-M39 WeakPolarHBondContact O-CG 3.47Å; V37-M39 PolarHBondContact O-N 3.15Å; V37-R45 HydrophobicContact CG1-CG 3.55Å
38	L	89.9	Confident	70.6	Confident	75 Å²	75	76 Å²	76	39%	0.393	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-62.9	126.6	-174.5	-177.2	66.5	0	0	0	109.4	G36 V46	G36-L38 PolarHBondContact O-N 3.41Å; L38-V46 HydrophobicContact CB-CB 4.11Å; L38-V46 HydrophobicContact CB-CG2 4.32Å; L38-V46 HydrophobicContact CD2-CB 4.24Å; L38-V46 HydrophobicContact CD2-CG1 4.26Å; L38-V46 HydrophobicContact CD2-CG2 4.14Å; L38-V46 HydrophobicContact CG-CB 4.22Å; L38-V46 HydrophobicContact CG-CG2 3.96Å; L38-V46 WeakPolarHBondContact O-CB 3.39Å; L38-V46 WeakPolarHBondContact O-CG2 3.41Å; L38-V46 PolarHBondContact O-N 2.95Å
39	M	95.1	Very high	73.3	Confident	63 Å²	63	75.2 Å²	75.2	31%	0.31	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.2	-179.4	-64	-60.8	-63.5	0	0	110.6	V37 F44 R45 L64 C110	V37-M39 WeakPolarHBondContact O-CG 3.47Å; V37-M39 PolarHBondContact O-N 3.15Å; M39-F44 CarbonylContact C-O 3.54Å; M39-F44 WeakPolarHBondContact CA-O 3.17Å; M39-F44 VanDerWaalsContact CE-C 3.48Å; M39-F44 WeakPolarHBondContact CE-O 3.17Å; M39-R45 HydrophobicContact CE-CB 4.43Å; M39-R45 VanDerWaalsContact SD-CA 3.59Å; M39-R45 HydrophobicContact SD-CB 3.94Å; M39-R45 HydrophobicContact SD-CG 4.42Å; M39-L64 HydrophobicContact CE-CD1 3.68Å; M39-L64 HydrophobicContact CE-CG 4.42Å; M39-L64 HydrophobicContact SD-CD1 4.28Å; M39-C110 PolarHBondContact O-SG 2.83Å
40	V	95.4	Very high	75.8	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.9	166.3	178.8	0	0	0	0	107.6	F44 V46 I72 Y106 C110 A115 V117	V40-F44 HydrophobicContact CB-CB 4.23Å; V40-F44 PolarHBondContact N-O 2.87Å; V40-F44 WeakPolarHBondContact O-CB 3.29Å; V40-F44 WeakPolarHBondContact O-CD2 3.36Å; V40-F44 PolarHBondContact O-N 2.79Å; V40-F44 VanDerWaalsContact O-N 3.16Å; V40-V46 HydrophobicContact CG2-CG2 3.68Å; V40-I72 HydrophobicContact CG2-CD1 4.28Å; V40-I72 HydrophobicContact CG2-CG2 3.95Å; V40-Y106 HydrophobicContact CG1-CD1 3.51Å; V40-Y106 HydrophobicContact CG1-CE1 3.57Å; V40-C110 HydrophobicContact CG2-CB 3.86Å; V40-C110 VanDerWaalsContact CG2-SG 3.54Å; V40-A115 HydrophobicContact CB-CB 4.39Å; V40-A115 HydrophobicContact CG1-CB 3.62Å; V40-A115 HydrophobicContact CG2-CB 3.76Å; V40-V117 HydrophobicContact CB-CG2 4.13Å; V40-V117 HydrophobicContact CG1-CG2 3.54Å
41	G	93.4	Very high	77.9	Confident	27 Å²	27	68.3 Å²	68.3	28%	0.278	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	-156.3	-174.4	0	0	0	0	0	112.8
42	P	91.9	Very high	79.6	Confident	91 Å²	91	65.5 Å²	65.5	59%	0.591	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-18.7	-176	30.8	-33	0	0	0	114
43	N	96.1	Very high	80.9	Confident	13 Å²	13	62.3 Å²	62.3	7%	0.07	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.8	-5.2	-161.1	65.3	-50.9	0	0	0	116	N63 L64 Y65	N43-N63 PolarHBondContact ND2-OD1 3.07Å; N43-L64 WeakPolarHBondContact O-CB 3.21Å; N43-L64 WeakPolarHBondContact O-CG 3.38Å; N43-L64 PolarHBondContact O-N 3.07Å; N43-Y65 HydrophobicContact CB-CD1 3.87Å; N43-Y65 HydrophobicContact CB-CD2 3.65Å; N43-Y65 HydrophobicContact CB-CE1 3.81Å; N43-Y65 HydrophobicContact CB-CE2 3.6Å; N43-Y65 HydrophobicContact CB-CG 3.79Å
44	F	97.6	Very high	81.9	Confident	11 Å²	11	59 Å²	59	5%	0.048	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.8	-177.9	-55.2	-76.8	0	0	0	111.8	M39 V40 K62 N63 V70 I72 F105 Y106 V117	M39-F44 CarbonylContact C-O 3.54Å; M39-F44 WeakPolarHBondContact CA-O 3.17Å; M39-F44 VanDerWaalsContact CE-C 3.48Å; M39-F44 WeakPolarHBondContact CE-O 3.17Å; V40-F44 HydrophobicContact CB-CB 4.23Å; V40-F44 PolarHBondContact N-O 2.87Å; V40-F44 WeakPolarHBondContact O-CB 3.29Å; V40-F44 WeakPolarHBondContact O-CD2 3.36Å; V40-F44 PolarHBondContact O-N 2.79Å; V40-F44 VanDerWaalsContact O-N 3.16Å; F44-K62 WeakPolarHBondContact CA-O 3.33Å; F44-N63 HydrophobicContact CD1-CB 3.87Å; F44-N63 HydrophobicContact CE1-CB 3.77Å; F44-V70 HydrophobicContact CD1-CG1 4.48Å; F44-V70 HydrophobicContact CD1-CG2 4.05Å; F44-V70 HydrophobicContact CE1-CG1 4.36Å; F44-I72 HydrophobicContact CB-CD1 4.35Å; F44-F105 HydrophobicContact CE1-CB 4.42Å; F44-F105 HydrophobicContact CZ-CB 3.88Å; F44-Y106 HydrophobicContact CE2-CG 4.37Å; F44-V117 HydrophobicContact CB-CG1 4.45Å; F44-V117 HydrophobicContact CB-CG2 4.35Å; F44-V117 HydrophobicContact CD1-CG1 3.68Å; F44-V117 HydrophobicContact CD2-CB 4.44Å; F44-V117 HydrophobicContact CD2-CG1 4.26Å; F44-V117 HydrophobicContact CD2-CG2 4.05Å; F44-V117 HydrophobicContact CE1-CG1 3.86Å; F44-V117 HydrophobicContact CE2-CG1 4.44Å; F44-V117 HydrophobicContact CG-CB 4.48Å; F44-V117 HydrophobicContact CG-CG1 3.87Å; F44-V117 HydrophobicContact CG-CG2 4.15Å; F44-V117 HydrophobicContact CZ-CG1 4.25Å
45	R	96.9	Very high	83.1	Confident	116 Å²	116	56.5 Å²	56.5	44%	0.438	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.2	174.1	177.7	172.4	-64.8	177.2	2.8	110.3	V37 M39 G61 K62 L64	V37-R45 HydrophobicContact CG1-CG 3.55Å; M39-R45 HydrophobicContact CE-CB 4.43Å; M39-R45 VanDerWaalsContact SD-CA 3.59Å; M39-R45 HydrophobicContact SD-CB 3.94Å; M39-R45 HydrophobicContact SD-CG 4.42Å; R45-G61 CarbonylContact O-C 3.59Å; R45-G61 WeakPolarHBondContact O-CA 3.35Å; R45-K62 PolarHBondContact N-O 3.48Å; R45-K62 PolarHBondContact O-N 3.26Å; R45-L64 HydrophobicContact CB-CD1 4.33Å; R45-L64 HydrophobicContact CB-CD2 3.99Å; R45-L64 HydrophobicContact CB-CG 4.19Å
46	V	96.2	Very high	84.4	Confident	16 Å²	16	52.1 Å²	52.1	10%	0.097	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.1	172.6	-172.7	0	0	0	0	109.8	L38 V40 K59 I72	L38-V46 HydrophobicContact CB-CB 4.11Å; L38-V46 HydrophobicContact CB-CG2 4.32Å; L38-V46 HydrophobicContact CD2-CB 4.24Å; L38-V46 HydrophobicContact CD2-CG1 4.26Å; L38-V46 HydrophobicContact CD2-CG2 4.14Å; L38-V46 HydrophobicContact CG-CB 4.22Å; L38-V46 HydrophobicContact CG-CG2 3.96Å; L38-V46 WeakPolarHBondContact O-CB 3.39Å; L38-V46 WeakPolarHBondContact O-CG2 3.41Å; L38-V46 PolarHBondContact O-N 2.95Å; V40-V46 HydrophobicContact CG2-CG2 3.68Å; V46-K59 HydrophobicContact CG1-CB 4.04Å; V46-K59 HydrophobicContact CG1-CD 3.64Å; V46-K59 HydrophobicContact CG1-CG 4.38Å; V46-I72 HydrophobicContact CG2-CD1 3.93Å
47	G	94	Very high	85.6	Confident	42 Å²	42	52 Å²	52	43%	0.433	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-146.7	179	0	0	0	0	0	113	L60	G47-L60 CarbonylContact C-O 3.57Å; G47-L60 WeakPolarHBondContact CA-O 3.34Å; G47-L60 PolarHBondContact N-O 2.91Å
48	K	92.6	Very high	86.3	Confident	119 Å²	119	49.9 Å²	49.9	52%	0.517	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	150.8	-177.6	68.9	175	-176.1	174.8	0	112.2	I50 K59 L60	K48-I50 HydrophobicContact CG-CG2 4.23Å; K48-K59 WeakPolarHBondContact O-CA 3.49Å; K48-L60 HydrophobicContact CG-CB 4.34Å; K48-L60 HydrophobicContact CG-CD2 4.5Å; K48-L60 PolarHBondContact O-N 3.21Å
49	K	91.8	Very high	86.5	Confident	105 Å²	105	48 Å²	48	46%	0.457	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	136.9	165.6	-171.2	-179.8	177	-172.3	0	108.9	G51 C52	K49-G51 WeakPolarHBondContact CE-O 3.22Å; K49-C52 WeakPolarHBondContact CE-SG 3.35Å; K49-C52 PolarHBondContact NZ-SG 3.23Å
50	I	87.1	Confident	86.5	Confident	32 Å²	32	46.8 Å²	46.8	16%	0.164	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	-7.1	174	62.9	177.3	0	0	0	113.3	K48 L58 L60 L120 P337	K48-I50 HydrophobicContact CG-CG2 4.23Å; I50-L58 HydrophobicContact CD1-CD2 4.34Å; I50-L58 HydrophobicContact CD1-CG 4.28Å; I50-L58 HydrophobicContact CG1-CB 4.45Å; I50-L58 HydrophobicContact CG1-CD2 4.16Å; I50-L58 HydrophobicContact CG1-CG 3.96Å; I50-L58 PolarHBondContact N-O 3.32Å; I50-L60 HydrophobicContact CD1-CB 4.38Å; I50-L60 HydrophobicContact CG2-CB 3.69Å; I50-L120 HydrophobicContact CD1-CD1 3.95Å; I50-P337 HydrophobicContact CB-CB 4.04Å; I50-P337 HydrophobicContact CG2-CB 4.13Å
51	G	77.6	Confident	86.6	Confident	2 Å²	2	46.9 Å²	46.9	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	-176.3	169.5	0	0	0	0	0	114.7	K49 L58	K49-G51 WeakPolarHBondContact CE-O 3.22Å; G51-L58 PolarHBondContact N-O 3.46Å; G51-L58 VanDerWaalsContact N-O 3.08Å; G51-L58 PolarHBondContact O-N 2.81Å
52	C	69.5	Low	86.7	Confident	46 Å²	46	48.1 Å²	48.1	31%	0.311	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.1	169.3	-56.9	0	0	0	0	107.5	K49 F340	K49-C52 WeakPolarHBondContact CE-SG 3.35Å; K49-C52 PolarHBondContact NZ-SG 3.23Å; C52-F340 HydrophobicContact CB-CB 3.88Å; C52-F340 WeakPolarHBondContact O-CB 3.06Å; C52-F340 PolarHBondContact SG-O 3.18Å
53	G	63.8	Low	87	Confident	27 Å²	27	44.6 Å²	44.6	28%	0.278	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	163.9	163.6	0	0	0	0	0	109.9	F55 G56	G53-F55 PolarHBondContact O-N 3Å; G53-G56 PolarHBondContact N-O 2.91Å; G53-G56 PolarHBondContact O-N 3.24Å
54	N	60.5	Low	87	Confident	80 Å²	80	47.4 Å²	47.4	43%	0.428	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-28.9	175.4	-75.5	-46.3	0	0	0	113.9	D164 K166 D187	N54-D164 PolarHBondContact ND2-OD2 3.06Å; N54-K166 PolarHBondContact ND2-NZ 3.2Å; N54-D187 PolarHBondContact ND2-OD2 3.33Å
55	F	65.7	Low	87	Confident	65 Å²	65	55 Å²	55	29%	0.285	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.8	12.2	-171.8	-49.3	-71.1	0	0	0	114.5	G53 Q83 L190	G53-F55 PolarHBondContact O-N 3Å; F55-Q83 VanDerWaalsContact CE1-NE2 3.27Å; F55-Q83 VanDerWaalsContact CZ-NE2 3.28Å; F55-L190 HydrophobicContact CE2-CD2 4.1Å; F55-L190 HydrophobicContact CE2-CG 4.13Å; F55-L190 HydrophobicContact CZ-CD2 3.89Å; F55-L190 HydrophobicContact CZ-CG 4.29Å
56	G	76.3	Confident	86.9	Confident	19 Å²	19	52.9 Å²	52.9	20%	0.196	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	-178.8	-174.9	0	0	0	0	0	116	G53 L74	G53-G56 PolarHBondContact N-O 2.91Å; G53-G56 PolarHBondContact O-N 3.24Å; G56-L74 CarbonylContact C-O 3.56Å; G56-L74 VanDerWaalsContact CA-O 3.22Å; G56-L74 WeakPolarHBondContact CA-O 3.3Å
57	E	88.4	Confident	86.8	Confident	58 Å²	58	57.5 Å²	57.5	27%	0.271	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.6	176.2	-66.3	173.3	-133.2	0	0	110.6	K59 L74 Y113	E57-K59 WeakPolarHBondContact OE2-CE 3.48Å; E57-K59 IonicContact OE2-NZ 2.76Å; E57-K59 PolarHBondContact OE2-NZ 3.02Å; E57-L74 HydrophobicContact CB-CB 4.44Å; E57-L74 PolarHBondContact N-O 2.94Å; E57-L74 PolarHBondContact O-N 2.67Å; E57-Y113 PolarHBondContact OE1-OH 3.39Å
58	L	92.4	Very high	86.8	Confident	40 Å²	40	60.9 Å²	60.9	21%	0.209	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.1	169.9	-167.8	69	0	0	0	109.8	I50 G51 A71 K73	I50-L58 HydrophobicContact CD1-CD2 4.34Å; I50-L58 HydrophobicContact CD1-CG 4.28Å; I50-L58 HydrophobicContact CG1-CB 4.45Å; I50-L58 HydrophobicContact CG1-CD2 4.16Å; I50-L58 HydrophobicContact CG1-CG 3.96Å; I50-L58 PolarHBondContact N-O 3.32Å; G51-L58 PolarHBondContact N-O 3.46Å; G51-L58 VanDerWaalsContact N-O 3.08Å; G51-L58 PolarHBondContact O-N 2.81Å; L58-A71 HydrophobicContact CD1-CB 4.32Å; L58-K73 HydrophobicContact CD1-CB 4.06Å; L58-K73 HydrophobicContact CD1-CG 4.43Å
59	K	94.1	Very high	86.9	Confident	35 Å²	35	60.4 Å²	60.4	15%	0.152	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.9	-178.7	-56.5	-160.8	172.7	168.4	0	111.7	V46 K48 E57 G61 I72 L74	V46-K59 HydrophobicContact CG1-CB 4.04Å; V46-K59 HydrophobicContact CG1-CD 3.64Å; V46-K59 HydrophobicContact CG1-CG 4.38Å; K48-K59 WeakPolarHBondContact O-CA 3.49Å; E57-K59 WeakPolarHBondContact OE2-CE 3.48Å; E57-K59 IonicContact OE2-NZ 2.76Å; E57-K59 PolarHBondContact OE2-NZ 3.02Å; K59-G61 PolarHBondContact O-N 3.32Å; K59-I72 PolarHBondContact N-O 3Å; K59-I72 PolarHBondContact O-N 3.25Å; K59-L74 HydrophobicContact CD-CD1 3.85Å; K59-L74 HydrophobicContact CG-CD1 4.25Å
60	L	95.4	Very high	87.2	Confident	38 Å²	38	55.6 Å²	55.6	20%	0.199	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	129.3	164.6	-178.9	63.2	0	0	0	107.7	G47 K48 I50 Y69 L120	G47-L60 CarbonylContact C-O 3.57Å; G47-L60 WeakPolarHBondContact CA-O 3.34Å; G47-L60 PolarHBondContact N-O 2.91Å; K48-L60 HydrophobicContact CG-CB 4.34Å; K48-L60 HydrophobicContact CG-CD2 4.5Å; K48-L60 PolarHBondContact O-N 3.21Å; I50-L60 HydrophobicContact CD1-CB 4.38Å; I50-L60 HydrophobicContact CG2-CB 3.69Å; L60-Y69 HydrophobicContact CD1-CD1 3.85Å; L60-Y69 HydrophobicContact CD1-CG 4.28Å; L60-Y69 HydrophobicContact CD2-CD1 4.17Å; L60-Y69 HydrophobicContact CD2-CE1 4.26Å; L60-Y69 HydrophobicContact CG-CD1 4.1Å; L60-L120 HydrophobicContact CD1-CD1 4.37Å; L60-L120 HydrophobicContact CD1-CD2 3.6Å
61	G	96.3	Very high	87.6	Confident	2 Å²	2	54.4 Å²	54.4	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	169.6	170.4	0	0	0	0	0	112	R45 K59 Y69 V70	R45-G61 CarbonylContact O-C 3.59Å; R45-G61 WeakPolarHBondContact O-CA 3.35Å; K59-G61 PolarHBondContact O-N 3.32Å; G61-Y69 WeakPolarHBondContact O-CA 3.45Å; G61-V70 PolarHBondContact N-O 2.85Å; G61-V70 PolarHBondContact O-N 3.43Å
62	K	97.1	Very high	88.5	Confident	53 Å²	53	54.3 Å²	54.3	23%	0.23	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.2	172.3	-164	173.8	-176.2	-178.7	0	111	F44 R45 L64 N67 E68 Y69	F44-K62 WeakPolarHBondContact CA-O 3.33Å; R45-K62 PolarHBondContact N-O 3.48Å; R45-K62 PolarHBondContact O-N 3.26Å; K62-L64 PolarHBondContact O-N 3.48Å; K62-N67 WeakPolarHBondContact CE-O 3.47Å; K62-N67 WeakPolarHBondContact CE-OD1 3.37Å; K62-N67 PolarHBondContact NZ-OD1 3.36Å; K62-E68 CarbonylContact C-O 3.58Å; K62-E68 WeakPolarHBondContact CA-O 3.29Å; K62-E68 WeakPolarHBondContact CG-O 3.5Å; K62-Y69 HydrophobicContact CB-CD1 4.26Å; K62-Y69 HydrophobicContact CB-CE1 4.42Å; K62-Y69 HydrophobicContact CD-CD1 4.41Å; K62-Y69 HydrophobicContact CD-CE1 3.97Å; K62-Y69 HydrophobicContact CG-CD1 4.22Å; K62-Y69 HydrophobicContact CG-CE1 4.27Å
63	N	97.3	Very high	89.7	Confident	17 Å²	17	52.9 Å²	52.9	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	114.3	169.3	-175.9	-13.9	0	0	0	108.5	N43 F44 Y65 T66 N67 E68 V70	N43-N63 PolarHBondContact ND2-OD1 3.07Å; F44-N63 HydrophobicContact CD1-CB 3.87Å; F44-N63 HydrophobicContact CE1-CB 3.77Å; N63-Y65 VanDerWaalsContact C-N 3.28Å; N63-Y65 PolarHBondContact O-N 3.17Å; N63-Y65 PolarHBondContact OD1-N 3.3Å; N63-T66 WeakPolarHBondContact CB-OG1 3.46Å; N63-T66 VanDerWaalsContact CG-OG1 3.26Å; N63-T66 PolarHBondContact ND2-OG1 2.94Å; N63-T66 VanDerWaalsContact ND2-OG1 3.1Å; N63-T66 PolarHBondContact OD1-N 2.87Å; N63-N67 CarbonylContact O-C 3.53Å; N63-N67 WeakPolarHBondContact O-CA 3.31Å; N63-N67 PolarHBondContact O-N 3.18Å; N63-E68 PolarHBondContact N-O 2.8Å; N63-V70 HydrophobicContact CB-CG1 4.47Å
64	L	96.5	Very high	91.2	Very high	73 Å²	73	51.6 Å²	51.6	38%	0.382	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-15.1	-177.8	-60.4	-176	0	0	0	113.3	M39 N43 R45 K62	M39-L64 HydrophobicContact CE-CD1 3.68Å; M39-L64 HydrophobicContact CE-CG 4.42Å; M39-L64 HydrophobicContact SD-CD1 4.28Å; N43-L64 WeakPolarHBondContact O-CB 3.21Å; N43-L64 WeakPolarHBondContact O-CG 3.38Å; N43-L64 PolarHBondContact O-N 3.07Å; R45-L64 HydrophobicContact CB-CD1 4.33Å; R45-L64 HydrophobicContact CB-CD2 3.99Å; R45-L64 HydrophobicContact CB-CG 4.19Å; K62-L64 PolarHBondContact O-N 3.48Å
65	Y	97	Very high	92.8	Very high	171 Å²	171	48 Å²	48	67%	0.671	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-39.8	176.8	-63.5	-13.2	0	0	0	112.2	N43 N63	N43-Y65 HydrophobicContact CB-CD1 3.87Å; N43-Y65 HydrophobicContact CB-CD2 3.65Å; N43-Y65 HydrophobicContact CB-CE1 3.81Å; N43-Y65 HydrophobicContact CB-CE2 3.6Å; N43-Y65 HydrophobicContact CB-CG 3.79Å; N63-Y65 VanDerWaalsContact C-N 3.28Å; N63-Y65 PolarHBondContact O-N 3.17Å; N63-Y65 PolarHBondContact OD1-N 3.3Å
66	T	96	Very high	94.1	Very high	71 Å²	71	47.6 Å²	47.6	44%	0.436	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-6.8	179	64.9	0	0	0	0	113.7	N63 E68	N63-T66 WeakPolarHBondContact CB-OG1 3.46Å; N63-T66 VanDerWaalsContact CG-OG1 3.26Å; N63-T66 PolarHBondContact ND2-OG1 2.94Å; N63-T66 VanDerWaalsContact ND2-OG1 3.1Å; N63-T66 PolarHBondContact OD1-N 2.87Å; T66-E68 WeakPolarHBondContact CB-OE2 3.38Å; T66-E68 PolarHBondContact O-N 3.23Å; T66-E68 WeakPolarHBondContact OG1-CB 3.26Å; T66-E68 WeakPolarHBondContact OG1-CG 3.16Å; T66-E68 PolarHBondContact OG1-OE2 3.17Å
67	N	94	Very high	94.9	Very high	113 Å²	113	50.7 Å²	50.7	60%	0.604	25%	0.251	S	S	*	.			trans	63.6	8.3	-173	-164.8	41.4	0	0	0	114.3	K62 N63	K62-N67 WeakPolarHBondContact CE-O 3.47Å; K62-N67 WeakPolarHBondContact CE-OD1 3.37Å; K62-N67 PolarHBondContact NZ-OD1 3.36Å; N63-N67 CarbonylContact O-C 3.53Å; N63-N67 WeakPolarHBondContact O-CA 3.31Å; N63-N67 PolarHBondContact O-N 3.18Å
68	E	93.6	Very high	95.1	Very high	112 Å²	112	57.5 Å²	57.5	52%	0.523	28%	0.28	S	S	.	.			trans	-83.7	152.1	-177.2	-64.3	170.4	123	0	0	113.3	K62 N63 T66	K62-E68 CarbonylContact C-O 3.58Å; K62-E68 WeakPolarHBondContact CA-O 3.29Å; K62-E68 WeakPolarHBondContact CG-O 3.5Å; N63-E68 PolarHBondContact N-O 2.8Å; T66-E68 WeakPolarHBondContact CB-OE2 3.38Å; T66-E68 PolarHBondContact O-N 3.23Å; T66-E68 WeakPolarHBondContact OG1-CB 3.26Å; T66-E68 WeakPolarHBondContact OG1-CG 3.16Å; T66-E68 PolarHBondContact OG1-OE2 3.17Å
69	Y	95.3	Very high	95.1	Very high	110 Å²	110	57.5 Å²	57.5	43%	0.431	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	141.7	172.1	-69.4	-73.6	0	0	0	111.8	L60 G61 K62	L60-Y69 HydrophobicContact CD1-CD1 3.85Å; L60-Y69 HydrophobicContact CD1-CG 4.28Å; L60-Y69 HydrophobicContact CD2-CD1 4.17Å; L60-Y69 HydrophobicContact CD2-CE1 4.26Å; L60-Y69 HydrophobicContact CG-CD1 4.1Å; G61-Y69 WeakPolarHBondContact O-CA 3.45Å; K62-Y69 HydrophobicContact CB-CD1 4.26Å; K62-Y69 HydrophobicContact CB-CE1 4.42Å; K62-Y69 HydrophobicContact CD-CD1 4.41Å; K62-Y69 HydrophobicContact CD-CE1 3.97Å; K62-Y69 HydrophobicContact CG-CD1 4.22Å; K62-Y69 HydrophobicContact CG-CE1 4.27Å
70	V	96.8	Very high	94.8	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.018	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.5	-177.3	-63.8	0	0	0	0	110.4	F44 G61 N63 I72 F105 V117 M118	F44-V70 HydrophobicContact CD1-CG1 4.48Å; F44-V70 HydrophobicContact CD1-CG2 4.05Å; F44-V70 HydrophobicContact CE1-CG1 4.36Å; G61-V70 PolarHBondContact N-O 2.85Å; G61-V70 PolarHBondContact O-N 3.43Å; N63-V70 HydrophobicContact CB-CG1 4.47Å; V70-I72 HydrophobicContact CG2-CD1 4.45Å; V70-I72 HydrophobicContact CG2-CG1 4.17Å; V70-F105 HydrophobicContact CG1-CD2 3.96Å; V70-F105 HydrophobicContact CG1-CE2 3.75Å; V70-V117 HydrophobicContact CB-CG1 3.85Å; V70-V117 HydrophobicContact CG1-CG1 4.31Å; V70-V117 HydrophobicContact CG2-CG1 3.6Å; V70-M118 WeakPolarHBondContact CB-O 3.4Å
71	A	96.3	Very high	94.3	Very high	8 Å²	8	68.6 Å²	68.6	7%	0.066	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.7	166.7	0	0	0	0	0	109.8	L58 V117 M118 L120	L58-A71 HydrophobicContact CD1-CB 4.32Å; A71-V117 WeakPolarHBondContact O-CA 3.38Å; A71-M118 HydrophobicContact CB-CG 3.9Å; A71-M118 PolarHBondContact N-O 3.3Å; A71-M118 PolarHBondContact O-N 3.38Å; A71-L120 HydrophobicContact CB-CD1 4.1Å
72	I	96.3	Very high	94	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	109.5	177.9	-56.3	-175.9	0	0	0	108.8	V40 F44 V46 K59 V70 L74 M116 V117	V40-I72 HydrophobicContact CG2-CD1 4.28Å; V40-I72 HydrophobicContact CG2-CG2 3.95Å; F44-I72 HydrophobicContact CB-CD1 4.35Å; V46-I72 HydrophobicContact CG2-CD1 3.93Å; K59-I72 PolarHBondContact N-O 3Å; K59-I72 PolarHBondContact O-N 3.25Å; V70-I72 HydrophobicContact CG2-CD1 4.45Å; V70-I72 HydrophobicContact CG2-CG1 4.17Å; I72-L74 HydrophobicContact CG2-CD2 3.76Å; I72-L74 HydrophobicContact CG2-CG 4.05Å; I72-M116 WeakPolarHBondContact CA-O 3.37Å; I72-V117 HydrophobicContact CG1-CG1 4.19Å; I72-V117 HydrophobicContact CG1-CG2 4.22Å
73	K	95.4	Very high	93.7	Very high	15 Å²	15	71.6 Å²	71.6	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.9	174	-161.7	174.9	-171.4	-169.7	0	108.6	L58 L84 E87 A115 M116 D187	L58-K73 HydrophobicContact CD1-CB 4.06Å; L58-K73 HydrophobicContact CD1-CG 4.43Å; K73-L84 HydrophobicContact CB-CD1 4.07Å; K73-L84 HydrophobicContact CD-CD1 3.64Å; K73-L84 HydrophobicContact CG-CD1 3.84Å; K73-E87 IonicContact NZ-OE1 3.29Å; K73-E87 PolarHBondContact NZ-OE1 3.05Å; K73-E87 IonicContact NZ-OE2 3.18Å; K73-E87 PolarHBondContact NZ-OE2 3.33Å; K73-A115 WeakPolarHBondContact O-CA 3.38Å; K73-M116 HydrophobicContact CD-CE 4.41Å; K73-M116 PolarHBondContact N-O 2.74Å; K73-M116 PolarHBondContact O-N 2.86Å; K73-D187 IonicContact NZ-OD1 2.73Å; K73-D187 PolarHBondContact NZ-OD1 3.39Å
74	L	94.6	Very high	93.6	Very high	1 Å²	1	71 Å²	71	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.7	-175.5	-63.9	176.6	0	0	0	110.9	G56 E57 K59 I72 C110 Y113 N114 A115	G56-L74 CarbonylContact C-O 3.56Å; G56-L74 VanDerWaalsContact CA-O 3.22Å; G56-L74 WeakPolarHBondContact CA-O 3.3Å; E57-L74 HydrophobicContact CB-CB 4.44Å; E57-L74 PolarHBondContact N-O 2.94Å; E57-L74 PolarHBondContact O-N 2.67Å; K59-L74 HydrophobicContact CD-CD1 3.85Å; K59-L74 HydrophobicContact CG-CD1 4.25Å; I72-L74 HydrophobicContact CG2-CD2 3.76Å; I72-L74 HydrophobicContact CG2-CG 4.05Å; L74-C110 HydrophobicContact CD2-CB 4.37Å; L74-Y113 HydrophobicContact CB-CD1 3.92Å; L74-Y113 HydrophobicContact CB-CE1 4.49Å; L74-Y113 HydrophobicContact CB-CG 4.23Å; L74-N114 WeakPolarHBondContact CA-O 3.19Å; L74-A115 HydrophobicContact CD2-CB 3.53Å
75	E	94.6	Very high	93.5	Very high	4 Å²	4	71.8 Å²	71.8	2%	0.019	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128	176.1	177	-174.5	-100.2	0	0	109.4	V77 P82 Q83 L84 Y113 N114	E75-V77 PolarHBondContact O-N 2.8Å; E75-P82 WeakPolarHBondContact OE1-CA 3.43Å; E75-Q83 PolarHBondContact OE1-N 2.97Å; E75-L84 HydrophobicContact CB-CB 3.83Å; E75-L84 HydrophobicContact CB-CD2 3.75Å; E75-L84 HydrophobicContact CB-CG 4.38Å; E75-L84 HydrophobicContact CG-CB 4.35Å; E75-L84 PolarHBondContact OE1-N 3.18Å; E75-Y113 CarbonylContact O-C 3.58Å; E75-Y113 WeakPolarHBondContact O-CA 3.38Å; E75-Y113 WeakPolarHBondContact O-CB 3.31Å; E75-N114 PolarHBondContact N-O 3.19Å; E75-N114 PolarHBondContact O-N 3Å
76	P	93.6	Very high	93.4	Very high	56 Å²	56	67.5 Å²	67.5	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	132.7	176.5	-22.9	33.4	0	0	0	111.7	K78 S79 Y113	P76-K78 PolarHBondContact O-N 2.89Å; P76-S79 VanDerWaalsContact O-CB 3.3Å; P76-S79 WeakPolarHBondContact O-CB 3.14Å; P76-S79 PolarHBondContact O-N 3.28Å; P76-Y113 HydrophobicContact CB-CD1 4.46Å; P76-Y113 HydrophobicContact CG-CD1 4.16Å; P76-Y113 HydrophobicContact CG-CE1 4.06Å
77	V	92.4	Very high	93.4	Very high	85 Å²	85	64.3 Å²	64.3	52%	0.515	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.9	178.4	176.1	0	0	0	0	112.1	E75 K112	E75-V77 PolarHBondContact O-N 2.8Å; V77-K112 PolarHBondContact N-O 3.32Å
78	K	92.8	Very high	93.5	Very high	200 Å²	200	61.4 Å²	61.4	87%	0.87	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	19.7	175.3	-59.2	-172.3	178	-174.2	0	113.8	P76	P76-K78 PolarHBondContact O-N 2.89Å
79	S	90.9	Very high	93.7	Very high	40 Å²	40	63.7 Å²	63.7	28%	0.28	31%	0.306	S	S	.	.			trans	-58.5	139.1	174.5	-177.3	0	0	0	0	110.8	P76 A81	P76-S79 VanDerWaalsContact O-CB 3.3Å; P76-S79 WeakPolarHBondContact O-CB 3.14Å; P76-S79 PolarHBondContact O-N 3.28Å; S79-A81 VanDerWaalsContact C-N 3.27Å; S79-A81 PolarHBondContact OG-N 3.2Å; S79-A81 PolarHBondContact OG-O 3.15Å
80	R	88	Confident	93.7	Very high	253 Å²	253	59 Å²	59	96%	0.955	29%	0.288	S	S	*	.	S	Bend	trans	-74.7	-18.9	175.8	-66.5	-176.7	179.7	178.6	-0.4	112.9
81	A	86.7	Confident	93.7	Very high	53 Å²	53	59.2 Å²	59.2	44%	0.438	29%	0.289	S	S	.	.	S	Bend	trans	-140.7	77.9	178.4	0	0	0	0	0	108.4	S79	S79-A81 VanDerWaalsContact C-N 3.27Å; S79-A81 PolarHBondContact OG-N 3.2Å; S79-A81 PolarHBondContact OG-O 3.15Å
82	P	89.4	Confident	93.7	Very high	88 Å²	88	63.9 Å²	63.9	57%	0.571	31%	0.307	S	S	*	.			trans	-71	133.3	179.4	29.8	-34.1	0	0	0	110.7	E75	E75-P82 WeakPolarHBondContact OE1-CA 3.43Å
83	Q	91.1	Very high	93.6	Very high	31 Å²	31	66.4 Å²	66.4	15%	0.145	33%	0.325	C	S	.	.			trans	-131.5	-25.1	-178.1	-63.8	-176.7	17.4	0	0	112.8	F55 E75 H85 L86 E87 G189	F55-Q83 VanDerWaalsContact CE1-NE2 3.27Å; F55-Q83 VanDerWaalsContact CZ-NE2 3.28Å; E75-Q83 PolarHBondContact OE1-N 2.97Å; Q83-H85 PolarHBondContact O-N 2.81Å; Q83-H85 VanDerWaalsContact O-N 3.11Å; Q83-L86 WeakPolarHBondContact O-CA 3.43Å; Q83-L86 WeakPolarHBondContact O-CB 3.37Å; Q83-L86 PolarHBondContact O-N 3.38Å; Q83-E87 PolarHBondContact O-N 2.81Å; Q83-G189 VanDerWaalsContact OE1-C 3.25Å; Q83-G189 PolarHBondContact OE1-O 3.46Å
84	L	94.1	Very high	93.5	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-31.8	-170.5	-168	67.3	0	0	0	113.6	K73 E75 E87 Y88 F107 N114 M116	K73-L84 HydrophobicContact CB-CD1 4.07Å; K73-L84 HydrophobicContact CD-CD1 3.64Å; K73-L84 HydrophobicContact CG-CD1 3.84Å; E75-L84 HydrophobicContact CB-CB 3.83Å; E75-L84 HydrophobicContact CB-CD2 3.75Å; E75-L84 HydrophobicContact CB-CG 4.38Å; E75-L84 HydrophobicContact CG-CB 4.35Å; E75-L84 PolarHBondContact OE1-N 3.18Å; L84-E87 WeakPolarHBondContact CD1-OE2 3.2Å; L84-Y88 WeakPolarHBondContact O-CB 3.42Å; L84-Y88 PolarHBondContact O-N 3.2Å; L84-F107 HydrophobicContact CB-CE2 4.46Å; L84-F107 HydrophobicContact CD2-CE2 4.29Å; L84-F107 HydrophobicContact CG-CE2 4.02Å; L84-N114 HydrophobicContact CD2-CB 4.06Å; L84-N114 WeakPolarHBondContact CD2-O 3.37Å; L84-M116 HydrophobicContact CD1-CB 3.93Å; L84-M116 HydrophobicContact CD1-CE 4Å; L84-M116 HydrophobicContact CD2-CB 4.25Å; L84-M116 HydrophobicContact CG-CB 4.16Å
85	H	95.4	Very high	93.3	Very high	90 Å²	90	66.9 Å²	66.9	42%	0.417	34%	0.335	S	S	.	.	H	α-helix	trans	-71.1	-34.9	174.6	-173.3	65.6	0	0	0	113.3	Q83 R89 F107	Q83-H85 PolarHBondContact O-N 2.81Å; Q83-H85 VanDerWaalsContact O-N 3.11Å; H85-R89 PolarHBondContact O-N 2.67Å; H85-R89 VanDerWaalsContact O-N 3.15Å; H85-F107 HydrophobicContact CB-CE1 4.38Å; H85-F107 HydrophobicContact CB-CE2 4.32Å; H85-F107 HydrophobicContact CB-CZ 3.72Å; H85-F107 AromaticContact CG-CZ 3.99Å; H85-F107 AromaticContact ND1-CD1 3.98Å; H85-F107 AromaticContact ND1-CE1 3.21Å; H85-F107 WeakPolarHBondContact ND1-CE1 3.34Å; H85-F107 AromaticContact ND1-CZ 3.46Å; H85-F107 WeakPolarHBondContact ND1-CZ 3.41Å
86	L	94.9	Very high	92.5	Very high	82 Å²	82	71.5 Å²	71.5	43%	0.429	36%	0.363	S	S	.	.	H	α-helix	trans	-73.3	-43.2	176.6	-178.3	62.2	0	0	0	110.5	Q83 Y88 R89 F90	Q83-L86 WeakPolarHBondContact O-CA 3.43Å; Q83-L86 WeakPolarHBondContact O-CB 3.37Å; Q83-L86 PolarHBondContact O-N 3.38Å; L86-Y88 VanDerWaalsContact C-N 3.32Å; L86-Y88 PolarHBondContact O-N 3.08Å; L86-R89 WeakPolarHBondContact O-CA 3.33Å; L86-R89 WeakPolarHBondContact O-CB 3.47Å; L86-R89 PolarHBondContact O-N 2.97Å; L86-F90 HydrophobicContact CD1-CE1 4.06Å; L86-F90 HydrophobicContact CD1-CE2 4.04Å; L86-F90 HydrophobicContact CD1-CZ 3.68Å; L86-F90 HydrophobicContact CD2-CE2 4Å; L86-F90 HydrophobicContact CD2-CZ 4.11Å; L86-F90 HydrophobicContact CG-CD2 4.25Å; L86-F90 HydrophobicContact CG-CE2 3.6Å; L86-F90 HydrophobicContact CG-CZ 3.76Å; L86-F90 PolarHBondContact O-N 3.03Å
87	E	95.9	Very high	91.8	Very high	4 Å²	4	75.3 Å²	75.3	2%	0.019	39%	0.385	C	S	.	.	H	α-helix	trans	-55.4	-46.1	171.6	-176.2	-177.1	-178.9	0	0	111.6	K73 Q83 L84 R89 F90 Y91 M116 F188	K73-E87 IonicContact NZ-OE1 3.29Å; K73-E87 PolarHBondContact NZ-OE1 3.05Å; K73-E87 IonicContact NZ-OE2 3.18Å; K73-E87 PolarHBondContact NZ-OE2 3.33Å; Q83-E87 PolarHBondContact O-N 2.81Å; L84-E87 WeakPolarHBondContact CD1-OE2 3.2Å; E87-R89 VanDerWaalsContact C-N 3.33Å; E87-R89 PolarHBondContact O-N 3.4Å; E87-F90 PolarHBondContact O-N 3.39Å; E87-F90 VanDerWaalsContact O-N 3.16Å; E87-Y91 HydrophobicContact CG-CD2 3.99Å; E87-Y91 HydrophobicContact CG-CE2 3.8Å; E87-Y91 WeakPolarHBondContact O-CD2 3.37Å; E87-Y91 PolarHBondContact O-N 3.31Å; E87-M116 HydrophobicContact CG-CE 4.05Å; E87-F188 HydrophobicContact CG-CB 4.06Å
88	Y	96.3	Very high	91.6	Very high	52 Å²	52	71.9 Å²	71.9	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-57.2	-42.6	173.3	169.8	-105.7	0	0	0	112.8	L84 L86 Y91 K92 V104 F107 M116	L84-Y88 WeakPolarHBondContact O-CB 3.42Å; L84-Y88 PolarHBondContact O-N 3.2Å; L86-Y88 VanDerWaalsContact C-N 3.32Å; L86-Y88 PolarHBondContact O-N 3.08Å; Y88-Y91 PolarHBondContact O-N 3.46Å; Y88-K92 HydrophobicContact CE1-CG 4.19Å; Y88-K92 HydrophobicContact CE2-CD 4.43Å; Y88-K92 HydrophobicContact CE2-CG 4.12Å; Y88-K92 VanDerWaalsContact CZ-CE 3.49Å; Y88-K92 PolarHBondContact O-N 3.4Å; Y88-K92 WeakPolarHBondContact OH-CE 3.44Å; Y88-V104 HydrophobicContact CD2-CG1 3.9Å; Y88-V104 HydrophobicContact CE2-CG1 3.99Å; Y88-F107 HydrophobicContact CD1-CB 4.03Å; Y88-F107 HydrophobicContact CD1-CD1 4.12Å; Y88-F107 HydrophobicContact CD1-CD2 4.45Å; Y88-F107 AromaticContact CD1-CG 3.93Å; Y88-F107 HydrophobicContact CD1-CG 3.93Å; Y88-F107 HydrophobicContact CD2-CB 3.35Å; Y88-F107 HydrophobicContact CD2-CD2 4.25Å; Y88-F107 AromaticContact CD2-CG 3.93Å; Y88-F107 HydrophobicContact CD2-CG 3.93Å; Y88-F107 HydrophobicContact CE1-CB 4.08Å; Y88-F107 HydrophobicContact CE1-CD1 4.38Å; Y88-F107 HydrophobicContact CE1-CG 4.34Å; Y88-F107 HydrophobicContact CE2-CB 3.38Å; Y88-F107 HydrophobicContact CE2-CG 4.31Å; Y88-F107 HydrophobicContact CG-CB 3.66Å; Y88-F107 HydrophobicContact CG-CD1 4.35Å; Y88-F107 AromaticContact CG-CD2 3.91Å; Y88-F107 HydrophobicContact CG-CD2 3.91Å; Y88-F107 AromaticContact CG-CG 3.7Å; Y88-F107 HydrophobicContact CG-CG 3.7Å; Y88-M116 HydrophobicContact CD2-SD 4.21Å
89	R	96.5	Very high	91.7	Very high	159 Å²	159	68 Å²	68	60%	0.6	35%	0.351	S	S	*	.	H	α-helix	trans	-63.1	-40.6	175.6	-79.2	179.4	152	-159.1	-8.1	111.8	H85 L86 E87 K92 S93	H85-R89 PolarHBondContact O-N 2.67Å; H85-R89 VanDerWaalsContact O-N 3.15Å; L86-R89 WeakPolarHBondContact O-CA 3.33Å; L86-R89 WeakPolarHBondContact O-CB 3.47Å; L86-R89 PolarHBondContact O-N 2.97Å; E87-R89 VanDerWaalsContact C-N 3.33Å; E87-R89 PolarHBondContact O-N 3.4Å; R89-K92 PolarHBondContact O-N 2.89Å; R89-S93 PolarHBondContact O-N 3.45Å
90	F	96.8	Very high	91.9	Very high	12 Å²	12	66.2 Å²	66.2	5%	0.053	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-44.9	174.6	-63.9	-34.6	0	0	0	111.9	L86 E87 K92 S93 L94 L160 F188 A191 E193	L86-F90 HydrophobicContact CD1-CE1 4.06Å; L86-F90 HydrophobicContact CD1-CE2 4.04Å; L86-F90 HydrophobicContact CD1-CZ 3.68Å; L86-F90 HydrophobicContact CD2-CE2 4Å; L86-F90 HydrophobicContact CD2-CZ 4.11Å; L86-F90 HydrophobicContact CG-CD2 4.25Å; L86-F90 HydrophobicContact CG-CE2 3.6Å; L86-F90 HydrophobicContact CG-CZ 3.76Å; L86-F90 PolarHBondContact O-N 3.03Å; E87-F90 PolarHBondContact O-N 3.39Å; E87-F90 VanDerWaalsContact O-N 3.16Å; F90-K92 VanDerWaalsContact C-N 3.25Å; F90-K92 PolarHBondContact O-N 3.23Å; F90-S93 WeakPolarHBondContact CA-OG 3.41Å; F90-S93 PolarHBondContact O-N 3Å; F90-S93 PolarHBondContact O-OG 3.25Å; F90-L94 WeakPolarHBondContact O-CG 3.4Å; F90-L94 PolarHBondContact O-N 3.41Å; F90-L160 HydrophobicContact CB-CD1 3.88Å; F90-L160 HydrophobicContact CD1-CD1 3.91Å; F90-L160 HydrophobicContact CD1-CD2 3.45Å; F90-L160 VanDerWaalsContact CD1-CD2 3.45Å; F90-L160 HydrophobicContact CD1-CG 4.34Å; F90-L160 HydrophobicContact CE1-CD2 3.48Å; F90-L160 VanDerWaalsContact CE1-CD2 3.48Å; F90-L160 HydrophobicContact CG-CD1 4.01Å; F90-L160 HydrophobicContact CG-CD2 4.19Å; F90-L160 HydrophobicContact CZ-CD2 4.21Å; F90-F188 HydrophobicContact CB-CB 4.2Å; F90-F188 HydrophobicContact CD2-CB 4.39Å; F90-A191 HydrophobicContact CD2-CB 3.83Å; F90-A191 HydrophobicContact CE2-CB 3.96Å; F90-A191 VanDerWaalsContact CE2-O 3.32Å; F90-A191 WeakPolarHBondContact CE2-O 3.41Å; F90-E193 HydrophobicContact CE1-CG 4.14Å
91	Y	96.7	Very high	92.3	Very high	8 Å²	8	54.7 Å²	54.7	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-56.2	-37.4	171.3	-83.5	-65.8	0	0	0	113.3	E87 Y88 L94 G95 V101 P102 V104 M116 M118 I186 D187 F188	E87-Y91 HydrophobicContact CG-CD2 3.99Å; E87-Y91 HydrophobicContact CG-CE2 3.8Å; E87-Y91 WeakPolarHBondContact O-CD2 3.37Å; E87-Y91 PolarHBondContact O-N 3.31Å; Y88-Y91 PolarHBondContact O-N 3.46Å; Y91-L94 HydrophobicContact CD1-CD1 4.4Å; Y91-G95 PolarHBondContact O-N 3.19Å; Y91-G95 VanDerWaalsContact O-N 3.17Å; Y91-V101 HydrophobicContact CD1-CG1 3.84Å; Y91-V101 HydrophobicContact CE1-CG1 3.82Å; Y91-P102 HydrophobicContact CE1-CG 3.78Å; Y91-V104 HydrophobicContact CD1-CG2 3.9Å; Y91-V104 HydrophobicContact CD2-CG2 3.94Å; Y91-V104 HydrophobicContact CG-CG2 3.56Å; Y91-M116 HydrophobicContact CD2-CE 3.9Å; Y91-M116 HydrophobicContact CD2-SD 4.05Å; Y91-M116 HydrophobicContact CE2-CE 3.78Å; Y91-M118 HydrophobicContact CE1-CE 4.21Å; Y91-M118 HydrophobicContact CE2-CE 3.83Å; Y91-M118 WeakPolarHBondContact OH-CE 3.25Å; Y91-I186 WeakPolarHBondContact OH-CA 3.46Å; Y91-D187 PolarHBondContact OH-N 2.88Å; Y91-F188 HydrophobicContact CD1-CD2 4.43Å; Y91-F188 AromaticContact CE1-CD2 3.78Å; Y91-F188 HydrophobicContact CE1-CD2 3.78Å; Y91-F188 AromaticContact CE1-CE2 3.89Å; Y91-F188 HydrophobicContact CE1-CE2 3.89Å; Y91-F188 AromaticContact CE2-CD2 3.99Å; Y91-F188 HydrophobicContact CE2-CD2 3.99Å; Y91-F188 AromaticContact CZ-CD2 3.54Å
92	K	95	Very high	92.7	Very high	105 Å²	105	52.4 Å²	52.4	46%	0.457	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-35.9	173.3	-71.7	-60.4	-171.2	-173.7	0	113.5	Y88 R89 F90 G95	Y88-K92 HydrophobicContact CE1-CG 4.19Å; Y88-K92 HydrophobicContact CE2-CD 4.43Å; Y88-K92 HydrophobicContact CE2-CG 4.12Å; Y88-K92 VanDerWaalsContact CZ-CE 3.49Å; Y88-K92 PolarHBondContact O-N 3.4Å; Y88-K92 WeakPolarHBondContact OH-CE 3.44Å; R89-K92 PolarHBondContact O-N 2.89Å; F90-K92 VanDerWaalsContact C-N 3.25Å; F90-K92 PolarHBondContact O-N 3.23Å; K92-G95 PolarHBondContact O-N 2.85Å
93	S	94	Very high	92.9	Very high	53 Å²	53	52.5 Å²	52.5	37%	0.371	27%	0.27	S	S	.	.	H	α-helix	trans	-73	-33.4	176.2	72.3	0	0	0	0	113.6	R89 F90 G95	R89-S93 PolarHBondContact O-N 3.45Å; F90-S93 WeakPolarHBondContact CA-OG 3.41Å; F90-S93 PolarHBondContact O-N 3Å; F90-S93 PolarHBondContact O-OG 3.25Å; S93-G95 VanDerWaalsContact C-N 3.31Å
94	L	94.8	Very high	93.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-38.6	172	-67.6	168.5	0	0	0	110.8	F90 Y91 V101 Y154 V155 K158 L160 F188	F90-L94 WeakPolarHBondContact O-CG 3.4Å; F90-L94 PolarHBondContact O-N 3.41Å; Y91-L94 HydrophobicContact CD1-CD1 4.4Å; L94-V101 HydrophobicContact CB-CG1 4.37Å; L94-V101 HydrophobicContact CD1-CG1 4.06Å; L94-Y154 HydrophobicContact CB-CE1 4.42Å; L94-Y154 HydrophobicContact CD2-CD1 4.3Å; L94-Y154 HydrophobicContact CD2-CE1 4.14Å; L94-Y154 PolarHBondContact O-OH 3.43Å; L94-V155 HydrophobicContact CD2-CG2 4.13Å; L94-K158 HydrophobicContact CD2-CB 4.07Å; L94-K158 HydrophobicContact CD2-CG 4.03Å; L94-L160 HydrophobicContact CD2-CD1 4.22Å; L94-L160 HydrophobicContact CG-CD1 4.31Å; L94-F188 HydrophobicContact CD1-CD1 4.02Å; L94-F188 HydrophobicContact CD1-CD2 4.13Å; L94-F188 HydrophobicContact CD1-CE1 3.61Å; L94-F188 HydrophobicContact CD1-CE2 3.72Å; L94-F188 HydrophobicContact CD1-CG 4.27Å; L94-F188 HydrophobicContact CD1-CZ 3.44Å; L94-F188 VanDerWaalsContact CD1-CZ 3.44Å
95	G	89.1	Confident	93.2	Very high	27 Å²	27	55.1 Å²	55.1	28%	0.278	28%	0.282	S	S	.	.			trans	87.3	172.3	176.1	0	0	0	0	0	113.7	Y91 K92 S93	Y91-G95 PolarHBondContact O-N 3.19Å; Y91-G95 VanDerWaalsContact O-N 3.17Å; K92-G95 PolarHBondContact O-N 2.85Å; S93-G95 VanDerWaalsContact C-N 3.31Å
96	T	78.9	Confident	93.3	Very high	101 Å²	101	54 Å²	54	62%	0.62	28%	0.275	S	S	*	.	S	Bend	trans	-96.2	-6.4	-166.4	53.1	0	0	0	0	115.4
97	T	79.1	Confident	93.4	Very high	135 Å²	135	52 Å²	52	83%	0.828	26%	0.263	S	S	*	.	S	Bend	trans	-106.5	4.5	-177.9	54.2	0	0	0	0	113.3	E99	T97-E99 PolarHBondContact O-N 3.47Å
98	A	87.9	Confident	93.4	Very high	13 Å²	13	52.2 Å²	52.2	11%	0.107	27%	0.266	C	S	.	.			trans	-71.5	123.9	-179.7	0	0	0	0	0	111.2	G100 V101 Y154	A98-G100 PolarHBondContact O-N 2.96Å; A98-V101 HydrophobicContact CB-CB 3.91Å; A98-V101 HydrophobicContact CB-CG2 3.67Å; A98-V101 PolarHBondContact O-N 2.72Å; A98-Y154 HydrophobicContact CB-CD1 4.14Å; A98-Y154 HydrophobicContact CB-CE1 3.36Å; A98-Y154 HydrophobicContact CB-CE2 4.25Å; A98-Y154 VanDerWaalsContact CB-CZ 3.43Å; A98-Y154 WeakPolarHBondContact CB-OH 3.33Å
99	E	93.4	Very high	93.3	Very high	118 Å²	118	54.3 Å²	54.3	55%	0.551	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	130.6	172.1	-167.8	-164.6	-106.2	0	0	110.2	T97 V101 R151 I182	T97-E99 PolarHBondContact O-N 3.47Å; E99-V101 VanDerWaalsContact C-N 3.35Å; E99-R151 PolarHBondContact O-NH1 2.67Å; E99-R151 IonicContact OE2-CZ 3.23Å; E99-R151 IonicContact OE2-NH1 2.72Å; E99-R151 PolarHBondContact OE2-NH1 2.72Å; E99-R151 IonicContact OE2-NH2 2.83Å; E99-R151 PolarHBondContact OE2-NH2 2.83Å; E99-I182 HydrophobicContact CG-CD1 3.96Å; E99-I182 HydrophobicContact CG-CG2 3.93Å
100	G	95.7	Very high	93.2	Very high	3 Å²	3	46.9 Å²	46.9	3%	0.031	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	17.5	-179.4	0	0	0	0	0	114.6	A98 H184 I185	A98-G100 PolarHBondContact O-N 2.96Å; G100-H184 CarbonylContact O-C 3.56Å; G100-H184 WeakPolarHBondContact O-CA 3.48Å; G100-I185 PolarHBondContact O-N 3.35Å
101	V	96.8	Very high	92.9	Very high	12 Å²	12	50 Å²	50	7%	0.073	29%	0.294	C	S	.	.	S	Bend	trans	-115.8	125	164.7	-175.3	0	0	0	0	107.8	Y91 L94 A98 E99 Y154 I185	Y91-V101 HydrophobicContact CD1-CG1 3.84Å; Y91-V101 HydrophobicContact CE1-CG1 3.82Å; L94-V101 HydrophobicContact CB-CG1 4.37Å; L94-V101 HydrophobicContact CD1-CG1 4.06Å; A98-V101 HydrophobicContact CB-CB 3.91Å; A98-V101 HydrophobicContact CB-CG2 3.67Å; A98-V101 PolarHBondContact O-N 2.72Å; E99-V101 VanDerWaalsContact C-N 3.35Å; V101-Y154 HydrophobicContact CG2-CD1 4.36Å; V101-Y154 HydrophobicContact CG2-CE1 4.38Å; V101-I185 HydrophobicContact CG2-CG2 4.35Å
102	P	94.7	Very high	92.8	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.026	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-65.1	139.3	-179.6	27	-36	0	0	0	111.5	Y91 V104 M118 E119 L121 I185 I186	Y91-P102 HydrophobicContact CE1-CG 3.78Å; P102-V104 PolarHBondContact O-N 2.76Å; P102-M118 HydrophobicContact CB-CE 4.3Å; P102-M118 HydrophobicContact CG-CE 3.73Å; P102-E119 HydrophobicContact CB-CB 3.94Å; P102-L121 HydrophobicContact CB-CD1 4.19Å; P102-L121 HydrophobicContact CB-CG 4.5Å; P102-L121 HydrophobicContact CG-CD1 4.46Å; P102-I185 VanDerWaalsContact CD-O 3.28Å; P102-I185 WeakPolarHBondContact CD-O 3.41Å; P102-I186 HydrophobicContact CG-CG2 4.07Å
103	Q	94.1	Very high	92.8	Very high	90 Å²	90	53.3 Å²	53.3	42%	0.421	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-65.5	132	175.3	-174	175.4	2.5	0	0	111.3	F105 M118 E119	Q103-F105 HydrophobicContact CB-CE1 4.17Å; Q103-F105 HydrophobicContact CB-CZ 4.34Å; Q103-F105 VanDerWaalsContact CD-CE1 3.42Å; Q103-F105 HydrophobicContact CG-CD1 4.05Å; Q103-F105 HydrophobicContact CG-CE1 3.78Å; Q103-F105 HydrophobicContact CG-CZ 4.43Å; Q103-M118 CarbonylContact O-C 3.46Å; Q103-M118 WeakPolarHBondContact O-CA 3.35Å; Q103-M118 WeakPolarHBondContact O-CB 3.09Å; Q103-E119 HydrophobicContact CB-CB 4.36Å; Q103-E119 PolarHBondContact N-OE2 3.4Å; Q103-E119 PolarHBondContact O-N 3.17Å
104	V	95.6	Very high	92.8	Very high	13 Å²	13	52.7 Å²	52.7	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.7	170.1	179.8	0	0	0	0	110.4	Y88 Y91 P102 M116 M118	Y88-V104 HydrophobicContact CD2-CG1 3.9Å; Y88-V104 HydrophobicContact CE2-CG1 3.99Å; Y91-V104 HydrophobicContact CD1-CG2 3.9Å; Y91-V104 HydrophobicContact CD2-CG2 3.94Å; Y91-V104 HydrophobicContact CG-CG2 3.56Å; P102-V104 PolarHBondContact O-N 2.76Å; V104-M116 HydrophobicContact CG1-CG 3.81Å; V104-M116 HydrophobicContact CG1-SD 4.13Å; V104-M116 HydrophobicContact CG2-SD 4.27Å; V104-M118 HydrophobicContact CG2-CB 4.17Å
105	F	95.8	Very high	92.9	Very high	77 Å²	77	52.7 Å²	52.7	34%	0.338	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-39.4	-176.3	-54.9	-64	0	0	0	113.1	F44 V70 Q103 V117 M118 E119	F44-F105 HydrophobicContact CE1-CB 4.42Å; F44-F105 HydrophobicContact CZ-CB 3.88Å; V70-F105 HydrophobicContact CG1-CD2 3.96Å; V70-F105 HydrophobicContact CG1-CE2 3.75Å; Q103-F105 HydrophobicContact CB-CE1 4.17Å; Q103-F105 HydrophobicContact CB-CZ 4.34Å; Q103-F105 VanDerWaalsContact CD-CE1 3.42Å; Q103-F105 HydrophobicContact CG-CD1 4.05Å; Q103-F105 HydrophobicContact CG-CE1 3.78Å; Q103-F105 HydrophobicContact CG-CZ 4.43Å; F105-V117 HydrophobicContact CD2-CG1 4.3Å; F105-V117 PolarHBondContact N-O 3.01Å; F105-M118 VanDerWaalsContact CE2-C 3.43Å; F105-E119 HydrophobicContact CE2-CB 4.43Å; F105-E119 VanDerWaalsContact CE2-N 3.34Å; F105-E119 HydrophobicContact CZ-CB 4.44Å
106	Y	96.9	Very high	93.3	Very high	66 Å²	66	51.4 Å²	51.4	26%	0.259	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	148.8	-173.9	-178.4	-94.2	0	0	0	112	V40 F44 M116 V117	V40-Y106 HydrophobicContact CG1-CD1 3.51Å; V40-Y106 HydrophobicContact CG1-CE1 3.57Å; F44-Y106 HydrophobicContact CE2-CG 4.37Å; Y106-M116 WeakPolarHBondContact O-CA 3.47Å; Y106-V117 HydrophobicContact CD1-CG2 4.2Å; Y106-V117 PolarHBondContact N-O 3.14Å; Y106-V117 PolarHBondContact O-N 2.83Å
107	F	97.1	Very high	94.2	Very high	41 Å²	41	46.6 Å²	46.6	18%	0.18	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.1	164	174.7	-87.6	0	0	0	109	L84 H85 Y88 N114 A115 M116	L84-F107 HydrophobicContact CB-CE2 4.46Å; L84-F107 HydrophobicContact CD2-CE2 4.29Å; L84-F107 HydrophobicContact CG-CE2 4.02Å; H85-F107 HydrophobicContact CB-CE1 4.38Å; H85-F107 HydrophobicContact CB-CE2 4.32Å; H85-F107 HydrophobicContact CB-CZ 3.72Å; H85-F107 AromaticContact CG-CZ 3.99Å; H85-F107 AromaticContact ND1-CD1 3.98Å; H85-F107 AromaticContact ND1-CE1 3.21Å; H85-F107 WeakPolarHBondContact ND1-CE1 3.34Å; H85-F107 AromaticContact ND1-CZ 3.46Å; H85-F107 WeakPolarHBondContact ND1-CZ 3.41Å; Y88-F107 HydrophobicContact CD1-CB 4.03Å; Y88-F107 HydrophobicContact CD1-CD1 4.12Å; Y88-F107 HydrophobicContact CD1-CD2 4.45Å; Y88-F107 AromaticContact CD1-CG 3.93Å; Y88-F107 HydrophobicContact CD1-CG 3.93Å; Y88-F107 HydrophobicContact CD2-CB 3.35Å; Y88-F107 HydrophobicContact CD2-CD2 4.25Å; Y88-F107 AromaticContact CD2-CG 3.93Å; Y88-F107 HydrophobicContact CD2-CG 3.93Å; Y88-F107 HydrophobicContact CE1-CB 4.08Å; Y88-F107 HydrophobicContact CE1-CD1 4.38Å; Y88-F107 HydrophobicContact CE1-CG 4.34Å; Y88-F107 HydrophobicContact CE2-CB 3.38Å; Y88-F107 HydrophobicContact CE2-CG 4.31Å; Y88-F107 HydrophobicContact CG-CB 3.66Å; Y88-F107 HydrophobicContact CG-CD1 4.35Å; Y88-F107 AromaticContact CG-CD2 3.91Å; Y88-F107 HydrophobicContact CG-CD2 3.91Å; Y88-F107 AromaticContact CG-CG 3.7Å; Y88-F107 HydrophobicContact CG-CG 3.7Å; F107-N114 HydrophobicContact CE2-CB 4.5Å; F107-N114 HydrophobicContact CZ-CB 4.4Å; F107-A115 VanDerWaalsContact CA-O 3.31Å; F107-A115 WeakPolarHBondContact CA-O 3.36Å; F107-M116 HydrophobicContact CD2-CB 4.18Å
108	G	96.3	Very high	94.9	Very high	8 Å²	8	40.8 Å²	40.8	8%	0.082	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-176	-179.8	0	0	0	0	0	113.6	A115	G108-A115 PolarHBondContact N-O 3.3Å; G108-A115 PolarHBondContact O-N 2.97Å
109	P	95	Very high	95.3	Very high	95 Å²	95	41.7 Å²	41.7	62%	0.617	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	148.7	-177.6	30.4	-35.1	0	0	0	112.8
110	C	94.1	Very high	95.3	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.027	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	87.1	172.6	-175.6	0	0	0	0	109.3	M39 V40 L74 K112 Y113 A115	M39-C110 PolarHBondContact O-SG 2.83Å; V40-C110 HydrophobicContact CG2-CB 3.86Å; V40-C110 VanDerWaalsContact CG2-SG 3.54Å; L74-C110 HydrophobicContact CD2-CB 4.37Å; C110-K112 PolarHBondContact O-N 2.55Å; C110-K112 VanDerWaalsContact O-N 3.07Å; C110-Y113 PolarHBondContact N-O 2.98Å; C110-Y113 PolarHBondContact O-N 3.23Å; C110-A115 HydrophobicContact CB-CB 3.76Å
111	G	91.1	Very high	95.3	Very high	78 Å²	78	38.4 Å²	38.4	80%	0.804	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	-112.6	-174.9	0	0	0	0	0	111.9	Y113	G111-Y113 VanDerWaalsContact C-N 3.35Å
112	K	92.7	Very high	95.2	Very high	152 Å²	152	38.7 Å²	38.7	66%	0.661	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	7.7	178.8	70.5	-179.7	-177.5	178.5	0	114.7	V77 C110	V77-K112 PolarHBondContact N-O 3.32Å; C110-K112 PolarHBondContact O-N 2.55Å; C110-K112 VanDerWaalsContact O-N 3.07Å
113	Y	94.9	Very high	95.1	Very high	30 Å²	30	40 Å²	40	12%	0.118	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150	-176.3	-57.9	-94.8	0	0	0	111.8	E57 L74 E75 P76 C110 G111	E57-Y113 PolarHBondContact OE1-OH 3.39Å; L74-Y113 HydrophobicContact CB-CD1 3.92Å; L74-Y113 HydrophobicContact CB-CE1 4.49Å; L74-Y113 HydrophobicContact CB-CG 4.23Å; E75-Y113 CarbonylContact O-C 3.58Å; E75-Y113 WeakPolarHBondContact O-CA 3.38Å; E75-Y113 WeakPolarHBondContact O-CB 3.31Å; P76-Y113 HydrophobicContact CB-CD1 4.46Å; P76-Y113 HydrophobicContact CG-CD1 4.16Å; P76-Y113 HydrophobicContact CG-CE1 4.06Å; C110-Y113 PolarHBondContact N-O 2.98Å; C110-Y113 PolarHBondContact O-N 3.23Å; G111-Y113 VanDerWaalsContact C-N 3.35Å
114	N	95.4	Very high	95.2	Very high	40 Å²	40	35.8 Å²	35.8	21%	0.214	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141.6	150.9	-64.5	-40.9	0	0	0	107.9	L74 E75 L84 F107	L74-N114 WeakPolarHBondContact CA-O 3.19Å; E75-N114 PolarHBondContact N-O 3.19Å; E75-N114 PolarHBondContact O-N 3Å; L84-N114 HydrophobicContact CD2-CB 4.06Å; L84-N114 WeakPolarHBondContact CD2-O 3.37Å; F107-N114 HydrophobicContact CE2-CB 4.5Å; F107-N114 HydrophobicContact CZ-CB 4.4Å
115	A	96.7	Very high	95.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.1	-178.4	0	0	0	0	0	111	V40 K73 L74 F107 G108 C110	V40-A115 HydrophobicContact CB-CB 4.39Å; V40-A115 HydrophobicContact CG1-CB 3.62Å; V40-A115 HydrophobicContact CG2-CB 3.76Å; K73-A115 WeakPolarHBondContact O-CA 3.38Å; L74-A115 HydrophobicContact CD2-CB 3.53Å; F107-A115 VanDerWaalsContact CA-O 3.31Å; F107-A115 WeakPolarHBondContact CA-O 3.36Å; G108-A115 PolarHBondContact N-O 3.3Å; G108-A115 PolarHBondContact O-N 2.97Å; C110-A115 HydrophobicContact CB-CB 3.76Å
116	M	96.8	Very high	95.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.4	168	-171.2	167.8	66	0	0	108.8	I72 K73 L84 E87 Y88 Y91 V104 Y106 F107 M118	I72-M116 WeakPolarHBondContact CA-O 3.37Å; K73-M116 HydrophobicContact CD-CE 4.41Å; K73-M116 PolarHBondContact N-O 2.74Å; K73-M116 PolarHBondContact O-N 2.86Å; L84-M116 HydrophobicContact CD1-CB 3.93Å; L84-M116 HydrophobicContact CD1-CE 4Å; L84-M116 HydrophobicContact CD2-CB 4.25Å; L84-M116 HydrophobicContact CG-CB 4.16Å; E87-M116 HydrophobicContact CG-CE 4.05Å; Y88-M116 HydrophobicContact CD2-SD 4.21Å; Y91-M116 HydrophobicContact CD2-CE 3.9Å; Y91-M116 HydrophobicContact CD2-SD 4.05Å; Y91-M116 HydrophobicContact CE2-CE 3.78Å; V104-M116 HydrophobicContact CG1-CG 3.81Å; V104-M116 HydrophobicContact CG1-SD 4.13Å; V104-M116 HydrophobicContact CG2-SD 4.27Å; Y106-M116 WeakPolarHBondContact O-CA 3.47Å; F107-M116 HydrophobicContact CD2-CB 4.18Å; M116-M118 HydrophobicContact CE-CE 4.25Å; M116-M118 HydrophobicContact CE-SD 3.96Å
117	V	97.3	Very high	95.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.8	179.2	-170.8	0	0	0	0	109.1	V40 F44 V70 A71 I72 F105 Y106	V40-V117 HydrophobicContact CB-CG2 4.13Å; V40-V117 HydrophobicContact CG1-CG2 3.54Å; F44-V117 HydrophobicContact CB-CG1 4.45Å; F44-V117 HydrophobicContact CB-CG2 4.35Å; F44-V117 HydrophobicContact CD1-CG1 3.68Å; F44-V117 HydrophobicContact CD2-CB 4.44Å; F44-V117 HydrophobicContact CD2-CG1 4.26Å; F44-V117 HydrophobicContact CD2-CG2 4.05Å; F44-V117 HydrophobicContact CE1-CG1 3.86Å; F44-V117 HydrophobicContact CE2-CG1 4.44Å; F44-V117 HydrophobicContact CG-CB 4.48Å; F44-V117 HydrophobicContact CG-CG1 3.87Å; F44-V117 HydrophobicContact CG-CG2 4.15Å; F44-V117 HydrophobicContact CZ-CG1 4.25Å; V70-V117 HydrophobicContact CB-CG1 3.85Å; V70-V117 HydrophobicContact CG1-CG1 4.31Å; V70-V117 HydrophobicContact CG2-CG1 3.6Å; A71-V117 WeakPolarHBondContact O-CA 3.38Å; I72-V117 HydrophobicContact CG1-CG1 4.19Å; I72-V117 HydrophobicContact CG1-CG2 4.22Å; F105-V117 HydrophobicContact CD2-CG1 4.3Å; F105-V117 PolarHBondContact N-O 3.01Å; Y106-V117 HydrophobicContact CD1-CG2 4.2Å; Y106-V117 PolarHBondContact N-O 3.14Å; Y106-V117 PolarHBondContact O-N 2.83Å
118	M	95.6	Very high	95.4	Very high	13 Å²	13	29.3 Å²	29.3	6%	0.064	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	169	-171.8	66.5	-156.9	-58.4	0	0	112.8	V70 A71 Y91 P102 Q103 V104 F105 M116 L120	V70-M118 WeakPolarHBondContact CB-O 3.4Å; A71-M118 HydrophobicContact CB-CG 3.9Å; A71-M118 PolarHBondContact N-O 3.3Å; A71-M118 PolarHBondContact O-N 3.38Å; Y91-M118 HydrophobicContact CE1-CE 4.21Å; Y91-M118 HydrophobicContact CE2-CE 3.83Å; Y91-M118 WeakPolarHBondContact OH-CE 3.25Å; P102-M118 HydrophobicContact CB-CE 4.3Å; P102-M118 HydrophobicContact CG-CE 3.73Å; Q103-M118 CarbonylContact O-C 3.46Å; Q103-M118 WeakPolarHBondContact O-CA 3.35Å; Q103-M118 WeakPolarHBondContact O-CB 3.09Å; V104-M118 HydrophobicContact CG2-CB 4.17Å; F105-M118 VanDerWaalsContact CE2-C 3.43Å; M116-M118 HydrophobicContact CE-CE 4.25Å; M116-M118 HydrophobicContact CE-SD 3.96Å; M118-L120 PolarHBondContact O-N 2.87Å
119	E	94.8	Very high	95.5	Very high	31 Å²	31	29 Å²	29	15%	0.145	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	128.3	176.1	-172.1	170.2	-172.2	0	0	110.6	P102 Q103 F105 L121 K179	P102-E119 HydrophobicContact CB-CB 3.94Å; Q103-E119 HydrophobicContact CB-CB 4.36Å; Q103-E119 PolarHBondContact N-OE2 3.4Å; Q103-E119 PolarHBondContact O-N 3.17Å; F105-E119 HydrophobicContact CE2-CB 4.43Å; F105-E119 VanDerWaalsContact CE2-N 3.34Å; F105-E119 HydrophobicContact CZ-CB 4.44Å; E119-L121 HydrophobicContact CG-CD2 4.26Å; E119-K179 IonicContact OE1-NZ 3.19Å; E119-K179 PolarHBondContact OE1-NZ 2.92Å; E119-K179 IonicContact OE2-NZ 3.97Å; E119-K179 PolarHBondContact OE2-NZ 3.38Å
120	L	95.3	Very high	95.6	Very high	34 Å²	34	28.4 Å²	28.4	18%	0.178	17%	0.165	C	C	.	.			trans	-79.7	121.9	172	-176	68	0	0	0	108.6	I50 L60 A71 M118 R174	I50-L120 HydrophobicContact CD1-CD1 3.95Å; L60-L120 HydrophobicContact CD1-CD1 4.37Å; L60-L120 HydrophobicContact CD1-CD2 3.6Å; A71-L120 HydrophobicContact CB-CD1 4.1Å; M118-L120 PolarHBondContact O-N 2.87Å; L120-R174 WeakPolarHBondContact O-CD 3.38Å; L120-R174 WeakPolarHBondContact O-CG 3.38Å
121	L	94.8	Very high	95.7	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.099	18%	0.176	C	C	.	.			trans	-97.3	-179.6	178.7	-63	177.3	0	0	0	111.6	P102 E119 L171 R174 H184 I186	P102-L121 HydrophobicContact CB-CD1 4.19Å; P102-L121 HydrophobicContact CB-CG 4.5Å; P102-L121 HydrophobicContact CG-CD1 4.46Å; E119-L121 HydrophobicContact CG-CD2 4.26Å; L121-L171 HydrophobicContact CB-CB 4.02Å; L121-L171 HydrophobicContact CB-CD2 3.9Å; L121-L171 HydrophobicContact CD1-CB 3.89Å; L121-L171 HydrophobicContact CD1-CD2 4.19Å; L121-R174 VanDerWaalsContact C-CG 3.47Å; L121-R174 WeakPolarHBondContact O-CG 3.24Å; L121-H184 HydrophobicContact CD1-CB 3.66Å; L121-H184 HydrophobicContact CD2-CB 4.36Å; L121-I186 HydrophobicContact CD1-CG2 3.7Å
122	G	94.2	Very high	96	Very high	18 Å²	18	27 Å²	27	19%	0.186	14%	0.139	C	C	.	.			trans	-82.5	-161.9	170.1	0	0	0	0	0	112.4	I172	G122-I172 WeakPolarHBondContact CA-O 3.49Å; G122-I172 PolarHBondContact N-O 3.34Å
123	P	93.8	Very high	96.2	Very high	30 Å²	30	25.6 Å²	25.6	20%	0.195	14%	0.139	C	C	.	.			trans	-62.6	160.3	175.5	-17.5	29.6	0	0	0	113.3	D127 L128 L171 I172 I333	P123-D127 HydrophobicContact CB-CB 3.77Å; P123-L128 HydrophobicContact CB-CD2 4.21Å; P123-L128 HydrophobicContact CB-CG 4.15Å; P123-L128 HydrophobicContact CG-CD2 4.31Å; P123-L171 WeakPolarHBondContact O-CA 3.41Å; P123-I172 PolarHBondContact O-N 2.97Å; P123-I333 HydrophobicContact CG-CD1 4.4Å; P123-I333 HydrophobicContact CG-CG2 3.42Å; P123-I333 VanDerWaalsContact CG-CG2 3.42Å
124	S	96	Very high	96.3	Very high	3 Å²	3	28 Å²	28	2%	0.021	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-77.4	165.5	170.5	73.3	0	0	0	0	112.2	E126 D127 L128 F170	S124-E126 PolarHBondContact O-N 2.75Å; S124-E126 PolarHBondContact OG-N 2.54Å; S124-D127 WeakPolarHBondContact CA-OD2 3.42Å; S124-D127 VanDerWaalsContact CB-OD2 3.28Å; S124-D127 WeakPolarHBondContact CB-OD2 3.41Å; S124-D127 PolarHBondContact N-OD2 3.47Å; S124-D127 PolarHBondContact O-N 2.98Å; S124-D127 VanDerWaalsContact OG-CG 3.23Å; S124-D127 PolarHBondContact OG-N 3.49Å; S124-D127 PolarHBondContact OG-OD2 2.84Å; S124-L128 VanDerWaalsContact O-CG 3.31Å; S124-L128 WeakPolarHBondContact O-CG 3.27Å; S124-L128 PolarHBondContact O-N 3.08Å; S124-F170 CarbonylContact C-O 3.52Å; S124-F170 VanDerWaalsContact CA-O 3.26Å; S124-F170 WeakPolarHBondContact CA-O 3.41Å
125	L	98.3	Very high	96.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-23.2	172.8	-66.9	-175.7	0	0	0	112.3	L128 F129 I144 L148 P167 F170 I183 F244 W328	L125-L128 HydrophobicContact CD2-CD1 4.27Å; L125-F129 WeakPolarHBondContact O-CB 3.35Å; L125-F129 PolarHBondContact O-N 3.36Å; L125-I144 HydrophobicContact CD1-CG2 3.77Å; L125-I144 HydrophobicContact CD2-CD1 4.26Å; L125-L148 HydrophobicContact CD1-CD1 4.16Å; L125-P167 HydrophobicContact CB-CB 4.16Å; L125-P167 PolarHBondContact N-O 2.9Å; L125-F170 HydrophobicContact CD1-CB 3.7Å; L125-F170 HydrophobicContact CD1-CG 4.48Å; L125-F170 HydrophobicContact CG-CB 3.9Å; L125-F170 PolarHBondContact N-O 2.83Å; L125-I183 HydrophobicContact CD1-CG2 4.28Å; L125-I183 HydrophobicContact CG-CG2 4.5Å; L125-F244 HydrophobicContact CB-CE1 4.34Å; L125-F244 HydrophobicContact CB-CZ 3.78Å; L125-F244 HydrophobicContact CD1-CE2 4.09Å; L125-F244 HydrophobicContact CD1-CZ 3.96Å; L125-W328 HydrophobicContact CD2-CH2 4.06Å
126	E	97.5	Very high	96.6	Very high	21 Å²	21	30 Å²	30	10%	0.098	16%	0.161	C	C	.	.	H	α-helix	trans	-72.2	-43.9	171.4	-166	65.5	-164.4	0	0	111.1	S124 L128 F129 D130 R134 P167 E168 Y243	S124-E126 PolarHBondContact O-N 2.75Å; S124-E126 PolarHBondContact OG-N 2.54Å; E126-L128 VanDerWaalsContact C-N 3.28Å; E126-L128 PolarHBondContact O-N 2.97Å; E126-F129 WeakPolarHBondContact O-CA 3.49Å; E126-F129 WeakPolarHBondContact O-CB 3.39Å; E126-F129 PolarHBondContact O-N 2.99Å; E126-D130 PolarHBondContact O-N 2.76Å; E126-R134 IonicContact OE1-CZ 2.79Å; E126-R134 IonicContact OE1-NH1 2.69Å; E126-R134 PolarHBondContact OE1-NH1 2.7Å; E126-R134 IonicContact OE1-NH2 2.87Å; E126-P167 HydrophobicContact CB-CB 3.94Å; E126-E168 HydrophobicContact CB-CG 3.99Å; E126-E168 HydrophobicContact CG-CG 4.34Å; E126-Y243 PolarHBondContact OE1-OH 3.13Å; E126-Y243 VanDerWaalsContact OE2-CE1 3.28Å; E126-Y243 WeakPolarHBondContact OE2-CE1 3.35Å; E126-Y243 PolarHBondContact OE2-OH 3.16Å
127	D	95.3	Very high	96.7	Very high	39 Å²	39	32.4 Å²	32.4	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-60	-41.1	177.4	-57.1	-60.7	0	0	0	111.2	P123 S124 F129 L131 C338	P123-D127 HydrophobicContact CB-CB 3.77Å; S124-D127 WeakPolarHBondContact CA-OD2 3.42Å; S124-D127 VanDerWaalsContact CB-OD2 3.28Å; S124-D127 WeakPolarHBondContact CB-OD2 3.41Å; S124-D127 PolarHBondContact N-OD2 3.47Å; S124-D127 PolarHBondContact O-N 2.98Å; S124-D127 VanDerWaalsContact OG-CG 3.23Å; S124-D127 PolarHBondContact OG-N 3.49Å; S124-D127 PolarHBondContact OG-OD2 2.84Å; D127-F129 VanDerWaalsContact C-N 3.33Å; D127-L131 WeakPolarHBondContact O-CB 3.45Å; D127-L131 PolarHBondContact O-N 2.92Å; D127-C338 PolarHBondContact OD1-SG 3Å
128	L	97.3	Very high	96.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-71.6	-29.4	176.6	-63.5	168.8	0	0	0	112.1	P123 S124 L125 E126 L131 C132 F136 I172 W328 I333	P123-L128 HydrophobicContact CB-CD2 4.21Å; P123-L128 HydrophobicContact CB-CG 4.15Å; P123-L128 HydrophobicContact CG-CD2 4.31Å; S124-L128 VanDerWaalsContact O-CG 3.31Å; S124-L128 WeakPolarHBondContact O-CG 3.27Å; S124-L128 PolarHBondContact O-N 3.08Å; L125-L128 HydrophobicContact CD2-CD1 4.27Å; E126-L128 VanDerWaalsContact C-N 3.28Å; E126-L128 PolarHBondContact O-N 2.97Å; L128-L131 HydrophobicContact CD2-CD2 4.42Å; L128-L131 PolarHBondContact O-N 2.71Å; L128-C132 WeakPolarHBondContact O-CB 3.24Å; L128-C132 PolarHBondContact O-N 3.25Å; L128-C132 PolarHBondContact O-SG 2.87Å; L128-C132 VanDerWaalsContact O-SG 3.36Å; L128-F136 HydrophobicContact CB-CZ 4.14Å; L128-I172 HydrophobicContact CD1-CB 4.48Å; L128-I172 HydrophobicContact CD1-CD1 3.96Å; L128-I172 HydrophobicContact CD1-CG1 4.03Å; L128-I172 HydrophobicContact CD1-CG2 3.67Å; L128-I172 HydrophobicContact CD2-CD1 4.38Å; L128-W328 HydrophobicContact CB-CD2 4.12Å; L128-W328 HydrophobicContact CB-CE3 3.9Å; L128-W328 HydrophobicContact CB-CG 4.49Å; L128-W328 HydrophobicContact CB-CZ3 4.38Å; L128-W328 HydrophobicContact CD1-CD2 3.95Å; L128-W328 HydrophobicContact CD1-CE3 4.25Å; L128-W328 HydrophobicContact CD1-CG 4.47Å; L128-W328 HydrophobicContact CD1-CH2 4.24Å; L128-W328 HydrophobicContact CD1-CZ2 3.95Å; L128-W328 HydrophobicContact CD1-CZ3 4.38Å; L128-W328 HydrophobicContact CD2-CB 4.03Å; L128-W328 HydrophobicContact CD2-CD2 4.1Å; L128-W328 HydrophobicContact CD2-CG 3.78Å; L128-W328 HydrophobicContact CG-CD2 4.28Å; L128-W328 HydrophobicContact CG-CG 4.46Å; L128-I333 HydrophobicContact CD2-CD1 4.23Å; L128-I333 HydrophobicContact CD2-CG1 4.45Å
129	F	98.1	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.5	-43.5	176	-174	-123.5	0	0	0	111.4	L125 E126 D127 L131 C132 D133 R134 F136 Y243 F244	L125-F129 WeakPolarHBondContact O-CB 3.35Å; L125-F129 PolarHBondContact O-N 3.36Å; E126-F129 WeakPolarHBondContact O-CA 3.49Å; E126-F129 WeakPolarHBondContact O-CB 3.39Å; E126-F129 PolarHBondContact O-N 2.99Å; D127-F129 VanDerWaalsContact C-N 3.33Å; F129-L131 VanDerWaalsContact C-N 3.33Å; F129-C132 CarbonylContact O-C 3.5Å; F129-C132 PolarHBondContact O-N 3.42Å; F129-C132 VanDerWaalsContact O-N 3.11Å; F129-D133 PolarHBondContact O-N 2.83Å; F129-R134 HydrophobicContact CD1-CB 4.23Å; F129-R134 HydrophobicContact CD1-CG 4.35Å; F129-R134 HydrophobicContact CE1-CB 4.02Å; F129-R134 WeakPolarHBondContact CE2-O 3.13Å; F129-R134 VanDerWaalsContact CZ-C 3.49Å; F129-R134 HydrophobicContact CZ-CB 4.39Å; F129-R134 WeakPolarHBondContact CZ-O 3.45Å; F129-R134 WeakPolarHBondContact O-CA 3.47Å; F129-R134 PolarHBondContact O-N 2.72Å; F129-F136 VanDerWaalsContact CA-CZ 3.48Å; F129-F136 HydrophobicContact CB-CE1 4.33Å; F129-F136 HydrophobicContact CB-CE2 4.08Å; F129-F136 HydrophobicContact CB-CZ 3.77Å; F129-F136 HydrophobicContact CD2-CD1 4.17Å; F129-F136 AromaticContact CD2-CD2 3.91Å; F129-F136 HydrophobicContact CD2-CD2 3.91Å; F129-F136 HydrophobicContact CD2-CE1 4.17Å; F129-F136 AromaticContact CD2-CE2 3.9Å; F129-F136 HydrophobicContact CD2-CE2 3.9Å; F129-F136 HydrophobicContact CD2-CG 4.03Å; F129-F136 HydrophobicContact CD2-CZ 4.03Å; F129-F136 HydrophobicContact CE2-CD2 4.47Å; F129-F136 HydrophobicContact CE2-CG 4.49Å; F129-F136 HydrophobicContact CG-CE2 4.46Å; F129-F136 HydrophobicContact CG-CZ 4.43Å; F129-Y243 AromaticContact CD1-CE1 3.84Å; F129-Y243 HydrophobicContact CD1-CE1 3.84Å; F129-Y243 HydrophobicContact CE1-CD1 4.16Å; F129-Y243 AromaticContact CE1-CE1 3.48Å; F129-Y243 HydrophobicContact CE1-CE1 3.48Å; F129-Y243 VanDerWaalsContact CE1-CE1 3.48Å; F129-Y243 HydrophobicContact CE1-CE2 4.16Å; F129-Y243 AromaticContact CE1-CZ 3.51Å; F129-Y243 HydrophobicContact CZ-CD1 4.35Å; F129-Y243 HydrophobicContact CZ-CE1 4.12Å; F129-F244 HydrophobicContact CB-CE1 4.45Å; F129-F244 AromaticContact CD2-CD1 3.77Å; F129-F244 HydrophobicContact CD2-CD1 3.77Å; F129-F244 HydrophobicContact CD2-CE1 4.44Å; F129-F244 HydrophobicContact CE2-CB 4.27Å; F129-F244 AromaticContact CE2-CD1 3.85Å; F129-F244 HydrophobicContact CE2-CD1 3.85Å; F129-F244 WeakPolarHBondContact CE2-O 3.14Å; F129-F244 HydrophobicContact CG-CD1 4.11Å; F129-F244 HydrophobicContact CG-CE1 4.39Å; F129-F244 HydrophobicContact CZ-CD1 4.25Å
130	D	97.1	Very high	97.1	Very high	83 Å²	83	33.1 Å²	33.1	44%	0.444	18%	0.181	S	C	.	.	H	α-helix	trans	-61.2	-41.5	170.5	-78.7	-27	0	0	0	111.6	E126 C132 D133 R134	E126-D130 PolarHBondContact O-N 2.76Å; D130-C132 PolarHBondContact O-N 3.1Å; D130-D133 PolarHBondContact O-N 2.88Å; D130-R134 WeakPolarHBondContact OD1-CD 3.48Å; D130-R134 WeakPolarHBondContact OD1-CG 3.3Å; D130-R134 IonicContact OD1-CZ 2.72Å; D130-R134 IonicContact OD1-NE 2.75Å; D130-R134 IonicContact OD1-NH1 3.12Å; D130-R134 PolarHBondContact OD1-NH1 3Å; D130-R134 IonicContact OD2-NH1 3.22Å
131	L	96.4	Very high	97.3	Very high	50 Å²	50	31.5 Å²	31.5	26%	0.262	17%	0.172	S	C	.	.	H	α-helix	trans	-63.1	-23.9	173.9	-176.8	61.9	0	0	0	113.4	D127 L128 F129 W328 R331 I333	D127-L131 WeakPolarHBondContact O-CB 3.45Å; D127-L131 PolarHBondContact O-N 2.92Å; L128-L131 HydrophobicContact CD2-CD2 4.42Å; L128-L131 PolarHBondContact O-N 2.71Å; F129-L131 VanDerWaalsContact C-N 3.33Å; L131-W328 HydrophobicContact CD2-CB 4.4Å; L131-R331 HydrophobicContact CD1-CB 4.21Å; L131-R331 HydrophobicContact CD2-CB 3.96Å; L131-R331 HydrophobicContact CG-CB 4.02Å; L131-R331 VanDerWaalsContact O-CD 3.27Å; L131-R331 WeakPolarHBondContact O-CD 3.47Å; L131-R331 PolarHBondContact O-NH1 3.08Å; L131-I333 HydrophobicContact CD2-CG1 3.92Å
132	C	97.3	Very high	97.5	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.02	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	32	177.2	-70.9	0	0	0	0	112.9	L128 F129 D130 R134 T135 F136 D327	L128-C132 WeakPolarHBondContact O-CB 3.24Å; L128-C132 PolarHBondContact O-N 3.25Å; L128-C132 PolarHBondContact O-SG 2.87Å; L128-C132 VanDerWaalsContact O-SG 3.36Å; F129-C132 CarbonylContact O-C 3.5Å; F129-C132 PolarHBondContact O-N 3.42Å; F129-C132 VanDerWaalsContact O-N 3.11Å; D130-C132 PolarHBondContact O-N 3.1Å; C132-R134 PolarHBondContact O-N 2.92Å; C132-R134 VanDerWaalsContact O-N 3.08Å; C132-T135 PolarHBondContact O-N 3.4Å; C132-F136 HydrophobicContact CB-CD1 3.85Å; C132-F136 HydrophobicContact CB-CE1 3.65Å; C132-D327 PolarHBondContact SG-O 3.43Å
133	D	97.1	Very high	97.7	Very high	122 Å²	122	29.8 Å²	29.8	65%	0.652	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	26.7	173.5	-47.8	-72.8	0	0	0	112.8	F129 D130 T135 R331	F129-D133 PolarHBondContact O-N 2.83Å; D130-D133 PolarHBondContact O-N 2.88Å; D133-T135 VanDerWaalsContact C-N 3.31Å; D133-T135 PolarHBondContact O-N 3.11Å; D133-R331 IonicContact OD2-CZ 1.87Å; D133-R331 IonicContact OD2-NH1 3.86Å; D133-R331 PolarHBondContact OD2-NH1 2.71Å; D133-R331 IonicContact OD2-NH2 3.92Å; D133-R331 PolarHBondContact OD2-NH2 2.9Å
134	R	98	Very high	97.9	Very high	80 Å²	80	28.3 Å²	28.3	30%	0.302	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	35.7	-179.6	-58.9	-175.2	57.7	75.7	14.2	114.5	E126 F129 D130 C132 Y243 G247	E126-R134 IonicContact OE1-CZ 2.79Å; E126-R134 IonicContact OE1-NH1 2.69Å; E126-R134 PolarHBondContact OE1-NH1 2.7Å; E126-R134 IonicContact OE1-NH2 2.87Å; F129-R134 HydrophobicContact CD1-CB 4.23Å; F129-R134 HydrophobicContact CD1-CG 4.35Å; F129-R134 HydrophobicContact CE1-CB 4.02Å; F129-R134 WeakPolarHBondContact CE2-O 3.13Å; F129-R134 VanDerWaalsContact CZ-C 3.49Å; F129-R134 HydrophobicContact CZ-CB 4.39Å; F129-R134 WeakPolarHBondContact CZ-O 3.45Å; F129-R134 WeakPolarHBondContact O-CA 3.47Å; F129-R134 PolarHBondContact O-N 2.72Å; D130-R134 WeakPolarHBondContact OD1-CD 3.48Å; D130-R134 WeakPolarHBondContact OD1-CG 3.3Å; D130-R134 IonicContact OD1-CZ 2.72Å; D130-R134 IonicContact OD1-NE 2.75Å; D130-R134 IonicContact OD1-NH1 3.12Å; D130-R134 PolarHBondContact OD1-NH1 3Å; D130-R134 IonicContact OD2-NH1 3.22Å; C132-R134 PolarHBondContact O-N 2.92Å; C132-R134 VanDerWaalsContact O-N 3.08Å; R134-Y243 PolarHBondContact NH2-OH 3.33Å; R134-G247 WeakPolarHBondContact O-CA 3.24Å
135	T	98.4	Very high	98.1	Very high	75 Å²	75	28.2 Å²	28.2	46%	0.46	15%	0.148	S	C	.	.			trans	-142.3	146.3	161.8	52.8	0	0	0	0	110	C132 D133	C132-T135 PolarHBondContact O-N 3.4Å; D133-T135 VanDerWaalsContact C-N 3.31Å; D133-T135 PolarHBondContact O-N 3.11Å
136	F	98.8	Very high	98.1	Very high	9 Å²	9	29.1 Å²	29.1	4%	0.039	15%	0.153	C	C	.	.			trans	-114.6	144.4	167.8	-71.4	-34.1	0	0	0	111	L128 F129 C132 T140 V141 I144 F244 D327 W328	L128-F136 HydrophobicContact CB-CZ 4.14Å; F129-F136 VanDerWaalsContact CA-CZ 3.48Å; F129-F136 HydrophobicContact CB-CE1 4.33Å; F129-F136 HydrophobicContact CB-CE2 4.08Å; F129-F136 HydrophobicContact CB-CZ 3.77Å; F129-F136 HydrophobicContact CD2-CD1 4.17Å; F129-F136 AromaticContact CD2-CD2 3.91Å; F129-F136 HydrophobicContact CD2-CD2 3.91Å; F129-F136 HydrophobicContact CD2-CE1 4.17Å; F129-F136 AromaticContact CD2-CE2 3.9Å; F129-F136 HydrophobicContact CD2-CE2 3.9Å; F129-F136 HydrophobicContact CD2-CG 4.03Å; F129-F136 HydrophobicContact CD2-CZ 4.03Å; F129-F136 HydrophobicContact CE2-CD2 4.47Å; F129-F136 HydrophobicContact CE2-CG 4.49Å; F129-F136 HydrophobicContact CG-CE2 4.46Å; F129-F136 HydrophobicContact CG-CZ 4.43Å; C132-F136 HydrophobicContact CB-CD1 3.85Å; C132-F136 HydrophobicContact CB-CE1 3.65Å; F136-T140 HydrophobicContact CB-CG2 3.8Å; F136-T140 HydrophobicContact CD1-CG2 3.92Å; F136-T140 HydrophobicContact CD2-CG2 4.03Å; F136-T140 HydrophobicContact CE1-CG2 4.5Å; F136-T140 HydrophobicContact CG-CG2 3.67Å; F136-V141 HydrophobicContact CB-CG2 3.61Å; F136-I144 HydrophobicContact CD2-CD1 3.93Å; F136-I144 HydrophobicContact CE2-CD1 3.97Å; F136-F244 HydrophobicContact CB-CB 4.32Å; F136-F244 HydrophobicContact CD2-CB 3.82Å; F136-F244 AromaticContact CD2-CD1 3.7Å; F136-F244 HydrophobicContact CD2-CD1 3.7Å; F136-F244 HydrophobicContact CD2-CD2 4.28Å; F136-F244 HydrophobicContact CD2-CE1 4.3Å; F136-F244 AromaticContact CD2-CG 3.7Å; F136-F244 HydrophobicContact CD2-CG 3.7Å; F136-F244 AromaticContact CE2-CD1 3.74Å; F136-F244 HydrophobicContact CE2-CD1 3.74Å; F136-F244 AromaticContact CE2-CE1 3.89Å; F136-F244 HydrophobicContact CE2-CE1 3.89Å; F136-F244 HydrophobicContact CE2-CG 4.13Å; F136-F244 HydrophobicContact CE2-CZ 4.38Å; F136-F244 HydrophobicContact CG-CB 4.5Å; F136-F244 PolarHBondContact N-O 3.26Å; F136-D327 VanDerWaalsContact CA-OD2 3.26Å; F136-D327 WeakPolarHBondContact CA-OD2 3.37Å; F136-D327 HydrophobicContact CD1-CB 4.44Å; F136-W328 HydrophobicContact CD1-CZ3 4.48Å; F136-W328 AromaticContact CE1-CE3 3.7Å; F136-W328 HydrophobicContact CE1-CE3 3.7Å; F136-W328 AromaticContact CE1-CZ3 3.81Å; F136-W328 HydrophobicContact CE1-CZ3 3.81Å; F136-W328 HydrophobicContact CE2-CZ3 4.12Å; F136-W328 AromaticContact CZ-CE3 3.86Å; F136-W328 HydrophobicContact CZ-CE3 3.86Å; F136-W328 AromaticContact CZ-CZ3 3.61Å; F136-W328 HydrophobicContact CZ-CZ3 3.61Å
137	S	98.8	Very high	98.1	Very high	49 Å²	49	28.8 Å²	28.8	34%	0.343	15%	0.152	S	C	.	.			trans	-64	154.5	172.3	77.1	0	0	0	0	111.1	K139 T140 V141 D327	S137-K139 PolarHBondContact O-N 3Å; S137-T140 PolarHBondContact O-N 3.42Å; S137-T140 VanDerWaalsContact O-N 3.13Å; S137-T140 PolarHBondContact OG-N 3.11Å; S137-T140 PolarHBondContact OG-OG1 2.9Å; S137-V141 PolarHBondContact O-N 3.38Å; S137-D327 WeakPolarHBondContact CB-OD1 3.36Å; S137-D327 PolarHBondContact N-OD2 3.4Å; S137-D327 PolarHBondContact OG-OD1 2.95Å; S137-D327 PolarHBondContact OG-OD2 3.45Å
138	L	98.8	Very high	98.3	Very high	26 Å²	26	27 Å²	27	14%	0.136	14%	0.142	C	C	.	.	H	α-helix	trans	-55.6	-39.6	176.1	179.9	64.8	0	0	0	111.9	V141 L142 L245 P283 M286 K318 Y320	L138-V141 PolarHBondContact O-N 2.85Å; L138-L142 HydrophobicContact CD1-CD1 3.93Å; L138-L142 HydrophobicContact CD1-CD2 4.39Å; L138-L142 HydrophobicContact CD1-CG 3.95Å; L138-L142 HydrophobicContact CD2-CD1 4.39Å; L138-L142 HydrophobicContact CG-CD1 3.77Å; L138-L142 HydrophobicContact CG-CG 4.23Å; L138-L142 WeakPolarHBondContact O-CB 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 3.22Å; L138-L245 HydrophobicContact CD1-CD2 4.17Å; L138-P283 HydrophobicContact CD1-CG 3.9Å; L138-P283 HydrophobicContact CD2-CG 3.59Å; L138-P283 HydrophobicContact CG-CG 4.42Å; L138-M286 HydrophobicContact CD1-CE 3.97Å; L138-K318 HydrophobicContact CD2-CD 4.34Å; L138-K318 HydrophobicContact CD2-CG 4.23Å; L138-Y320 HydrophobicContact CB-CE2 4.49Å; L138-Y320 HydrophobicContact CD2-CE2 4.29Å; L138-Y320 HydrophobicContact CG-CE2 4.27Å
139	K	98.8	Very high	98.4	Very high	34 Å²	34	26.9 Å²	26.9	15%	0.148	14%	0.142	C	C	.	.	H	α-helix	trans	-58.7	-49.8	177	-172.7	-167.2	172.5	-161.4	0	111	S137 L142 M143 F315 Y320 T321 D323 T325	S137-K139 PolarHBondContact O-N 3Å; K139-L142 PolarHBondContact O-N 3.17Å; K139-M143 HydrophobicContact CD-CE 4.42Å; K139-M143 HydrophobicContact CG-CE 4.15Å; K139-M143 WeakPolarHBondContact O-CG 3.42Å; K139-M143 PolarHBondContact O-N 3.13Å; K139-M143 VanDerWaalsContact O-N 3.11Å; K139-F315 HydrophobicContact CG-CE2 3.66Å; K139-F315 HydrophobicContact CG-CZ 4.11Å; K139-Y320 HydrophobicContact CB-CD1 4.32Å; K139-Y320 HydrophobicContact CB-CD2 3.84Å; K139-Y320 HydrophobicContact CB-CE1 4.3Å; K139-Y320 HydrophobicContact CB-CE2 3.81Å; K139-Y320 HydrophobicContact CB-CG 4.11Å; K139-Y320 HydrophobicContact CD-CD1 4.44Å; K139-Y320 HydrophobicContact CD-CG 4.4Å; K139-Y320 HydrophobicContact CG-CD1 4.27Å; K139-Y320 HydrophobicContact CG-CD2 3.95Å; K139-Y320 HydrophobicContact CG-CE2 4.43Å; K139-Y320 HydrophobicContact CG-CG 3.86Å; K139-T321 VanDerWaalsContact CE-O 3.25Å; K139-T321 WeakPolarHBondContact CE-O 3.36Å; K139-D323 WeakPolarHBondContact CE-OD1 3.12Å; K139-D323 IonicContact NZ-OD1 3.77Å; K139-D323 PolarHBondContact NZ-OD1 2.86Å; K139-D323 IonicContact NZ-OD2 3.19Å; K139-D323 PolarHBondContact NZ-OD2 2.86Å; K139-T325 PolarHBondContact NZ-O 3.24Å
140	T	98.9	Very high	98.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-47.8	178	-75.5	0	0	0	0	111.4	F136 S137 L142 M143 I144 Y326 D327 W328	F136-T140 HydrophobicContact CB-CG2 3.8Å; F136-T140 HydrophobicContact CD1-CG2 3.92Å; F136-T140 HydrophobicContact CD2-CG2 4.03Å; F136-T140 HydrophobicContact CE1-CG2 4.5Å; F136-T140 HydrophobicContact CG-CG2 3.67Å; S137-T140 PolarHBondContact O-N 3.42Å; S137-T140 VanDerWaalsContact O-N 3.13Å; S137-T140 PolarHBondContact OG-N 3.11Å; S137-T140 PolarHBondContact OG-OG1 2.9Å; T140-L142 PolarHBondContact O-N 2.82Å; T140-M143 PolarHBondContact O-N 3.45Å; T140-I144 HydrophobicContact CG2-CD1 3.71Å; T140-I144 VanDerWaalsContact O-CG1 3.25Å; T140-I144 WeakPolarHBondContact O-CG1 3.36Å; T140-I144 PolarHBondContact O-N 3.34Å; T140-Y326 HydrophobicContact CG2-CD1 4.12Å; T140-Y326 WeakPolarHBondContact OG1-CA 3.4Å; T140-D327 VanDerWaalsContact CB-OD2 3.25Å; T140-D327 WeakPolarHBondContact CB-OD2 3.19Å; T140-D327 PolarHBondContact OG1-N 3.37Å; T140-D327 PolarHBondContact OG1-OD1 2.98Å; T140-D327 PolarHBondContact OG1-OD2 3.44Å; T140-W328 HydrophobicContact CG2-CE3 4.41Å; T140-W328 HydrophobicContact CG2-CH2 4.33Å; T140-W328 HydrophobicContact CG2-CZ3 3.71Å
141	V	98.9	Very high	98.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-38.3	179.9	177.4	0	0	0	0	112.4	F136 S137 L138 I144 A145 F241 F244 L245	F136-V141 HydrophobicContact CB-CG2 3.61Å; S137-V141 PolarHBondContact O-N 3.38Å; L138-V141 PolarHBondContact O-N 2.85Å; V141-I144 PolarHBondContact O-N 2.72Å; V141-A145 VanDerWaalsContact O-CB 3.27Å; V141-A145 WeakPolarHBondContact O-CB 3.4Å; V141-A145 PolarHBondContact O-N 3.36Å; V141-F241 HydrophobicContact CG1-CB 4.04Å; V141-F244 HydrophobicContact CG2-CB 3.69Å; V141-L245 HydrophobicContact CB-CD2 3.9Å; V141-L245 HydrophobicContact CB-CG 4.21Å; V141-L245 HydrophobicContact CG1-CD1 4.31Å; V141-L245 HydrophobicContact CG1-CD2 4.21Å; V141-L245 HydrophobicContact CG1-CG 4.01Å; V141-L245 HydrophobicContact CG2-CD2 3.73Å; V141-L245 HydrophobicContact CG2-CG 3.98Å
142	L	98.9	Very high	98.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67	-44.4	177.3	-69.4	171.8	0	0	0	112.1	L138 K139 T140 I144 A145 I146 M286 F311 L314 F315 Y320	L138-L142 HydrophobicContact CD1-CD1 3.93Å; L138-L142 HydrophobicContact CD1-CD2 4.39Å; L138-L142 HydrophobicContact CD1-CG 3.95Å; L138-L142 HydrophobicContact CD2-CD1 4.39Å; L138-L142 HydrophobicContact CG-CD1 3.77Å; L138-L142 HydrophobicContact CG-CG 4.23Å; L138-L142 WeakPolarHBondContact O-CB 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 3.22Å; K139-L142 PolarHBondContact O-N 3.17Å; T140-L142 PolarHBondContact O-N 2.82Å; L142-I144 VanDerWaalsContact C-N 3.3Å; L142-I144 PolarHBondContact O-N 3.39Å; L142-A145 PolarHBondContact O-N 3.14Å; L142-I146 WeakPolarHBondContact O-CD1 3.46Å; L142-I146 VanDerWaalsContact O-CG1 3.32Å; L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.27Å; L142-M286 HydrophobicContact CD2-CE 3.71Å; L142-F311 HydrophobicContact CD2-CB 3.73Å; L142-F311 HydrophobicContact CD2-CD1 3.54Å; L142-F311 HydrophobicContact CD2-CE1 4.37Å; L142-F311 HydrophobicContact CD2-CG 3.79Å; L142-L314 HydrophobicContact CD1-CD2 3.99Å; L142-L314 HydrophobicContact CD1-CG 3.99Å; L142-L314 HydrophobicContact CD2-CD2 3.88Å; L142-F315 HydrophobicContact CB-CD2 3.74Å; L142-F315 HydrophobicContact CB-CE2 4.44Å; L142-F315 HydrophobicContact CD1-CB 4.14Å; L142-F315 HydrophobicContact CD1-CD2 3.98Å; L142-Y320 HydrophobicContact CD1-CD2 4.49Å; L142-Y320 HydrophobicContact CD1-CE2 4.45Å
143	M	98.8	Very high	98.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-38	174.7	-67.8	-171.5	-61.1	0	0	112.1	K139 T140 Q147 F315 F322 Y326	K139-M143 HydrophobicContact CD-CE 4.42Å; K139-M143 HydrophobicContact CG-CE 4.15Å; K139-M143 WeakPolarHBondContact O-CG 3.42Å; K139-M143 PolarHBondContact O-N 3.13Å; K139-M143 VanDerWaalsContact O-N 3.11Å; T140-M143 PolarHBondContact O-N 3.45Å; M143-Q147 PolarHBondContact O-N 2.91Å; M143-F315 HydrophobicContact CG-CE2 3.55Å; M143-F315 HydrophobicContact CG-CZ 3.78Å; M143-F315 HydrophobicContact SD-CE2 4.27Å; M143-F315 HydrophobicContact SD-CZ 4.03Å; M143-F322 HydrophobicContact CB-CE2 4.14Å; M143-F322 HydrophobicContact CB-CZ 4.15Å; M143-F322 HydrophobicContact CG-CD2 3.96Å; M143-F322 HydrophobicContact CG-CE2 3.8Å; M143-F322 HydrophobicContact CG-CG 4.44Å; M143-F322 HydrophobicContact CG-CZ 4.13Å; M143-Y326 HydrophobicContact CB-CD1 4.45Å; M143-Y326 HydrophobicContact CB-CE1 3.69Å; M143-Y326 HydrophobicContact CE-CD1 3.66Å; M143-Y326 HydrophobicContact CE-CE1 3.86Å; M143-Y326 HydrophobicContact CE-CG 4.2Å
144	I	98.9	Very high	98.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63	-51.3	172	-68.5	164.9	0	0	0	110.6	L125 F136 T140 V141 L142 I146 Q147 L148 I183 F244 Y326 W328	L125-I144 HydrophobicContact CD1-CG2 3.77Å; L125-I144 HydrophobicContact CD2-CD1 4.26Å; F136-I144 HydrophobicContact CD2-CD1 3.93Å; F136-I144 HydrophobicContact CE2-CD1 3.97Å; T140-I144 HydrophobicContact CG2-CD1 3.71Å; T140-I144 VanDerWaalsContact O-CG1 3.25Å; T140-I144 WeakPolarHBondContact O-CG1 3.36Å; T140-I144 PolarHBondContact O-N 3.34Å; V141-I144 PolarHBondContact O-N 2.72Å; L142-I144 VanDerWaalsContact C-N 3.3Å; L142-I144 PolarHBondContact O-N 3.39Å; I144-I146 PolarHBondContact O-N 3.08Å; I144-Q147 PolarHBondContact O-N 2.89Å; I144-L148 HydrophobicContact CG2-CD1 3.69Å; I144-L148 HydrophobicContact CG2-CG 4.02Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.75Å; I144-I183 HydrophobicContact CB-CD1 3.97Å; I144-I183 HydrophobicContact CG1-CD1 3.68Å; I144-I183 HydrophobicContact CG2-CD1 4.03Å; I144-F244 HydrophobicContact CG2-CE2 4.37Å; I144-Y326 HydrophobicContact CG1-CE1 4.25Å; I144-W328 HydrophobicContact CD1-CH2 4.06Å; I144-W328 HydrophobicContact CD1-CZ3 4.13Å; I144-W328 HydrophobicContact CG1-CH2 4.34Å
145	A	98.9	Very high	98.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.3	-44.2	-173.5	0	0	0	0	0	112.4	V141 L142 Q147 L148 I149 F241 F311	V141-A145 VanDerWaalsContact O-CB 3.27Å; V141-A145 WeakPolarHBondContact O-CB 3.4Å; V141-A145 PolarHBondContact O-N 3.36Å; L142-A145 PolarHBondContact O-N 3.14Å; A145-Q147 VanDerWaalsContact C-N 3.35Å; A145-Q147 PolarHBondContact O-N 3.09Å; A145-L148 PolarHBondContact O-N 3.42Å; A145-I149 WeakPolarHBondContact O-CD1 3.4Å; A145-I149 VanDerWaalsContact O-CG1 3.26Å; A145-I149 WeakPolarHBondContact O-CG1 3.19Å; A145-I149 PolarHBondContact O-N 2.77Å; A145-F241 HydrophobicContact CB-CD1 4.03Å; A145-F241 HydrophobicContact CB-CD2 4.11Å; A145-F241 HydrophobicContact CB-CE1 3.68Å; A145-F241 HydrophobicContact CB-CE2 3.76Å; A145-F241 HydrophobicContact CB-CG 4.25Å; A145-F241 HydrophobicContact CB-CZ 3.53Å; A145-F311 HydrophobicContact CB-CD2 3.66Å; A145-F311 HydrophobicContact CB-CE2 3.76Å; A145-F311 HydrophobicContact CB-CG 4.49Å
146	I	98.8	Very high	98.8	Very high	19 Å²	19	15.6 Å²	15.6	10%	0.097	8%	0.08	C	C	.	.	H	α-helix	trans	-58.8	-45.3	177.1	-68.4	159.8	0	0	0	110.8	L142 I144 S150 F311 T312 F322	L142-I146 WeakPolarHBondContact O-CD1 3.46Å; L142-I146 VanDerWaalsContact O-CG1 3.32Å; L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.27Å; I144-I146 PolarHBondContact O-N 3.08Å; I146-S150 PolarHBondContact O-N 3.5Å; I146-S150 PolarHBondContact O-OG 2.96Å; I146-F311 HydrophobicContact CD1-CB 4.31Å; I146-F311 HydrophobicContact CG1-CB 3.96Å; I146-T312 HydrophobicContact CD1-CG2 3.65Å; I146-T312 HydrophobicContact CG1-CG2 4.1Å; I146-F322 HydrophobicContact CB-CE2 4.43Å; I146-F322 HydrophobicContact CD1-CE2 3.9Å; I146-F322 HydrophobicContact CG2-CE2 4.37Å
147	Q	98.8	Very high	98.8	Very high	15 Å²	15	18.6 Å²	18.6	7%	0.07	10%	0.103	C	C	.	.	H	α-helix	trans	-64.8	-46.6	174.9	-73	-163	53.3	0	0	112.2	M143 I144 A145 I149 S150 R151 H181 I183 Y326	M143-Q147 PolarHBondContact O-N 2.91Å; I144-Q147 PolarHBondContact O-N 2.89Å; A145-Q147 VanDerWaalsContact C-N 3.35Å; A145-Q147 PolarHBondContact O-N 3.09Å; Q147-I149 PolarHBondContact O-N 3.29Å; Q147-S150 CarbonylContact O-C 3.44Å; Q147-S150 WeakPolarHBondContact O-CB 3.48Å; Q147-S150 PolarHBondContact O-N 3.21Å; Q147-S150 VanDerWaalsContact O-N 3.12Å; Q147-R151 WeakPolarHBondContact O-CG 3.27Å; Q147-R151 PolarHBondContact O-N 3.11Å; Q147-H181 PolarHBondContact NE2-O 3.49Å; Q147-I183 HydrophobicContact CB-CD1 4.35Å; Q147-Y326 PolarHBondContact NE2-OH 3.12Å
148	L	98.9	Very high	98.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70.2	-31.3	-173.6	-68.5	-167.8	0	0	0	113.8	L125 I144 A145 S150 R151 M152 F170 I183 L237 M240 F241	L125-L148 HydrophobicContact CD1-CD1 4.16Å; I144-L148 HydrophobicContact CG2-CD1 3.69Å; I144-L148 HydrophobicContact CG2-CG 4.02Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.75Å; A145-L148 PolarHBondContact O-N 3.42Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-R151 HydrophobicContact CD2-CG 4.21Å; L148-R151 PolarHBondContact O-N 3.38Å; L148-M152 WeakPolarHBondContact O-CB 3.42Å; L148-M152 PolarHBondContact O-N 2.87Å; L148-F170 HydrophobicContact CD1-CD1 4.12Å; L148-F170 HydrophobicContact CD1-CD2 4.1Å; L148-F170 HydrophobicContact CD1-CE1 4.3Å; L148-F170 HydrophobicContact CD1-CE2 4.3Å; L148-F170 HydrophobicContact CD1-CG 4.01Å; L148-F170 HydrophobicContact CD1-CZ 4.38Å; L148-F170 HydrophobicContact CD2-CB 4.43Å; L148-F170 HydrophobicContact CD2-CD1 3.34Å; L148-F170 HydrophobicContact CD2-CE1 3.68Å; L148-F170 HydrophobicContact CD2-CG 3.93Å; L148-F170 HydrophobicContact CG-CD1 4.39Å; L148-I183 HydrophobicContact CD2-CB 4.3Å; L148-I183 HydrophobicContact CD2-CG2 3.65Å; L148-L237 HydrophobicContact CB-CD1 4.43Å; L148-L237 HydrophobicContact CB-CD2 4Å; L148-L237 HydrophobicContact CD1-CD2 3.97Å; L148-M240 HydrophobicContact CD1-CE 3.35Å; L148-F241 HydrophobicContact CD1-CE1 4.37Å
149	I	98.9	Very high	98.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-44	169.2	-65.9	161	0	0	0	109.8	A145 Q147 M152 E153 Y289 Y304 L307 R308 F311	A145-I149 WeakPolarHBondContact O-CD1 3.4Å; A145-I149 VanDerWaalsContact O-CG1 3.26Å; A145-I149 WeakPolarHBondContact O-CG1 3.19Å; A145-I149 PolarHBondContact O-N 2.77Å; Q147-I149 PolarHBondContact O-N 3.29Å; I149-M152 PolarHBondContact O-N 3.34Å; I149-E153 WeakPolarHBondContact O-CB 3.37Å; I149-E153 PolarHBondContact O-N 3.42Å; I149-Y289 HydrophobicContact CD1-CE2 3.87Å; I149-Y289 HydrophobicContact CG1-CE2 4.24Å; I149-Y304 HydrophobicContact CG2-CD1 4.37Å; I149-L307 HydrophobicContact CD1-CB 4.18Å; I149-L307 HydrophobicContact CG2-CB 4.44Å; I149-R308 HydrophobicContact CB-CG 4.2Å; I149-R308 HydrophobicContact CD1-CG 4.48Å; I149-R308 HydrophobicContact CG2-CG 3.92Å; I149-F311 HydrophobicContact CD1-CD2 3.8Å; I149-F311 HydrophobicContact CD1-CE2 3.91Å
150	S	98.7	Very high	98.7	Very high	41 Å²	41	20.2 Å²	20.2	29%	0.287	11%	0.106	S	C	.	.	H	α-helix	trans	-66.5	-37.6	176	-60.6	0	0	0	0	113.6	I146 Q147 L148 M152 Y154 R308	I146-S150 PolarHBondContact O-N 3.5Å; I146-S150 PolarHBondContact O-OG 2.96Å; Q147-S150 CarbonylContact O-C 3.44Å; Q147-S150 WeakPolarHBondContact O-CB 3.48Å; Q147-S150 PolarHBondContact O-N 3.21Å; Q147-S150 VanDerWaalsContact O-N 3.12Å; L148-S150 VanDerWaalsContact C-N 3.32Å; S150-M152 VanDerWaalsContact C-N 3.32Å; S150-M152 PolarHBondContact O-N 2.92Å; S150-Y154 WeakPolarHBondContact O-CB 3.47Å; S150-Y154 PolarHBondContact O-N 3.25Å; S150-R308 WeakPolarHBondContact OG-CD 3.43Å; S150-R308 PolarHBondContact OG-NH1 2.82Å
151	R	98.6	Very high	98.7	Very high	16 Å²	16	20.2 Å²	20.2	6%	0.06	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-42.1	171.4	-57.5	-50.2	167	-132.3	-14.5	111.1	E99 Q147 L148 Y154 V155 I183 I185	E99-R151 PolarHBondContact O-NH1 2.67Å; E99-R151 IonicContact OE2-CZ 3.23Å; E99-R151 IonicContact OE2-NH1 2.72Å; E99-R151 PolarHBondContact OE2-NH1 2.72Å; E99-R151 IonicContact OE2-NH2 2.83Å; E99-R151 PolarHBondContact OE2-NH2 2.83Å; Q147-R151 WeakPolarHBondContact O-CG 3.27Å; Q147-R151 PolarHBondContact O-N 3.11Å; L148-R151 HydrophobicContact CD2-CG 4.21Å; L148-R151 PolarHBondContact O-N 3.38Å; R151-Y154 WeakPolarHBondContact O-CB 3.37Å; R151-Y154 PolarHBondContact O-N 3.34Å; R151-V155 WeakPolarHBondContact O-CG2 3.27Å; R151-V155 PolarHBondContact O-N 3.21Å; R151-I183 PolarHBondContact NE-O 3.3Å; R151-I185 HydrophobicContact CB-CG2 4.35Å
152	M	98.8	Very high	98.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-71.6	-41.7	-178.2	-162.9	57.7	66.8	0	0	112.2	L148 I149 S150 Y154 V155 H156 Y162 V165 I185 D233 L234 L237	L148-M152 WeakPolarHBondContact O-CB 3.42Å; L148-M152 PolarHBondContact O-N 2.87Å; I149-M152 PolarHBondContact O-N 3.34Å; S150-M152 VanDerWaalsContact C-N 3.32Å; S150-M152 PolarHBondContact O-N 2.92Å; M152-Y154 VanDerWaalsContact C-N 3.28Å; M152-Y154 PolarHBondContact O-N 2.72Å; M152-V155 PolarHBondContact O-N 1.87Å; M152-H156 WeakPolarHBondContact CG-CE1 3.44Å; M152-H156 WeakPolarHBondContact O-CB 3.45Å; M152-H156 PolarHBondContact O-N 3.41Å; M152-H156 PolarHBondContact SD-NE2 3.41Å; M152-H156 VanDerWaalsContact SD-NE2 3.41Å; M152-Y162 HydrophobicContact CE-CD1 3.94Å; M152-Y162 HydrophobicContact CE-CG 4.25Å; M152-V165 HydrophobicContact CE-CG2 3.69Å; M152-I185 HydrophobicContact CE-CD1 4.37Å; M152-D233 HydrophobicContact CE-CB 4.02Å; M152-D233 HydrophobicContact CG-CB 3.99Å; M152-D233 HydrophobicContact SD-CB 3.59Å; M152-D233 VanDerWaalsContact SD-CB 3.59Å; M152-L234 HydrophobicContact CB-CD2 4.31Å; M152-L234 HydrophobicContact CG-CD2 4.02Å; M152-L237 HydrophobicContact CB-CD1 4.02Å; M152-L237 HydrophobicContact CE-CD1 4.32Å; M152-L237 HydrophobicContact CG-CD1 4.32Å
153	E	98.8	Very high	98.6	Very high	54 Å²	54	22 Å²	22	25%	0.252	11%	0.112	S	C	.	.	H	α-helix	trans	-56.5	-43.6	169.7	-178.6	169.1	-153.8	0	0	111.1	I149 V155 H156 S157 Y304 R308	I149-E153 WeakPolarHBondContact O-CB 3.37Å; I149-E153 PolarHBondContact O-N 3.42Å; E153-V155 PolarHBondContact O-N 2.87Å; E153-H156 CarbonylContact O-C 3.36Å; E153-H156 PolarHBondContact O-N 2.74Å; E153-S157 WeakPolarHBondContact O-CB 3.36Å; E153-S157 PolarHBondContact O-N 3.29Å; E153-Y304 HydrophobicContact CB-CD1 3.63Å; E153-Y304 HydrophobicContact CB-CD2 4.05Å; E153-Y304 HydrophobicContact CB-CE1 4.01Å; E153-Y304 HydrophobicContact CB-CE2 4.42Å; E153-Y304 HydrophobicContact CB-CG 3.65Å; E153-Y304 HydrophobicContact CG-CD1 4.16Å; E153-Y304 HydrophobicContact CG-CD2 3.61Å; E153-Y304 HydrophobicContact CG-CE1 4.47Å; E153-Y304 HydrophobicContact CG-CE2 4Å; E153-Y304 HydrophobicContact CG-CG 3.71Å; E153-Y304 WeakPolarHBondContact OE1-CD2 3.18Å; E153-Y304 WeakPolarHBondContact OE2-CB 3.44Å; E153-R308 IonicContact OE2-CZ 2.67Å; E153-R308 VanDerWaalsContact OE2-CZ 3.23Å; E153-R308 IonicContact OE2-NH1 2.71Å; E153-R308 PolarHBondContact OE2-NH1 2.86Å; E153-R308 IonicContact OE2-NH2 2.66Å; E153-R308 PolarHBondContact OE2-NH2 2.81Å
154	Y	98.6	Very high	98.5	Very high	61 Å²	61	22.1 Å²	22.1	24%	0.239	11%	0.113	C	C	.	.	H	α-helix	trans	-59.8	-47.8	177.7	-173.4	-96.5	0	0	0	112.1	L94 A98 V101 S150 R151 M152 H156 S157 K158	L94-Y154 HydrophobicContact CB-CE1 4.42Å; L94-Y154 HydrophobicContact CD2-CD1 4.3Å; L94-Y154 HydrophobicContact CD2-CE1 4.14Å; L94-Y154 PolarHBondContact O-OH 3.43Å; A98-Y154 HydrophobicContact CB-CD1 4.14Å; A98-Y154 HydrophobicContact CB-CE1 3.36Å; A98-Y154 HydrophobicContact CB-CE2 4.25Å; A98-Y154 VanDerWaalsContact CB-CZ 3.43Å; A98-Y154 WeakPolarHBondContact CB-OH 3.33Å; V101-Y154 HydrophobicContact CG2-CD1 4.36Å; V101-Y154 HydrophobicContact CG2-CE1 4.38Å; S150-Y154 WeakPolarHBondContact O-CB 3.47Å; S150-Y154 PolarHBondContact O-N 3.25Å; R151-Y154 WeakPolarHBondContact O-CB 3.37Å; R151-Y154 PolarHBondContact O-N 3.34Å; M152-Y154 VanDerWaalsContact C-N 3.28Å; M152-Y154 PolarHBondContact O-N 2.72Å; Y154-H156 VanDerWaalsContact C-N 3.35Å; Y154-H156 PolarHBondContact O-N 2.97Å; Y154-S157 WeakPolarHBondContact O-CB 3.35Å; Y154-S157 PolarHBondContact O-N 2.95Å; Y154-S157 PolarHBondContact O-OG 3.01Å; Y154-K158 HydrophobicContact CE1-CG 4.15Å; Y154-K158 WeakPolarHBondContact O-CG 3.34Å; Y154-K158 PolarHBondContact O-N 3.44Å; Y154-K158 WeakPolarHBondContact OH-CE 3.42Å; Y154-K158 PolarHBondContact OH-NZ 3.17Å
155	V	98.6	Very high	98.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-45	175.9	174.1	0	0	0	0	110.9	L94 R151 M152 E153 S157 K158 L160 I185 F188	L94-V155 HydrophobicContact CD2-CG2 4.13Å; R151-V155 WeakPolarHBondContact O-CG2 3.27Å; R151-V155 PolarHBondContact O-N 3.21Å; M152-V155 PolarHBondContact O-N 1.87Å; E153-V155 PolarHBondContact O-N 2.87Å; V155-S157 VanDerWaalsContact C-N 3.3Å; V155-S157 PolarHBondContact O-N 3.22Å; V155-K158 PolarHBondContact O-N 3.38Å; V155-L160 CarbonylContact C-O 3.59Å; V155-L160 HydrophobicContact CG1-CB 3.79Å; V155-L160 PolarHBondContact O-N 2.98Å; V155-I185 HydrophobicContact CG2-CD1 4.32Å; V155-F188 HydrophobicContact CG1-CE1 4.04Å; V155-F188 HydrophobicContact CG2-CE1 3.72Å; V155-F188 HydrophobicContact CG2-CZ 3.89Å
156	H	98.8	Very high	98.5	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.009	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-30.2	176.9	-65.6	166.3	0	0	0	113.1	M152 E153 Y154 K158 N159 L160 Y194 R230 D233 Y304	M152-H156 WeakPolarHBondContact CG-CE1 3.44Å; M152-H156 WeakPolarHBondContact O-CB 3.45Å; M152-H156 PolarHBondContact O-N 3.41Å; M152-H156 PolarHBondContact SD-NE2 3.41Å; M152-H156 VanDerWaalsContact SD-NE2 3.41Å; E153-H156 CarbonylContact O-C 3.36Å; E153-H156 PolarHBondContact O-N 2.74Å; Y154-H156 VanDerWaalsContact C-N 3.35Å; Y154-H156 PolarHBondContact O-N 2.97Å; H156-K158 PolarHBondContact O-N 2.99Å; H156-N159 PolarHBondContact O-N 3.41Å; H156-L160 WeakPolarHBondContact CA-O 3.34Å; H156-L160 PolarHBondContact CD2-O 3.42Å; H156-L160 VanDerWaalsContact CD2-O 3.25Å; H156-Y194 HydrophobicContact CB-CE1 4.49Å; H156-Y194 VanDerWaalsContact O-CE1 3.27Å; H156-Y194 WeakPolarHBondContact O-CE1 3.41Å; H156-Y194 PolarHBondContact O-OH 2.9Å; H156-R230 HydrophobicContact CB-CG 4.25Å; H156-R230 VanDerWaalsContact CE1-CA 3.49Å; H156-R230 WeakPolarHBondContact CE1-CA 3.42Å; H156-R230 PolarHBondContact CE1-O 3.37Å; H156-D233 IonicContact CD2-OD2 2.69Å; H156-D233 VanDerWaalsContact CE1-CB 3.44Å; H156-D233 WeakPolarHBondContact CE1-CB 3.41Å; H156-D233 IonicContact CE1-OD2 3.96Å; H156-D233 WeakPolarHBondContact NE2-CB 3.39Å; H156-D233 IonicContact NE2-OD1 3.56Å; H156-D233 IonicContact NE2-OD2 3.58Å; H156-D233 PolarHBondContact NE2-OD2 2.85Å; H156-Y304 VanDerWaalsContact CB-OH 3.24Å; H156-Y304 WeakPolarHBondContact CB-OH 3.37Å; H156-Y304 VanDerWaalsContact CG-OH 3.3Å; H156-Y304 AromaticContact ND1-CE1 3.47Å; H156-Y304 WeakPolarHBondContact ND1-CE1 3.47Å; H156-Y304 AromaticContact ND1-CZ 3.48Å; H156-Y304 PolarHBondContact ND1-OH 3.42Å
157	S	97.9	Very high	98.5	Very high	73 Å²	73	22.2 Å²	22.2	51%	0.51	11%	0.113	S	C	.	.	H	α-helix	trans	-69	-21.3	173.5	84	0	0	0	0	113.1	E153 Y154 V155 N159	E153-S157 WeakPolarHBondContact O-CB 3.36Å; E153-S157 PolarHBondContact O-N 3.29Å; Y154-S157 WeakPolarHBondContact O-CB 3.35Å; Y154-S157 PolarHBondContact O-N 2.95Å; Y154-S157 PolarHBondContact O-OG 3.01Å; V155-S157 VanDerWaalsContact C-N 3.3Å; V155-S157 PolarHBondContact O-N 3.22Å; S157-N159 VanDerWaalsContact C-N 3.3Å
158	K	97.8	Very high	98.4	Very high	77 Å²	77	23.7 Å²	23.7	34%	0.335	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	19.7	176.6	-60.9	-64.1	-172	172.6	0	112.8	L94 Y154 V155 H156 L160	L94-K158 HydrophobicContact CD2-CB 4.07Å; L94-K158 HydrophobicContact CD2-CG 4.03Å; Y154-K158 HydrophobicContact CE1-CG 4.15Å; Y154-K158 WeakPolarHBondContact O-CG 3.34Å; Y154-K158 PolarHBondContact O-N 3.44Å; Y154-K158 WeakPolarHBondContact OH-CE 3.42Å; Y154-K158 PolarHBondContact OH-NZ 3.17Å; V155-K158 PolarHBondContact O-N 3.38Å; H156-K158 PolarHBondContact O-N 2.99Å; K158-L160 PolarHBondContact O-N 2.97Å
159	N	98.2	Very high	98.3	Very high	65 Å²	65	24 Å²	24	35%	0.348	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	13.1	-179.8	-61.1	-30.6	0	0	0	115.2	H156 S157 E193 Y194 I195	H156-N159 PolarHBondContact O-N 3.41Å; S157-N159 VanDerWaalsContact C-N 3.3Å; N159-E193 CarbonylContact O-C 3.42Å; N159-E193 WeakPolarHBondContact O-CA 3.27Å; N159-Y194 WeakPolarHBondContact O-CD1 3.32Å; N159-Y194 PolarHBondContact O-N 3.31Å; N159-I195 HydrophobicContact CB-CB 3.88Å; N159-I195 HydrophobicContact CB-CG1 4.22Å; N159-I195 WeakPolarHBondContact OD1-CG1 3.42Å
160	L	98.5	Very high	98.3	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	147.3	178.7	-61.6	177.6	0	0	0	111.1	F90 L94 V155 H156 K158 K192 E193	F90-L160 HydrophobicContact CB-CD1 3.88Å; F90-L160 HydrophobicContact CD1-CD1 3.91Å; F90-L160 HydrophobicContact CD1-CD2 3.45Å; F90-L160 VanDerWaalsContact CD1-CD2 3.45Å; F90-L160 HydrophobicContact CD1-CG 4.34Å; F90-L160 HydrophobicContact CE1-CD2 3.48Å; F90-L160 VanDerWaalsContact CE1-CD2 3.48Å; F90-L160 HydrophobicContact CG-CD1 4.01Å; F90-L160 HydrophobicContact CG-CD2 4.19Å; F90-L160 HydrophobicContact CZ-CD2 4.21Å; L94-L160 HydrophobicContact CD2-CD1 4.22Å; L94-L160 HydrophobicContact CG-CD1 4.31Å; V155-L160 CarbonylContact C-O 3.59Å; V155-L160 HydrophobicContact CG1-CB 3.79Å; V155-L160 PolarHBondContact O-N 2.98Å; H156-L160 WeakPolarHBondContact CA-O 3.34Å; H156-L160 PolarHBondContact CD2-O 3.42Å; H156-L160 VanDerWaalsContact CD2-O 3.25Å; K158-L160 PolarHBondContact O-N 2.97Å; L160-K192 CarbonylContact C-O 3.53Å; L160-K192 WeakPolarHBondContact CA-O 3.26Å; L160-E193 HydrophobicContact CD2-CG 3.66Å
161	I	98.8	Very high	98.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.3	158.6	51.2	174.7	0	0	0	108.5	R163 A191 K192 Y194 Q228 R230	I161-R163 HydrophobicContact CB-CG 4.31Å; I161-R163 HydrophobicContact CD1-CG 3.99Å; I161-R163 HydrophobicContact CG1-CG 3.92Å; I161-A191 CarbonylContact O-C 3.44Å; I161-A191 VanDerWaalsContact O-CA 3.26Å; I161-A191 WeakPolarHBondContact O-CA 3.42Å; I161-A191 WeakPolarHBondContact O-CB 3.47Å; I161-K192 HydrophobicContact CG1-CB 4.1Å; I161-K192 WeakPolarHBondContact CG1-O 3.35Å; I161-K192 PolarHBondContact N-O 2.84Å; I161-K192 PolarHBondContact O-N 3Å; I161-Y194 HydrophobicContact CG2-CD1 3.74Å; I161-Y194 HydrophobicContact CG2-CG 3.9Å; I161-Q228 HydrophobicContact CD1-CB 4.18Å; I161-Q228 WeakPolarHBondContact CD1-O 3.44Å; I161-R230 HydrophobicContact CG2-CG 4.14Å
162	Y	98.6	Very high	98.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.			trans	-93	-43.6	-164.1	179.4	-113.7	0	0	0	113.5	M152 D164 V165 N169 F170 I185 I186 F188 D233	M152-Y162 HydrophobicContact CE-CD1 3.94Å; M152-Y162 HydrophobicContact CE-CG 4.25Å; Y162-D164 VanDerWaalsContact C-N 3.25Å; Y162-D164 VanDerWaalsContact CE1-O 3.22Å; Y162-D164 WeakPolarHBondContact CE1-O 3.45Å; Y162-D164 PolarHBondContact O-N 3.11Å; Y162-D164 VanDerWaalsContact O-N 3.08Å; Y162-V165 HydrophobicContact CD1-CG2 3.75Å; Y162-V165 HydrophobicContact CE1-CG2 4.27Å; Y162-N169 WeakPolarHBondContact OH-CB 3.44Å; Y162-N169 PolarHBondContact OH-ND2 3.07Å; Y162-F170 HydrophobicContact CE1-CZ 4.48Å; Y162-I185 HydrophobicContact CD1-CD1 3.99Å; Y162-I185 HydrophobicContact CD2-CD1 3.71Å; Y162-I185 HydrophobicContact CD2-CG1 4.34Å; Y162-I185 HydrophobicContact CE1-CD1 4Å; Y162-I185 HydrophobicContact CE1-CG1 4.38Å; Y162-I185 HydrophobicContact CE2-CD1 3.76Å; Y162-I185 HydrophobicContact CE2-CG1 3.89Å; Y162-I185 HydrophobicContact CG-CD1 3.85Å; Y162-I186 WeakPolarHBondContact CE2-O 3.46Å; Y162-I186 PolarHBondContact OH-O 2.69Å; Y162-F188 AromaticContact CD2-CD1 3.91Å; Y162-F188 HydrophobicContact CD2-CD1 3.91Å; Y162-F188 AromaticContact CD2-CE1 3.76Å; Y162-F188 HydrophobicContact CD2-CE1 3.76Å; Y162-F188 HydrophobicContact CD2-CZ 4.33Å; Y162-F188 HydrophobicContact CE2-CD1 4.23Å; Y162-F188 HydrophobicContact CE2-CE1 4.19Å; Y162-F188 HydrophobicContact CE2-CG 4.45Å; Y162-F188 HydrophobicContact CE2-CZ 4.41Å; Y162-D233 PolarHBondContact N-OD2 2.95Å
163	R	98.4	Very high	97.9	Very high	36 Å²	36	23.1 Å²	23.1	14%	0.136	12%	0.115	C	C	.	.			trans	66.6	-7.6	168.6	-45.5	-168.5	-51.2	135.4	0.4	118.4	I161 L190 Q228 D233	I161-R163 HydrophobicContact CB-CG 4.31Å; I161-R163 HydrophobicContact CD1-CG 3.99Å; I161-R163 HydrophobicContact CG1-CG 3.92Å; R163-L190 PolarHBondContact NE-O 3Å; R163-L190 PolarHBondContact NH2-O 3.4Å; R163-Q228 HydrophobicContact CG-CB 4.37Å; R163-D233 WeakPolarHBondContact CA-OD1 3.41Å; R163-D233 PolarHBondContact N-OD1 3.29Å
164	D	97.4	Very high	97.5	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.016	12%	0.122	C	C	.	.			trans	-128.2	51.6	172.9	-161.8	34	0	0	0	113	N54 Y162 K166 N169 L190 G213 T214	N54-D164 PolarHBondContact ND2-OD2 3.06Å; Y162-D164 VanDerWaalsContact C-N 3.25Å; Y162-D164 VanDerWaalsContact CE1-O 3.22Å; Y162-D164 WeakPolarHBondContact CE1-O 3.45Å; Y162-D164 PolarHBondContact O-N 3.11Å; Y162-D164 VanDerWaalsContact O-N 3.08Å; D164-K166 PolarHBondContact O-N 3.31Å; D164-K166 IonicContact OD2-NZ 3.44Å; D164-K166 PolarHBondContact OD2-NZ 3.3Å; D164-N169 PolarHBondContact O-ND2 3.48Å; D164-N169 PolarHBondContact OD2-ND2 3.38Å; D164-L190 HydrophobicContact CB-CB 4.23Å; D164-L190 HydrophobicContact CB-CD1 3.86Å; D164-G213 WeakPolarHBondContact OD1-CA 3.1Å; D164-T214 PolarHBondContact OD1-N 3.28Å; D164-T214 VanDerWaalsContact OD1-N 3.07Å; D164-T214 PolarHBondContact OD1-OG1 3.41Å
165	V	98.8	Very high	96.9	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.03	15%	0.147	C	C	.	.			trans	-61.4	115.1	171.3	177.9	0	0	0	0	109.8	M152 Y162 F170 Y217 D233 A236 L237 M240	M152-V165 HydrophobicContact CE-CG2 3.69Å; Y162-V165 HydrophobicContact CD1-CG2 3.75Å; Y162-V165 HydrophobicContact CE1-CG2 4.27Å; V165-F170 HydrophobicContact CG1-CE2 4Å; V165-F170 HydrophobicContact CG1-CZ 4.28Å; V165-Y217 VanDerWaalsContact O-CB 3.23Å; V165-Y217 WeakPolarHBondContact O-CB 3.49Å; V165-D233 HydrophobicContact CG2-CB 4.35Å; V165-A236 HydrophobicContact CB-CB 3.7Å; V165-A236 HydrophobicContact CG1-CB 4.01Å; V165-A236 HydrophobicContact CG2-CB 4.13Å; V165-L237 HydrophobicContact CG1-CD2 3.71Å; V165-L237 HydrophobicContact CG1-CG 4Å; V165-M240 HydrophobicContact CG1-CE 4.48Å; V165-M240 HydrophobicContact CG1-SD 4.19Å
166	K	98.2	Very high	96	Very high	17 Å²	17	34 Å²	34	7%	0.074	18%	0.184	C	C	.	.			trans	-161.7	149.4	175.6	70.1	-172	-168.1	-139.9	0	109.8	N54 D164 E168 N169 F170 T214 Y217 M240	N54-K166 PolarHBondContact ND2-NZ 3.2Å; D164-K166 PolarHBondContact O-N 3.31Å; D164-K166 IonicContact OD2-NZ 3.44Å; D164-K166 PolarHBondContact OD2-NZ 3.3Å; K166-E168 WeakPolarHBondContact CB-OE2 3.37Å; K166-E168 HydrophobicContact CD-CB 4.45Å; K166-E168 HydrophobicContact CG-CB 4.26Å; K166-E168 WeakPolarHBondContact CG-OE2 3.08Å; K166-E168 PolarHBondContact O-N 3.26Å; K166-E168 VanDerWaalsContact O-N 3.17Å; K166-N169 VanDerWaalsContact CE-CG 3.46Å; K166-N169 VanDerWaalsContact CE-ND2 3.3Å; K166-N169 WeakPolarHBondContact CE-ND2 3.32Å; K166-N169 VanDerWaalsContact CE-OD1 3.3Å; K166-N169 WeakPolarHBondContact CE-OD1 3.13Å; K166-N169 HydrophobicContact CG-CB 4.11Å; K166-N169 PolarHBondContact NZ-ND2 2.78Å; K166-N169 PolarHBondContact O-N 3.47Å; K166-F170 WeakPolarHBondContact O-CD2 3.3Å; K166-F170 WeakPolarHBondContact O-CE2 3.35Å; K166-T214 WeakPolarHBondContact CD-OG1 3.23Å; K166-Y217 HydrophobicContact CB-CD2 3.58Å; K166-Y217 HydrophobicContact CB-CE2 3.7Å; K166-M240 VanDerWaalsContact C-SD 3.58Å
167	P	98.4	Very high	95.2	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-54.5	-34.1	-176.7	-28.9	36.7	0	0	0	114.5	L125 E126 N169 F170 Y217 M240 Y243 F244	L125-P167 HydrophobicContact CB-CB 4.16Å; L125-P167 PolarHBondContact N-O 2.9Å; E126-P167 HydrophobicContact CB-CB 3.94Å; P167-N169 PolarHBondContact O-N 3.28Å; P167-F170 PolarHBondContact O-N 3.4Å; P167-F170 VanDerWaalsContact O-N 3.13Å; P167-Y217 VanDerWaalsContact CD-CE2 3.4Å; P167-Y217 VanDerWaalsContact CD-OH 3.26Å; P167-Y217 WeakPolarHBondContact CD-OH 3.23Å; P167-Y217 HydrophobicContact CG-CE1 4.31Å; P167-Y217 HydrophobicContact CG-CE2 4.44Å; P167-Y217 WeakPolarHBondContact CG-OH 3.41Å; P167-M240 HydrophobicContact CB-SD 4.41Å; P167-M240 VanDerWaalsContact CD-SD 3.56Å; P167-M240 HydrophobicContact CG-CG 3.73Å; P167-M240 HydrophobicContact CG-SD 3.77Å; P167-M240 VanDerWaalsContact N-SD 3.41Å; P167-Y243 HydrophobicContact CG-CD1 4.07Å; P167-Y243 HydrophobicContact CG-CE1 3.83Å; P167-F244 HydrophobicContact CB-CE1 3.84Å; P167-F244 HydrophobicContact CB-CZ 3.74Å; P167-F244 HydrophobicContact CG-CE1 3.71Å; P167-F244 HydrophobicContact CG-CZ 3.68Å
168	E	96.3	Very high	94.6	Very high	45 Å²	45	42.8 Å²	42.8	21%	0.21	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-62.3	-22.5	-180	-53.9	90.4	148.8	0	0	112.8	E126 K166 L171 R216	E126-E168 HydrophobicContact CB-CG 3.99Å; E126-E168 HydrophobicContact CG-CG 4.34Å; K166-E168 WeakPolarHBondContact CB-OE2 3.37Å; K166-E168 HydrophobicContact CD-CB 4.45Å; K166-E168 HydrophobicContact CG-CB 4.26Å; K166-E168 WeakPolarHBondContact CG-OE2 3.08Å; K166-E168 PolarHBondContact O-N 3.26Å; K166-E168 VanDerWaalsContact O-N 3.17Å; E168-L171 WeakPolarHBondContact O-CD1 3.34Å; E168-R216 IonicContact OE1-NH1 2.71Å
169	N	97.4	Very high	94.1	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.043	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-96.9	3	179.9	-74.3	-13.4	0	0	0	113.9	Y162 D164 K166 P167 I186	Y162-N169 WeakPolarHBondContact OH-CB 3.44Å; Y162-N169 PolarHBondContact OH-ND2 3.07Å; D164-N169 PolarHBondContact O-ND2 3.48Å; D164-N169 PolarHBondContact OD2-ND2 3.38Å; K166-N169 VanDerWaalsContact CE-CG 3.46Å; K166-N169 VanDerWaalsContact CE-ND2 3.3Å; K166-N169 WeakPolarHBondContact CE-ND2 3.32Å; K166-N169 VanDerWaalsContact CE-OD1 3.3Å; K166-N169 WeakPolarHBondContact CE-OD1 3.13Å; K166-N169 HydrophobicContact CG-CB 4.11Å; K166-N169 PolarHBondContact NZ-ND2 2.78Å; K166-N169 PolarHBondContact O-N 3.47Å; P167-N169 PolarHBondContact O-N 3.28Å; N169-I186 HydrophobicContact CB-CG1 4.38Å; N169-I186 WeakPolarHBondContact O-CG1 3.46Å; N169-I186 PolarHBondContact O-N 3.18Å
170	F	98.4	Very high	93.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.4	175.5	-62.2	-71.3	0	0	0	109.4	S124 L125 L148 Y162 V165 K166 P167 I183 H184 I185 L237 M240	S124-F170 CarbonylContact C-O 3.52Å; S124-F170 VanDerWaalsContact CA-O 3.26Å; S124-F170 WeakPolarHBondContact CA-O 3.41Å; L125-F170 HydrophobicContact CD1-CB 3.7Å; L125-F170 HydrophobicContact CD1-CG 4.48Å; L125-F170 HydrophobicContact CG-CB 3.9Å; L125-F170 PolarHBondContact N-O 2.83Å; L148-F170 HydrophobicContact CD1-CD1 4.12Å; L148-F170 HydrophobicContact CD1-CD2 4.1Å; L148-F170 HydrophobicContact CD1-CE1 4.3Å; L148-F170 HydrophobicContact CD1-CE2 4.3Å; L148-F170 HydrophobicContact CD1-CG 4.01Å; L148-F170 HydrophobicContact CD1-CZ 4.38Å; L148-F170 HydrophobicContact CD2-CB 4.43Å; L148-F170 HydrophobicContact CD2-CD1 3.34Å; L148-F170 HydrophobicContact CD2-CE1 3.68Å; L148-F170 HydrophobicContact CD2-CG 3.93Å; L148-F170 HydrophobicContact CG-CD1 4.39Å; Y162-F170 HydrophobicContact CE1-CZ 4.48Å; V165-F170 HydrophobicContact CG1-CE2 4Å; V165-F170 HydrophobicContact CG1-CZ 4.28Å; K166-F170 WeakPolarHBondContact O-CD2 3.3Å; K166-F170 WeakPolarHBondContact O-CE2 3.35Å; P167-F170 PolarHBondContact O-N 3.4Å; P167-F170 VanDerWaalsContact O-N 3.13Å; F170-I183 HydrophobicContact CB-CG2 3.95Å; F170-H184 CarbonylContact C-O 3.58Å; F170-H184 VanDerWaalsContact CA-O 3.26Å; F170-H184 WeakPolarHBondContact CA-O 3.5Å; F170-I185 HydrophobicContact CD1-CB 4.15Å; F170-I185 HydrophobicContact CD1-CG1 4.24Å; F170-I185 HydrophobicContact CE1-CB 4.03Å; F170-I185 HydrophobicContact CE1-CD1 3.84Å; F170-I185 HydrophobicContact CE1-CG1 3.77Å; F170-I185 HydrophobicContact CZ-CD1 4.43Å; F170-L237 HydrophobicContact CE2-CD2 4.34Å; F170-L237 HydrophobicContact CZ-CD2 4.09Å; F170-M240 HydrophobicContact CD2-CE 3.69Å; F170-M240 HydrophobicContact CD2-SD 3.88Å; F170-M240 HydrophobicContact CE2-CE 3.6Å; F170-M240 HydrophobicContact CE2-SD 3.81Å; F170-M240 HydrophobicContact CZ-CE 4.49Å
171	L	97.4	Very high	93.5	Very high	27 Å²	27	46 Å²	46	14%	0.141	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141	-171.5	-78.5	64.7	0	0	0	111	L121 P123 E168 H184 I186	L121-L171 HydrophobicContact CB-CB 4.02Å; L121-L171 HydrophobicContact CB-CD2 3.9Å; L121-L171 HydrophobicContact CD1-CB 3.89Å; L121-L171 HydrophobicContact CD1-CD2 4.19Å; P123-L171 WeakPolarHBondContact O-CA 3.41Å; E168-L171 WeakPolarHBondContact O-CD1 3.34Å; L171-H184 PolarHBondContact N-O 3.5Å; L171-H184 WeakPolarHBondContact O-CB 3.21Å; L171-H184 PolarHBondContact O-N 3.41Å; L171-H184 PolarHBondContact O-ND1 2.66Å; L171-I186 HydrophobicContact CD1-CD1 3.57Å; L171-I186 HydrophobicContact CD1-CG1 3.88Å; L171-I186 HydrophobicContact CD1-CG2 4.47Å; L171-I186 HydrophobicContact CD2-CD1 4.02Å; L171-I186 HydrophobicContact CG-CD1 4.47Å
172	I	96.6	Very high	93.4	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.051	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	164.4	171.9	63.6	164.5	0	0	0	111.2	G122 P123 L128 W328 I333	G122-I172 WeakPolarHBondContact CA-O 3.49Å; G122-I172 PolarHBondContact N-O 3.34Å; P123-I172 PolarHBondContact O-N 2.97Å; L128-I172 HydrophobicContact CD1-CB 4.48Å; L128-I172 HydrophobicContact CD1-CD1 3.96Å; L128-I172 HydrophobicContact CD1-CG1 4.03Å; L128-I172 HydrophobicContact CD1-CG2 3.67Å; L128-I172 HydrophobicContact CD2-CD1 4.38Å; I172-W328 HydrophobicContact CG2-CZ2 4.04Å; I172-I333 HydrophobicContact CD1-CD1 4.44Å
173	G	93.4	Very high	93.4	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.021	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-64.6	162.7	168.2	0	0	0	0	0	111.9	K179 E180 I182	G173-K179 WeakPolarHBondContact CA-O 3.37Å; G173-E180 PolarHBondContact N-O 3.42Å; G173-I182 PolarHBondContact N-O 3.41Å
174	R	90.7	Very high	93.4	Very high	105 Å²	105	45.1 Å²	45.1	40%	0.396	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-66.3	137	174.4	-71.9	178.2	58.6	-146.3	-9	110.8	L120 L121 G176 N177	L120-R174 WeakPolarHBondContact O-CD 3.38Å; L120-R174 WeakPolarHBondContact O-CG 3.38Å; L121-R174 VanDerWaalsContact C-CG 3.47Å; L121-R174 WeakPolarHBondContact O-CG 3.24Å; R174-G176 PolarHBondContact O-N 2.83Å; R174-N177 WeakPolarHBondContact O-CB 3.19Å; R174-N177 PolarHBondContact O-N 3.49Å
175	Q	85.6	Confident	93.4	Very high	162 Å²	162	45 Å²	45	76%	0.757	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	137.1	174.5	-169.9	179.8	14.3	0	0	111.7	N177 E180	Q175-N177 PolarHBondContact O-N 3.25Å; Q175-E180 WeakPolarHBondContact CA-OE2 3.38Å
176	G	80.8	Confident	93.3	Very high	75 Å²	75	46.3 Å²	46.3	77%	0.773	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.3	1.3	-175.5	0	0	0	0	0	114.7	R174 E180	R174-G176 PolarHBondContact O-N 2.83Å; G176-E180 PolarHBondContact N-OE2 3.01Å
177	N	81.9	Confident	93.1	Very high	67 Å²	67	46.1 Å²	46.1	36%	0.358	23%	0.232	S	C	.	.	S	Bend	trans	-91	145.5	167.1	-169.2	-39.4	0	0	0	109.3	R174 Q175 K179 E180	R174-N177 WeakPolarHBondContact O-CB 3.19Å; R174-N177 PolarHBondContact O-N 3.49Å; Q175-N177 PolarHBondContact O-N 3.25Å; N177-K179 PolarHBondContact O-N 3.12Å; N177-K179 PolarHBondContact OD1-N 3.45Å; N177-E180 WeakPolarHBondContact O-CB 3.29Å; N177-E180 WeakPolarHBondContact O-CG 3.42Å; N177-E180 PolarHBondContact O-N 2.94Å
178	K	85.4	Confident	93	Very high	193 Å²	193	46.1 Å²	46.1	84%	0.839	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-24.7	171.9	-63.3	-174.8	178.5	-175.7	0	113.6	H181	K178-H181 PolarHBondContact O-CE1 3.23Å
179	K	87.8	Confident	92.8	Very high	70 Å²	70	44.3 Å²	44.3	30%	0.304	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	6.5	176.8	-55.9	-171.5	-173.6	169.7	0	115.1	E119 G173 N177 H181 I182	E119-K179 IonicContact OE1-NZ 3.19Å; E119-K179 PolarHBondContact OE1-NZ 2.92Å; E119-K179 IonicContact OE2-NZ 3.97Å; E119-K179 PolarHBondContact OE2-NZ 3.38Å; G173-K179 WeakPolarHBondContact CA-O 3.37Å; N177-K179 PolarHBondContact O-N 3.12Å; N177-K179 PolarHBondContact OD1-N 3.45Å; K179-H181 PolarHBondContact O-N 3.47Å; K179-H181 VanDerWaalsContact O-N 3.12Å; K179-I182 HydrophobicContact CB-CB 4.35Å; K179-I182 HydrophobicContact CB-CD1 3.94Å; K179-I182 HydrophobicContact CB-CG1 4.31Å; K179-I182 HydrophobicContact CG-CD1 4.01Å; K179-I182 WeakPolarHBondContact O-CB 3.46Å; K179-I182 PolarHBondContact O-N 3.43Å
180	E	90.7	Very high	92.7	Very high	86 Å²	86	45 Å²	45	40%	0.402	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.5	-170.4	68	-177.4	-173.9	0	0	114.7	G173 Q175 G176 N177	G173-E180 PolarHBondContact N-O 3.42Å; Q175-E180 WeakPolarHBondContact CA-OE2 3.38Å; G176-E180 PolarHBondContact N-OE2 3.01Å; N177-E180 WeakPolarHBondContact O-CB 3.29Å; N177-E180 WeakPolarHBondContact O-CG 3.42Å; N177-E180 PolarHBondContact O-N 2.94Å
181	H	92.8	Very high	92.7	Very high	55 Å²	55	45.2 Å²	45.2	26%	0.255	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.8	177.2	59	-95.4	0	0	0	114.5	Q147 K178 K179 Y324 Y326	Q147-H181 PolarHBondContact NE2-O 3.49Å; K178-H181 PolarHBondContact O-CE1 3.23Å; K179-H181 PolarHBondContact O-N 3.47Å; K179-H181 VanDerWaalsContact O-N 3.12Å; H181-Y324 HydrophobicContact CB-CD1 3.53Å; H181-Y324 HydrophobicContact CB-CD2 4.42Å; H181-Y324 HydrophobicContact CB-CE1 4.23Å; H181-Y324 HydrophobicContact CB-CG 3.62Å; H181-Y324 AromaticContact CD2-CD1 3.58Å; H181-Y324 AromaticContact CD2-CE1 3.35Å; H181-Y324 WeakPolarHBondContact CD2-CE1 3.49Å; H181-Y324 AromaticContact CD2-CE2 3.98Å; H181-Y324 AromaticContact CD2-CG 3.94Å; H181-Y324 AromaticContact CD2-CZ 3.58Å; H181-Y324 AromaticContact CG-CD1 3.73Å; H181-Y324 AromaticContact CG-CE1 3.99Å; H181-Y324 AromaticContact CG-CG 3.77Å; H181-Y326 HydrophobicContact CB-CE2 4.31Å; H181-Y326 PolarHBondContact O-OH 2.86Å
182	I	96.6	Very high	92.6	Very high	16 Å²	16	46.4 Å²	46.4	8%	0.082	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-82.8	123.7	-178.7	-59.1	-176.7	0	0	0	108.4	E99 G173 K179 H184	E99-I182 HydrophobicContact CG-CD1 3.96Å; E99-I182 HydrophobicContact CG-CG2 3.93Å; G173-I182 PolarHBondContact N-O 3.41Å; K179-I182 HydrophobicContact CB-CB 4.35Å; K179-I182 HydrophobicContact CB-CD1 3.94Å; K179-I182 HydrophobicContact CB-CG1 4.31Å; K179-I182 HydrophobicContact CG-CD1 4.01Å; K179-I182 WeakPolarHBondContact O-CB 3.46Å; K179-I182 PolarHBondContact O-N 3.43Å; I182-H184 PolarHBondContact O-CE1 2.93Å; I182-H184 VanDerWaalsContact O-CE1 3.25Å; I182-H184 PolarHBondContact O-ND1 3.43Å
183	I	98.3	Very high	92.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121	174.5	-51.7	172.4	0	0	0	108.2	L125 I144 Q147 L148 R151 F170	L125-I183 HydrophobicContact CD1-CG2 4.28Å; L125-I183 HydrophobicContact CG-CG2 4.5Å; I144-I183 HydrophobicContact CB-CD1 3.97Å; I144-I183 HydrophobicContact CG1-CD1 3.68Å; I144-I183 HydrophobicContact CG2-CD1 4.03Å; Q147-I183 HydrophobicContact CB-CD1 4.35Å; L148-I183 HydrophobicContact CD2-CB 4.3Å; L148-I183 HydrophobicContact CD2-CG2 3.65Å; R151-I183 PolarHBondContact NE-O 3.3Å; F170-I183 HydrophobicContact CB-CG2 3.95Å
184	H	98.2	Very high	93	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	148.1	-178.2	-58.8	68.3	0	0	0	110.7	G100 L121 F170 L171 I182	G100-H184 CarbonylContact O-C 3.56Å; G100-H184 WeakPolarHBondContact O-CA 3.48Å; L121-H184 HydrophobicContact CD1-CB 3.66Å; L121-H184 HydrophobicContact CD2-CB 4.36Å; F170-H184 CarbonylContact C-O 3.58Å; F170-H184 VanDerWaalsContact CA-O 3.26Å; F170-H184 WeakPolarHBondContact CA-O 3.5Å; L171-H184 PolarHBondContact N-O 3.5Å; L171-H184 WeakPolarHBondContact O-CB 3.21Å; L171-H184 PolarHBondContact O-N 3.41Å; L171-H184 PolarHBondContact O-ND1 2.66Å; I182-H184 PolarHBondContact O-CE1 2.93Å; I182-H184 VanDerWaalsContact O-CE1 3.25Å; I182-H184 PolarHBondContact O-ND1 3.43Å
185	I	98.2	Very high	93.3	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.8	173.1	-174.3	172.2	0	0	0	110.5	G100 V101 P102 R151 M152 V155 Y162 F170 F188	G100-I185 PolarHBondContact O-N 3.35Å; V101-I185 HydrophobicContact CG2-CG2 4.35Å; P102-I185 VanDerWaalsContact CD-O 3.28Å; P102-I185 WeakPolarHBondContact CD-O 3.41Å; R151-I185 HydrophobicContact CB-CG2 4.35Å; M152-I185 HydrophobicContact CE-CD1 4.37Å; V155-I185 HydrophobicContact CG2-CD1 4.32Å; Y162-I185 HydrophobicContact CD1-CD1 3.99Å; Y162-I185 HydrophobicContact CD2-CD1 3.71Å; Y162-I185 HydrophobicContact CD2-CG1 4.34Å; Y162-I185 HydrophobicContact CE1-CD1 4Å; Y162-I185 HydrophobicContact CE1-CG1 4.38Å; Y162-I185 HydrophobicContact CE2-CD1 3.76Å; Y162-I185 HydrophobicContact CE2-CG1 3.89Å; Y162-I185 HydrophobicContact CG-CD1 3.85Å; F170-I185 HydrophobicContact CD1-CB 4.15Å; F170-I185 HydrophobicContact CD1-CG1 4.24Å; F170-I185 HydrophobicContact CE1-CB 4.03Å; F170-I185 HydrophobicContact CE1-CD1 3.84Å; F170-I185 HydrophobicContact CE1-CG1 3.77Å; F170-I185 HydrophobicContact CZ-CD1 4.43Å; I185-F188 HydrophobicContact CD1-CZ 4.15Å; I185-F188 HydrophobicContact CG1-CE2 4.39Å; I185-F188 HydrophobicContact CG1-CZ 4.09Å; I185-F188 HydrophobicContact CG2-CE2 4.24Å; I185-F188 HydrophobicContact CG2-CZ 3.85Å
186	I	95.9	Very high	93.7	Very high	33 Å²	33	41.8 Å²	41.8	17%	0.169	22%	0.22	C	C	.	.			trans	-125.6	-174.1	-179.2	73.5	163.4	0	0	0	112.9	Y91 P102 L121 Y162 N169 L171	Y91-I186 WeakPolarHBondContact OH-CA 3.46Å; P102-I186 HydrophobicContact CG-CG2 4.07Å; L121-I186 HydrophobicContact CD1-CG2 3.7Å; Y162-I186 WeakPolarHBondContact CE2-O 3.46Å; Y162-I186 PolarHBondContact OH-O 2.69Å; N169-I186 HydrophobicContact CB-CG1 4.38Å; N169-I186 WeakPolarHBondContact O-CG1 3.46Å; N169-I186 PolarHBondContact O-N 3.18Å; L171-I186 HydrophobicContact CD1-CD1 3.57Å; L171-I186 HydrophobicContact CD1-CG1 3.88Å; L171-I186 HydrophobicContact CD1-CG2 4.47Å; L171-I186 HydrophobicContact CD2-CD1 4.02Å; L171-I186 HydrophobicContact CG-CD1 4.47Å
187	D	94.2	Very high	94.2	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.064	20%	0.203	C	C	.	.			trans	51.3	64.3	173	-160.1	21.5	0	0	0	116	N54 K73 Y91 G189	N54-D187 PolarHBondContact ND2-OD2 3.33Å; K73-D187 IonicContact NZ-OD1 2.73Å; K73-D187 PolarHBondContact NZ-OD1 3.39Å; Y91-D187 PolarHBondContact OH-N 2.88Å; D187-G189 PolarHBondContact O-N 2.95Å; D187-G189 VanDerWaalsContact O-N 3.11Å
188	F	95.8	Very high	94.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-76.6	14.7	174.8	-70.4	-95.3	0	0	0	113.9	E87 F90 Y91 L94 V155 Y162 I185 L190 A191	E87-F188 HydrophobicContact CG-CB 4.06Å; F90-F188 HydrophobicContact CB-CB 4.2Å; F90-F188 HydrophobicContact CD2-CB 4.39Å; Y91-F188 HydrophobicContact CD1-CD2 4.43Å; Y91-F188 AromaticContact CE1-CD2 3.78Å; Y91-F188 HydrophobicContact CE1-CD2 3.78Å; Y91-F188 AromaticContact CE1-CE2 3.89Å; Y91-F188 HydrophobicContact CE1-CE2 3.89Å; Y91-F188 AromaticContact CE2-CD2 3.99Å; Y91-F188 HydrophobicContact CE2-CD2 3.99Å; Y91-F188 AromaticContact CZ-CD2 3.54Å; L94-F188 HydrophobicContact CD1-CD1 4.02Å; L94-F188 HydrophobicContact CD1-CD2 4.13Å; L94-F188 HydrophobicContact CD1-CE1 3.61Å; L94-F188 HydrophobicContact CD1-CE2 3.72Å; L94-F188 HydrophobicContact CD1-CG 4.27Å; L94-F188 HydrophobicContact CD1-CZ 3.44Å; L94-F188 VanDerWaalsContact CD1-CZ 3.44Å; V155-F188 HydrophobicContact CG1-CE1 4.04Å; V155-F188 HydrophobicContact CG2-CE1 3.72Å; V155-F188 HydrophobicContact CG2-CZ 3.89Å; Y162-F188 AromaticContact CD2-CD1 3.91Å; Y162-F188 HydrophobicContact CD2-CD1 3.91Å; Y162-F188 AromaticContact CD2-CE1 3.76Å; Y162-F188 HydrophobicContact CD2-CE1 3.76Å; Y162-F188 HydrophobicContact CD2-CZ 4.33Å; Y162-F188 HydrophobicContact CE2-CD1 4.23Å; Y162-F188 HydrophobicContact CE2-CE1 4.19Å; Y162-F188 HydrophobicContact CE2-CG 4.45Å; Y162-F188 HydrophobicContact CE2-CZ 4.41Å; I185-F188 HydrophobicContact CD1-CZ 4.15Å; I185-F188 HydrophobicContact CG1-CE2 4.39Å; I185-F188 HydrophobicContact CG1-CZ 4.09Å; I185-F188 HydrophobicContact CG2-CE2 4.24Å; I185-F188 HydrophobicContact CG2-CZ 3.85Å; F188-L190 PolarHBondContact O-N 3.36Å; F188-A191 HydrophobicContact CB-CB 4.04Å; F188-A191 HydrophobicContact CD1-CB 3.84Å; F188-A191 HydrophobicContact CG-CB 4.44Å; F188-A191 WeakPolarHBondContact O-CB 3.48Å; F188-A191 PolarHBondContact O-N 3.28Å; F188-A191 VanDerWaalsContact O-N 3.07Å
189	G	93.8	Very high	95.3	Very high	7 Å²	7	41.1 Å²	41.1	7%	0.072	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-59.9	-32.9	-179.7	0	0	0	0	0	113.7	Q83 D187	Q83-G189 VanDerWaalsContact OE1-C 3.25Å; Q83-G189 PolarHBondContact OE1-O 3.46Å; D187-G189 PolarHBondContact O-N 2.95Å; D187-G189 VanDerWaalsContact O-N 3.11Å
190	L	95	Very high	95.7	Very high	22 Å²	22	44.7 Å²	44.7	12%	0.115	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-95	-0.3	175.7	-66.5	-178.2	0	0	0	114.3	F55 R163 D164 F188 T212	F55-L190 HydrophobicContact CE2-CD2 4.1Å; F55-L190 HydrophobicContact CE2-CG 4.13Å; F55-L190 HydrophobicContact CZ-CD2 3.89Å; F55-L190 HydrophobicContact CZ-CG 4.29Å; R163-L190 PolarHBondContact NE-O 3Å; R163-L190 PolarHBondContact NH2-O 3.4Å; D164-L190 HydrophobicContact CB-CB 4.23Å; D164-L190 HydrophobicContact CB-CD1 3.86Å; F188-L190 PolarHBondContact O-N 3.36Å; L190-T212 HydrophobicContact CD1-CG2 4.15Å; L190-T212 HydrophobicContact CD2-CG2 3.87Å; L190-T212 HydrophobicContact CG-CG2 4.45Å
191	A	97.1	Very high	96.1	Very high	6 Å²	6	47.7 Å²	47.7	5%	0.05	24%	0.236	C	C	.	.			trans	-65.3	161.8	178.4	0	0	0	0	0	112.1	F90 I161 F188	F90-A191 HydrophobicContact CD2-CB 3.83Å; F90-A191 HydrophobicContact CE2-CB 3.96Å; F90-A191 VanDerWaalsContact CE2-O 3.32Å; F90-A191 WeakPolarHBondContact CE2-O 3.41Å; I161-A191 CarbonylContact O-C 3.44Å; I161-A191 VanDerWaalsContact O-CA 3.26Å; I161-A191 WeakPolarHBondContact O-CA 3.42Å; I161-A191 WeakPolarHBondContact O-CB 3.47Å; F188-A191 HydrophobicContact CB-CB 4.04Å; F188-A191 HydrophobicContact CD1-CB 3.84Å; F188-A191 HydrophobicContact CG-CB 4.44Å; F188-A191 WeakPolarHBondContact O-CB 3.48Å; F188-A191 PolarHBondContact O-N 3.28Å; F188-A191 VanDerWaalsContact O-N 3.07Å
192	K	97	Very high	96.3	Very high	52 Å²	52	46.8 Å²	46.8	23%	0.226	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	143.7	-176.6	-173.8	-169.6	170.3	-164.1	0	111.1	L160 I161 Y194 E227	L160-K192 CarbonylContact C-O 3.53Å; L160-K192 WeakPolarHBondContact CA-O 3.26Å; I161-K192 HydrophobicContact CG1-CB 4.1Å; I161-K192 WeakPolarHBondContact CG1-O 3.35Å; I161-K192 PolarHBondContact N-O 2.84Å; I161-K192 PolarHBondContact O-N 3Å; K192-Y194 PolarHBondContact O-N 2.83Å; K192-E227 IonicContact NZ-OE1 2.79Å; K192-E227 PolarHBondContact NZ-OE1 3.27Å; K192-E227 IonicContact NZ-OE2 3.65Å; K192-E227 PolarHBondContact NZ-OE2 2.63Å; K192-E227 VanDerWaalsContact NZ-OE2 3.12Å
193	E	98.2	Very high	96.4	Very high	89 Å²	89	47 Å²	47	42%	0.416	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	124.3	168.3	-67.3	172.6	148.3	0	0	110.6	F90 N159 L160	F90-E193 HydrophobicContact CE1-CG 4.14Å; N159-E193 CarbonylContact O-C 3.42Å; N159-E193 WeakPolarHBondContact O-CA 3.27Å; L160-E193 HydrophobicContact CD2-CG 3.66Å
194	Y	98.4	Very high	96.4	Very high	11 Å²	11	50.3 Å²	50.3	4%	0.043	25%	0.254	C	S	.	.	S	Bend	trans	-104.3	-16.4	175.5	83	-86.9	0	0	0	112.9	H156 N159 I161 K192 H202 I203 R230	H156-Y194 HydrophobicContact CB-CE1 4.49Å; H156-Y194 VanDerWaalsContact O-CE1 3.27Å; H156-Y194 WeakPolarHBondContact O-CE1 3.41Å; H156-Y194 PolarHBondContact O-OH 2.9Å; N159-Y194 WeakPolarHBondContact O-CD1 3.32Å; N159-Y194 PolarHBondContact O-N 3.31Å; I161-Y194 HydrophobicContact CG2-CD1 3.74Å; I161-Y194 HydrophobicContact CG2-CG 3.9Å; K192-Y194 PolarHBondContact O-N 2.83Å; Y194-H202 AromaticContact CD2-CD2 3.55Å; Y194-H202 AromaticContact CD2-NE2 3.57Å; Y194-H202 AromaticContact CE2-CD2 3.95Å; Y194-H202 CarbonylContact O-C 3.45Å; Y194-H202 WeakPolarHBondContact O-CA 3.46Å; Y194-I203 PolarHBondContact O-N 2.78Å; Y194-R230 HydrophobicContact CD2-CG 4.34Å; Y194-R230 HydrophobicContact CE1-CG 4.26Å; Y194-R230 HydrophobicContact CE2-CG 4.03Å; Y194-R230 VanDerWaalsContact CE2-NH1 3.29Å; Y194-R230 PolarHBondContact OH-NH1 3.39Å
195	I	98.1	Very high	96.4	Very high	24 Å²	24	54.3 Å²	54.3	12%	0.123	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-104.3	125.2	161.8	-54.7	-57.1	0	0	0	107.4	N159 K201 H202	N159-I195 HydrophobicContact CB-CB 3.88Å; N159-I195 HydrophobicContact CB-CG1 4.22Å; N159-I195 WeakPolarHBondContact OD1-CG1 3.42Å; I195-K201 WeakPolarHBondContact CA-O 3.23Å; I195-H202 HydrophobicContact CD1-CB 4.13Å
196	D	94.6	Very high	96.4	Very high	58 Å²	58	61.1 Å²	61.1	31%	0.31	30%	0.295	S	S	.	.			trans	-66	128.3	176.7	174.7	-86.2	0	0	0	110.6	E198 T199 K200 K201	D196-E198 VanDerWaalsContact C-N 3.28Å; D196-E198 PolarHBondContact O-N 3.2Å; D196-E198 PolarHBondContact OD1-N 3.03Å; D196-E198 VanDerWaalsContact OD1-N 3.17Å; D196-T199 WeakPolarHBondContact CB-OG1 3.38Å; D196-T199 VanDerWaalsContact CG-OG1 3.27Å; D196-T199 WeakPolarHBondContact OD1-CB 3.16Å; D196-T199 WeakPolarHBondContact OD1-CG2 3.42Å; D196-T199 PolarHBondContact OD1-N 2.77Å; D196-T199 PolarHBondContact OD1-OG1 2.92Å; D196-K200 VanDerWaalsContact O-CA 3.24Å; D196-K200 WeakPolarHBondContact O-CA 3.48Å; D196-K200 PolarHBondContact O-N 2.95Å; D196-K201 PolarHBondContact N-O 2.95Å
197	P	90.6	Very high	96.4	Very high	65 Å²	65	63.8 Å²	63.8	42%	0.422	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-19.4	-169.9	27.6	-35	0	0	0	113.8	K200	P197-K200 WeakPolarHBondContact O-CE 3.21Å; P197-K200 PolarHBondContact O-NZ 3.48Å
198	E	94.1	Very high	96.4	Very high	174 Å²	174	71.8 Å²	71.8	81%	0.813	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-55.3	-179.7	-62.6	-177.3	-179.3	0	0	110.8	D196	D196-E198 VanDerWaalsContact C-N 3.28Å; D196-E198 PolarHBondContact O-N 3.2Å; D196-E198 PolarHBondContact OD1-N 3.03Å; D196-E198 VanDerWaalsContact OD1-N 3.17Å
199	T	96.3	Very high	96.4	Very high	82 Å²	82	75.1 Å²	75.1	50%	0.503	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-15.3	-175.4	65.3	0	0	0	0	114	D196 K201	D196-T199 WeakPolarHBondContact CB-OG1 3.38Å; D196-T199 VanDerWaalsContact CG-OG1 3.27Å; D196-T199 WeakPolarHBondContact OD1-CB 3.16Å; D196-T199 WeakPolarHBondContact OD1-CG2 3.42Å; D196-T199 PolarHBondContact OD1-N 2.77Å; D196-T199 PolarHBondContact OD1-OG1 2.92Å; T199-K201 PolarHBondContact O-N 3.06Å; T199-K201 VanDerWaalsContact O-N 3.15Å; T199-K201 PolarHBondContact OG1-N 3.39Å
200	K	96.5	Very high	96.2	Very high	144 Å²	144	79.2 Å²	79.2	63%	0.626	39%	0.386	S	S	*	.			trans	57	18.8	-172.5	-50	-53.2	-172.8	-169.4	0	114.5	D196 P197	D196-K200 VanDerWaalsContact O-CA 3.24Å; D196-K200 WeakPolarHBondContact O-CA 3.48Å; D196-K200 PolarHBondContact O-N 2.95Å; P197-K200 WeakPolarHBondContact O-CE 3.21Å; P197-K200 PolarHBondContact O-NZ 3.48Å
201	K	97.8	Very high	96	Very high	150 Å²	150	81.5 Å²	81.5	65%	0.652	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-95.2	153.6	178.3	-68.8	179	-178.6	179.7	0	111.1	I195 D196 T199	I195-K201 WeakPolarHBondContact CA-O 3.23Å; D196-K201 PolarHBondContact N-O 2.95Å; T199-K201 PolarHBondContact O-N 3.06Å; T199-K201 VanDerWaalsContact O-N 3.15Å; T199-K201 PolarHBondContact OG1-N 3.39Å
202	H	98.7	Very high	95.6	Very high	35 Å²	35	82.6 Å²	82.6	16%	0.162	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-61.8	141.7	169	-166	-70.6	0	0	0	110.1	Y194 I195 F298 F299	Y194-H202 AromaticContact CD2-CD2 3.55Å; Y194-H202 AromaticContact CD2-NE2 3.57Å; Y194-H202 AromaticContact CE2-CD2 3.95Å; Y194-H202 CarbonylContact O-C 3.45Å; Y194-H202 WeakPolarHBondContact O-CA 3.46Å; I195-H202 HydrophobicContact CD1-CB 4.13Å; H202-F298 AromaticContact CE1-CE1 3.61Å; H202-F298 AromaticContact CE1-CZ 3.79Å; H202-F298 AromaticContact ND1-CE1 3.81Å; H202-F298 PolarHBondContact NE2-O 2.9Å; H202-F299 HydrophobicContact CB-CD1 3.99Å; H202-F299 AromaticContact CG-CD1 3.74Å; H202-F299 AromaticContact ND1-CD1 3.51Å; H202-F299 AromaticContact ND1-CE1 3.95Å
203	I	98.2	Very high	95.3	Very high	21 Å²	21	80.7 Å²	80.7	11%	0.108	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-53.5	142.9	173.9	55.7	170.7	0	0	0	110.6	Y194 E227 F298	Y194-I203 PolarHBondContact O-N 2.78Å; I203-E227 HydrophobicContact CD1-CG 3.96Å; I203-F298 HydrophobicContact CD1-CZ 4.48Å; I203-F298 HydrophobicContact CG1-CZ 4.26Å; I203-F298 WeakPolarHBondContact O-CE1 3.37Å
204	P	97.9	Very high	95.1	Very high	70 Å²	70	78.2 Å²	78.2	46%	0.455	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-67.2	148.1	-179.9	28	-35.4	0	0	0	111.2
205	Y	98.2	Very high	95	Very high	84 Å²	84	78.1 Å²	78.1	33%	0.329	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-60.8	137.7	169.8	-178	-104.9	0	0	0	110.5	E207 K226 F298	Y205-E207 HydrophobicContact CE1-CG 3.59Å; Y205-E207 WeakPolarHBondContact CE1-OE1 3.49Å; Y205-E207 PolarHBondContact OH-OE1 3.03Å; Y205-K226 HydrophobicContact CE2-CB 4.32Å; Y205-K226 HydrophobicContact CE2-CD 4.37Å; Y205-K226 HydrophobicContact CE2-CG 4.47Å; Y205-K226 WeakPolarHBondContact OH-CD 3.36Å; Y205-K226 WeakPolarHBondContact OH-CE 3.41Å; Y205-K226 WeakPolarHBondContact OH-CG 3.48Å; Y205-F298 VanDerWaalsContact CA-CE1 3.49Å; Y205-F298 HydrophobicContact CD2-CB 4.15Å; Y205-F298 AromaticContact CD2-CD1 3.89Å; Y205-F298 HydrophobicContact CD2-CD1 3.89Å; Y205-F298 AromaticContact CD2-CD2 3.94Å; Y205-F298 HydrophobicContact CD2-CD2 3.94Å; Y205-F298 HydrophobicContact CD2-CE1 4.27Å; Y205-F298 HydrophobicContact CD2-CE2 4.3Å; Y205-F298 AromaticContact CD2-CG 3.71Å; Y205-F298 HydrophobicContact CD2-CG 3.71Å; Y205-F298 HydrophobicContact CD2-CZ 4.46Å; Y205-F298 HydrophobicContact CE2-CG 4.5Å; Y205-F298 HydrophobicContact CG-CD1 4.37Å
206	R	97.3	Very high	95	Very high	144 Å²	144	80.5 Å²	80.5	54%	0.543	40%	0.399	S	S	.	.			trans	-146.4	152.7	177	-62	-176.9	-179	178.4	2.4	109.6	E227	R206-E227 HydrophobicContact CB-CB 4.19Å; R206-E227 WeakPolarHBondContact O-CB 3.25Å; R206-E227 PolarHBondContact O-N 3.08Å
207	E	96.8	Very high	95.2	Very high	90 Å²	90	77.8 Å²	77.8	42%	0.421	39%	0.385	S	S	.	.			trans	-117.3	-172.6	172.4	-55.9	-163.1	164.1	0	0	110.5	Y205 K209 G225 K226	Y205-E207 HydrophobicContact CE1-CG 3.59Å; Y205-E207 WeakPolarHBondContact CE1-OE1 3.49Å; Y205-E207 PolarHBondContact OH-OE1 3.03Å; E207-K209 PolarHBondContact O-N 3Å; E207-G225 CarbonylContact C-O 3.27Å; E207-G225 VanDerWaalsContact C-O 3.27Å; E207-G225 WeakPolarHBondContact CA-O 3.48Å; E207-K226 HydrophobicContact CG-CG 4.37Å
208	H	94.4	Very high	95.6	Very high	180 Å²	180	75 Å²	75	83%	0.833	37%	0.366	S	S	*	.	S	Bend	trans	55.6	29.9	-178.5	-46.5	-53.3	0	0	0	114.6	G225	H208-G225 PolarHBondContact N-O 2.71Å
209	K	95.6	Very high	95.8	Very high	70 Å²	70	66.8 Å²	66.8	30%	0.304	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-70.5	145	172.8	-58.6	-62.5	-57.9	-160	0	111	E207 G225 E227	E207-K209 PolarHBondContact O-N 3Å; K209-G225 WeakPolarHBondContact CB-O 3.36Å; K209-G225 WeakPolarHBondContact CG-O 3.2Å; K209-G225 PolarHBondContact N-O 2.9Å; K209-E227 HydrophobicContact CD-CB 4.39Å; K209-E227 WeakPolarHBondContact CE-OE1 3.5Å; K209-E227 WeakPolarHBondContact CE-OE2 3.45Å; K209-E227 HydrophobicContact CG-CB 4.21Å; K209-E227 VanDerWaalsContact NZ-CD 3.31Å; K209-E227 IonicContact NZ-OE1 3.23Å; K209-E227 PolarHBondContact NZ-OE1 3.07Å; K209-E227 IonicContact NZ-OE2 3.82Å; K209-E227 PolarHBondContact NZ-OE2 2.84Å
210	S	90.5	Very high	95.9	Very high	92 Å²	92	64 Å²	64	64%	0.643	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-65.2	130.4	166.7	52.8	0	0	0	0	110.8	T212	S210-T212 PolarHBondContact O-N 3.43Å; S210-T212 PolarHBondContact O-OG1 2.99Å
211	L	89.7	Confident	96	Very high	70 Å²	70	58.2 Å²	58.2	37%	0.366	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-53	121.4	173.6	-67.7	157.3	0	0	0	109.8	M218 T222 Y263	L211-M218 HydrophobicContact CD2-SD 4.27Å; L211-T222 VanDerWaalsContact CD2-O 3.27Å; L211-T222 WeakPolarHBondContact CD2-O 3.45Å; L211-Y263 HydrophobicContact CB-CD1 3.97Å; L211-Y263 HydrophobicContact CB-CE1 4.14Å; L211-Y263 HydrophobicContact CD1-CD1 3.8Å; L211-Y263 HydrophobicContact CD1-CG 4.14Å; L211-Y263 HydrophobicContact CD2-CD1 4.2Å; L211-Y263 HydrophobicContact CG-CD1 4.2Å
212	T	89.4	Confident	96	Very high	29 Å²	29	51.3 Å²	51.3	18%	0.178	26%	0.256	C	S	.	.			trans	-132.9	142.9	-175.1	-52.3	0	0	0	0	108.9	L190 S210 M218	L190-T212 HydrophobicContact CD1-CG2 4.15Å; L190-T212 HydrophobicContact CD2-CG2 3.87Å; L190-T212 HydrophobicContact CG-CG2 4.45Å; S210-T212 PolarHBondContact O-N 3.43Å; S210-T212 PolarHBondContact O-OG1 2.99Å; T212-M218 VanDerWaalsContact O-CE 3.23Å; T212-M218 WeakPolarHBondContact O-CE 3.26Å
213	G	90.3	Very high	96	Very high	13 Å²	13	50.5 Å²	50.5	13%	0.134	25%	0.252	C	S	.	.	S	Bend	trans	83.2	-176.4	-175.7	0	0	0	0	0	113.5	D164 A215 M218	D164-G213 WeakPolarHBondContact OD1-CA 3.1Å; G213-A215 PolarHBondContact O-N 3.43Å; G213-M218 WeakPolarHBondContact O-CE 3.4Å
214	T	94.3	Very high	95.9	Very high	36 Å²	36	53.1 Å²	53.1	22%	0.221	27%	0.266	C	S	.	.			trans	-83	116	-168.4	-60.6	0	0	0	0	113.6	D164 K166 R216 Y217 M218	D164-T214 PolarHBondContact OD1-N 3.28Å; D164-T214 VanDerWaalsContact OD1-N 3.07Å; D164-T214 PolarHBondContact OD1-OG1 3.41Å; K166-T214 WeakPolarHBondContact CD-OG1 3.23Å; T214-R216 HydrophobicContact CG2-CB 4.25Å; T214-R216 PolarHBondContact O-N 2.89Å; T214-Y217 HydrophobicContact CG2-CD2 3.7Å; T214-Y217 HydrophobicContact CG2-CE2 4.06Å; T214-Y217 PolarHBondContact O-N 2.75Å; T214-M218 PolarHBondContact O-N 3.06Å
215	A	96.4	Very high	95.8	Very high	10 Å²	10	50.2 Å²	50.2	8%	0.083	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-37.9	-175.4	0	0	0	0	0	114.9	G213 Y217 H223 Y263 I266 K270	G213-A215 PolarHBondContact O-N 3.43Å; A215-Y217 VanDerWaalsContact C-N 3.3Å; A215-Y217 PolarHBondContact O-N 3.04Å; A215-H223 PolarHBondContact O-NE2 2.95Å; A215-Y263 HydrophobicContact CB-CD1 3.92Å; A215-Y263 HydrophobicContact CB-CD2 4.2Å; A215-Y263 HydrophobicContact CB-CE1 3.67Å; A215-Y263 HydrophobicContact CB-CE2 3.94Å; A215-Y263 HydrophobicContact CB-CG 4.22Å; A215-I266 HydrophobicContact CB-CD1 3.96Å; A215-I266 WeakPolarHBondContact O-CG2 3.22Å; A215-K270 PolarHBondContact O-NZ 2.96Å
216	R	98.1	Very high	95.9	Very high	74 Å²	74	48.6 Å²	48.6	28%	0.279	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-40	-179.1	-163.5	-168.2	-64.5	142.1	-4.2	111.4	E168 T214 L249 W251 Q252 K270	E168-R216 IonicContact OE1-NH1 2.71Å; T214-R216 HydrophobicContact CG2-CB 4.25Å; T214-R216 PolarHBondContact O-N 2.89Å; R216-L249 HydrophobicContact CG-CD1 4.16Å; R216-W251 PolarHBondContact O-NE1 2.86Å; R216-Q252 HydrophobicContact CG-CG 4.08Å; R216-K270 WeakPolarHBondContact O-CE 3.06Å; R216-K270 PolarHBondContact O-NZ 2.78Å
217	Y	98.6	Very high	95.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-34.1	-172	-53.5	-69.4	0	0	0	113.9	V165 K166 P167 T214 A215 A236 H239 M240 Y243 L249	V165-Y217 VanDerWaalsContact O-CB 3.23Å; V165-Y217 WeakPolarHBondContact O-CB 3.49Å; K166-Y217 HydrophobicContact CB-CD2 3.58Å; K166-Y217 HydrophobicContact CB-CE2 3.7Å; P167-Y217 VanDerWaalsContact CD-CE2 3.4Å; P167-Y217 VanDerWaalsContact CD-OH 3.26Å; P167-Y217 WeakPolarHBondContact CD-OH 3.23Å; P167-Y217 HydrophobicContact CG-CE1 4.31Å; P167-Y217 HydrophobicContact CG-CE2 4.44Å; P167-Y217 WeakPolarHBondContact CG-OH 3.41Å; T214-Y217 HydrophobicContact CG2-CD2 3.7Å; T214-Y217 HydrophobicContact CG2-CE2 4.06Å; T214-Y217 PolarHBondContact O-N 2.75Å; A215-Y217 VanDerWaalsContact C-N 3.3Å; A215-Y217 PolarHBondContact O-N 3.04Å; Y217-A236 VanDerWaalsContact O-CA 3.3Å; Y217-A236 WeakPolarHBondContact O-CA 3.42Å; Y217-A236 WeakPolarHBondContact O-CB 3.32Å; Y217-H239 PolarHBondContact O-ND1 3.05Å; Y217-M240 HydrophobicContact CD1-CB 3.99Å; Y217-M240 HydrophobicContact CD1-CG 4.28Å; Y217-M240 HydrophobicContact CE1-CB 4.27Å; Y217-M240 HydrophobicContact CE1-CG 4.13Å; Y217-Y243 AromaticContact CE1-CD1 3.98Å; Y217-Y243 HydrophobicContact CE1-CD1 3.98Å; Y217-Y243 HydrophobicContact CE1-CD2 4.42Å; Y217-Y243 HydrophobicContact CE1-CE1 4.5Å; Y217-Y243 AromaticContact CE1-CG 3.91Å; Y217-Y243 HydrophobicContact CE1-CG 3.91Å; Y217-Y243 VanDerWaalsContact OH-CE1 3.24Å; Y217-Y243 WeakPolarHBondContact OH-CE1 3.32Å; Y217-L249 HydrophobicContact CD1-CD1 4.44Å; Y217-L249 HydrophobicContact CE1-CD1 4.43Å
218	M	98.3	Very high	96	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.039	20%	0.201	C	C	.	.	S	Bend	trans	-48.6	149.3	-175.5	66.2	170.1	54.8	0	0	114.9	L211 T212 G213 T214 T222 H223 Y263 K270	L211-M218 HydrophobicContact CD2-SD 4.27Å; T212-M218 VanDerWaalsContact O-CE 3.23Å; T212-M218 WeakPolarHBondContact O-CE 3.26Å; G213-M218 WeakPolarHBondContact O-CE 3.4Å; T214-M218 PolarHBondContact O-N 3.06Å; M218-T222 HydrophobicContact CB-CG2 4.07Å; M218-T222 HydrophobicContact CE-CG2 4.01Å; M218-T222 HydrophobicContact CG-CG2 4.35Å; M218-T222 HydrophobicContact SD-CG2 3.66Å; M218-H223 WeakPolarHBondContact CG-NE2 3.36Å; M218-Y263 HydrophobicContact CE-CD1 4.4Å; M218-Y263 HydrophobicContact CE-CE1 3.89Å; M218-Y263 HydrophobicContact SD-CD1 4.42Å; M218-Y263 HydrophobicContact SD-CE1 4.47Å; M218-K270 PolarHBondContact O-NZ 2.99Å
219	S	98.7	Very high	96.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.			trans	-60.9	161.3	-178.7	68.6	0	0	0	0	113.9	N221 T222 H223 D232 E235	S219-N221 VanDerWaalsContact C-N 3.26Å; S219-N221 PolarHBondContact O-N 2.65Å; S219-T222 PolarHBondContact O-N 2.89Å; S219-T222 PolarHBondContact OG-N 2.9Å; S219-T222 PolarHBondContact OG-OG1 2.82Å; S219-H223 PolarHBondContact O-CD2 2.99Å; S219-H223 PolarHBondContact O-N 3.4Å; S219-D232 VanDerWaalsContact CB-OD1 3.25Å; S219-D232 WeakPolarHBondContact CB-OD1 3.47Å; S219-D232 PolarHBondContact OG-OD1 3.27Å; S219-E235 WeakPolarHBondContact CA-OE1 3.46Å; S219-E235 WeakPolarHBondContact CB-OE2 3.33Å
220	I	98.5	Very high	96.4	Very high	25 Å²	25	27.5 Å²	27.5	13%	0.128	15%	0.152	C	C	.	.	H	α-helix	trans	-57.8	-40.6	168.9	-72.1	169.9	0	0	0	110.8	T222 H223 L224 E235 K270 R271	I220-T222 VanDerWaalsContact C-N 3.32Å; I220-T222 PolarHBondContact O-N 3.23Å; I220-H223 WeakPolarHBondContact O-CB 3.22Å; I220-H223 PolarHBondContact O-N 3.48Å; I220-L224 HydrophobicContact CG2-CD1 4.11Å; I220-L224 WeakPolarHBondContact O-CG 3.42Å; I220-L224 PolarHBondContact O-N 3.4Å; I220-E235 PolarHBondContact N-OE1 3.26Å; I220-K270 HydrophobicContact CG1-CB 4.01Å; I220-R271 HydrophobicContact CD1-CG 4.2Å; I220-R271 HydrophobicContact CG1-CG 4.21Å; I220-R271 HydrophobicContact CG2-CG 3.58Å
221	N	98.5	Very high	96.8	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.118	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-36.2	178.5	-71	-55.5	0	0	0	112.5	S219 L224 G225 K226 D232	S219-N221 VanDerWaalsContact C-N 3.26Å; S219-N221 PolarHBondContact O-N 2.65Å; N221-L224 CarbonylContact O-C 3.53Å; N221-L224 PolarHBondContact O-N 3.13Å; N221-G225 PolarHBondContact O-N 2.73Å; N221-K226 HydrophobicContact CB-CB 4.28Å; N221-K226 HydrophobicContact CB-CD 4.02Å; N221-K226 WeakPolarHBondContact O-CB 3.21Å; N221-K226 PolarHBondContact O-N 3.05Å; N221-K226 VanDerWaalsContact O-N 3.08Å; N221-K226 WeakPolarHBondContact OD1-CD 3.33Å; N221-D232 WeakPolarHBondContact CB-OD1 3.34Å
222	T	98.1	Very high	97.2	Very high	5 Å²	5	21 Å²	21	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-44.1	173.6	-52.7	0	0	0	0	110.7	L211 M218 S219 I220 L224 G225 Q228	L211-T222 VanDerWaalsContact CD2-O 3.27Å; L211-T222 WeakPolarHBondContact CD2-O 3.45Å; M218-T222 HydrophobicContact CB-CG2 4.07Å; M218-T222 HydrophobicContact CE-CG2 4.01Å; M218-T222 HydrophobicContact CG-CG2 4.35Å; M218-T222 HydrophobicContact SD-CG2 3.66Å; S219-T222 PolarHBondContact O-N 2.89Å; S219-T222 PolarHBondContact OG-N 2.9Å; S219-T222 PolarHBondContact OG-OG1 2.82Å; I220-T222 VanDerWaalsContact C-N 3.32Å; I220-T222 PolarHBondContact O-N 3.23Å; T222-L224 VanDerWaalsContact C-N 3.25Å; T222-L224 PolarHBondContact O-N 3.25Å; T222-G225 PolarHBondContact O-N 2.96Å; T222-Q228 HydrophobicContact CG2-CG 4.28Å; T222-Q228 WeakPolarHBondContact OG1-CG 3.26Å; T222-Q228 PolarHBondContact OG1-NE2 3.21Å
223	H	97.6	Very high	97.7	Very high	18 Å²	18	19.7 Å²	19.7	8%	0.083	10%	0.1	C	C	.	.	H	α-helix	trans	-60.4	-32.7	174.5	-86.5	-72.6	0	0	0	113.3	A215 M218 S219 I220 G225 Y263 G267	A215-H223 PolarHBondContact O-NE2 2.95Å; M218-H223 WeakPolarHBondContact CG-NE2 3.36Å; S219-H223 PolarHBondContact O-CD2 2.99Å; S219-H223 PolarHBondContact O-N 3.4Å; I220-H223 WeakPolarHBondContact O-CB 3.22Å; I220-H223 PolarHBondContact O-N 3.48Å; H223-G225 PolarHBondContact O-N 2.76Å; H223-Y263 PolarHBondContact CE1-O 3.14Å; H223-Y263 VanDerWaalsContact CE1-O 3.27Å; H223-Y263 PolarHBondContact ND1-O 3.37Å; H223-Y263 VanDerWaalsContact ND1-O 3.17Å; H223-G267 VanDerWaalsContact CG-CA 3.49Å
224	L	96.6	Very high	98.1	Very high	75 Å²	75	19 Å²	19	39%	0.393	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	5.6	173.9	-63.4	173.3	0	0	0	113.7	I220 N221 T222 K226	I220-L224 HydrophobicContact CG2-CD1 4.11Å; I220-L224 WeakPolarHBondContact O-CG 3.42Å; I220-L224 PolarHBondContact O-N 3.4Å; N221-L224 CarbonylContact O-C 3.53Å; N221-L224 PolarHBondContact O-N 3.13Å; T222-L224 VanDerWaalsContact C-N 3.25Å; T222-L224 PolarHBondContact O-N 3.25Å; L224-K226 VanDerWaalsContact C-N 3.27Å; L224-K226 HydrophobicContact CB-CD 4.33Å; L224-K226 HydrophobicContact CB-CG 4.22Å; L224-K226 PolarHBondContact O-N 3.45Å
225	G	97.1	Very high	98.3	Very high	10 Å²	10	17.5 Å²	17.5	10%	0.103	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	24.2	179.8	0	0	0	0	0	113.7	E207 H208 K209 N221 T222 H223	E207-G225 CarbonylContact C-O 3.27Å; E207-G225 VanDerWaalsContact C-O 3.27Å; E207-G225 WeakPolarHBondContact CA-O 3.48Å; H208-G225 PolarHBondContact N-O 2.71Å; K209-G225 WeakPolarHBondContact CB-O 3.36Å; K209-G225 WeakPolarHBondContact CG-O 3.2Å; K209-G225 PolarHBondContact N-O 2.9Å; N221-G225 PolarHBondContact O-N 2.73Å; T222-G225 PolarHBondContact O-N 2.96Å; H223-G225 PolarHBondContact O-N 2.76Å
226	K	98.3	Very high	98.4	Very high	50 Å²	50	17.2 Å²	17.2	22%	0.217	8%	0.082	C	C	.	.	P	Polyproline II helix	trans	-81.3	151	175.1	-59.9	176.5	172.7	-169.9	0	110.1	Y205 E207 N221 L224 Q228	Y205-K226 HydrophobicContact CE2-CB 4.32Å; Y205-K226 HydrophobicContact CE2-CD 4.37Å; Y205-K226 HydrophobicContact CE2-CG 4.47Å; Y205-K226 WeakPolarHBondContact OH-CD 3.36Å; Y205-K226 WeakPolarHBondContact OH-CE 3.41Å; Y205-K226 WeakPolarHBondContact OH-CG 3.48Å; E207-K226 HydrophobicContact CG-CG 4.37Å; N221-K226 HydrophobicContact CB-CB 4.28Å; N221-K226 HydrophobicContact CB-CD 4.02Å; N221-K226 WeakPolarHBondContact O-CB 3.21Å; N221-K226 PolarHBondContact O-N 3.05Å; N221-K226 VanDerWaalsContact O-N 3.08Å; N221-K226 WeakPolarHBondContact OD1-CD 3.33Å; L224-K226 VanDerWaalsContact C-N 3.27Å; L224-K226 HydrophobicContact CB-CD 4.33Å; L224-K226 HydrophobicContact CB-CG 4.22Å; L224-K226 PolarHBondContact O-N 3.45Å; K226-Q228 PolarHBondContact O-N 3.11Å
227	E	98.4	Very high	98.5	Very high	5 Å²	5	13.7 Å²	13.7	2%	0.023	7%	0.068	C	C	.	.	P	Polyproline II helix	trans	-60.6	134.5	169.4	-168.1	76	-102.8	0	0	108.9	K192 I203 R206 K209 F298	K192-E227 IonicContact NZ-OE1 2.79Å; K192-E227 PolarHBondContact NZ-OE1 3.27Å; K192-E227 IonicContact NZ-OE2 3.65Å; K192-E227 PolarHBondContact NZ-OE2 2.63Å; K192-E227 VanDerWaalsContact NZ-OE2 3.12Å; I203-E227 HydrophobicContact CD1-CG 3.96Å; R206-E227 HydrophobicContact CB-CB 4.19Å; R206-E227 WeakPolarHBondContact O-CB 3.25Å; R206-E227 PolarHBondContact O-N 3.08Å; K209-E227 HydrophobicContact CD-CB 4.39Å; K209-E227 WeakPolarHBondContact CE-OE1 3.5Å; K209-E227 WeakPolarHBondContact CE-OE2 3.45Å; K209-E227 HydrophobicContact CG-CB 4.21Å; K209-E227 VanDerWaalsContact NZ-CD 3.31Å; K209-E227 IonicContact NZ-OE1 3.23Å; K209-E227 PolarHBondContact NZ-OE1 3.07Å; K209-E227 IonicContact NZ-OE2 3.82Å; K209-E227 PolarHBondContact NZ-OE2 2.84Å; E227-F298 HydrophobicContact CB-CE2 4.22Å; E227-F298 HydrophobicContact CB-CZ 4.27Å; E227-F298 HydrophobicContact CG-CE2 4.48Å; E227-F298 HydrophobicContact CG-CZ 4.28Å; E227-F298 WeakPolarHBondContact O-CE2 3.28Å
228	Q	98.8	Very high	98.5	Very high	11 Å²	11	13.8 Å²	13.8	5%	0.051	7%	0.069	C	C	.	.	P	Polyproline II helix	trans	-79	145.5	-179.8	-67.2	170	-80	0	0	110.1	I161 R163 T222 K226 D232	I161-Q228 HydrophobicContact CD1-CB 4.18Å; I161-Q228 WeakPolarHBondContact CD1-O 3.44Å; R163-Q228 HydrophobicContact CG-CB 4.37Å; T222-Q228 HydrophobicContact CG2-CG 4.28Å; T222-Q228 WeakPolarHBondContact OG1-CG 3.26Å; T222-Q228 PolarHBondContact OG1-NE2 3.21Å; K226-Q228 PolarHBondContact O-N 3.11Å; Q228-D232 WeakPolarHBondContact CA-OD2 3.43Å; Q228-D232 HydrophobicContact CB-CB 4.19Å; Q228-D232 HydrophobicContact CG-CB 4.25Å
229	S	98.8	Very high	98.5	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.007	7%	0.067	C	C	.	.			trans	-135.7	-167.6	165.3	76.4	0	0	0	0	111	R231 D232 F298	S229-R231 PolarHBondContact O-N 2.95Å; S229-R231 VanDerWaalsContact O-N 3.14Å; S229-D232 PolarHBondContact N-OD2 3.49Å; S229-D232 WeakPolarHBondContact O-CB 3.01Å; S229-D232 PolarHBondContact O-N 2.69Å; S229-F298 WeakPolarHBondContact CB-O 3.48Å; S229-F298 PolarHBondContact OG-O 3.26Å
230	R	98.9	Very high	98.5	Very high	23 Å²	23	13.4 Å²	13.4	9%	0.087	7%	0.067	C	C	.	.	H	α-helix	trans	-53	-36	-174.3	-63.4	178.5	-76.3	-142.2	-2.1	113.8	H156 I161 Y194 D232 L234 F299 E300 P302 Y304	H156-R230 HydrophobicContact CB-CG 4.25Å; H156-R230 VanDerWaalsContact CE1-CA 3.49Å; H156-R230 WeakPolarHBondContact CE1-CA 3.42Å; H156-R230 PolarHBondContact CE1-O 3.37Å; I161-R230 HydrophobicContact CG2-CG 4.14Å; Y194-R230 HydrophobicContact CD2-CG 4.34Å; Y194-R230 HydrophobicContact CE1-CG 4.26Å; Y194-R230 HydrophobicContact CE2-CG 4.03Å; Y194-R230 VanDerWaalsContact CE2-NH1 3.29Å; Y194-R230 PolarHBondContact OH-NH1 3.39Å; R230-D232 VanDerWaalsContact C-N 3.27Å; R230-D232 PolarHBondContact O-N 2.98Å; R230-L234 PolarHBondContact O-N 2.84Å; R230-F299 PolarHBondContact NH2-O 3.1Å; R230-E300 VanDerWaalsContact CZ-O 3.28Å; R230-E300 PolarHBondContact NE-O 3.39Å; R230-E300 VanDerWaalsContact NE-O 3.07Å; R230-E300 PolarHBondContact NH2-O 2.87Å; R230-P302 HydrophobicContact CB-CG 3.95Å; R230-Y304 WeakPolarHBondContact CD-OH 2.99Å
231	R	98.9	Very high	98.5	Very high	23 Å²	23	12.2 Å²	12.2	9%	0.087	6%	0.062	C	C	.	.	H	α-helix	trans	-62.8	-32.5	178.9	68	-175.9	-179.3	177.8	-1.8	113.1	S229 L234 E235 L296	S229-R231 PolarHBondContact O-N 2.95Å; S229-R231 VanDerWaalsContact O-N 3.14Å; R231-L234 PolarHBondContact O-N 3.18Å; R231-E235 PolarHBondContact O-N 3.32Å; R231-L296 HydrophobicContact CB-CB 3.69Å; R231-L296 HydrophobicContact CB-CD1 3.79Å; R231-L296 HydrophobicContact CB-CG 4.42Å; R231-L296 WeakPolarHBondContact CD-O 3.41Å; R231-L296 PolarHBondContact NH1-O 2.93Å
232	D	98.9	Very high	98.6	Very high	2 Å²	2	11.2 Å²	11.2	1%	0.011	6%	0.056	C	C	.	.	H	α-helix	trans	-74.8	-32.4	-173.8	-62.1	-74.2	0	0	0	112	S219 N221 Q228 S229 R230 A236	S219-D232 VanDerWaalsContact CB-OD1 3.25Å; S219-D232 WeakPolarHBondContact CB-OD1 3.47Å; S219-D232 PolarHBondContact OG-OD1 3.27Å; N221-D232 WeakPolarHBondContact CB-OD1 3.34Å; Q228-D232 WeakPolarHBondContact CA-OD2 3.43Å; Q228-D232 HydrophobicContact CB-CB 4.19Å; Q228-D232 HydrophobicContact CG-CB 4.25Å; S229-D232 PolarHBondContact N-OD2 3.49Å; S229-D232 WeakPolarHBondContact O-CB 3.01Å; S229-D232 PolarHBondContact O-N 2.69Å; R230-D232 VanDerWaalsContact C-N 3.27Å; R230-D232 PolarHBondContact O-N 2.98Å; D232-A236 WeakPolarHBondContact O-CB 3.47Å; D232-A236 PolarHBondContact O-N 3.07Å; D232-A236 VanDerWaalsContact O-N 3.11Å
233	D	98.9	Very high	98.6	Very high	2 Å²	2	11 Å²	11	1%	0.011	6%	0.055	C	C	.	.	H	α-helix	trans	-66.9	-40.6	170.6	-70.8	-34.1	0	0	0	111.4	M152 H156 Y162 R163 V165 A236 L237	M152-D233 HydrophobicContact CE-CB 4.02Å; M152-D233 HydrophobicContact CG-CB 3.99Å; M152-D233 HydrophobicContact SD-CB 3.59Å; M152-D233 VanDerWaalsContact SD-CB 3.59Å; H156-D233 IonicContact CD2-OD2 2.69Å; H156-D233 VanDerWaalsContact CE1-CB 3.44Å; H156-D233 WeakPolarHBondContact CE1-CB 3.41Å; H156-D233 IonicContact CE1-OD2 3.96Å; H156-D233 WeakPolarHBondContact NE2-CB 3.39Å; H156-D233 IonicContact NE2-OD1 3.56Å; H156-D233 IonicContact NE2-OD2 3.58Å; H156-D233 PolarHBondContact NE2-OD2 2.85Å; Y162-D233 PolarHBondContact N-OD2 2.95Å; R163-D233 WeakPolarHBondContact CA-OD1 3.41Å; R163-D233 PolarHBondContact N-OD1 3.29Å; V165-D233 HydrophobicContact CG2-CB 4.35Å; D233-A236 PolarHBondContact O-N 2.72Å; D233-L237 PolarHBondContact O-N 3.24Å
234	L	98.9	Very high	98.7	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-72.1	-40	178.5	-61.8	178.8	0	0	0	112.4	M152 R230 R231 A236 L237 G238 Y289 V293 L296 P302 Y304 L307	M152-L234 HydrophobicContact CB-CD2 4.31Å; M152-L234 HydrophobicContact CG-CD2 4.02Å; R230-L234 PolarHBondContact O-N 2.84Å; R231-L234 PolarHBondContact O-N 3.18Å; L234-A236 VanDerWaalsContact C-N 3.26Å; L234-A236 PolarHBondContact O-N 3.4Å; L234-L237 HydrophobicContact CD2-CD1 4.19Å; L234-L237 WeakPolarHBondContact O-CB 3.38Å; L234-L237 PolarHBondContact O-N 2.79Å; L234-G238 PolarHBondContact O-N 2.97Å; L234-Y289 WeakPolarHBondContact O-CE1 3.25Å; L234-Y289 PolarHBondContact O-OH 3.16Å; L234-V293 HydrophobicContact CB-CB 4.14Å; L234-V293 HydrophobicContact CB-CG1 3.71Å; L234-V293 HydrophobicContact CD1-CG1 4.42Å; L234-L296 HydrophobicContact CD1-CD1 4.41Å; L234-P302 HydrophobicContact CD1-CB 3.41Å; L234-P302 VanDerWaalsContact CD1-CB 3.41Å; L234-P302 HydrophobicContact CD1-CG 3.47Å; L234-P302 VanDerWaalsContact CD1-CG 3.47Å; L234-Y304 HydrophobicContact CD1-CD1 4.36Å; L234-Y304 HydrophobicContact CD1-CE1 4.05Å; L234-Y304 HydrophobicContact CD2-CD1 4.42Å; L234-Y304 HydrophobicContact CD2-CE1 4.29Å; L234-L307 HydrophobicContact CD1-CD1 3.91Å
235	E	98.9	Very high	98.8	Very high	3 Å²	3	7.3 Å²	7.3	1%	0.014	4%	0.036	C	C	.	.	H	α-helix	trans	-60.7	-38.7	171.8	-167.7	-172.6	141	0	0	111.3	S219 I220 R231 G238 H239 V293 R294	S219-E235 WeakPolarHBondContact CA-OE1 3.46Å; S219-E235 WeakPolarHBondContact CB-OE2 3.33Å; I220-E235 PolarHBondContact N-OE1 3.26Å; R231-E235 PolarHBondContact O-N 3.32Å; E235-G238 PolarHBondContact O-N 3.02Å; E235-H239 PolarHBondContact O-N 3.06Å; E235-H239 PolarHBondContact O-ND1 2.93Å; E235-H239 IonicContact OE1-CE1 3.99Å; E235-H239 PolarHBondContact OE1-CE1 3.41Å; E235-H239 VanDerWaalsContact OE1-CE1 3.23Å; E235-H239 IonicContact OE1-NE2 2.72Å; E235-V293 HydrophobicContact CB-CG2 4.01Å; E235-V293 HydrophobicContact CG-CG2 4.33Å; E235-R294 HydrophobicContact CG-CG 3.87Å; E235-R294 IonicContact OE1-NE 3.59Å
236	A	98.9	Very high	98.8	Very high	4 Å²	4	11 Å²	11	3%	0.033	5%	0.047	C	C	.	.	H	α-helix	trans	-68.7	-35.3	176	0	0	0	0	0	113.3	V165 Y217 D232 D233 L234 H239 M240	V165-A236 HydrophobicContact CB-CB 3.7Å; V165-A236 HydrophobicContact CG1-CB 4.01Å; V165-A236 HydrophobicContact CG2-CB 4.13Å; Y217-A236 VanDerWaalsContact O-CA 3.3Å; Y217-A236 WeakPolarHBondContact O-CA 3.42Å; Y217-A236 WeakPolarHBondContact O-CB 3.32Å; D232-A236 WeakPolarHBondContact O-CB 3.47Å; D232-A236 PolarHBondContact O-N 3.07Å; D232-A236 VanDerWaalsContact O-N 3.11Å; D233-A236 PolarHBondContact O-N 2.72Å; L234-A236 VanDerWaalsContact C-N 3.26Å; L234-A236 PolarHBondContact O-N 3.4Å; A236-H239 PolarHBondContact O-N 2.94Å; A236-M240 WeakPolarHBondContact O-CB 3.35Å; A236-M240 PolarHBondContact O-N 3.11Å
237	L	98.9	Very high	98.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-61.7	-44.8	169.2	-79.2	178.2	0	0	0	111.2	L148 M152 V165 F170 D233 L234 H239 M240 F241	L148-L237 HydrophobicContact CB-CD1 4.43Å; L148-L237 HydrophobicContact CB-CD2 4Å; L148-L237 HydrophobicContact CD1-CD2 3.97Å; M152-L237 HydrophobicContact CB-CD1 4.02Å; M152-L237 HydrophobicContact CE-CD1 4.32Å; M152-L237 HydrophobicContact CG-CD1 4.32Å; V165-L237 HydrophobicContact CG1-CD2 3.71Å; V165-L237 HydrophobicContact CG1-CG 4Å; F170-L237 HydrophobicContact CE2-CD2 4.34Å; F170-L237 HydrophobicContact CZ-CD2 4.09Å; D233-L237 PolarHBondContact O-N 3.24Å; L234-L237 HydrophobicContact CD2-CD1 4.19Å; L234-L237 WeakPolarHBondContact O-CB 3.38Å; L234-L237 PolarHBondContact O-N 2.79Å; L237-H239 PolarHBondContact O-N 3.18Å; L237-M240 HydrophobicContact CD2-CE 3.66Å; L237-M240 CarbonylContact O-C 3.53Å; L237-M240 WeakPolarHBondContact O-CA 3.25Å; L237-M240 WeakPolarHBondContact O-CB 3.45Å; L237-M240 PolarHBondContact O-N 2.8Å; L237-F241 HydrophobicContact CB-CE1 4.38Å; L237-F241 HydrophobicContact CB-CE2 4Å; L237-F241 HydrophobicContact CB-CZ 3.78Å; L237-F241 HydrophobicContact CD1-CZ 4.45Å; L237-F241 HydrophobicContact CD2-CE1 4.28Å; L237-F241 HydrophobicContact CD2-CZ 4.23Å; L237-F241 HydrophobicContact CG-CZ 4.38Å; L237-F241 WeakPolarHBondContact O-CD1 3.34Å; L237-F241 WeakPolarHBondContact O-CD2 3.3Å; L237-F241 WeakPolarHBondContact O-CG 3.47Å; L237-F241 PolarHBondContact O-N 2.96Å
238	G	98.9	Very high	98.8	Very high	2 Å²	2	11.9 Å²	11.9	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-58.7	-43.6	175.6	0	0	0	0	0	113.2	L234 E235 M240 F241 M242	L234-G238 PolarHBondContact O-N 2.97Å; E235-G238 PolarHBondContact O-N 3.02Å; G238-M240 VanDerWaalsContact C-N 3.28Å; G238-M240 PolarHBondContact O-N 2.66Å; G238-F241 PolarHBondContact O-N 3.21Å; G238-M242 WeakPolarHBondContact O-CG 3.32Å; G238-M242 PolarHBondContact O-N 3.05Å; G238-M242 VanDerWaalsContact O-N 3.11Å
239	H	98.9	Very high	98.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.5	-36	171.7	-66.1	143.3	0	0	0	112.4	Y217 E235 A236 L237 Y243 W251 R294	Y217-H239 PolarHBondContact O-ND1 3.05Å; E235-H239 PolarHBondContact O-N 3.06Å; E235-H239 PolarHBondContact O-ND1 2.93Å; E235-H239 IonicContact OE1-CE1 3.99Å; E235-H239 PolarHBondContact OE1-CE1 3.41Å; E235-H239 VanDerWaalsContact OE1-CE1 3.23Å; E235-H239 IonicContact OE1-NE2 2.72Å; A236-H239 PolarHBondContact O-N 2.94Å; L237-H239 PolarHBondContact O-N 3.18Å; H239-Y243 WeakPolarHBondContact O-CB 3.36Å; H239-Y243 PolarHBondContact O-N 3.17Å; H239-W251 HydrophobicContact CB-CZ2 4.37Å; H239-W251 AromaticContact CD2-CH2 3.66Å; H239-W251 AromaticContact CD2-CZ2 3.69Å; H239-W251 AromaticContact NE2-CH2 3.99Å; H239-R294 PolarHBondContact NE2-NH2 2.87Å
240	M	98.9	Very high	98.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-72.3	-36.9	178	-167	177.4	74.2	0	0	112.9	L148 V165 K166 P167 F170 Y217 A236 L237 G238 Y243 F244	L148-M240 HydrophobicContact CD1-CE 3.35Å; V165-M240 HydrophobicContact CG1-CE 4.48Å; V165-M240 HydrophobicContact CG1-SD 4.19Å; K166-M240 VanDerWaalsContact C-SD 3.58Å; P167-M240 HydrophobicContact CB-SD 4.41Å; P167-M240 VanDerWaalsContact CD-SD 3.56Å; P167-M240 HydrophobicContact CG-CG 3.73Å; P167-M240 HydrophobicContact CG-SD 3.77Å; P167-M240 VanDerWaalsContact N-SD 3.41Å; F170-M240 HydrophobicContact CD2-CE 3.69Å; F170-M240 HydrophobicContact CD2-SD 3.88Å; F170-M240 HydrophobicContact CE2-CE 3.6Å; F170-M240 HydrophobicContact CE2-SD 3.81Å; F170-M240 HydrophobicContact CZ-CE 4.49Å; Y217-M240 HydrophobicContact CD1-CB 3.99Å; Y217-M240 HydrophobicContact CD1-CG 4.28Å; Y217-M240 HydrophobicContact CE1-CB 4.27Å; Y217-M240 HydrophobicContact CE1-CG 4.13Å; A236-M240 WeakPolarHBondContact O-CB 3.35Å; A236-M240 PolarHBondContact O-N 3.11Å; L237-M240 HydrophobicContact CD2-CE 3.66Å; L237-M240 CarbonylContact O-C 3.53Å; L237-M240 WeakPolarHBondContact O-CA 3.25Å; L237-M240 WeakPolarHBondContact O-CB 3.45Å; L237-M240 PolarHBondContact O-N 2.8Å; G238-M240 VanDerWaalsContact C-N 3.28Å; G238-M240 PolarHBondContact O-N 2.66Å; M240-Y243 WeakPolarHBondContact O-CB 3.37Å; M240-Y243 PolarHBondContact O-N 3.19Å; M240-F244 HydrophobicContact CE-CE2 4.01Å; M240-F244 HydrophobicContact CE-CZ 4.46Å; M240-F244 HydrophobicContact CG-CD2 4.38Å; M240-F244 HydrophobicContact CG-CE2 3.78Å; M240-F244 HydrophobicContact CG-CZ 3.95Å; M240-F244 VanDerWaalsContact O-CD2 3.28Å; M240-F244 WeakPolarHBondContact O-CD2 3.16Å; M240-F244 WeakPolarHBondContact O-CG 3.16Å; M240-F244 PolarHBondContact O-N 3.01Å; M240-F244 HydrophobicContact SD-CE2 4.31Å; M240-F244 HydrophobicContact SD-CZ 4.29Å
241	F	98.9	Very high	98.8	Very high	1 Å²	1	13.3 Å²	13.3	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-63.5	-44.5	173	-54.3	-30.7	0	0	0	111.1	V141 A145 L148 L237 G238 Y243 F244 L245 Y289 F311	V141-F241 HydrophobicContact CG1-CB 4.04Å; A145-F241 HydrophobicContact CB-CD1 4.03Å; A145-F241 HydrophobicContact CB-CD2 4.11Å; A145-F241 HydrophobicContact CB-CE1 3.68Å; A145-F241 HydrophobicContact CB-CE2 3.76Å; A145-F241 HydrophobicContact CB-CG 4.25Å; A145-F241 HydrophobicContact CB-CZ 3.53Å; L148-F241 HydrophobicContact CD1-CE1 4.37Å; L237-F241 HydrophobicContact CB-CE1 4.38Å; L237-F241 HydrophobicContact CB-CE2 4Å; L237-F241 HydrophobicContact CB-CZ 3.78Å; L237-F241 HydrophobicContact CD1-CZ 4.45Å; L237-F241 HydrophobicContact CD2-CE1 4.28Å; L237-F241 HydrophobicContact CD2-CZ 4.23Å; L237-F241 HydrophobicContact CG-CZ 4.38Å; L237-F241 WeakPolarHBondContact O-CD1 3.34Å; L237-F241 WeakPolarHBondContact O-CD2 3.3Å; L237-F241 WeakPolarHBondContact O-CG 3.47Å; L237-F241 PolarHBondContact O-N 2.96Å; G238-F241 PolarHBondContact O-N 3.21Å; F241-Y243 VanDerWaalsContact C-N 3.31Å; F241-Y243 PolarHBondContact O-N 2.99Å; F241-F244 PolarHBondContact O-N 3.38Å; F241-L245 WeakPolarHBondContact O-CG 3.17Å; F241-L245 PolarHBondContact O-N 3.46Å; F241-Y289 HydrophobicContact CD2-CE1 4.5Å; F241-Y289 HydrophobicContact CE2-CE1 4.29Å; F241-Y289 HydrophobicContact CE2-CE2 4.17Å; F241-Y289 AromaticContact CE2-CZ 3.9Å; F241-F311 HydrophobicContact CD2-CE2 4.15Å; F241-F311 HydrophobicContact CD2-CZ 4.27Å; F241-F311 AromaticContact CE2-CE2 3.97Å; F241-F311 HydrophobicContact CE2-CE2 3.97Å
242	M	98.9	Very high	98.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-32	175.1	-66.8	-49	-51.1	0	0	113	G238 L245 R246 L249 L278 C279 F282 M286 L290	G238-M242 WeakPolarHBondContact O-CG 3.32Å; G238-M242 PolarHBondContact O-N 3.05Å; G238-M242 VanDerWaalsContact O-N 3.11Å; M242-L245 HydrophobicContact CE-CD1 4.43Å; M242-L245 HydrophobicContact SD-CD1 4.07Å; M242-R246 HydrophobicContact CE-CG 4.06Å; M242-R246 WeakPolarHBondContact O-CB 3.3Å; M242-R246 WeakPolarHBondContact O-CG 3.46Å; M242-R246 PolarHBondContact O-N 3.26Å; M242-L249 HydrophobicContact CB-CD2 4.06Å; M242-L278 HydrophobicContact CB-CD1 4.46Å; M242-L278 HydrophobicContact CB-CG 4.36Å; M242-L278 VanDerWaalsContact CE-O 3.3Å; M242-L278 WeakPolarHBondContact CE-O 3.21Å; M242-L278 HydrophobicContact CG-CD2 4.29Å; M242-L278 HydrophobicContact CG-CG 4.22Å; M242-C279 HydrophobicContact CE-CB 4.41Å; M242-C279 VanDerWaalsContact SD-SG 3.62Å; M242-F282 HydrophobicContact CE-CB 4.42Å; M242-F282 HydrophobicContact CE-CD2 3.69Å; M242-F282 HydrophobicContact CE-CE2 4.23Å; M242-F282 HydrophobicContact CE-CG 4.07Å; M242-M286 HydrophobicContact SD-CB 3.73Å; M242-M286 HydrophobicContact SD-CG 4.08Å; M242-M286 HydrophobicContact SD-SD 4.34Å; M242-L290 HydrophobicContact CG-CD1 4Å
243	Y	98.9	Very high	98.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.1	-47.8	171.5	168.5	-105.2	0	0	0	111.8	E126 F129 R134 P167 Y217 H239 M240 F241 R246 G247 L249	E126-Y243 PolarHBondContact OE1-OH 3.13Å; E126-Y243 VanDerWaalsContact OE2-CE1 3.28Å; E126-Y243 WeakPolarHBondContact OE2-CE1 3.35Å; E126-Y243 PolarHBondContact OE2-OH 3.16Å; F129-Y243 AromaticContact CD1-CE1 3.84Å; F129-Y243 HydrophobicContact CD1-CE1 3.84Å; F129-Y243 HydrophobicContact CE1-CD1 4.16Å; F129-Y243 AromaticContact CE1-CE1 3.48Å; F129-Y243 HydrophobicContact CE1-CE1 3.48Å; F129-Y243 VanDerWaalsContact CE1-CE1 3.48Å; F129-Y243 HydrophobicContact CE1-CE2 4.16Å; F129-Y243 AromaticContact CE1-CZ 3.51Å; F129-Y243 HydrophobicContact CZ-CD1 4.35Å; F129-Y243 HydrophobicContact CZ-CE1 4.12Å; R134-Y243 PolarHBondContact NH2-OH 3.33Å; P167-Y243 HydrophobicContact CG-CD1 4.07Å; P167-Y243 HydrophobicContact CG-CE1 3.83Å; Y217-Y243 AromaticContact CE1-CD1 3.98Å; Y217-Y243 HydrophobicContact CE1-CD1 3.98Å; Y217-Y243 HydrophobicContact CE1-CD2 4.42Å; Y217-Y243 HydrophobicContact CE1-CE1 4.5Å; Y217-Y243 AromaticContact CE1-CG 3.91Å; Y217-Y243 HydrophobicContact CE1-CG 3.91Å; Y217-Y243 VanDerWaalsContact OH-CE1 3.24Å; Y217-Y243 WeakPolarHBondContact OH-CE1 3.32Å; H239-Y243 WeakPolarHBondContact O-CB 3.36Å; H239-Y243 PolarHBondContact O-N 3.17Å; M240-Y243 WeakPolarHBondContact O-CB 3.37Å; M240-Y243 PolarHBondContact O-N 3.19Å; F241-Y243 VanDerWaalsContact C-N 3.31Å; F241-Y243 PolarHBondContact O-N 2.99Å; Y243-R246 PolarHBondContact O-N 3.37Å; Y243-G247 WeakPolarHBondContact O-CA 3.49Å; Y243-G247 PolarHBondContact O-N 3.03Å; Y243-L249 HydrophobicContact CD2-CD1 4.4Å; Y243-L249 HydrophobicContact CD2-CG 4.31Å
244	F	98.9	Very high	98.1	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-41.2	178.6	-67.1	-41.5	0	0	0	113.2	L125 F129 F136 V141 I144 P167 M240 F241	L125-F244 HydrophobicContact CB-CE1 4.34Å; L125-F244 HydrophobicContact CB-CZ 3.78Å; L125-F244 HydrophobicContact CD1-CE2 4.09Å; L125-F244 HydrophobicContact CD1-CZ 3.96Å; F129-F244 HydrophobicContact CB-CE1 4.45Å; F129-F244 AromaticContact CD2-CD1 3.77Å; F129-F244 HydrophobicContact CD2-CD1 3.77Å; F129-F244 HydrophobicContact CD2-CE1 4.44Å; F129-F244 HydrophobicContact CE2-CB 4.27Å; F129-F244 AromaticContact CE2-CD1 3.85Å; F129-F244 HydrophobicContact CE2-CD1 3.85Å; F129-F244 WeakPolarHBondContact CE2-O 3.14Å; F129-F244 HydrophobicContact CG-CD1 4.11Å; F129-F244 HydrophobicContact CG-CE1 4.39Å; F129-F244 HydrophobicContact CZ-CD1 4.25Å; F136-F244 HydrophobicContact CB-CB 4.32Å; F136-F244 HydrophobicContact CD2-CB 3.82Å; F136-F244 AromaticContact CD2-CD1 3.7Å; F136-F244 HydrophobicContact CD2-CD1 3.7Å; F136-F244 HydrophobicContact CD2-CD2 4.28Å; F136-F244 HydrophobicContact CD2-CE1 4.3Å; F136-F244 AromaticContact CD2-CG 3.7Å; F136-F244 HydrophobicContact CD2-CG 3.7Å; F136-F244 AromaticContact CE2-CD1 3.74Å; F136-F244 HydrophobicContact CE2-CD1 3.74Å; F136-F244 AromaticContact CE2-CE1 3.89Å; F136-F244 HydrophobicContact CE2-CE1 3.89Å; F136-F244 HydrophobicContact CE2-CG 4.13Å; F136-F244 HydrophobicContact CE2-CZ 4.38Å; F136-F244 HydrophobicContact CG-CB 4.5Å; F136-F244 PolarHBondContact N-O 3.26Å; V141-F244 HydrophobicContact CG2-CB 3.69Å; I144-F244 HydrophobicContact CG2-CE2 4.37Å; P167-F244 HydrophobicContact CB-CE1 3.84Å; P167-F244 HydrophobicContact CB-CZ 3.74Å; P167-F244 HydrophobicContact CG-CE1 3.71Å; P167-F244 HydrophobicContact CG-CZ 3.68Å; M240-F244 HydrophobicContact CE-CE2 4.01Å; M240-F244 HydrophobicContact CE-CZ 4.46Å; M240-F244 HydrophobicContact CG-CD2 4.38Å; M240-F244 HydrophobicContact CG-CE2 3.78Å; M240-F244 HydrophobicContact CG-CZ 3.95Å; M240-F244 VanDerWaalsContact O-CD2 3.28Å; M240-F244 WeakPolarHBondContact O-CD2 3.16Å; M240-F244 WeakPolarHBondContact O-CG 3.16Å; M240-F244 PolarHBondContact O-N 3.01Å; M240-F244 HydrophobicContact SD-CE2 4.31Å; M240-F244 HydrophobicContact SD-CZ 4.29Å; F241-F244 PolarHBondContact O-N 3.38Å
245	L	98.8	Very high	97.8	Very high	16 Å²	16	28.8 Å²	28.8	8%	0.084	16%	0.163	C	C	.	.	H	α-helix	trans	-69.6	-34.7	179	-71	171.1	0	0	0	113.5	L138 V141 F241 M242 F282 M286	L138-L245 HydrophobicContact CD1-CD2 4.17Å; V141-L245 HydrophobicContact CB-CD2 3.9Å; V141-L245 HydrophobicContact CB-CG 4.21Å; V141-L245 HydrophobicContact CG1-CD1 4.31Å; V141-L245 HydrophobicContact CG1-CD2 4.21Å; V141-L245 HydrophobicContact CG1-CG 4.01Å; V141-L245 HydrophobicContact CG2-CD2 3.73Å; V141-L245 HydrophobicContact CG2-CG 3.98Å; F241-L245 WeakPolarHBondContact O-CG 3.17Å; F241-L245 PolarHBondContact O-N 3.46Å; M242-L245 HydrophobicContact CE-CD1 4.43Å; M242-L245 HydrophobicContact SD-CD1 4.07Å; L245-F282 HydrophobicContact CB-CD1 3.86Å; L245-F282 HydrophobicContact CB-CE1 3.64Å; L245-F282 HydrophobicContact CB-CZ 4.2Å; L245-F282 HydrophobicContact CD1-CD1 4.1Å; L245-F282 HydrophobicContact CD1-CG 4.46Å; L245-F282 HydrophobicContact CD2-CD1 4.34Å; L245-F282 HydrophobicContact CG-CD1 4.32Å; L245-F282 WeakPolarHBondContact O-CE1 3.17Å; L245-M286 HydrophobicContact CD1-CE 3.88Å; L245-M286 HydrophobicContact CD1-CG 4.01Å; L245-M286 HydrophobicContact CD1-SD 3.78Å
246	R	98.5	Very high	97.5	Very high	86 Å²	86	30 Å²	30	33%	0.325	17%	0.174	S	C	.	.	H	α-helix	trans	-97.7	-11.4	-173	-65	179.4	67.4	90.1	13.5	114.5	M242 Y243 S248 L278 F282	M242-R246 HydrophobicContact CE-CG 4.06Å; M242-R246 WeakPolarHBondContact O-CB 3.3Å; M242-R246 WeakPolarHBondContact O-CG 3.46Å; M242-R246 PolarHBondContact O-N 3.26Å; Y243-R246 PolarHBondContact O-N 3.37Å; R246-S248 WeakPolarHBondContact CB-O 3.28Å; R246-S248 PolarHBondContact O-N 3.17Å; R246-L278 WeakPolarHBondContact CD-O 3.46Å; R246-L278 PolarHBondContact NH1-O 3.11Å; R246-F282 HydrophobicContact CG-CD2 4.39Å; R246-F282 HydrophobicContact CG-CE2 3.5Å; R246-F282 HydrophobicContact CG-CZ 3.68Å
247	G	98.4	Very high	97.3	Very high	13 Å²	13	37.5 Å²	37.5	13%	0.134	21%	0.214	C	C	.	.	S	Bend	trans	72.4	-25.4	-166.9	0	0	0	0	0	115.1	R134 Y243	R134-G247 WeakPolarHBondContact O-CA 3.24Å; Y243-G247 WeakPolarHBondContact O-CA 3.49Å; Y243-G247 PolarHBondContact O-N 3.03Å
248	S	98.3	Very high	97	Very high	62 Å²	62	40.8 Å²	40.8	43%	0.434	23%	0.234	S	C	.	.	S	Bend	trans	-157.5	156.5	176.2	63.3	0	0	0	0	112.9	R246	R246-S248 WeakPolarHBondContact CB-O 3.28Å; R246-S248 PolarHBondContact O-N 3.17Å
249	L	98.6	Very high	96.5	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	26%	0.263	C	S	.	.			trans	-99.1	146	174	-66.8	165.9	0	0	0	111.1	R216 Y217 M242 Y243 W251 Q252 L278	R216-L249 HydrophobicContact CG-CD1 4.16Å; Y217-L249 HydrophobicContact CD1-CD1 4.44Å; Y217-L249 HydrophobicContact CE1-CD1 4.43Å; M242-L249 HydrophobicContact CB-CD2 4.06Å; Y243-L249 HydrophobicContact CD2-CD1 4.4Å; Y243-L249 HydrophobicContact CD2-CG 4.31Å; L249-W251 HydrophobicContact CB-CD2 4.11Å; L249-W251 HydrophobicContact CB-CG 4.47Å; L249-W251 HydrophobicContact CB-CZ2 3.93Å; L249-W251 HydrophobicContact CD1-CZ2 3.71Å; L249-W251 HydrophobicContact CD2-CH2 4.12Å; L249-W251 HydrophobicContact CD2-CZ2 3.79Å; L249-W251 HydrophobicContact CG-CZ2 4.01Å; L249-W251 PolarHBondContact O-N 3.39Å; L249-Q252 HydrophobicContact CB-CG 4.44Å; L249-Q252 WeakPolarHBondContact O-CB 3.26Å; L249-Q252 PolarHBondContact O-N 2.92Å; L249-L278 HydrophobicContact CD2-CD1 4.03Å
250	P	98.3	Very high	96	Very high	59 Å²	59	54.6 Å²	54.6	38%	0.383	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.4	-175.7	-27.5	36.1	0	0	0	116	T273 L278	P250-T273 HydrophobicContact CG-CG2 4.35Å; P250-L278 HydrophobicContact CG-CD1 4.1Å
251	W	98.4	Very high	95.8	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.008	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	12	178.5	50.3	80.6	0	0	0	114.1	R216 H239 L249 L254 I266 T269 K270 L278	R216-W251 PolarHBondContact O-NE1 2.86Å; H239-W251 HydrophobicContact CB-CZ2 4.37Å; H239-W251 AromaticContact CD2-CH2 3.66Å; H239-W251 AromaticContact CD2-CZ2 3.69Å; H239-W251 AromaticContact NE2-CH2 3.99Å; L249-W251 HydrophobicContact CB-CD2 4.11Å; L249-W251 HydrophobicContact CB-CG 4.47Å; L249-W251 HydrophobicContact CB-CZ2 3.93Å; L249-W251 HydrophobicContact CD1-CZ2 3.71Å; L249-W251 HydrophobicContact CD2-CH2 4.12Å; L249-W251 HydrophobicContact CD2-CZ2 3.79Å; L249-W251 HydrophobicContact CG-CZ2 4.01Å; L249-W251 PolarHBondContact O-N 3.39Å; W251-L254 HydrophobicContact CB-CD1 4.11Å; W251-I266 HydrophobicContact CB-CG2 4.15Å; W251-I266 HydrophobicContact CG-CG2 4.12Å; W251-T269 HydrophobicContact CB-CG2 3.81Å; W251-T269 HydrophobicContact CE3-CG2 4.47Å; W251-K270 HydrophobicContact CD2-CD 4.36Å; W251-K270 HydrophobicContact CD2-CG 3.51Å; W251-K270 HydrophobicContact CE3-CB 4.46Å; W251-K270 HydrophobicContact CE3-CG 3.61Å; W251-K270 HydrophobicContact CG-CG 4.05Å; W251-K270 HydrophobicContact CH2-CG 4.01Å; W251-K270 HydrophobicContact CZ2-CD 4.34Å; W251-K270 VanDerWaalsContact CZ2-CE 3.45Å; W251-K270 HydrophobicContact CZ2-CG 3.93Å; W251-K270 HydrophobicContact CZ3-CG 3.87Å; W251-L278 HydrophobicContact CH2-CD1 4.13Å; W251-L278 HydrophobicContact CH2-CD2 3.82Å; W251-L278 HydrophobicContact CZ3-CD1 4.23Å; W251-L278 HydrophobicContact CZ3-CD2 4.32Å
252	Q	96.4	Very high	95.5	Very high	56 Å²	56	64.1 Å²	64.1	26%	0.262	34%	0.338	S	S	.	.	S	Bend	trans	-77.3	159	169.5	-75.8	178.6	-119.5	0	0	111.8	R216 L249 L254	R216-Q252 HydrophobicContact CG-CG 4.08Å; L249-Q252 HydrophobicContact CB-CG 4.44Å; L249-Q252 WeakPolarHBondContact O-CB 3.26Å; L249-Q252 PolarHBondContact O-N 2.92Å; Q252-L254 PolarHBondContact O-N 2.76Å
253	G	92.7	Very high	95.2	Very high	64 Å²	64	66.5 Å²	66.5	66%	0.66	35%	0.347	S	S	*	.	S	Bend	trans	72.1	-7.5	176.1	0	0	0	0	0	116.6	K255	G253-K255 PolarHBondContact O-N 2.81Å
254	L	93.2	Very high	95	Very high	46 Å²	46	71 Å²	71	24%	0.241	37%	0.368	C	S	.	.			trans	-57	127.3	-178.2	-60.5	-179.8	0	0	0	112.4	W251 Q252 R262 K265 I266	W251-L254 HydrophobicContact CB-CD1 4.11Å; Q252-L254 PolarHBondContact O-N 2.76Å; L254-R262 PolarHBondContact O-NE 3.08Å; L254-K265 HydrophobicContact CD1-CB 4.28Å; L254-I266 HydrophobicContact CD1-CG1 4.03Å
255	K	92.1	Very high	94.9	Very high	185 Å²	185	75.6 Å²	75.6	80%	0.804	39%	0.388	S	S	*	.			trans	-94.8	139.1	179.1	-61.9	-177.6	-179	179.4	0	111.3	G253 K265	G253-K255 PolarHBondContact O-N 2.81Å; K255-K265 PolarHBondContact O-NZ 3.32Å
256	A	93.3	Very high	94.9	Very high	29 Å²	29	75.4 Å²	75.4	24%	0.24	39%	0.387	C	S	.	.			trans	-156.6	159.7	170.4	0	0	0	0	0	109.2	E261 R262 K265	A256-E261 HydrophobicContact CB-CB 3.75Å; A256-R262 HydrophobicContact CB-CB 4Å; A256-K265 HydrophobicContact CB-CD 4.19Å
257	D	94.1	Very high	94.9	Very high	161 Å²	161	71.5 Å²	71.5	86%	0.861	37%	0.373	S	S	*	.	S	Bend	trans	-79.6	-32.2	-173.8	-53.7	-45.8	0	0	0	111.5
258	T	93.8	Very high	94.8	Very high	69 Å²	69	73 Å²	73	42%	0.423	38%	0.378	S	S	.	.	S	Bend	trans	-114.6	155.7	173.2	71.7	0	0	0	0	113.3	K260 E261 R262	T258-K260 VanDerWaalsContact C-N 3.26Å; T258-K260 PolarHBondContact O-N 3.25Å; T258-E261 WeakPolarHBondContact CB-OE2 3.14Å; T258-E261 WeakPolarHBondContact CG2-OE2 3.43Å; T258-E261 PolarHBondContact N-OE2 2.96Å; T258-E261 PolarHBondContact O-N 2.95Å; T258-E261 WeakPolarHBondContact OG1-CB 3.44Å; T258-E261 VanDerWaalsContact OG1-CG 3.23Å; T258-E261 WeakPolarHBondContact OG1-CG 3.07Å; T258-E261 PolarHBondContact OG1-N 3.2Å; T258-E261 PolarHBondContact OG1-OE2 3.35Å; T258-R262 PolarHBondContact O-N 3.09Å
259	L	88.3	Confident	94.9	Very high	121 Å²	121	71.8 Å²	71.8	63%	0.634	37%	0.369	S	S	*	.	H	α-helix	trans	-60.2	-37	173.5	-169.4	66.5	0	0	0	112	R262 Y263	L259-R262 WeakPolarHBondContact O-CB 3.28Å; L259-R262 PolarHBondContact O-N 3.47Å; L259-Y263 HydrophobicContact CD1-CD2 4.11Å; L259-Y263 HydrophobicContact CD1-CE2 3.7Å; L259-Y263 HydrophobicContact CD2-CE2 4.47Å; L259-Y263 HydrophobicContact CG-CD2 4.1Å; L259-Y263 HydrophobicContact CG-CE2 3.88Å; L259-Y263 VanDerWaalsContact O-CD2 3.25Å; L259-Y263 WeakPolarHBondContact O-CD2 3.44Å; L259-Y263 PolarHBondContact O-N 3.42Å
260	K	89.4	Confident	94.9	Very high	172 Å²	172	71.6 Å²	71.6	75%	0.748	37%	0.368	S	S	*	.	H	α-helix	trans	-62.8	-48.8	178.8	-175.1	-176.8	177	-173.3	0	111.3	T258 R262 Y263 Q264	T258-K260 VanDerWaalsContact C-N 3.26Å; T258-K260 PolarHBondContact O-N 3.25Å; K260-R262 VanDerWaalsContact C-N 3.3Å; K260-R262 PolarHBondContact O-N 2.86Å; K260-Y263 PolarHBondContact O-N 3.2Å; K260-Q264 PolarHBondContact O-N 3.19Å
261	E	93.6	Very high	94.8	Very high	85 Å²	85	74.7 Å²	74.7	40%	0.397	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-35.7	175.7	-68.4	157.2	152.8	0	0	111.8	A256 T258 Q264 K265	A256-E261 HydrophobicContact CB-CB 3.75Å; T258-E261 WeakPolarHBondContact CB-OE2 3.14Å; T258-E261 WeakPolarHBondContact CG2-OE2 3.43Å; T258-E261 PolarHBondContact N-OE2 2.96Å; T258-E261 PolarHBondContact O-N 2.95Å; T258-E261 WeakPolarHBondContact OG1-CB 3.44Å; T258-E261 VanDerWaalsContact OG1-CG 3.23Å; T258-E261 WeakPolarHBondContact OG1-CG 3.07Å; T258-E261 PolarHBondContact OG1-N 3.2Å; T258-E261 PolarHBondContact OG1-OE2 3.35Å; E261-Q264 PolarHBondContact O-N 2.72Å; E261-K265 WeakPolarHBondContact O-CB 3.26Å; E261-K265 WeakPolarHBondContact O-CG 3.37Å; E261-K265 PolarHBondContact O-N 3.07Å
262	R	93.6	Very high	94.8	Very high	116 Å²	116	80.6 Å²	80.6	44%	0.438	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-44.4	176	-164.6	179	-174	-160.4	-2.1	111.6	L254 A256 T258 L259 K260 I266	L254-R262 PolarHBondContact O-NE 3.08Å; A256-R262 HydrophobicContact CB-CB 4Å; T258-R262 PolarHBondContact O-N 3.09Å; L259-R262 WeakPolarHBondContact O-CB 3.28Å; L259-R262 PolarHBondContact O-N 3.47Å; K260-R262 VanDerWaalsContact C-N 3.3Å; K260-R262 PolarHBondContact O-N 2.86Å; R262-I266 HydrophobicContact CG-CD1 4.29Å; R262-I266 WeakPolarHBondContact O-CD1 3.12Å; R262-I266 VanDerWaalsContact O-CG1 3.26Å; R262-I266 WeakPolarHBondContact O-CG1 3.12Å; R262-I266 PolarHBondContact O-N 3.35Å; R262-I266 VanDerWaalsContact O-N 3.09Å
263	Y	92.6	Very high	94.9	Very high	51 Å²	51	78.8 Å²	78.8	20%	0.2	40%	0.396	C	S	.	.	H	α-helix	trans	-63.9	-46.2	174.6	-84.9	-122.4	0	0	0	110.6	L211 A215 M218 H223 L259 K260 K265 I266 G267	L211-Y263 HydrophobicContact CB-CD1 3.97Å; L211-Y263 HydrophobicContact CB-CE1 4.14Å; L211-Y263 HydrophobicContact CD1-CD1 3.8Å; L211-Y263 HydrophobicContact CD1-CG 4.14Å; L211-Y263 HydrophobicContact CD2-CD1 4.2Å; L211-Y263 HydrophobicContact CG-CD1 4.2Å; A215-Y263 HydrophobicContact CB-CD1 3.92Å; A215-Y263 HydrophobicContact CB-CD2 4.2Å; A215-Y263 HydrophobicContact CB-CE1 3.67Å; A215-Y263 HydrophobicContact CB-CE2 3.94Å; A215-Y263 HydrophobicContact CB-CG 4.22Å; M218-Y263 HydrophobicContact CE-CD1 4.4Å; M218-Y263 HydrophobicContact CE-CE1 3.89Å; M218-Y263 HydrophobicContact SD-CD1 4.42Å; M218-Y263 HydrophobicContact SD-CE1 4.47Å; H223-Y263 PolarHBondContact CE1-O 3.14Å; H223-Y263 VanDerWaalsContact CE1-O 3.27Å; H223-Y263 PolarHBondContact ND1-O 3.37Å; H223-Y263 VanDerWaalsContact ND1-O 3.17Å; L259-Y263 HydrophobicContact CD1-CD2 4.11Å; L259-Y263 HydrophobicContact CD1-CE2 3.7Å; L259-Y263 HydrophobicContact CD2-CE2 4.47Å; L259-Y263 HydrophobicContact CG-CD2 4.1Å; L259-Y263 HydrophobicContact CG-CE2 3.88Å; L259-Y263 VanDerWaalsContact O-CD2 3.25Å; L259-Y263 WeakPolarHBondContact O-CD2 3.44Å; L259-Y263 PolarHBondContact O-N 3.42Å; K260-Y263 PolarHBondContact O-N 3.2Å; Y263-K265 PolarHBondContact O-N 2.83Å; Y263-I266 PolarHBondContact O-N 2.9Å; Y263-I266 VanDerWaalsContact O-N 3.14Å; Y263-G267 PolarHBondContact O-N 2.92Å
264	Q	94.1	Very high	95.2	Very high	94 Å²	94	78.9 Å²	78.9	44%	0.439	39%	0.385	S	S	.	.	H	α-helix	trans	-55.1	-50.6	176.5	-172.6	62.1	57.1	0	0	111.9	K260 E261 I266 G267 D268	K260-Q264 PolarHBondContact O-N 3.19Å; E261-Q264 PolarHBondContact O-N 2.72Å; Q264-I266 VanDerWaalsContact C-N 3.33Å; Q264-I266 PolarHBondContact O-N 3.11Å; Q264-G267 PolarHBondContact O-N 2.74Å; Q264-G267 VanDerWaalsContact O-N 3.13Å; Q264-D268 PolarHBondContact NE2-OD1 3.27Å; Q264-D268 PolarHBondContact NE2-OD2 3.38Å; Q264-D268 WeakPolarHBondContact O-CB 3.25Å; Q264-D268 PolarHBondContact O-N 3.46Å
265	K	97.4	Very high	95.5	Very high	96 Å²	96	77.6 Å²	77.6	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-58.5	-41.5	176.8	-71.1	-175	-169.1	-176	0	112.3	L254 K255 A256 E261 Y263 D268 T269	L254-K265 HydrophobicContact CD1-CB 4.28Å; K255-K265 PolarHBondContact O-NZ 3.32Å; A256-K265 HydrophobicContact CB-CD 4.19Å; E261-K265 WeakPolarHBondContact O-CB 3.26Å; E261-K265 WeakPolarHBondContact O-CG 3.37Å; E261-K265 PolarHBondContact O-N 3.07Å; Y263-K265 PolarHBondContact O-N 2.83Å; K265-D268 PolarHBondContact O-N 3.15Å; K265-T269 PolarHBondContact O-N 2.71Å; K265-T269 PolarHBondContact O-OG1 2.69Å; K265-T269 VanDerWaalsContact O-OG1 3.08Å
266	I	98.1	Very high	95.7	Very high	13 Å²	13	73.9 Å²	73.9	7%	0.067	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175.6	-69.3	165.1	0	0	0	110.8	A215 W251 L254 R262 Y263 Q264 T269 K270	A215-I266 HydrophobicContact CB-CD1 3.96Å; A215-I266 WeakPolarHBondContact O-CG2 3.22Å; W251-I266 HydrophobicContact CB-CG2 4.15Å; W251-I266 HydrophobicContact CG-CG2 4.12Å; L254-I266 HydrophobicContact CD1-CG1 4.03Å; R262-I266 HydrophobicContact CG-CD1 4.29Å; R262-I266 WeakPolarHBondContact O-CD1 3.12Å; R262-I266 VanDerWaalsContact O-CG1 3.26Å; R262-I266 WeakPolarHBondContact O-CG1 3.12Å; R262-I266 PolarHBondContact O-N 3.35Å; R262-I266 VanDerWaalsContact O-N 3.09Å; Y263-I266 PolarHBondContact O-N 2.9Å; Y263-I266 VanDerWaalsContact O-N 3.14Å; Q264-I266 VanDerWaalsContact C-N 3.33Å; Q264-I266 PolarHBondContact O-N 3.11Å; I266-T269 PolarHBondContact O-N 2.79Å; I266-K270 HydrophobicContact CG2-CD 4.28Å; I266-K270 WeakPolarHBondContact O-CB 3.35Å; I266-K270 WeakPolarHBondContact O-CG 3.49Å; I266-K270 PolarHBondContact O-N 2.95Å
267	G	97.6	Very high	96	Very high	3 Å²	3	76.2 Å²	76.2	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-62.9	-39.7	176.3	0	0	0	0	0	113	H223 Y263 Q264 K270 R271	H223-G267 VanDerWaalsContact CG-CA 3.49Å; Y263-G267 PolarHBondContact O-N 2.92Å; Q264-G267 PolarHBondContact O-N 2.74Å; Q264-G267 VanDerWaalsContact O-N 3.13Å; G267-K270 PolarHBondContact O-N 2.93Å; G267-R271 WeakPolarHBondContact O-CG 3.26Å; G267-R271 PolarHBondContact O-N 3.21Å
268	D	98	Very high	96.2	Very high	44 Å²	44	68.6 Å²	68.6	24%	0.235	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-46.8	176.9	-64	-22.7	0	0	0	111.3	Q264 K265 K270 R271 N272	Q264-D268 PolarHBondContact NE2-OD1 3.27Å; Q264-D268 PolarHBondContact NE2-OD2 3.38Å; Q264-D268 WeakPolarHBondContact O-CB 3.25Å; Q264-D268 PolarHBondContact O-N 3.46Å; K265-D268 PolarHBondContact O-N 3.15Å; D268-K270 VanDerWaalsContact C-N 3.31Å; D268-K270 PolarHBondContact O-N 3Å; D268-R271 PolarHBondContact O-N 2.67Å; D268-R271 IonicContact OD1-CZ 3.17Å; D268-R271 IonicContact OD1-NE 2.67Å; D268-R271 IonicContact OD1-NH2 2.74Å; D268-R271 PolarHBondContact OD1-NH2 3.22Å; D268-N272 VanDerWaalsContact O-CB 3.31Å; D268-N272 WeakPolarHBondContact O-CB 3.4Å; D268-N272 PolarHBondContact O-N 2.66Å; D268-N272 PolarHBondContact O-ND2 2.79Å
269	T	98.4	Very high	96.4	Very high	38 Å²	38	65.6 Å²	65.6	23%	0.233	32%	0.316	C	S	.	.	H	α-helix	trans	-60.9	-39.3	173.4	-58.1	0	0	0	0	111.6	W251 K265 I266 R271 N272 T273	W251-T269 HydrophobicContact CB-CG2 3.81Å; W251-T269 HydrophobicContact CE3-CG2 4.47Å; K265-T269 PolarHBondContact O-N 2.71Å; K265-T269 PolarHBondContact O-OG1 2.69Å; K265-T269 VanDerWaalsContact O-OG1 3.08Å; I266-T269 PolarHBondContact O-N 2.79Å; T269-R271 PolarHBondContact O-N 2.62Å; T269-N272 PolarHBondContact O-N 3.37Å; T269-T273 WeakPolarHBondContact O-CB 3.33Å; T269-T273 PolarHBondContact O-N 3.35Å; T269-T273 PolarHBondContact O-OG1 3.07Å
270	K	98.6	Very high	96.9	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-40.6	174.9	-82.9	178.2	169.4	-178.2	0	113.4	A215 R216 M218 I220 W251 I266 G267 D268	A215-K270 PolarHBondContact O-NZ 2.96Å; R216-K270 WeakPolarHBondContact O-CE 3.06Å; R216-K270 PolarHBondContact O-NZ 2.78Å; M218-K270 PolarHBondContact O-NZ 2.99Å; I220-K270 HydrophobicContact CG1-CB 4.01Å; W251-K270 HydrophobicContact CD2-CD 4.36Å; W251-K270 HydrophobicContact CD2-CG 3.51Å; W251-K270 HydrophobicContact CE3-CB 4.46Å; W251-K270 HydrophobicContact CE3-CG 3.61Å; W251-K270 HydrophobicContact CG-CG 4.05Å; W251-K270 HydrophobicContact CH2-CG 4.01Å; W251-K270 HydrophobicContact CZ2-CD 4.34Å; W251-K270 VanDerWaalsContact CZ2-CE 3.45Å; W251-K270 HydrophobicContact CZ2-CG 3.93Å; W251-K270 HydrophobicContact CZ3-CG 3.87Å; I266-K270 HydrophobicContact CG2-CD 4.28Å; I266-K270 WeakPolarHBondContact O-CB 3.35Å; I266-K270 WeakPolarHBondContact O-CG 3.49Å; I266-K270 PolarHBondContact O-N 2.95Å; G267-K270 PolarHBondContact O-N 2.93Å; D268-K270 VanDerWaalsContact C-N 3.31Å; D268-K270 PolarHBondContact O-N 3Å
271	R	97.8	Very high	97.2	Very high	123 Å²	123	64.4 Å²	64.4	46%	0.464	32%	0.315	S	S	.	.	H	α-helix	trans	-70.9	-39.2	176.2	-71.4	-172	-61.9	151.5	-2.8	112.3	I220 G267 D268 T269	I220-R271 HydrophobicContact CD1-CG 4.2Å; I220-R271 HydrophobicContact CG1-CG 4.21Å; I220-R271 HydrophobicContact CG2-CG 3.58Å; G267-R271 WeakPolarHBondContact O-CG 3.26Å; G267-R271 PolarHBondContact O-N 3.21Å; D268-R271 PolarHBondContact O-N 2.67Å; D268-R271 IonicContact OD1-CZ 3.17Å; D268-R271 IonicContact OD1-NE 2.67Å; D268-R271 IonicContact OD1-NH2 2.74Å; D268-R271 PolarHBondContact OD1-NH2 3.22Å; T269-R271 PolarHBondContact O-N 2.62Å
272	N	98.1	Very high	97.5	Very high	127 Å²	127	63.4 Å²	63.4	68%	0.679	31%	0.309	S	S	*	.	H	α-helix	trans	-86.6	-3.5	-175.2	-63.3	-10.6	0	0	0	113.7	D268 T269 P274	D268-N272 VanDerWaalsContact O-CB 3.31Å; D268-N272 WeakPolarHBondContact O-CB 3.4Å; D268-N272 PolarHBondContact O-N 2.66Å; D268-N272 PolarHBondContact O-ND2 2.79Å; T269-N272 PolarHBondContact O-N 3.37Å; N272-P274 WeakPolarHBondContact O-CD 3.43Å
273	T	98.5	Very high	97.7	Very high	18 Å²	18	59 Å²	59	11%	0.11	30%	0.295	C	S	.	.	S	Bend	trans	-94.4	110.3	171.4	-54.4	0	0	0	0	108.7	P250 T269 V277 L278	P250-T273 HydrophobicContact CG-CG2 4.35Å; T269-T273 WeakPolarHBondContact O-CB 3.33Å; T269-T273 PolarHBondContact O-N 3.35Å; T269-T273 PolarHBondContact O-OG1 3.07Å; T273-V277 HydrophobicContact CG2-CG1 4.46Å; T273-L278 HydrophobicContact CG2-CB 4.14Å
274	P	98.4	Very high	98	Very high	65 Å²	65	61.5 Å²	61.5	42%	0.422	31%	0.309	S	S	.	.			trans	-57.4	150.6	172.4	-22.2	33.3	0	0	0	111.1	N272 E276 V277 L278	N272-P274 WeakPolarHBondContact O-CD 3.43Å; P274-E276 WeakPolarHBondContact CB-OE2 3.46Å; P274-E276 PolarHBondContact O-N 3.24Å; P274-V277 HydrophobicContact CB-CB 4.27Å; P274-V277 HydrophobicContact CB-CG2 3.97Å; P274-V277 HydrophobicContact CG-CB 4.41Å; P274-V277 HydrophobicContact CG-CG2 3.89Å; P274-V277 PolarHBondContact O-N 3.01Å; P274-L278 PolarHBondContact O-N 2.89Å
275	I	98.8	Very high	98.2	Very high	19 Å²	19	58 Å²	58	10%	0.097	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-36.9	-179.4	-64.7	166.6	0	0	0	109.4	V277 L278 C279 A287 L290 R291	I275-V277 VanDerWaalsContact C-N 3.3Å; I275-V277 PolarHBondContact O-N 3.03Å; I275-L278 PolarHBondContact O-N 3.49Å; I275-C279 WeakPolarHBondContact O-CB 3.36Å; I275-C279 PolarHBondContact O-N 3.05Å; I275-C279 PolarHBondContact O-SG 3.47Å; I275-A287 HydrophobicContact CG2-CB 3.9Å; I275-L290 HydrophobicContact CD1-CB 4.38Å; I275-L290 HydrophobicContact CG1-CB 4.45Å; I275-L290 HydrophobicContact CG2-CB 3.71Å; I275-L290 HydrophobicContact CG2-CD1 4.23Å; I275-R291 HydrophobicContact CD1-CB 4.4Å; I275-R291 HydrophobicContact CD1-CG 3.61Å; I275-R291 HydrophobicContact CG2-CG 4.28Å
276	E	98	Very high	98.3	Very high	107 Å²	107	53.7 Å²	53.7	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-37	178	-58.3	68.8	-151.2	0	0	111.1	P274 E280	P274-E276 WeakPolarHBondContact CB-OE2 3.46Å; P274-E276 PolarHBondContact O-N 3.24Å; E276-E280 WeakPolarHBondContact O-CA 3.28Å; E276-E280 PolarHBondContact O-N 3.33Å
277	V	98.4	Very high	98.3	Very high	78 Å²	78	53.1 Å²	53.1	47%	0.473	27%	0.271	S	S	.	.	H	α-helix	trans	-76.4	-37.8	174.7	174.8	0	0	0	0	111.4	T273 P274 I275 C279	T273-V277 HydrophobicContact CG2-CG1 4.46Å; P274-V277 HydrophobicContact CB-CB 4.27Å; P274-V277 HydrophobicContact CB-CG2 3.97Å; P274-V277 HydrophobicContact CG-CB 4.41Å; P274-V277 HydrophobicContact CG-CG2 3.89Å; P274-V277 PolarHBondContact O-N 3.01Å; I275-V277 VanDerWaalsContact C-N 3.3Å; I275-V277 PolarHBondContact O-N 3.03Å; V277-C279 VanDerWaalsContact C-N 3.34Å
278	L	98.6	Very high	98.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-39.4	175.7	-179.3	62.1	0	0	0	111.6	M242 R246 L249 P250 W251 T273 P274 I275 L290	M242-L278 HydrophobicContact CB-CD1 4.46Å; M242-L278 HydrophobicContact CB-CG 4.36Å; M242-L278 VanDerWaalsContact CE-O 3.3Å; M242-L278 WeakPolarHBondContact CE-O 3.21Å; M242-L278 HydrophobicContact CG-CD2 4.29Å; M242-L278 HydrophobicContact CG-CG 4.22Å; R246-L278 WeakPolarHBondContact CD-O 3.46Å; R246-L278 PolarHBondContact NH1-O 3.11Å; L249-L278 HydrophobicContact CD2-CD1 4.03Å; P250-L278 HydrophobicContact CG-CD1 4.1Å; W251-L278 HydrophobicContact CH2-CD1 4.13Å; W251-L278 HydrophobicContact CH2-CD2 3.82Å; W251-L278 HydrophobicContact CZ3-CD1 4.23Å; W251-L278 HydrophobicContact CZ3-CD2 4.32Å; T273-L278 HydrophobicContact CG2-CB 4.14Å; P274-L278 PolarHBondContact O-N 2.89Å; I275-L278 PolarHBondContact O-N 3.49Å; L278-L290 HydrophobicContact CD2-CD1 3.82Å
279	C	98.6	Very high	98.4	Very high	7 Å²	7	52.1 Å²	52.1	5%	0.047	27%	0.266	C	S	.	.	S	Bend	trans	-94.4	4.7	-177.9	-63.3	0	0	0	0	114.1	M242 I275 V277 N281 F282 M286 A287	M242-C279 HydrophobicContact CE-CB 4.41Å; M242-C279 VanDerWaalsContact SD-SG 3.62Å; I275-C279 WeakPolarHBondContact O-CB 3.36Å; I275-C279 PolarHBondContact O-N 3.05Å; I275-C279 PolarHBondContact O-SG 3.47Å; V277-C279 VanDerWaalsContact C-N 3.34Å; C279-N281 PolarHBondContact O-N 2.85Å; C279-F282 WeakPolarHBondContact O-CB 3.16Å; C279-F282 PolarHBondContact O-N 3.23Å; C279-M286 HydrophobicContact CB-CB 4.46Å; C279-A287 HydrophobicContact CB-CB 3.89Å
280	E	97.7	Very high	98.4	Very high	117 Å²	117	50.3 Å²	50.3	55%	0.547	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	133.9	178	-166.2	-170.2	-138.5	0	0	111.6	E276 F282	E276-E280 WeakPolarHBondContact O-CA 3.28Å; E276-E280 PolarHBondContact O-N 3.33Å; E280-F282 WeakPolarHBondContact O-CD2 3.49Å; E280-F282 WeakPolarHBondContact O-CE2 3.36Å; E280-F282 PolarHBondContact O-N 3.08Å
281	N	97.2	Very high	98.4	Very high	150 Å²	150	54 Å²	54	80%	0.802	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	6.4	-173.8	-51.7	-67.9	0	0	0	116.1	C279	C279-N281 PolarHBondContact O-N 2.85Å
282	F	98.4	Very high	98.5	Very high	64 Å²	64	50.7 Å²	50.7	28%	0.281	26%	0.257	S	S	.	.	S	Bend	trans	-110.2	166.5	171.2	-58	-79.8	0	0	0	111	M242 L245 R246 C279 E280	M242-F282 HydrophobicContact CE-CB 4.42Å; M242-F282 HydrophobicContact CE-CD2 3.69Å; M242-F282 HydrophobicContact CE-CE2 4.23Å; M242-F282 HydrophobicContact CE-CG 4.07Å; L245-F282 HydrophobicContact CB-CD1 3.86Å; L245-F282 HydrophobicContact CB-CE1 3.64Å; L245-F282 HydrophobicContact CB-CZ 4.2Å; L245-F282 HydrophobicContact CD1-CD1 4.1Å; L245-F282 HydrophobicContact CD1-CG 4.46Å; L245-F282 HydrophobicContact CD2-CD1 4.34Å; L245-F282 HydrophobicContact CG-CD1 4.32Å; L245-F282 WeakPolarHBondContact O-CE1 3.17Å; R246-F282 HydrophobicContact CG-CD2 4.39Å; R246-F282 HydrophobicContact CG-CE2 3.5Å; R246-F282 HydrophobicContact CG-CZ 3.68Å; C279-F282 WeakPolarHBondContact O-CB 3.16Å; C279-F282 PolarHBondContact O-N 3.23Å; E280-F282 WeakPolarHBondContact O-CD2 3.49Å; E280-F282 WeakPolarHBondContact O-CE2 3.36Å; E280-F282 PolarHBondContact O-N 3.08Å
283	P	98.5	Very high	98.5	Very high	23 Å²	23	44.7 Å²	44.7	15%	0.149	23%	0.225	C	C	.	.			trans	-61.6	143.2	179.1	-23.4	35.1	0	0	0	113.1	L138 E285 M286 L314	L138-P283 HydrophobicContact CD1-CG 3.9Å; L138-P283 HydrophobicContact CD2-CG 3.59Å; L138-P283 HydrophobicContact CG-CG 4.42Å; P283-E285 WeakPolarHBondContact CB-OE2 3.11Å; P283-E285 PolarHBondContact O-N 3.26Å; P283-E285 VanDerWaalsContact O-N 3.08Å; P283-M286 WeakPolarHBondContact O-CB 3.36Å; P283-M286 PolarHBondContact O-N 3.04Å; P283-L314 HydrophobicContact CB-CD1 3.9Å; P283-L314 HydrophobicContact CB-CD2 3.55Å; P283-L314 HydrophobicContact CB-CG 4.39Å; P283-L314 HydrophobicContact CG-CD1 4.22Å; P283-L314 HydrophobicContact CG-CD2 3.89Å
284	E	98.4	Very high	98.5	Very high	104 Å²	104	46.4 Å²	46.4	49%	0.486	23%	0.229	S	C	.	.	H	α-helix	trans	-60.7	-21	-176.5	180	51.3	-142.8	0	0	113.3	M286 A287 T288 R291	E284-M286 PolarHBondContact O-N 3.44Å; E284-A287 PolarHBondContact O-N 3.01Å; E284-A287 VanDerWaalsContact O-N 3.17Å; E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.49Å; E284-T288 PolarHBondContact O-OG1 2.73Å; E284-R291 IonicContact OE1-CZ 3.62Å; E284-R291 IonicContact OE1-NE 3.82Å; E284-R291 IonicContact OE1-NH2 2.65Å; E284-R291 PolarHBondContact OE1-NH2 3.47Å
285	E	98.8	Very high	98.5	Very high	22 Å²	22	52.9 Å²	52.9	10%	0.103	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-29.4	174.1	-63.4	80.9	178.6	0	0	112.1	P283 T288 Y289 F311 L314 R317	P283-E285 WeakPolarHBondContact CB-OE2 3.11Å; P283-E285 PolarHBondContact O-N 3.26Å; P283-E285 VanDerWaalsContact O-N 3.08Å; E285-T288 PolarHBondContact O-N 3.05Å; E285-Y289 VanDerWaalsContact O-CB 3.3Å; E285-Y289 WeakPolarHBondContact O-CB 3.28Å; E285-Y289 PolarHBondContact O-N 2.73Å; E285-F311 HydrophobicContact CB-CD1 4.38Å; E285-F311 HydrophobicContact CB-CE1 4.37Å; E285-L314 HydrophobicContact CB-CD2 3.99Å; E285-L314 HydrophobicContact CG-CB 4.07Å; E285-L314 HydrophobicContact CG-CD2 4.17Å; E285-R317 IonicContact OE1-CZ 2.71Å; E285-R317 IonicContact OE1-NH1 2.87Å; E285-R317 PolarHBondContact OE1-NH1 3.44Å; E285-R317 IonicContact OE1-NH2 2.69Å; E285-R317 PolarHBondContact OE1-NH2 2.83Å
286	M	98.8	Very high	98.5	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-43.2	173.9	-63	-67.5	160.8	0	0	111.4	L138 L142 M242 L245 C279 P283 E284 L290 F311	L138-M286 HydrophobicContact CD1-CE 3.97Å; L142-M286 HydrophobicContact CD2-CE 3.71Å; M242-M286 HydrophobicContact SD-CB 3.73Å; M242-M286 HydrophobicContact SD-CG 4.08Å; M242-M286 HydrophobicContact SD-SD 4.34Å; L245-M286 HydrophobicContact CD1-CE 3.88Å; L245-M286 HydrophobicContact CD1-CG 4.01Å; L245-M286 HydrophobicContact CD1-SD 3.78Å; C279-M286 HydrophobicContact CB-CB 4.46Å; P283-M286 WeakPolarHBondContact O-CB 3.36Å; P283-M286 PolarHBondContact O-N 3.04Å; E284-M286 PolarHBondContact O-N 3.44Å; M286-L290 PolarHBondContact O-N 3.2Å; M286-L290 VanDerWaalsContact O-N 3.16Å; M286-F311 HydrophobicContact CE-CD1 4.2Å; M286-F311 HydrophobicContact CE-CE1 3.74Å; M286-F311 HydrophobicContact CE-CZ 4.35Å; M286-F311 HydrophobicContact SD-CE1 3.79Å; M286-F311 HydrophobicContact SD-CZ 4.05Å
287	A	98.8	Very high	98.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-67.9	-40.7	174.9	0	0	0	0	0	111	I275 C279 E284 L290 R291	I275-A287 HydrophobicContact CG2-CB 3.9Å; C279-A287 HydrophobicContact CB-CB 3.89Å; E284-A287 PolarHBondContact O-N 3.01Å; E284-A287 VanDerWaalsContact O-N 3.17Å; A287-L290 PolarHBondContact O-N 3.36Å; A287-R291 WeakPolarHBondContact O-CB 3.48Å; A287-R291 VanDerWaalsContact O-CG 3.29Å; A287-R291 WeakPolarHBondContact O-CG 3.5Å; A287-R291 PolarHBondContact O-N 3.29Å
288	T	98.9	Very high	98.6	Very high	24 Å²	24	49.2 Å²	49.2	15%	0.147	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-46	176.9	-59.7	0	0	0	0	111.7	E284 E285 L290 R291 Y292 Y306 L310	E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.49Å; E284-T288 PolarHBondContact O-OG1 2.73Å; E285-T288 PolarHBondContact O-N 3.05Å; T288-L290 PolarHBondContact O-N 3.18Å; T288-R291 PolarHBondContact O-N 2.79Å; T288-R291 PolarHBondContact OG1-NH2 3.03Å; T288-Y292 WeakPolarHBondContact O-CB 3.31Å; T288-Y292 PolarHBondContact O-N 3.34Å; T288-Y306 WeakPolarHBondContact CG2-OH 3.26Å; T288-L310 HydrophobicContact CG2-CD1 3.96Å; T288-L310 HydrophobicContact CG2-CD2 4Å
289	Y	98.9	Very high	98.6	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-54.6	-52.6	172.7	-179.9	-79.2	0	0	0	111.1	I149 L234 F241 E285 R291 Y292 V293 L307 F311	I149-Y289 HydrophobicContact CD1-CE2 3.87Å; I149-Y289 HydrophobicContact CG1-CE2 4.24Å; L234-Y289 WeakPolarHBondContact O-CE1 3.25Å; L234-Y289 PolarHBondContact O-OH 3.16Å; F241-Y289 HydrophobicContact CD2-CE1 4.5Å; F241-Y289 HydrophobicContact CE2-CE1 4.29Å; F241-Y289 HydrophobicContact CE2-CE2 4.17Å; F241-Y289 AromaticContact CE2-CZ 3.9Å; E285-Y289 VanDerWaalsContact O-CB 3.3Å; E285-Y289 WeakPolarHBondContact O-CB 3.28Å; E285-Y289 PolarHBondContact O-N 2.73Å; Y289-R291 PolarHBondContact O-N 3.12Å; Y289-Y292 PolarHBondContact O-N 2.99Å; Y289-V293 HydrophobicContact CD1-CG1 4.29Å; Y289-V293 HydrophobicContact CD1-CG2 4.34Å; Y289-V293 HydrophobicContact CE1-CG1 3.9Å; Y289-V293 HydrophobicContact CE1-CG2 4.15Å; Y289-V293 WeakPolarHBondContact O-CG2 3.43Å; Y289-V293 PolarHBondContact O-N 3.05Å; Y289-L307 HydrophobicContact CD2-CB 4.31Å; Y289-L307 HydrophobicContact CD2-CD2 3.62Å; Y289-L307 HydrophobicContact CD2-CG 4.42Å; Y289-L307 HydrophobicContact CE2-CB 4.1Å; Y289-L307 HydrophobicContact CE2-CD1 4.17Å; Y289-L307 HydrophobicContact CE2-CD2 3.9Å; Y289-L307 HydrophobicContact CE2-CG 4.28Å; Y289-L307 HydrophobicContact CG-CD2 4.29Å; Y289-F311 AromaticContact CD2-CE2 3.49Å; Y289-F311 HydrophobicContact CD2-CE2 3.49Å; Y289-F311 VanDerWaalsContact CD2-CE2 3.49Å; Y289-F311 AromaticContact CD2-CZ 3.51Å; Y289-F311 HydrophobicContact CD2-CZ 3.51Å; Y289-F311 AromaticContact CE2-CE2 3.86Å; Y289-F311 HydrophobicContact CE2-CE2 3.86Å; Y289-F311 HydrophobicContact CE2-CZ 4.28Å; Y289-F311 HydrophobicContact CG-CE2 4.2Å; Y289-F311 AromaticContact CG-CZ 3.77Å; Y289-F311 HydrophobicContact CG-CZ 3.77Å
290	L	98.9	Very high	98.6	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-37	-179.4	-79.6	173.8	0	0	0	112.9	M242 I275 L278 M286 A287 T288 V293 R294	M242-L290 HydrophobicContact CG-CD1 4Å; I275-L290 HydrophobicContact CD1-CB 4.38Å; I275-L290 HydrophobicContact CG1-CB 4.45Å; I275-L290 HydrophobicContact CG2-CB 3.71Å; I275-L290 HydrophobicContact CG2-CD1 4.23Å; L278-L290 HydrophobicContact CD2-CD1 3.82Å; M286-L290 PolarHBondContact O-N 3.2Å; M286-L290 VanDerWaalsContact O-N 3.16Å; A287-L290 PolarHBondContact O-N 3.36Å; T288-L290 PolarHBondContact O-N 3.18Å; L290-V293 HydrophobicContact CD2-CG2 4.45Å; L290-R294 VanDerWaalsContact O-CB 3.3Å; L290-R294 WeakPolarHBondContact O-CB 3.34Å; L290-R294 WeakPolarHBondContact O-CG 3.36Å; L290-R294 PolarHBondContact O-N 2.93Å
291	R	98.8	Very high	98.7	Very high	77 Å²	77	59.2 Å²	59.2	29%	0.291	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-38.3	174.4	-77.5	-173.1	-68.4	109.4	-6.5	111.5	I275 E284 A287 T288 Y289 R295	I275-R291 HydrophobicContact CD1-CB 4.4Å; I275-R291 HydrophobicContact CD1-CG 3.61Å; I275-R291 HydrophobicContact CG2-CG 4.28Å; E284-R291 IonicContact OE1-CZ 3.62Å; E284-R291 IonicContact OE1-NE 3.82Å; E284-R291 IonicContact OE1-NH2 2.65Å; E284-R291 PolarHBondContact OE1-NH2 3.47Å; A287-R291 WeakPolarHBondContact O-CB 3.48Å; A287-R291 VanDerWaalsContact O-CG 3.29Å; A287-R291 WeakPolarHBondContact O-CG 3.5Å; A287-R291 PolarHBondContact O-N 3.29Å; T288-R291 PolarHBondContact O-N 2.79Å; T288-R291 PolarHBondContact OG1-NH2 3.03Å; Y289-R291 PolarHBondContact O-N 3.12Å; R291-R295 WeakPolarHBondContact O-CD 3.39Å; R291-R295 WeakPolarHBondContact O-CG 3.27Å
292	Y	98.9	Very high	98.7	Very high	53 Å²	53	52.2 Å²	52.2	21%	0.208	23%	0.231	C	C	.	.	H	α-helix	trans	-66.4	-58.7	175.3	179.4	-87.5	0	0	0	111.2	T288 Y289 R294 R295 L296 D303 Y306 L307	T288-Y292 WeakPolarHBondContact O-CB 3.31Å; T288-Y292 PolarHBondContact O-N 3.34Å; Y289-Y292 PolarHBondContact O-N 2.99Å; Y292-R294 VanDerWaalsContact C-N 3.29Å; Y292-R294 PolarHBondContact O-N 2.87Å; Y292-R295 PolarHBondContact O-N 3.33Å; Y292-L296 HydrophobicContact CD1-CD1 4.35Å; Y292-L296 HydrophobicContact CD1-CD2 4.45Å; Y292-L296 HydrophobicContact CD1-CG 4.3Å; Y292-L296 HydrophobicContact CE1-CD1 3.98Å; Y292-L296 HydrophobicContact CE1-CD2 3.71Å; Y292-L296 HydrophobicContact CE1-CG 3.98Å; Y292-L296 PolarHBondContact O-N 2.91Å; Y292-D303 VanDerWaalsContact OH-CB 3.31Å; Y292-D303 WeakPolarHBondContact OH-CB 3.44Å; Y292-D303 PolarHBondContact OH-N 3.02Å; Y292-Y306 AromaticContact CD2-CD1 3.91Å; Y292-Y306 HydrophobicContact CD2-CD1 3.91Å; Y292-Y306 AromaticContact CD2-CE1 3.57Å; Y292-Y306 HydrophobicContact CD2-CE1 3.57Å; Y292-Y306 AromaticContact CE2-CD1 3.9Å; Y292-Y306 HydrophobicContact CE2-CD1 3.9Å; Y292-Y306 HydrophobicContact CE2-CE1 4.02Å; Y292-Y306 HydrophobicContact CG-CD1 4.36Å; Y292-Y306 AromaticContact CG-CE1 3.99Å; Y292-Y306 HydrophobicContact CG-CE1 3.99Å; Y292-L307 HydrophobicContact CD1-CD1 4.07Å; Y292-L307 HydrophobicContact CD1-CD2 3.61Å; Y292-L307 HydrophobicContact CD1-CG 4.1Å; Y292-L307 HydrophobicContact CE1-CD1 3.96Å; Y292-L307 HydrophobicContact CE1-CD2 4.14Å; Y292-L307 HydrophobicContact CE1-CG 4.13Å; Y292-L307 HydrophobicContact CG-CD2 4.09Å
293	V	98.9	Very high	98.8	Very high	1 Å²	1	53 Å²	53	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-29.6	-171.2	-57.8	0	0	0	0	113.4	L234 E235 Y289 L290 R295 L296 L307	L234-V293 HydrophobicContact CB-CB 4.14Å; L234-V293 HydrophobicContact CB-CG1 3.71Å; L234-V293 HydrophobicContact CD1-CG1 4.42Å; E235-V293 HydrophobicContact CB-CG2 4.01Å; E235-V293 HydrophobicContact CG-CG2 4.33Å; Y289-V293 HydrophobicContact CD1-CG1 4.29Å; Y289-V293 HydrophobicContact CD1-CG2 4.34Å; Y289-V293 HydrophobicContact CE1-CG1 3.9Å; Y289-V293 HydrophobicContact CE1-CG2 4.15Å; Y289-V293 WeakPolarHBondContact O-CG2 3.43Å; Y289-V293 PolarHBondContact O-N 3.05Å; L290-V293 HydrophobicContact CD2-CG2 4.45Å; V293-R295 VanDerWaalsContact C-N 3.32Å; V293-L296 HydrophobicContact CB-CD1 4.41Å; V293-L307 HydrophobicContact CG1-CD1 4.04Å; V293-L307 HydrophobicContact CG1-CD2 4.35Å
294	R	98.6	Very high	98.8	Very high	54 Å²	54	52.2 Å²	52.2	20%	0.204	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.8	173.7	-75.3	176.2	170.1	-168.9	3.9	113.9	E235 H239 L290 Y292	E235-R294 HydrophobicContact CG-CG 3.87Å; E235-R294 IonicContact OE1-NE 3.59Å; H239-R294 PolarHBondContact NE2-NH2 2.87Å; L290-R294 VanDerWaalsContact O-CB 3.3Å; L290-R294 WeakPolarHBondContact O-CB 3.34Å; L290-R294 WeakPolarHBondContact O-CG 3.36Å; L290-R294 PolarHBondContact O-N 2.93Å; Y292-R294 VanDerWaalsContact C-N 3.29Å; Y292-R294 PolarHBondContact O-N 2.87Å
295	R	98.6	Very high	98.8	Very high	202 Å²	202	52.2 Å²	52.2	76%	0.762	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.8	177.7	-75.2	177.4	-177.8	-157.8	0.7	113.6	R291 Y292 V293 D297	R291-R295 WeakPolarHBondContact O-CD 3.39Å; R291-R295 WeakPolarHBondContact O-CG 3.27Å; Y292-R295 PolarHBondContact O-N 3.33Å; V293-R295 VanDerWaalsContact C-N 3.32Å; R295-D297 PolarHBondContact O-N 2.85Å
296	L	98.8	Very high	98.8	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	24%	0.244	C	C	.	.			trans	-52.7	134	178.4	-73.4	172.6	0	0	0	112	R231 L234 Y292 V293 E300 P302	R231-L296 HydrophobicContact CB-CB 3.69Å; R231-L296 HydrophobicContact CB-CD1 3.79Å; R231-L296 HydrophobicContact CB-CG 4.42Å; R231-L296 WeakPolarHBondContact CD-O 3.41Å; R231-L296 PolarHBondContact NH1-O 2.93Å; L234-L296 HydrophobicContact CD1-CD1 4.41Å; Y292-L296 HydrophobicContact CD1-CD1 4.35Å; Y292-L296 HydrophobicContact CD1-CD2 4.45Å; Y292-L296 HydrophobicContact CD1-CG 4.3Å; Y292-L296 HydrophobicContact CE1-CD1 3.98Å; Y292-L296 HydrophobicContact CE1-CD2 3.71Å; Y292-L296 HydrophobicContact CE1-CG 3.98Å; Y292-L296 PolarHBondContact O-N 2.91Å; V293-L296 HydrophobicContact CB-CD1 4.41Å; L296-E300 VanDerWaalsContact CA-OE2 3.29Å; L296-E300 WeakPolarHBondContact CA-OE2 3.4Å; L296-E300 HydrophobicContact CD2-CB 4.35Å; L296-E300 VanDerWaalsContact CD2-CD 3.4Å; L296-E300 HydrophobicContact CD2-CG 3.97Å; L296-E300 WeakPolarHBondContact CD2-OE2 3.45Å; L296-P302 HydrophobicContact CD1-CB 4.04Å; L296-P302 HydrophobicContact CD1-CG 3.98Å
297	D	98.8	Very high	98.8	Very high	116 Å²	116	55.1 Å²	55.1	62%	0.62	24%	0.243	S	C	*	.			trans	-70.8	156.8	173.6	-105	-40.8	0	0	0	112	R295 F299 E300	R295-D297 PolarHBondContact O-N 2.85Å; D297-F299 PolarHBondContact O-N 2.82Å; D297-E300 HydrophobicContact CB-CB 4Å; D297-E300 PolarHBondContact N-OE2 2.87Å; D297-E300 WeakPolarHBondContact O-CB 3.3Å; D297-E300 PolarHBondContact O-N 2.81Å
298	F	98.8	Very high	98.8	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.026	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-35.5	-173.9	172.8	-105.1	0	0	0	112.9	H202 I203 Y205 E227 S229	H202-F298 AromaticContact CE1-CE1 3.61Å; H202-F298 AromaticContact CE1-CZ 3.79Å; H202-F298 AromaticContact ND1-CE1 3.81Å; H202-F298 PolarHBondContact NE2-O 2.9Å; I203-F298 HydrophobicContact CD1-CZ 4.48Å; I203-F298 HydrophobicContact CG1-CZ 4.26Å; I203-F298 WeakPolarHBondContact O-CE1 3.37Å; Y205-F298 VanDerWaalsContact CA-CE1 3.49Å; Y205-F298 HydrophobicContact CD2-CB 4.15Å; Y205-F298 AromaticContact CD2-CD1 3.89Å; Y205-F298 HydrophobicContact CD2-CD1 3.89Å; Y205-F298 AromaticContact CD2-CD2 3.94Å; Y205-F298 HydrophobicContact CD2-CD2 3.94Å; Y205-F298 HydrophobicContact CD2-CE1 4.27Å; Y205-F298 HydrophobicContact CD2-CE2 4.3Å; Y205-F298 AromaticContact CD2-CG 3.71Å; Y205-F298 HydrophobicContact CD2-CG 3.71Å; Y205-F298 HydrophobicContact CD2-CZ 4.46Å; Y205-F298 HydrophobicContact CE2-CG 4.5Å; Y205-F298 HydrophobicContact CG-CD1 4.37Å; E227-F298 HydrophobicContact CB-CE2 4.22Å; E227-F298 HydrophobicContact CB-CZ 4.27Å; E227-F298 HydrophobicContact CG-CE2 4.48Å; E227-F298 HydrophobicContact CG-CZ 4.28Å; E227-F298 WeakPolarHBondContact O-CE2 3.28Å; S229-F298 WeakPolarHBondContact CB-O 3.48Å; S229-F298 PolarHBondContact OG-O 3.26Å
299	F	98.6	Very high	98.8	Very high	114 Å²	114	57.4 Å²	57.4	50%	0.5	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.7	-179.9	-55.4	-75.8	0	0	0	113.3	H202 R230 D297	H202-F299 HydrophobicContact CB-CD1 3.99Å; H202-F299 AromaticContact CG-CD1 3.74Å; H202-F299 AromaticContact ND1-CD1 3.51Å; H202-F299 AromaticContact ND1-CE1 3.95Å; R230-F299 PolarHBondContact NH2-O 3.1Å; D297-F299 PolarHBondContact O-N 2.82Å
300	E	98.7	Very high	98.8	Very high	81 Å²	81	58.2 Å²	58.2	38%	0.379	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-66.4	146	-170.3	-164.3	172.2	171.5	0	0	111.5	R230 L296 D297 P302	R230-E300 VanDerWaalsContact CZ-O 3.28Å; R230-E300 PolarHBondContact NE-O 3.39Å; R230-E300 VanDerWaalsContact NE-O 3.07Å; R230-E300 PolarHBondContact NH2-O 2.87Å; L296-E300 VanDerWaalsContact CA-OE2 3.29Å; L296-E300 WeakPolarHBondContact CA-OE2 3.4Å; L296-E300 HydrophobicContact CD2-CB 4.35Å; L296-E300 VanDerWaalsContact CD2-CD 3.4Å; L296-E300 HydrophobicContact CD2-CG 3.97Å; L296-E300 WeakPolarHBondContact CD2-OE2 3.45Å; D297-E300 HydrophobicContact CB-CB 4Å; D297-E300 PolarHBondContact N-OE2 2.87Å; D297-E300 WeakPolarHBondContact O-CB 3.3Å; D297-E300 PolarHBondContact O-N 2.81Å; E300-P302 WeakPolarHBondContact O-CD 3.22Å
301	K	98.8	Very high	98.8	Very high	140 Å²	140	58.1 Å²	58.1	61%	0.609	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-89.8	116.2	168.3	-174.3	-164.7	172.6	-165.5	0	106.8	Y304	K301-Y304 HydrophobicContact CG-CE2 4.42Å
302	P	98.8	Very high	98.8	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.013	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-57.7	145.3	174.6	-19.2	29.4	0	0	0	111.7	R230 L234 L296 E300 Y304	R230-P302 HydrophobicContact CB-CG 3.95Å; L234-P302 HydrophobicContact CD1-CB 3.41Å; L234-P302 VanDerWaalsContact CD1-CB 3.41Å; L234-P302 HydrophobicContact CD1-CG 3.47Å; L234-P302 VanDerWaalsContact CD1-CG 3.47Å; L296-P302 HydrophobicContact CD1-CB 4.04Å; L296-P302 HydrophobicContact CD1-CG 3.98Å; E300-P302 WeakPolarHBondContact O-CD 3.22Å; P302-Y304 HydrophobicContact CB-CD1 4.28Å; P302-Y304 HydrophobicContact CB-CD2 4.43Å; P302-Y304 HydrophobicContact CB-CE1 3.97Å; P302-Y304 HydrophobicContact CB-CE2 4.09Å; P302-Y304 WeakPolarHBondContact CD-OH 3.4Å; P302-Y304 HydrophobicContact CG-CE1 4.04Å; P302-Y304 HydrophobicContact CG-CE2 4.3Å; P302-Y304 WeakPolarHBondContact O-CD2 3.22Å; P302-Y304 VanDerWaalsContact O-CE2 3.26Å; P302-Y304 WeakPolarHBondContact O-CE2 3.42Å; P302-Y304 PolarHBondContact O-N 3.5Å
303	D	98.9	Very high	98.8	Very high	81 Å²	81	59.1 Å²	59.1	43%	0.433	27%	0.27	S	S	.	.			trans	-82.8	86	164.3	-166.9	-23.3	0	0	0	108.8	Y292 E305 Y306 L307	Y292-D303 VanDerWaalsContact OH-CB 3.31Å; Y292-D303 WeakPolarHBondContact OH-CB 3.44Å; Y292-D303 PolarHBondContact OH-N 3.02Å; D303-E305 PolarHBondContact O-N 2.78Å; D303-E305 PolarHBondContact OD1-N 3.04Å; D303-Y306 VanDerWaalsContact CG-CB 3.47Å; D303-Y306 PolarHBondContact OD1-N 3.39Å; D303-L307 WeakPolarHBondContact O-CG 3.19Å; D303-L307 PolarHBondContact O-N 3.13Å
304	Y	98.9	Very high	98.8	Very high	7 Å²	7	59.1 Å²	59.1	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-26.1	178.8	-53.6	-86.9	0	0	0	112.4	I149 E153 H156 R230 L234 K301 P302 R308	I149-Y304 HydrophobicContact CG2-CD1 4.37Å; E153-Y304 HydrophobicContact CB-CD1 3.63Å; E153-Y304 HydrophobicContact CB-CD2 4.05Å; E153-Y304 HydrophobicContact CB-CE1 4.01Å; E153-Y304 HydrophobicContact CB-CE2 4.42Å; E153-Y304 HydrophobicContact CB-CG 3.65Å; E153-Y304 HydrophobicContact CG-CD1 4.16Å; E153-Y304 HydrophobicContact CG-CD2 3.61Å; E153-Y304 HydrophobicContact CG-CE1 4.47Å; E153-Y304 HydrophobicContact CG-CE2 4Å; E153-Y304 HydrophobicContact CG-CG 3.71Å; E153-Y304 WeakPolarHBondContact OE1-CD2 3.18Å; E153-Y304 WeakPolarHBondContact OE2-CB 3.44Å; H156-Y304 VanDerWaalsContact CB-OH 3.24Å; H156-Y304 WeakPolarHBondContact CB-OH 3.37Å; H156-Y304 VanDerWaalsContact CG-OH 3.3Å; H156-Y304 AromaticContact ND1-CE1 3.47Å; H156-Y304 WeakPolarHBondContact ND1-CE1 3.47Å; H156-Y304 AromaticContact ND1-CZ 3.48Å; H156-Y304 PolarHBondContact ND1-OH 3.42Å; R230-Y304 WeakPolarHBondContact CD-OH 2.99Å; L234-Y304 HydrophobicContact CD1-CD1 4.36Å; L234-Y304 HydrophobicContact CD1-CE1 4.05Å; L234-Y304 HydrophobicContact CD2-CD1 4.42Å; L234-Y304 HydrophobicContact CD2-CE1 4.29Å; K301-Y304 HydrophobicContact CG-CE2 4.42Å; P302-Y304 HydrophobicContact CB-CD1 4.28Å; P302-Y304 HydrophobicContact CB-CD2 4.43Å; P302-Y304 HydrophobicContact CB-CE1 3.97Å; P302-Y304 HydrophobicContact CB-CE2 4.09Å; P302-Y304 WeakPolarHBondContact CD-OH 3.4Å; P302-Y304 HydrophobicContact CG-CE1 4.04Å; P302-Y304 HydrophobicContact CG-CE2 4.3Å; P302-Y304 WeakPolarHBondContact O-CD2 3.22Å; P302-Y304 VanDerWaalsContact O-CE2 3.26Å; P302-Y304 WeakPolarHBondContact O-CE2 3.42Å; P302-Y304 PolarHBondContact O-N 3.5Å; Y304-R308 WeakPolarHBondContact O-CG 3.38Å; Y304-R308 PolarHBondContact O-N 3.48Å; Y304-R308 VanDerWaalsContact O-N 3.1Å
305	E	98.8	Very high	98.8	Very high	104 Å²	104	57 Å²	57	49%	0.486	26%	0.262	S	S	.	.	H	α-helix	trans	-73.4	-51	179.3	-169.7	57	-154.5	0	0	109.9	D303 L307 R308 T309	D303-E305 PolarHBondContact O-N 2.78Å; D303-E305 PolarHBondContact OD1-N 3.04Å; E305-L307 PolarHBondContact O-N 2.92Å; E305-R308 CarbonylContact O-C 3.57Å; E305-R308 WeakPolarHBondContact O-CA 3.33Å; E305-R308 WeakPolarHBondContact O-CB 3.09Å; E305-R308 PolarHBondContact O-N 3.02Å; E305-R308 IonicContact OE2-CZ 3.63Å; E305-R308 IonicContact OE2-NE 3.8Å; E305-R308 PolarHBondContact OE2-NE 2.81Å; E305-R308 IonicContact OE2-NH2 2.67Å; E305-R308 PolarHBondContact OE2-NH2 2.89Å; E305-T309 PolarHBondContact O-N 3Å; E305-T309 PolarHBondContact O-OG1 3.1Å
306	Y	98.9	Very high	98.7	Very high	87 Å²	87	54 Å²	54	34%	0.341	26%	0.257	S	S	.	.	H	α-helix	trans	-49	-45	171.2	169	-110	0	0	0	112.5	T288 Y292 D303 R308 T309 L310	T288-Y306 WeakPolarHBondContact CG2-OH 3.26Å; Y292-Y306 AromaticContact CD2-CD1 3.91Å; Y292-Y306 HydrophobicContact CD2-CD1 3.91Å; Y292-Y306 AromaticContact CD2-CE1 3.57Å; Y292-Y306 HydrophobicContact CD2-CE1 3.57Å; Y292-Y306 AromaticContact CE2-CD1 3.9Å; Y292-Y306 HydrophobicContact CE2-CD1 3.9Å; Y292-Y306 HydrophobicContact CE2-CE1 4.02Å; Y292-Y306 HydrophobicContact CG-CD1 4.36Å; Y292-Y306 AromaticContact CG-CE1 3.99Å; Y292-Y306 HydrophobicContact CG-CE1 3.99Å; D303-Y306 VanDerWaalsContact CG-CB 3.47Å; D303-Y306 PolarHBondContact OD1-N 3.39Å; Y306-R308 VanDerWaalsContact C-N 3.33Å; Y306-R308 PolarHBondContact O-N 2.77Å; Y306-T309 PolarHBondContact O-N 2.79Å; Y306-L310 HydrophobicContact CD1-CD1 4.46Å; Y306-L310 HydrophobicContact CE1-CD1 3.83Å; Y306-L310 HydrophobicContact CE1-CG 4.37Å; Y306-L310 HydrophobicContact CE2-CD1 4.35Å; Y306-L310 HydrophobicContact CE2-CD2 4.01Å; Y306-L310 HydrophobicContact CE2-CG 4.03Å; Y306-L310 WeakPolarHBondContact O-CG 3.43Å; Y306-L310 PolarHBondContact O-N 2.92Å
307	L	98.9	Very high	98.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-30	178.8	-67	175.3	0	0	0	113.7	I149 L234 Y289 Y292 V293 D303 E305 L310	I149-L307 HydrophobicContact CD1-CB 4.18Å; I149-L307 HydrophobicContact CG2-CB 4.44Å; L234-L307 HydrophobicContact CD1-CD1 3.91Å; Y289-L307 HydrophobicContact CD2-CB 4.31Å; Y289-L307 HydrophobicContact CD2-CD2 3.62Å; Y289-L307 HydrophobicContact CD2-CG 4.42Å; Y289-L307 HydrophobicContact CE2-CB 4.1Å; Y289-L307 HydrophobicContact CE2-CD1 4.17Å; Y289-L307 HydrophobicContact CE2-CD2 3.9Å; Y289-L307 HydrophobicContact CE2-CG 4.28Å; Y289-L307 HydrophobicContact CG-CD2 4.29Å; Y292-L307 HydrophobicContact CD1-CD1 4.07Å; Y292-L307 HydrophobicContact CD1-CD2 3.61Å; Y292-L307 HydrophobicContact CD1-CG 4.1Å; Y292-L307 HydrophobicContact CE1-CD1 3.96Å; Y292-L307 HydrophobicContact CE1-CD2 4.14Å; Y292-L307 HydrophobicContact CE1-CG 4.13Å; Y292-L307 HydrophobicContact CG-CD2 4.09Å; V293-L307 HydrophobicContact CG1-CD1 4.04Å; V293-L307 HydrophobicContact CG1-CD2 4.35Å; D303-L307 WeakPolarHBondContact O-CG 3.19Å; D303-L307 PolarHBondContact O-N 3.13Å; E305-L307 PolarHBondContact O-N 2.92Å; L307-L310 HydrophobicContact CD2-CD1 4.32Å
308	R	98.8	Very high	98.7	Very high	30 Å²	30	60.9 Å²	60.9	11%	0.113	28%	0.277	C	S	.	.	H	α-helix	trans	-72.8	-46.9	168.8	-76.9	-176.7	-73.8	-92	-4.1	111.2	I149 S150 E153 Y304 E305 Y306 L310 F311 T312	I149-R308 HydrophobicContact CB-CG 4.2Å; I149-R308 HydrophobicContact CD1-CG 4.48Å; I149-R308 HydrophobicContact CG2-CG 3.92Å; S150-R308 WeakPolarHBondContact OG-CD 3.43Å; S150-R308 PolarHBondContact OG-NH1 2.82Å; E153-R308 IonicContact OE2-CZ 2.67Å; E153-R308 VanDerWaalsContact OE2-CZ 3.23Å; E153-R308 IonicContact OE2-NH1 2.71Å; E153-R308 PolarHBondContact OE2-NH1 2.86Å; E153-R308 IonicContact OE2-NH2 2.66Å; E153-R308 PolarHBondContact OE2-NH2 2.81Å; Y304-R308 WeakPolarHBondContact O-CG 3.38Å; Y304-R308 PolarHBondContact O-N 3.48Å; Y304-R308 VanDerWaalsContact O-N 3.1Å; E305-R308 CarbonylContact O-C 3.57Å; E305-R308 WeakPolarHBondContact O-CA 3.33Å; E305-R308 WeakPolarHBondContact O-CB 3.09Å; E305-R308 PolarHBondContact O-N 3.02Å; E305-R308 IonicContact OE2-CZ 3.63Å; E305-R308 IonicContact OE2-NE 3.8Å; E305-R308 PolarHBondContact OE2-NE 2.81Å; E305-R308 IonicContact OE2-NH2 2.67Å; E305-R308 PolarHBondContact OE2-NH2 2.89Å; Y306-R308 VanDerWaalsContact C-N 3.33Å; Y306-R308 PolarHBondContact O-N 2.77Å; R308-L310 VanDerWaalsContact C-N 3.3Å; R308-L310 PolarHBondContact O-N 3.23Å; R308-F311 CarbonylContact O-C 3.6Å; R308-F311 WeakPolarHBondContact O-CA 3.43Å; R308-F311 PolarHBondContact O-N 3.04Å; R308-T312 PolarHBondContact O-N 3.14Å; R308-T312 PolarHBondContact O-OG1 3Å
309	T	98.8	Very high	98.7	Very high	42 Å²	42	63.7 Å²	63.7	26%	0.258	31%	0.307	S	S	.	.	H	α-helix	trans	-55.2	-43.7	-178.2	-51.4	0	0	0	0	111.6	E305 Y306 F311 T312 E313	E305-T309 PolarHBondContact O-N 3Å; E305-T309 PolarHBondContact O-OG1 3.1Å; Y306-T309 PolarHBondContact O-N 2.79Å; T309-F311 PolarHBondContact O-N 2.86Å; T309-T312 WeakPolarHBondContact CA-OG1 3.47Å; T309-T312 PolarHBondContact O-N 2.96Å; T309-T312 PolarHBondContact O-OG1 3.08Å; T309-E313 HydrophobicContact CG2-CG 3.95Å; T309-E313 WeakPolarHBondContact CG2-OE1 3.14Å; T309-E313 WeakPolarHBondContact O-CB 3.42Å; T309-E313 WeakPolarHBondContact O-CG 3.4Å; T309-E313 PolarHBondContact O-N 2.87Å
310	L	98.8	Very high	98.7	Very high	19 Å²	19	61.9 Å²	61.9	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-50.1	-43.6	172.7	-75.7	177.5	0	0	0	112.8	T288 Y306 L307 R308 L314	T288-L310 HydrophobicContact CG2-CD1 3.96Å; T288-L310 HydrophobicContact CG2-CD2 4Å; Y306-L310 HydrophobicContact CD1-CD1 4.46Å; Y306-L310 HydrophobicContact CE1-CD1 3.83Å; Y306-L310 HydrophobicContact CE1-CG 4.37Å; Y306-L310 HydrophobicContact CE2-CD1 4.35Å; Y306-L310 HydrophobicContact CE2-CD2 4.01Å; Y306-L310 HydrophobicContact CE2-CG 4.03Å; Y306-L310 WeakPolarHBondContact O-CG 3.43Å; Y306-L310 PolarHBondContact O-N 2.92Å; L307-L310 HydrophobicContact CD2-CD1 4.32Å; R308-L310 VanDerWaalsContact C-N 3.3Å; R308-L310 PolarHBondContact O-N 3.23Å; L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 2.85Å
311	F	98.8	Very high	98.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-85.1	-32.5	-177.5	-66	-32.8	0	0	0	113.2	L142 A145 I146 I149 F241 E285 M286 Y289 R308 T309 F315	L142-F311 HydrophobicContact CD2-CB 3.73Å; L142-F311 HydrophobicContact CD2-CD1 3.54Å; L142-F311 HydrophobicContact CD2-CE1 4.37Å; L142-F311 HydrophobicContact CD2-CG 3.79Å; A145-F311 HydrophobicContact CB-CD2 3.66Å; A145-F311 HydrophobicContact CB-CE2 3.76Å; A145-F311 HydrophobicContact CB-CG 4.49Å; I146-F311 HydrophobicContact CD1-CB 4.31Å; I146-F311 HydrophobicContact CG1-CB 3.96Å; I149-F311 HydrophobicContact CD1-CD2 3.8Å; I149-F311 HydrophobicContact CD1-CE2 3.91Å; F241-F311 HydrophobicContact CD2-CE2 4.15Å; F241-F311 HydrophobicContact CD2-CZ 4.27Å; F241-F311 AromaticContact CE2-CE2 3.97Å; F241-F311 HydrophobicContact CE2-CE2 3.97Å; E285-F311 HydrophobicContact CB-CD1 4.38Å; E285-F311 HydrophobicContact CB-CE1 4.37Å; M286-F311 HydrophobicContact CE-CD1 4.2Å; M286-F311 HydrophobicContact CE-CE1 3.74Å; M286-F311 HydrophobicContact CE-CZ 4.35Å; M286-F311 HydrophobicContact SD-CE1 3.79Å; M286-F311 HydrophobicContact SD-CZ 4.05Å; Y289-F311 AromaticContact CD2-CE2 3.49Å; Y289-F311 HydrophobicContact CD2-CE2 3.49Å; Y289-F311 VanDerWaalsContact CD2-CE2 3.49Å; Y289-F311 AromaticContact CD2-CZ 3.51Å; Y289-F311 HydrophobicContact CD2-CZ 3.51Å; Y289-F311 AromaticContact CE2-CE2 3.86Å; Y289-F311 HydrophobicContact CE2-CE2 3.86Å; Y289-F311 HydrophobicContact CE2-CZ 4.28Å; Y289-F311 HydrophobicContact CG-CE2 4.2Å; Y289-F311 AromaticContact CG-CZ 3.77Å; Y289-F311 HydrophobicContact CG-CZ 3.77Å; R308-F311 CarbonylContact O-C 3.6Å; R308-F311 WeakPolarHBondContact O-CA 3.43Å; R308-F311 PolarHBondContact O-N 3.04Å; T309-F311 PolarHBondContact O-N 2.86Å; F311-F315 WeakPolarHBondContact O-CB 3.39Å; F311-F315 PolarHBondContact O-N 3.45Å
312	T	98.7	Very high	98.5	Very high	46 Å²	46	59.9 Å²	59.9	28%	0.282	30%	0.296	S	S	.	.	H	α-helix	trans	-69.5	-44.5	174.3	55.2	0	0	0	0	111.8	I146 R308 T309 L314 F315 E316	I146-T312 HydrophobicContact CD1-CG2 3.65Å; I146-T312 HydrophobicContact CG1-CG2 4.1Å; R308-T312 PolarHBondContact O-N 3.14Å; R308-T312 PolarHBondContact O-OG1 3Å; T309-T312 WeakPolarHBondContact CA-OG1 3.47Å; T309-T312 PolarHBondContact O-N 2.96Å; T309-T312 PolarHBondContact O-OG1 3.08Å; T312-L314 VanDerWaalsContact C-N 3.34Å; T312-L314 PolarHBondContact O-N 2.94Å; T312-F315 WeakPolarHBondContact O-CB 3.4Å; T312-F315 PolarHBondContact O-N 2.64Å; T312-F315 VanDerWaalsContact O-N 3.11Å; T312-E316 WeakPolarHBondContact O-CG 3.35Å; T312-E316 PolarHBondContact O-N 3.01Å
313	E	98.6	Very high	98.4	Very high	104 Å²	104	63 Å²	63	49%	0.486	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.2	-72.1	-177.6	173.2	0	0	111.9	T309 R317	T309-E313 HydrophobicContact CG2-CG 3.95Å; T309-E313 WeakPolarHBondContact CG2-OE1 3.14Å; T309-E313 WeakPolarHBondContact O-CB 3.42Å; T309-E313 WeakPolarHBondContact O-CG 3.4Å; T309-E313 PolarHBondContact O-N 2.87Å; E313-R317 WeakPolarHBondContact O-CB 3.49Å; E313-R317 PolarHBondContact O-N 3.21Å
314	L	98.8	Very high	98.3	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-41.5	172.8	171.5	61.8	0	0	0	111.6	L142 P283 E285 L310 T312 R317 K318	L142-L314 HydrophobicContact CD1-CD2 3.99Å; L142-L314 HydrophobicContact CD1-CG 3.99Å; L142-L314 HydrophobicContact CD2-CD2 3.88Å; P283-L314 HydrophobicContact CB-CD1 3.9Å; P283-L314 HydrophobicContact CB-CD2 3.55Å; P283-L314 HydrophobicContact CB-CG 4.39Å; P283-L314 HydrophobicContact CG-CD1 4.22Å; P283-L314 HydrophobicContact CG-CD2 3.89Å; E285-L314 HydrophobicContact CB-CD2 3.99Å; E285-L314 HydrophobicContact CG-CB 4.07Å; E285-L314 HydrophobicContact CG-CD2 4.17Å; L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 2.85Å; T312-L314 VanDerWaalsContact C-N 3.34Å; T312-L314 PolarHBondContact O-N 2.94Å; L314-R317 PolarHBondContact O-N 3.19Å; L314-K318 HydrophobicContact CD1-CG 4.05Å; L314-K318 WeakPolarHBondContact O-CB 3.16Å; L314-K318 VanDerWaalsContact O-CG 3.27Å; L314-K318 WeakPolarHBondContact O-CG 3.47Å; L314-K318 PolarHBondContact O-N 3.06Å
315	F	98.6	Very high	98.1	Very high	8 Å²	8	66.5 Å²	66.5	4%	0.035	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-46.1	179.7	-170.5	-92.2	0	0	0	111.6	K139 L142 M143 F311 T312 K318 G319 Y320 T321 F322	K139-F315 HydrophobicContact CG-CE2 3.66Å; K139-F315 HydrophobicContact CG-CZ 4.11Å; L142-F315 HydrophobicContact CB-CD2 3.74Å; L142-F315 HydrophobicContact CB-CE2 4.44Å; L142-F315 HydrophobicContact CD1-CB 4.14Å; L142-F315 HydrophobicContact CD1-CD2 3.98Å; M143-F315 HydrophobicContact CG-CE2 3.55Å; M143-F315 HydrophobicContact CG-CZ 3.78Å; M143-F315 HydrophobicContact SD-CE2 4.27Å; M143-F315 HydrophobicContact SD-CZ 4.03Å; F311-F315 WeakPolarHBondContact O-CB 3.39Å; F311-F315 PolarHBondContact O-N 3.45Å; T312-F315 WeakPolarHBondContact O-CB 3.4Å; T312-F315 PolarHBondContact O-N 2.64Å; T312-F315 VanDerWaalsContact O-N 3.11Å; F315-K318 PolarHBondContact O-N 3.1Å; F315-G319 PolarHBondContact O-N 3.01Å; F315-Y320 WeakPolarHBondContact CD1-O 3.43Å; F315-Y320 AromaticContact CD2-CD2 3.7Å; F315-Y320 HydrophobicContact CD2-CD2 3.7Å; F315-Y320 HydrophobicContact CD2-CG 4.27Å; F315-Y320 VanDerWaalsContact CE1-C 3.48Å; F315-Y320 WeakPolarHBondContact CE1-O 3.46Å; F315-Y320 AromaticContact CE2-CD2 3.95Å; F315-Y320 HydrophobicContact CE2-CD2 3.95Å; F315-Y320 HydrophobicContact CE2-CG 4.21Å; F315-Y320 HydrophobicContact CG-CD2 4.23Å; F315-Y320 VanDerWaalsContact CZ-CB 3.49Å; F315-Y320 PolarHBondContact O-N 3.07Å; F315-Y320 VanDerWaalsContact O-N 3.11Å; F315-T321 VanDerWaalsContact CE1-C 3.45Å; F315-T321 WeakPolarHBondContact CZ-O 2.87Å; F315-F322 HydrophobicContact CE1-CB 3.88Å; F315-F322 HydrophobicContact CE1-CD2 4.06Å; F315-F322 HydrophobicContact CE1-CG 4.41Å; F315-F322 HydrophobicContact CZ-CB 4.25Å; F315-F322 HydrophobicContact CZ-CD2 4.12Å; F315-F322 HydrophobicContact CZ-CG 4.49Å
316	E	98.3	Very high	98.1	Very high	140 Å²	140	61.9 Å²	61.9	65%	0.654	31%	0.307	S	S	*	.	H	α-helix	trans	-62.8	-45.8	173.9	-71.1	173.5	-170.5	0	0	111.9	T312 K318 G319	T312-E316 WeakPolarHBondContact O-CG 3.35Å; T312-E316 PolarHBondContact O-N 3.01Å; E316-K318 PolarHBondContact O-N 3.21Å; E316-G319 WeakPolarHBondContact O-CA 3.39Å; E316-G319 PolarHBondContact O-N 2.69Å
317	R	98.5	Very high	98	Very high	155 Å²	155	59.9 Å²	59.9	59%	0.585	30%	0.302	S	S	*	.	H	α-helix	trans	-64.1	-24.8	178.4	-160.6	-165.8	-40	137.6	12.2	113.3	E285 E313 L314 G319	E285-R317 IonicContact OE1-CZ 2.71Å; E285-R317 IonicContact OE1-NH1 2.87Å; E285-R317 PolarHBondContact OE1-NH1 3.44Å; E285-R317 IonicContact OE1-NH2 2.69Å; E285-R317 PolarHBondContact OE1-NH2 2.83Å; E313-R317 WeakPolarHBondContact O-CB 3.49Å; E313-R317 PolarHBondContact O-N 3.21Å; L314-R317 PolarHBondContact O-N 3.19Å; R317-G319 VanDerWaalsContact C-N 3.28Å
318	K	98.4	Very high	97.9	Very high	111 Å²	111	60.5 Å²	60.5	48%	0.483	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.5	171.4	-71.2	-70	-178.4	-177.3	0	113.4	L138 L314 F315 E316 Y320	L138-K318 HydrophobicContact CD2-CD 4.34Å; L138-K318 HydrophobicContact CD2-CG 4.23Å; L314-K318 HydrophobicContact CD1-CG 4.05Å; L314-K318 WeakPolarHBondContact O-CB 3.16Å; L314-K318 VanDerWaalsContact O-CG 3.27Å; L314-K318 WeakPolarHBondContact O-CG 3.47Å; L314-K318 PolarHBondContact O-N 3.06Å; F315-K318 PolarHBondContact O-N 3.1Å; E316-K318 PolarHBondContact O-N 3.21Å; K318-Y320 VanDerWaalsContact C-N 3.28Å; K318-Y320 HydrophobicContact CB-CD1 4.16Å; K318-Y320 HydrophobicContact CB-CD2 3.62Å; K318-Y320 HydrophobicContact CB-CE1 4.05Å; K318-Y320 HydrophobicContact CB-CE2 3.49Å; K318-Y320 VanDerWaalsContact CB-CE2 3.49Å; K318-Y320 HydrophobicContact CB-CG 3.96Å; K318-Y320 HydrophobicContact CG-CD2 4.41Å; K318-Y320 HydrophobicContact CG-CE2 3.91Å; K318-Y320 PolarHBondContact O-N 3.16Å
319	G	98.3	Very high	97.6	Very high	64 Å²	64	63.1 Å²	63.1	66%	0.66	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	25	-176.9	0	0	0	0	0	113.2	F315 E316 R317	F315-G319 PolarHBondContact O-N 3.01Å; E316-G319 WeakPolarHBondContact O-CA 3.39Å; E316-G319 PolarHBondContact O-N 2.69Å; R317-G319 VanDerWaalsContact C-N 3.28Å
320	Y	98.6	Very high	97	Very high	77 Å²	77	65.1 Å²	65.1	30%	0.302	35%	0.352	S	S	.	.			trans	-83.6	140.5	179.5	-61.3	-30.7	0	0	0	111.6	L138 K139 L142 F315 K318	L138-Y320 HydrophobicContact CB-CE2 4.49Å; L138-Y320 HydrophobicContact CD2-CE2 4.29Å; L138-Y320 HydrophobicContact CG-CE2 4.27Å; K139-Y320 HydrophobicContact CB-CD1 4.32Å; K139-Y320 HydrophobicContact CB-CD2 3.84Å; K139-Y320 HydrophobicContact CB-CE1 4.3Å; K139-Y320 HydrophobicContact CB-CE2 3.81Å; K139-Y320 HydrophobicContact CB-CG 4.11Å; K139-Y320 HydrophobicContact CD-CD1 4.44Å; K139-Y320 HydrophobicContact CD-CG 4.4Å; K139-Y320 HydrophobicContact CG-CD1 4.27Å; K139-Y320 HydrophobicContact CG-CD2 3.95Å; K139-Y320 HydrophobicContact CG-CE2 4.43Å; K139-Y320 HydrophobicContact CG-CG 3.86Å; L142-Y320 HydrophobicContact CD1-CD2 4.49Å; L142-Y320 HydrophobicContact CD1-CE2 4.45Å; F315-Y320 WeakPolarHBondContact CD1-O 3.43Å; F315-Y320 AromaticContact CD2-CD2 3.7Å; F315-Y320 HydrophobicContact CD2-CD2 3.7Å; F315-Y320 HydrophobicContact CD2-CG 4.27Å; F315-Y320 VanDerWaalsContact CE1-C 3.48Å; F315-Y320 WeakPolarHBondContact CE1-O 3.46Å; F315-Y320 AromaticContact CE2-CD2 3.95Å; F315-Y320 HydrophobicContact CE2-CD2 3.95Å; F315-Y320 HydrophobicContact CE2-CG 4.21Å; F315-Y320 HydrophobicContact CG-CD2 4.23Å; F315-Y320 VanDerWaalsContact CZ-CB 3.49Å; F315-Y320 PolarHBondContact O-N 3.07Å; F315-Y320 VanDerWaalsContact O-N 3.11Å; K318-Y320 VanDerWaalsContact C-N 3.28Å; K318-Y320 HydrophobicContact CB-CD1 4.16Å; K318-Y320 HydrophobicContact CB-CD2 3.62Å; K318-Y320 HydrophobicContact CB-CE1 4.05Å; K318-Y320 HydrophobicContact CB-CE2 3.49Å; K318-Y320 VanDerWaalsContact CB-CE2 3.49Å; K318-Y320 HydrophobicContact CB-CG 3.96Å; K318-Y320 HydrophobicContact CG-CD2 4.41Å; K318-Y320 HydrophobicContact CG-CE2 3.91Å; K318-Y320 PolarHBondContact O-N 3.16Å
321	T	97.4	Very high	96.5	Very high	100 Å²	100	69 Å²	69	61%	0.613	37%	0.366	S	S	*	.			trans	-94.6	135.6	171.3	-50.3	0	0	0	0	110.1	K139 F315 D323	K139-T321 VanDerWaalsContact CE-O 3.25Å; K139-T321 WeakPolarHBondContact CE-O 3.36Å; F315-T321 VanDerWaalsContact CE1-C 3.45Å; F315-T321 WeakPolarHBondContact CZ-O 2.87Å; T321-D323 HydrophobicContact CG2-CB 4.19Å; T321-D323 PolarHBondContact O-N 2.84Å
322	F	96.2	Very high	95.7	Very high	78 Å²	78	77 Å²	77	34%	0.342	40%	0.403	S	S	.	.			trans	-82.3	72.2	177.2	-154.1	-73.2	0	0	0	109.2	M143 I146 F315 Y324	M143-F322 HydrophobicContact CB-CE2 4.14Å; M143-F322 HydrophobicContact CB-CZ 4.15Å; M143-F322 HydrophobicContact CG-CD2 3.96Å; M143-F322 HydrophobicContact CG-CE2 3.8Å; M143-F322 HydrophobicContact CG-CG 4.44Å; M143-F322 HydrophobicContact CG-CZ 4.13Å; I146-F322 HydrophobicContact CB-CE2 4.43Å; I146-F322 HydrophobicContact CD1-CE2 3.9Å; I146-F322 HydrophobicContact CG2-CE2 4.37Å; F315-F322 HydrophobicContact CE1-CB 3.88Å; F315-F322 HydrophobicContact CE1-CD2 4.06Å; F315-F322 HydrophobicContact CE1-CG 4.41Å; F315-F322 HydrophobicContact CZ-CB 4.25Å; F315-F322 HydrophobicContact CZ-CD2 4.12Å; F315-F322 HydrophobicContact CZ-CG 4.49Å; F322-Y324 HydrophobicContact CD1-CE1 4.13Å; F322-Y324 HydrophobicContact CD1-CE2 4.45Å; F322-Y324 HydrophobicContact CE1-CD1 4.06Å; F322-Y324 AromaticContact CE1-CE1 3.5Å; F322-Y324 HydrophobicContact CE1-CE1 3.5Å; F322-Y324 AromaticContact CE1-CZ 3.78Å
323	D	96.4	Very high	94.7	Very high	67 Å²	67	77.1 Å²	77.1	36%	0.358	40%	0.401	S	S	.	.	S	Bend	trans	-103	-1.6	-169.6	62.1	-4	0	0	0	113.5	K139 T321 T325	K139-D323 WeakPolarHBondContact CE-OD1 3.12Å; K139-D323 IonicContact NZ-OD1 3.77Å; K139-D323 PolarHBondContact NZ-OD1 2.86Å; K139-D323 IonicContact NZ-OD2 3.19Å; K139-D323 PolarHBondContact NZ-OD2 2.86Å; T321-D323 HydrophobicContact CG2-CB 4.19Å; T321-D323 PolarHBondContact O-N 2.84Å; D323-T325 PolarHBondContact O-N 2.77Å; D323-T325 WeakPolarHBondContact OD1-CB 3.39Å; D323-T325 PolarHBondContact OD1-N 2.89Å; D323-T325 PolarHBondContact OD1-OG1 2.79Å; D323-T325 VanDerWaalsContact OD2-CB 3.28Å; D323-T325 WeakPolarHBondContact OD2-CB 3.21Å; D323-T325 PolarHBondContact OD2-OG1 2.88Å
324	Y	96.1	Very high	93	Very high	93 Å²	93	77 Å²	77	37%	0.365	41%	0.407	S	S	.	.			trans	60.1	18.4	-170.3	-52.4	-79.7	0	0	0	114.8	H181 F322 Y326	H181-Y324 HydrophobicContact CB-CD1 3.53Å; H181-Y324 HydrophobicContact CB-CD2 4.42Å; H181-Y324 HydrophobicContact CB-CE1 4.23Å; H181-Y324 HydrophobicContact CB-CG 3.62Å; H181-Y324 AromaticContact CD2-CD1 3.58Å; H181-Y324 AromaticContact CD2-CE1 3.35Å; H181-Y324 WeakPolarHBondContact CD2-CE1 3.49Å; H181-Y324 AromaticContact CD2-CE2 3.98Å; H181-Y324 AromaticContact CD2-CG 3.94Å; H181-Y324 AromaticContact CD2-CZ 3.58Å; H181-Y324 AromaticContact CG-CD1 3.73Å; H181-Y324 AromaticContact CG-CE1 3.99Å; H181-Y324 AromaticContact CG-CG 3.77Å; F322-Y324 HydrophobicContact CD1-CE1 4.13Å; F322-Y324 HydrophobicContact CD1-CE2 4.45Å; F322-Y324 HydrophobicContact CE1-CD1 4.06Å; F322-Y324 AromaticContact CE1-CE1 3.5Å; F322-Y324 HydrophobicContact CE1-CE1 3.5Å; F322-Y324 AromaticContact CE1-CZ 3.78Å; Y324-Y326 HydrophobicContact CD1-CE2 4.31Å; Y324-Y326 WeakPolarHBondContact O-CD2 3.42Å; Y324-Y326 WeakPolarHBondContact O-CE2 3.42Å; Y324-Y326 PolarHBondContact O-N 2.82Å; Y324-Y326 VanDerWaalsContact O-N 3.08Å
325	T	96.4	Very high	90.9	Very high	69 Å²	69	82.4 Å²	82.4	42%	0.423	45%	0.445	S	S	.	.			trans	-81.4	85.5	171.8	-49	0	0	0	0	109.3	K139 D323 V329	K139-T325 PolarHBondContact NZ-O 3.24Å; D323-T325 PolarHBondContact O-N 2.77Å; D323-T325 WeakPolarHBondContact OD1-CB 3.39Å; D323-T325 PolarHBondContact OD1-N 2.89Å; D323-T325 PolarHBondContact OD1-OG1 2.79Å; D323-T325 VanDerWaalsContact OD2-CB 3.28Å; D323-T325 WeakPolarHBondContact OD2-CB 3.21Å; D323-T325 PolarHBondContact OD2-OG1 2.88Å; T325-V329 HydrophobicContact CG2-CB 4.49Å
326	Y	97.6	Very high	88.3	Confident	8 Å²	8	89.2 Å²	89.2	3%	0.031	48%	0.478	C	S	.	.			trans	-81.6	164.7	173.6	-55.6	-82.7	0	0	0	112.6	T140 M143 I144 Q147 H181 Y324 W328 V329	T140-Y326 HydrophobicContact CG2-CD1 4.12Å; T140-Y326 WeakPolarHBondContact OG1-CA 3.4Å; M143-Y326 HydrophobicContact CB-CD1 4.45Å; M143-Y326 HydrophobicContact CB-CE1 3.69Å; M143-Y326 HydrophobicContact CE-CD1 3.66Å; M143-Y326 HydrophobicContact CE-CE1 3.86Å; M143-Y326 HydrophobicContact CE-CG 4.2Å; I144-Y326 HydrophobicContact CG1-CE1 4.25Å; Q147-Y326 PolarHBondContact NE2-OH 3.12Å; H181-Y326 HydrophobicContact CB-CE2 4.31Å; H181-Y326 PolarHBondContact O-OH 2.86Å; Y324-Y326 HydrophobicContact CD1-CE2 4.31Å; Y324-Y326 WeakPolarHBondContact O-CD2 3.42Å; Y324-Y326 WeakPolarHBondContact O-CE2 3.42Å; Y324-Y326 PolarHBondContact O-N 2.82Å; Y324-Y326 VanDerWaalsContact O-N 3.08Å; Y326-W328 VanDerWaalsContact CB-CZ2 3.47Å; Y326-W328 AromaticContact CD1-CH2 3.5Å; Y326-W328 HydrophobicContact CD1-CH2 3.5Å; Y326-W328 AromaticContact CD1-CZ2 3.67Å; Y326-W328 HydrophobicContact CD1-CZ2 3.67Å; Y326-W328 HydrophobicContact CD1-CZ3 4.2Å; Y326-W328 AromaticContact CD2-CE2 3.82Å; Y326-W328 HydrophobicContact CD2-CH2 4.17Å; Y326-W328 AromaticContact CD2-CZ2 3.44Å; Y326-W328 HydrophobicContact CD2-CZ2 3.44Å; Y326-W328 VanDerWaalsContact CD2-CZ2 3.44Å; Y326-W328 HydrophobicContact CE1-CH2 4.08Å; Y326-W328 HydrophobicContact CE1-CZ2 4.2Å; Y326-W328 HydrophobicContact CE2-CZ2 4Å; Y326-W328 HydrophobicContact CG-CD2 4.35Å; Y326-W328 AromaticContact CG-CE2 3.68Å; Y326-W328 AromaticContact CG-CH2 3.55Å; Y326-W328 HydrophobicContact CG-CH2 3.55Å; Y326-W328 AromaticContact CG-CZ2 3.25Å; Y326-W328 HydrophobicContact CG-CZ2 3.25Å; Y326-W328 HydrophobicContact CG-CZ3 4.2Å; Y326-W328 PolarHBondContact O-N 2.81Å; Y326-W328 VanDerWaalsContact O-N 3.09Å; Y326-V329 WeakPolarHBondContact O-CB 3.43Å; Y326-V329 WeakPolarHBondContact O-CG2 3.49Å; Y326-V329 PolarHBondContact O-N 2.81Å
327	D	98.1	Very high	85.5	Confident	44 Å²	44	84.8 Å²	84.8	24%	0.235	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.1	-175.5	-50.2	-26.6	0	0	0	114.6	C132 F136 S137 T140 R331	C132-D327 PolarHBondContact SG-O 3.43Å; F136-D327 VanDerWaalsContact CA-OD2 3.26Å; F136-D327 WeakPolarHBondContact CA-OD2 3.37Å; F136-D327 HydrophobicContact CD1-CB 4.44Å; S137-D327 WeakPolarHBondContact CB-OD1 3.36Å; S137-D327 PolarHBondContact N-OD2 3.4Å; S137-D327 PolarHBondContact OG-OD1 2.95Å; S137-D327 PolarHBondContact OG-OD2 3.45Å; T140-D327 VanDerWaalsContact CB-OD2 3.25Å; T140-D327 WeakPolarHBondContact CB-OD2 3.19Å; T140-D327 PolarHBondContact OG1-N 3.37Å; T140-D327 PolarHBondContact OG1-OD1 2.98Å; T140-D327 PolarHBondContact OG1-OD2 3.44Å; D327-R331 PolarHBondContact O-NE 2.71Å
328	W	95.7	Very high	82.4	Confident	13 Å²	13	80.6 Å²	80.6	5%	0.049	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.5	175.7	58.8	81.3	0	0	0	113.5	L125 L128 L131 F136 T140 I144 I172 Y326 G330 R331	L125-W328 HydrophobicContact CD2-CH2 4.06Å; L128-W328 HydrophobicContact CB-CD2 4.12Å; L128-W328 HydrophobicContact CB-CE3 3.9Å; L128-W328 HydrophobicContact CB-CG 4.49Å; L128-W328 HydrophobicContact CB-CZ3 4.38Å; L128-W328 HydrophobicContact CD1-CD2 3.95Å; L128-W328 HydrophobicContact CD1-CE3 4.25Å; L128-W328 HydrophobicContact CD1-CG 4.47Å; L128-W328 HydrophobicContact CD1-CH2 4.24Å; L128-W328 HydrophobicContact CD1-CZ2 3.95Å; L128-W328 HydrophobicContact CD1-CZ3 4.38Å; L128-W328 HydrophobicContact CD2-CB 4.03Å; L128-W328 HydrophobicContact CD2-CD2 4.1Å; L128-W328 HydrophobicContact CD2-CG 3.78Å; L128-W328 HydrophobicContact CG-CD2 4.28Å; L128-W328 HydrophobicContact CG-CG 4.46Å; L131-W328 HydrophobicContact CD2-CB 4.4Å; F136-W328 HydrophobicContact CD1-CZ3 4.48Å; F136-W328 AromaticContact CE1-CE3 3.7Å; F136-W328 HydrophobicContact CE1-CE3 3.7Å; F136-W328 AromaticContact CE1-CZ3 3.81Å; F136-W328 HydrophobicContact CE1-CZ3 3.81Å; F136-W328 HydrophobicContact CE2-CZ3 4.12Å; F136-W328 AromaticContact CZ-CE3 3.86Å; F136-W328 HydrophobicContact CZ-CE3 3.86Å; F136-W328 AromaticContact CZ-CZ3 3.61Å; F136-W328 HydrophobicContact CZ-CZ3 3.61Å; T140-W328 HydrophobicContact CG2-CE3 4.41Å; T140-W328 HydrophobicContact CG2-CH2 4.33Å; T140-W328 HydrophobicContact CG2-CZ3 3.71Å; I144-W328 HydrophobicContact CD1-CH2 4.06Å; I144-W328 HydrophobicContact CD1-CZ3 4.13Å; I144-W328 HydrophobicContact CG1-CH2 4.34Å; I172-W328 HydrophobicContact CG2-CZ2 4.04Å; Y326-W328 VanDerWaalsContact CB-CZ2 3.47Å; Y326-W328 AromaticContact CD1-CH2 3.5Å; Y326-W328 HydrophobicContact CD1-CH2 3.5Å; Y326-W328 AromaticContact CD1-CZ2 3.67Å; Y326-W328 HydrophobicContact CD1-CZ2 3.67Å; Y326-W328 HydrophobicContact CD1-CZ3 4.2Å; Y326-W328 AromaticContact CD2-CE2 3.82Å; Y326-W328 HydrophobicContact CD2-CH2 4.17Å; Y326-W328 AromaticContact CD2-CZ2 3.44Å; Y326-W328 HydrophobicContact CD2-CZ2 3.44Å; Y326-W328 VanDerWaalsContact CD2-CZ2 3.44Å; Y326-W328 HydrophobicContact CE1-CH2 4.08Å; Y326-W328 HydrophobicContact CE1-CZ2 4.2Å; Y326-W328 HydrophobicContact CE2-CZ2 4Å; Y326-W328 HydrophobicContact CG-CD2 4.35Å; Y326-W328 AromaticContact CG-CE2 3.68Å; Y326-W328 AromaticContact CG-CH2 3.55Å; Y326-W328 HydrophobicContact CG-CH2 3.55Å; Y326-W328 AromaticContact CG-CZ2 3.25Å; Y326-W328 HydrophobicContact CG-CZ2 3.25Å; Y326-W328 HydrophobicContact CG-CZ3 4.2Å; Y326-W328 PolarHBondContact O-N 2.81Å; Y326-W328 VanDerWaalsContact O-N 3.09Å; W328-G330 PolarHBondContact O-N 2.9Å; W328-R331 WeakPolarHBondContact O-CB 3Å; W328-R331 PolarHBondContact O-N 3.19Å
329	V	92	Very high	79	Confident	85 Å²	85	81.4 Å²	81.4	52%	0.515	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	127.6	178.1	176.4	0	0	0	0	109.3	T325 Y326 R331	T325-V329 HydrophobicContact CG2-CB 4.49Å; Y326-V329 WeakPolarHBondContact O-CB 3.43Å; Y326-V329 WeakPolarHBondContact O-CG2 3.49Å; Y326-V329 PolarHBondContact O-N 2.81Å; V329-R331 VanDerWaalsContact C-N 3.29Å; V329-R331 PolarHBondContact O-N 3.04Å
330	G	86.5	Confident	76.1	Confident	84 Å²	84	84.9 Å²	84.9	87%	0.866	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-10.1	-173.6	0	0	0	0	0	115	W328	W328-G330 PolarHBondContact O-N 2.9Å
331	R	89.3	Confident	75	Confident	101 Å²	101	85.3 Å²	85.3	38%	0.381	48%	0.478	S	S	.	.	S	Bend	trans	-79.1	145.2	169.6	-59.1	-168.7	-177.5	-133	0.4	110.1	L131 D133 D327 W328 V329 I333	L131-R331 HydrophobicContact CD1-CB 4.21Å; L131-R331 HydrophobicContact CD2-CB 3.96Å; L131-R331 HydrophobicContact CG-CB 4.02Å; L131-R331 VanDerWaalsContact O-CD 3.27Å; L131-R331 WeakPolarHBondContact O-CD 3.47Å; L131-R331 PolarHBondContact O-NH1 3.08Å; D133-R331 IonicContact OD2-CZ 1.87Å; D133-R331 IonicContact OD2-NH1 3.86Å; D133-R331 PolarHBondContact OD2-NH1 2.71Å; D133-R331 IonicContact OD2-NH2 3.92Å; D133-R331 PolarHBondContact OD2-NH2 2.9Å; D327-R331 PolarHBondContact O-NE 2.71Å; W328-R331 WeakPolarHBondContact O-CB 3Å; W328-R331 PolarHBondContact O-N 3.19Å; V329-R331 VanDerWaalsContact C-N 3.29Å; V329-R331 PolarHBondContact O-N 3.04Å; R331-I333 PolarHBondContact O-N 3.26Å; R331-I333 VanDerWaalsContact O-N 3.13Å
332	Q	82.3	Confident	73.8	Confident	169 Å²	169	84.5 Å²	84.5	79%	0.79	47%	0.471	S	S	*	.			trans	-77	102	179.1	-173.1	174.1	0.9	0	0	110.4	V334	Q332-V334 PolarHBondContact O-N 2.69Å
333	I	77.1	Confident	72.5	Confident	47 Å²	47	84.9 Å²	84.9	24%	0.241	48%	0.478	C	S	.	.			trans	-66.5	105.9	171.7	-62.6	173.9	0	0	0	108.5	P123 L128 L131 I172 R331 S335	P123-I333 HydrophobicContact CG-CD1 4.4Å; P123-I333 HydrophobicContact CG-CG2 3.42Å; P123-I333 VanDerWaalsContact CG-CG2 3.42Å; L128-I333 HydrophobicContact CD2-CD1 4.23Å; L128-I333 HydrophobicContact CD2-CG1 4.45Å; L131-I333 HydrophobicContact CD2-CG1 3.92Å; I172-I333 HydrophobicContact CD1-CD1 4.44Å; R331-I333 PolarHBondContact O-N 3.26Å; R331-I333 VanDerWaalsContact O-N 3.13Å; I333-S335 PolarHBondContact O-N 2.84Å
334	V	63	Low	71.1	Confident	101 Å²	101	85.9 Å²	85.9	61%	0.612	49%	0.485	S	S	*	.			trans	-71	111.8	175	-175.8	0	0	0	0	108.1	Q332 E336	Q332-V334 PolarHBondContact O-N 2.69Å; V334-E336 HydrophobicContact CG1-CB 3.98Å; V334-E336 HydrophobicContact CG1-CG 3.82Å; V334-E336 PolarHBondContact O-N 2.76Å
335	S	54	Low	69.6	Low	116 Å²	116	85.5 Å²	85.5	81%	0.811	49%	0.493	S	S	*	.			trans	-79.6	29.7	-179.8	55.8	0	0	0	0	113.6	I333	I333-S335 PolarHBondContact O-N 2.84Å
336	E	44	Very low	67.8	Low	152 Å²	152	86.6 Å²	86.6	71%	0.71	50%	0.498	S	S	*	.	S	Bend	trans	-78.2	139.6	168	-71.1	-161.2	158	0	0	109.7	V334 C338	V334-E336 HydrophobicContact CG1-CB 3.98Å; V334-E336 HydrophobicContact CG1-CG 3.82Å; V334-E336 PolarHBondContact O-N 2.76Å; E336-C338 PolarHBondContact O-N 2.85Å; E336-C338 VanDerWaalsContact O-N 3.1Å
337	P	38.8	Very low	65.7	Low	47 Å²	47	92.2 Å²	92.2	31%	0.305	53%	0.531	S	S	.	.			trans	-71.5	108.5	179.4	27.9	-31.5	0	0	0	110.1	I50 C339	I50-P337 HydrophobicContact CB-CB 4.04Å; I50-P337 HydrophobicContact CG2-CB 4.13Å; P337-C339 PolarHBondContact O-N 2.77Å
338	C	33.8	Very low	63.2	Low	66 Å²	66	95.9 Å²	95.9	45%	0.446	55%	0.554	S	S	.	*			trans	-51.4	126.7	168.8	-69.7	0	0	0	0	109.9	D127 E336 F340	D127-C338 PolarHBondContact OD1-SG 3Å; E336-C338 PolarHBondContact O-N 2.85Å; E336-C338 VanDerWaalsContact O-N 3.1Å; C338-F340 WeakPolarHBondContact O-CD2 2.96Å; C338-F340 PolarHBondContact O-N 3.2Å; C338-F340 VanDerWaalsContact O-N 3.14Å
339	C	28.1	Very low	60.5	Low	128 Å²	128	102.8 Å²	102.8	87%	0.865	60%	0.596	S	S	*	*			trans	-81.8	92.5	175.3	-71.1	0	0	0	0	108.9	P337	P337-C339 PolarHBondContact O-N 2.77Å
340	F	36.6	Very low	57.6	Low	138 Å²	138	104.5 Å²	104.5	61%	0.605	60%	0.603	S	S	*	*			trans	-59.5	0	164.7	-55.3	-106.6	0	0	0	111.4	C52 C338	C52-F340 HydrophobicContact CB-CB 3.88Å; C52-F340 WeakPolarHBondContact O-CB 3.06Å; C52-F340 PolarHBondContact SG-O 3.18Å; C338-F340 WeakPolarHBondContact O-CD2 2.96Å; C338-F340 PolarHBondContact O-N 3.2Å; C338-F340 VanDerWaalsContact O-N 3.14Å

Retrieved 340 of 340 residues in 144.4 ms (Link to these results)

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