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COP9 signalosome complex subunit 1

Essential component of the COP9 signalosome complex (CSN), a complex involved in various cellular and developmental processes. The CSN complex is an essential regulator of the ubiquitin (Ubl) conjugation pathway by mediating the deneddylation of the cullin subunits of SCF-type E3 ligase complexes, leading to decrease the Ubl ligase activity of SCF-type complexes such as SCF, CSA or DDB2. The complex is also involved in phosphorylation of p53/TP53, c-jun/JUN, IkappaBalpha/NFKBIA, ITPK1 and IRF8/ICSBP, possibly via its association with CK2 and PKD kinases. CSN-dependent phosphorylation of TP53 and JUN promotes and protects degradation by the Ubl system, respectively. Suppresses G-protein- and mitogen-activated protein kinase-mediated signal transduction.

AlphaFold DB , UniProt , Accession A0A096LPJ3, Species HUMAN (Homo sapiens, Human), Gene GPS1, Length 490 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	37.1	Very low	30.5	Very low	239 Å²	239	158.9 Å²	158.9	100%	1.177	84%	0.844	S	S	*	*				0	103.9	0	-76.3	-164.2	-83.3	0	0	108.3
2	P	34.8	Very low	30.2	Very low	134 Å²	134	151.1 Å²	151.1	87%	0.87	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-93.7	145.5	176.5	23.2	-7.7	0	0	0	111.5
3	L	31.2	Very low	30.2	Very low	166 Å²	166	147.3 Å²	147.3	87%	0.869	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-72.1	160.2	-179	-76.8	153.1	0	0	0	112.6
4	P	33.3	Very low	30.7	Very low	120 Å²	120	147 Å²	147	78%	0.779	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-82.2	144	-166.4	21.2	-12.2	0	0	0	114.1
5	V	30.9	Very low	30.8	Very low	131 Å²	131	148.7 Å²	148.7	79%	0.794	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78	118	176.5	-179.3	0	0	0	0	109.6
6	Q	29.7	Very low	31	Very low	165 Å²	165	147.3 Å²	147.3	77%	0.771	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.2	118.3	167.9	-84.8	177.8	-24.6	0	0	109.8	F8	Q6-F8 PolarHBondContact O-N 3.18Å
7	V	27.7	Very low	31.6	Very low	129 Å²	129	148.4 Å²	148.4	78%	0.782	83%	0.83	S	S	*	*			trans	-79.1	110.7	173.5	-176.4	0	0	0	0	108.1	N9	V7-N9 PolarHBondContact O-N 2.68Å
8	F	26.9	Very low	31.7	Very low	176 Å²	176	149.6 Å²	149.6	77%	0.772	83%	0.828	S	S	*	*			trans	-80.4	108.6	170.4	-90.2	-86.7	0	0	0	109.8	Q6 L10	Q6-F8 PolarHBondContact O-N 3.18Å; F8-L10 PolarHBondContact O-N 3.26Å
9	N	24.9	Very low	31.9	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	83%	0.825	S	S	*	*			trans	-73.9	102.2	168.6	-121	0.6	0	0	0	108.8	V7 Q11	V7-N9 PolarHBondContact O-N 2.68Å; N9-Q11 PolarHBondContact O-N 3.22Å
10	L	28.2	Very low	32	Very low	169 Å²	169	149.2 Å²	149.2	89%	0.885	82%	0.821	S	S	*	*			trans	-88.5	77.2	170.3	-86.7	153.8	0	0	0	109.5	F8	F8-L10 PolarHBondContact O-N 3.26Å
11	Q	30.2	Very low	32	Very low	179 Å²	179	147.9 Å²	147.9	84%	0.836	82%	0.817	S	S	*	*			trans	-101.5	84.9	157.8	-90.5	174.9	-24.9	0	0	107.8	N9	N9-Q11 PolarHBondContact O-N 3.22Å
12	G	27.8	Very low	31.9	Very low	65 Å²	65	143.6 Å²	143.6	67%	0.67	80%	0.799	S	S	*	*			trans	-91.9	109.2	165.5	0	0	0	0	0	109.2	V14	G12-V14 PolarHBondContact O-N 3.29Å
13	A	29.8	Very low	32.1	Very low	102 Å²	102	142.6 Å²	142.6	84%	0.843	79%	0.792	S	S	*	*			trans	-65.7	120.6	165.5	0	0	0	0	0	108.4	E15	A13-E15 PolarHBondContact O-N 2.99Å
14	V	36.9	Very low	32.4	Very low	143 Å²	143	143.9 Å²	143.9	87%	0.867	79%	0.794	S	S	*	*			trans	-81.4	115.3	174.8	-178	0	0	0	0	107.5	G12	G12-V14 PolarHBondContact O-N 3.29Å
15	E	31.9	Very low	32.4	Very low	173 Å²	173	147.1 Å²	147.1	81%	0.808	80%	0.799	S	S	*	*			trans	-60.1	152.4	176.4	-76.5	-177	153.8	0	0	112.4	A13	A13-E15 PolarHBondContact O-N 2.99Å
16	P	33.8	Very low	32.4	Very low	125 Å²	125	147.6 Å²	147.6	81%	0.812	80%	0.797	S	S	*	*			trans	-67	133.4	178.6	26.6	-32.2	0	0	0	112.1	Q18	P16-Q18 PolarHBondContact O-N 3.04Å
17	M	42.4	Very low	32.6	Very low	166 Å²	166	145.6 Å²	145.6	82%	0.818	80%	0.798	S	S	*	*			trans	-45.4	113.2	179.2	-78.6	178.6	-74.6	0	0	113.3
18	Q	32.9	Very low	32.9	Very low	171 Å²	171	148 Å²	148	80%	0.799	80%	0.801	S	S	*	*			trans	-84.5	127.7	158.7	-86	176	-31	0	0	109.1	P16 D20	P16-Q18 PolarHBondContact O-N 3.04Å; Q18-D20 PolarHBondContact O-N 3.25Å
19	I	35.8	Very low	33.7	Very low	152 Å²	152	144.5 Å²	144.5	78%	0.779	79%	0.79	S	S	*	*			trans	-83.2	92.6	173.1	-59.7	164.6	0	0	0	105.4	V21	I19-V21 HydrophobicContact CG2-CG2 4.34Å; I19-V21 PolarHBondContact O-N 3.33Å
20	D	32.9	Very low	34.4	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	78%	0.784	S	S	*	*			trans	-72.9	108	169.3	-74.6	-26.3	0	0	0	108	Q18 D22	Q18-D20 PolarHBondContact O-N 3.25Å; D20-D22 PolarHBondContact O-N 3.42Å
21	V	33.1	Very low	35.3	Very low	121 Å²	121	136.7 Å²	136.7	73%	0.733	76%	0.763	S	S	*	*			trans	-78.4	110.1	168.1	177	0	0	0	0	106.5	I19 P23	I19-V21 HydrophobicContact CG2-CG2 4.34Å; I19-V21 PolarHBondContact O-N 3.33Å; V21-P23 VanDerWaalsContact O-CD 3.27Å; V21-P23 WeakPolarHBondContact O-CD 3.47Å
22	D	34	Very low	36	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	75%	0.752	S	S	*	*			trans	-59.2	120.8	172.7	-88.6	-40.1	0	0	0	110	D20	D20-D22 PolarHBondContact O-N 3.42Å
23	P	39.9	Very low	37.2	Very low	112 Å²	112	135 Å²	135	73%	0.727	75%	0.748	S	S	*	*			trans	-99.4	89.8	173.7	32.4	-20.6	0	0	0	109.1	V21	V21-P23 VanDerWaalsContact O-CD 3.27Å; V21-P23 WeakPolarHBondContact O-CD 3.47Å
24	Q	37.5	Very low	38.8	Very low	194 Å²	194	137.8 Å²	137.8	91%	0.907	75%	0.749	S	S	*	*			trans	-172.1	80.4	159.7	-107	160.2	14.6	0	0	111.6
25	E	33	Very low	40.8	Very low	188 Å²	188	133.4 Å²	133.4	88%	0.879	72%	0.717	S	S	*	*			trans	-91.6	117	154.6	-71.2	-165.6	151.4	0	0	108.4	P27	E25-P27 WeakPolarHBondContact O-CD 3.23Å
26	D	31.4	Very low	43.2	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	71%	0.705	S	S	*	*			trans	-60.7	122.3	171.2	-93.3	-40	0	0	0	110.1	Q28	D26-Q28 PolarHBondContact O-N 3.24Å
27	P	33.2	Very low	45.5	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	1.3	-173	25.3	-32.6	0	0	0	115.3	E25	E25-P27 WeakPolarHBondContact O-CD 3.23Å
28	Q	33.8	Very low	46.9	Very low	181 Å²	181	122.9 Å²	122.9	85%	0.846	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-6.5	179.1	-84	179.9	-8.4	0	0	114.7	D26	D26-Q28 PolarHBondContact O-N 3.24Å
29	N	45.2	Very low	48.5	Very low	101 Å²	101	121.4 Å²	121.4	54%	0.54	66%	0.659	S	S	.	*			trans	-141.9	46.7	-177.1	-77.6	-42.4	0	0	0	112.4	R260	N29-R260 PolarHBondContact O-NH2 2.88Å
30	A	39.3	Very low	50.2	Low	75 Å²	75	115.2 Å²	115.2	62%	0.62	63%	0.628	S	S	*	*			trans	-60.8	140.8	161.8	0	0	0	0	0	108.8	D32	A30-D32 PolarHBondContact O-N 3.38Å
31	P	45.4	Very low	52.6	Low	70 Å²	70	113.3 Å²	113.3	46%	0.455	63%	0.626	S	S	.	*			trans	-54.6	132	173.6	21.5	-29	0	0	0	108.5	V33	P31-V33 HydrophobicContact CB-CG2 4.25Å; P31-V33 HydrophobicContact CG-CG2 3.94Å; P31-V33 WeakPolarHBondContact O-CG2 3.47Å; P31-V33 PolarHBondContact O-N 3.32Å
32	D	45.8	Very low	55.2	Low	111 Å²	111	109.4 Å²	109.4	59%	0.594	60%	0.601	S	S	*	*			trans	-64.1	89.3	166.4	-85.7	-45.5	0	0	0	106.3	A30 N34 Y35 R362	A30-D32 PolarHBondContact O-N 3.38Å; D32-N34 PolarHBondContact O-N 3.01Å; D32-Y35 VanDerWaalsContact O-CD1 3.27Å; D32-Y35 WeakPolarHBondContact O-CD1 3.46Å; D32-Y35 WeakPolarHBondContact O-CE1 3.37Å; D32-R362 IonicContact OD2-NH1 3.2Å; D32-R362 PolarHBondContact OD2-NH1 3.02Å
33	V	53.3	Low	57.9	Low	97 Å²	97	106.5 Å²	106.5	59%	0.588	59%	0.586	S	S	*	*			trans	-73.2	-9.3	-171.3	-166.3	0	0	0	0	112.2	P31	P31-V33 HydrophobicContact CB-CG2 4.25Å; P31-V33 HydrophobicContact CG-CG2 3.94Å; P31-V33 WeakPolarHBondContact O-CG2 3.47Å; P31-V33 PolarHBondContact O-N 3.32Å
34	N	62.3	Low	60.3	Low	161 Å²	161	101.5 Å²	101.5	86%	0.861	55%	0.552	S	S	*	*			trans	-126.4	79.7	-175.1	-74.6	-35.6	0	0	0	111.2	D32	D32-N34 PolarHBondContact O-N 3.01Å
35	Y	80.3	Confident	62.8	Low	51 Å²	51	97.9 Å²	97.9	20%	0.2	54%	0.535	C	S	.	.			trans	-123.4	157.7	162	61.6	-95	0	0	0	109.5	D32 V37 H66 L352 A358	D32-Y35 VanDerWaalsContact O-CD1 3.27Å; D32-Y35 WeakPolarHBondContact O-CD1 3.46Å; D32-Y35 WeakPolarHBondContact O-CE1 3.37Å; Y35-V37 HydrophobicContact CD2-CG2 4.02Å; Y35-V37 HydrophobicContact CE2-CG2 4.06Å; Y35-H66 AromaticContact CE1-CD2 3.92Å; Y35-H66 HydrophobicContact CE2-CB 4.11Å; Y35-H66 AromaticContact CE2-CD2 3.52Å; Y35-H66 AromaticContact CZ-CD2 3.37Å; Y35-H66 AromaticContact CZ-NE2 3.96Å; Y35-H66 PolarHBondContact OH-CD2 3.44Å; Y35-L352 HydrophobicContact CD1-CD2 4.4Å; Y35-L352 HydrophobicContact CD2-CD2 3.22Å; Y35-L352 HydrophobicContact CD2-CG 3.75Å; Y35-L352 HydrophobicContact CE1-CD1 4.31Å; Y35-L352 HydrophobicContact CE1-CD2 4.45Å; Y35-L352 HydrophobicContact CE1-CG 4.23Å; Y35-L352 HydrophobicContact CE2-CB 4.25Å; Y35-L352 HydrophobicContact CE2-CD1 4.18Å; Y35-L352 HydrophobicContact CE2-CD2 3.32Å; Y35-L352 HydrophobicContact CE2-CG 3.24Å; Y35-L352 HydrophobicContact CG-CD2 3.83Å; Y35-L352 HydrophobicContact CG-CG 4.45Å; Y35-L352 PolarHBondContact OH-O 3.5Å; Y35-A358 WeakPolarHBondContact OH-CB 3.21Å
36	V	81.1	Confident	65.6	Low	91 Å²	91	95.1 Å²	95.1	55%	0.552	52%	0.523	S	S	*	.			trans	-123.2	131.7	-179.3	175.9	0	0	0	0	108.6	E38 H66 P68	V36-E38 HydrophobicContact CG1-CG 4.05Å; V36-H66 WeakPolarHBondContact CA-O 3.25Å; V36-P68 HydrophobicContact CG1-CG 3.73Å
37	V	83.1	Confident	68.4	Low	4 Å²	4	89.8 Å²	89.8	2%	0.024	49%	0.492	C	S	.	.			trans	-108.1	109.7	175.4	-176.1	0	0	0	0	108.7	Y35 P40 H66 C67 D349 L352 L353	Y35-V37 HydrophobicContact CD2-CG2 4.02Å; Y35-V37 HydrophobicContact CE2-CG2 4.06Å; V37-P40 HydrophobicContact CG1-CB 4.45Å; V37-H66 PolarHBondContact N-O 3.47Å; V37-C67 PolarHBondContact O-SG 2.97Å; V37-D349 HydrophobicContact CG1-CB 3.94Å; V37-L352 HydrophobicContact CG2-CB 4.16Å; V37-L352 HydrophobicContact CG2-CD2 3.88Å; V37-L352 HydrophobicContact CG2-CG 4.37Å; V37-L353 HydrophobicContact CB-CD2 3.84Å; V37-L353 HydrophobicContact CB-CG 4.38Å; V37-L353 HydrophobicContact CG1-CD1 4.49Å; V37-L353 HydrophobicContact CG1-CD2 4.33Å; V37-L353 HydrophobicContact CG1-CG 4.34Å; V37-L353 HydrophobicContact CG2-CD2 3.86Å; V37-L353 HydrophobicContact CG2-CG 4.41Å
38	E	71.6	Confident	71.2	Confident	149 Å²	149	84.4 Å²	84.4	70%	0.696	46%	0.458	S	S	*	.			trans	-89.5	-28	-173.9	-66.8	-173	160.2	0	0	113.8	V36 P40	V36-E38 HydrophobicContact CG1-CG 4.05Å; E38-P40 VanDerWaalsContact C-CD 3.42Å; E38-P40 WeakPolarHBondContact O-CD 3.37Å
39	N	66.3	Low	73.9	Confident	140 Å²	140	78.8 Å²	78.8	75%	0.749	44%	0.443	S	S	*	.			trans	-126.3	62.5	-171.1	-159.8	-0.9	0	0	0	113.7
40	P	72.4	Confident	76.1	Confident	21 Å²	21	75.9 Å²	75.9	14%	0.136	43%	0.43	C	S	.	.			trans	-80.4	141.5	175.3	34.3	-35.7	0	0	0	111.8	V37 E38 L42 C67 L70 L353	V37-P40 HydrophobicContact CG1-CB 4.45Å; E38-P40 VanDerWaalsContact C-CD 3.42Å; E38-P40 WeakPolarHBondContact O-CD 3.37Å; P40-L42 HydrophobicContact CB-CB 4.15Å; P40-L42 PolarHBondContact O-N 2.81Å; P40-C67 VanDerWaalsContact CG-SG 3.57Å; P40-L70 HydrophobicContact CB-CD1 4.25Å; P40-L70 HydrophobicContact CG-CD1 3.54Å; P40-L70 HydrophobicContact CG-CG 4.01Å; P40-L353 HydrophobicContact CB-CD1 3.43Å; P40-L353 VanDerWaalsContact CB-CD1 3.43Å; P40-L353 HydrophobicContact CG-CD1 4Å
41	S	83.7	Confident	78.6	Confident	99 Å²	99	72.4 Å²	72.4	69%	0.692	40%	0.401	S	S	*	.			trans	-91.7	24.1	168.3	74.1	0	0	0	0	111.7	N350	S41-N350 PolarHBondContact N-OD1 3.44Å; S41-N350 PolarHBondContact OG-ND2 3.34Å
42	L	87.4	Confident	80.8	Confident	39 Å²	39	70.7 Å²	70.7	20%	0.204	39%	0.391	C	S	.	.			trans	-78.6	125.4	-170.7	-175.5	70.5	0	0	0	111	P40 L44 Y47 I63 L70 L353	P40-L42 HydrophobicContact CB-CB 4.15Å; P40-L42 PolarHBondContact O-N 2.81Å; L42-L44 HydrophobicContact CD2-CD2 4.37Å; L42-L44 PolarHBondContact O-N 3.42Å; L42-Y47 HydrophobicContact CD1-CD2 4.16Å; L42-Y47 HydrophobicContact CD1-CG 4.47Å; L42-I63 HydrophobicContact CD2-CD1 3.86Å; L42-I63 HydrophobicContact CD2-CG1 4.38Å; L42-I63 HydrophobicContact CD2-CG2 4.48Å; L42-L70 HydrophobicContact CB-CD1 4.22Å; L42-L70 HydrophobicContact CD2-CD1 4.45Å; L42-L353 HydrophobicContact CB-CD1 4.44Å; L42-L353 HydrophobicContact CD2-CB 4.41Å; L42-L353 HydrophobicContact CD2-CD1 3.97Å
43	D	90.4	Very high	82.8	Confident	90 Å²	90	66.9 Å²	66.9	48%	0.481	38%	0.377	S	S	.	.			trans	-82.1	104.7	168.2	-179.8	-18.3	0	0	0	109.5	E45 Q46 Y47	D43-E45 PolarHBondContact OD1-N 3.5Å; D43-E45 VanDerWaalsContact OD1-N 3.15Å; D43-Q46 HydrophobicContact CB-CB 4.27Å; D43-Q46 PolarHBondContact OD1-N 3.4Å; D43-Q46 WeakPolarHBondContact OD2-CB 3.39Å; D43-Y47 WeakPolarHBondContact O-CB 3.29Å; D43-Y47 PolarHBondContact O-N 2.93Å; D43-Y47 VanDerWaalsContact O-N 3.14Å
44	L	88.9	Confident	84.6	Confident	6 Å²	6	63.2 Å²	63.2	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-67	-39.7	-177	-76.8	171.3	0	0	0	112.3	L42 Y47 A48 I63 L70 E73 A74 M77	L42-L44 HydrophobicContact CD2-CD2 4.37Å; L42-L44 PolarHBondContact O-N 3.42Å; L44-Y47 PolarHBondContact O-N 2.95Å; L44-A48 VanDerWaalsContact O-CB 3.25Å; L44-A48 WeakPolarHBondContact O-CB 3.47Å; L44-A48 PolarHBondContact O-N 3.05Å; L44-I63 HydrophobicContact CD2-CD1 4.25Å; L44-I63 HydrophobicContact CD2-CG2 4.01Å; L44-L70 HydrophobicContact CD1-CB 4Å; L44-L70 HydrophobicContact CD1-CD1 4.33Å; L44-L70 HydrophobicContact CD1-CD2 3.79Å; L44-L70 HydrophobicContact CD1-CG 4.24Å; L44-L70 HydrophobicContact CD2-CB 4.49Å; L44-L70 HydrophobicContact CD2-CD1 4.19Å; L44-L70 HydrophobicContact CG-CD1 4.1Å; L44-L70 HydrophobicContact CG-CD2 4.3Å; L44-E73 HydrophobicContact CD1-CB 3.9Å; L44-A74 HydrophobicContact CD2-CB 4.31Å; L44-M77 HydrophobicContact CB-CE 4.01Å; L44-M77 HydrophobicContact CB-SD 4.22Å
45	E	90.8	Very high	85.9	Confident	118 Å²	118	55.6 Å²	55.6	55%	0.551	31%	0.313	S	S	*	.	H	α-helix	trans	-64	-50.3	-176.5	-71.8	75.1	-171.6	0	0	110.6	D43 Y47 A48 A49 M77	D43-E45 PolarHBondContact OD1-N 3.5Å; D43-E45 VanDerWaalsContact OD1-N 3.15Å; E45-Y47 VanDerWaalsContact C-N 3.33Å; E45-Y47 PolarHBondContact O-N 3.22Å; E45-A48 PolarHBondContact O-N 3.02Å; E45-A49 VanDerWaalsContact O-CB 3.31Å; E45-A49 WeakPolarHBondContact O-CB 3.45Å; E45-A49 PolarHBondContact O-N 3Å; E45-M77 VanDerWaalsContact CD-CE 3.41Å; E45-M77 HydrophobicContact CG-CE 3.68Å; E45-M77 WeakPolarHBondContact OE1-CE 3.46Å
46	Q	91.1	Very high	86.5	Confident	130 Å²	130	55.4 Å²	55.4	61%	0.607	31%	0.313	S	S	*	.	H	α-helix	trans	-65.1	-40.1	178.4	-173.8	60.7	32.2	0	0	111	D43 A49 S50	D43-Q46 HydrophobicContact CB-CB 4.27Å; D43-Q46 PolarHBondContact OD1-N 3.4Å; D43-Q46 WeakPolarHBondContact OD2-CB 3.39Å; Q46-A49 PolarHBondContact O-N 2.84Å; Q46-S50 PolarHBondContact O-N 3.49Å
47	Y	90.9	Very high	87.1	Confident	30 Å²	30	51.2 Å²	51.2	12%	0.118	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-47.2	178.2	-168.6	-97.8	0	0	0	111.8	L42 D43 L44 E45 A49 S50 Y51 R59 I63 D354	L42-Y47 HydrophobicContact CD1-CD2 4.16Å; L42-Y47 HydrophobicContact CD1-CG 4.47Å; D43-Y47 WeakPolarHBondContact O-CB 3.29Å; D43-Y47 PolarHBondContact O-N 2.93Å; D43-Y47 VanDerWaalsContact O-N 3.14Å; L44-Y47 PolarHBondContact O-N 2.95Å; E45-Y47 VanDerWaalsContact C-N 3.33Å; E45-Y47 PolarHBondContact O-N 3.22Å; Y47-A49 VanDerWaalsContact C-N 3.33Å; Y47-A49 PolarHBondContact O-N 3.07Å; Y47-S50 PolarHBondContact O-N 3.44Å; Y47-S50 PolarHBondContact O-OG 3.04Å; Y47-Y51 HydrophobicContact CE1-CE2 4.47Å; Y47-Y51 HydrophobicContact CE2-CE2 4.38Å; Y47-Y51 WeakPolarHBondContact O-CD2 3.34Å; Y47-R59 HydrophobicContact CE1-CB 4.23Å; Y47-R59 PolarHBondContact OH-NH1 3.44Å; Y47-I63 HydrophobicContact CD1-CD1 3.78Å; Y47-I63 HydrophobicContact CE1-CD1 3.56Å; Y47-D354 PolarHBondContact OH-OD2 3.47Å
48	A	91.4	Very high	87.5	Confident	9 Å²	9	54 Å²	54	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-38.3	177.1	0	0	0	0	0	112.1	L44 E45 S50 Y51 R56 L60 M77	L44-A48 VanDerWaalsContact O-CB 3.25Å; L44-A48 WeakPolarHBondContact O-CB 3.47Å; L44-A48 PolarHBondContact O-N 3.05Å; E45-A48 PolarHBondContact O-N 3.02Å; A48-S50 PolarHBondContact O-N 3.34Å; A48-Y51 PolarHBondContact O-N 3.12Å; A48-R56 PolarHBondContact O-NE 3.47Å; A48-R56 PolarHBondContact O-NH2 3.46Å; A48-R56 VanDerWaalsContact O-NH2 3.1Å; A48-L60 HydrophobicContact CB-CD1 4.37Å; A48-L60 HydrophobicContact CB-CD2 4.24Å; A48-M77 HydrophobicContact CB-SD 4.36Å
49	A	91.4	Very high	88.6	Confident	63 Å²	63	47 Å²	47	52%	0.521	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-31.4	178.9	0	0	0	0	0	112.9	E45 Q46 Y47 Y51 R56	E45-A49 VanDerWaalsContact O-CB 3.31Å; E45-A49 WeakPolarHBondContact O-CB 3.45Å; E45-A49 PolarHBondContact O-N 3Å; Q46-A49 PolarHBondContact O-N 2.84Å; Y47-A49 VanDerWaalsContact C-N 3.33Å; Y47-A49 PolarHBondContact O-N 3.07Å; A49-Y51 VanDerWaalsContact C-N 3.28Å; A49-Y51 PolarHBondContact O-N 3.18Å; A49-R56 PolarHBondContact O-NH2 2.9Å
50	S	90.6	Very high	89.9	Confident	39 Å²	39	40.4 Å²	40.4	27%	0.273	23%	0.232	S	C	.	.	H	α-helix	trans	-70.7	-18.8	-178.6	73.8	0	0	0	0	114.8	Q46 Y47 A48 P280	Q46-S50 PolarHBondContact O-N 3.49Å; Y47-S50 PolarHBondContact O-N 3.44Å; Y47-S50 PolarHBondContact O-OG 3.04Å; A48-S50 PolarHBondContact O-N 3.34Å; S50-P280 WeakPolarHBondContact O-CB 3.29Å
51	Y	92.2	Very high	90.9	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.008	23%	0.23	C	C	.	.			trans	-112.4	161.6	-176.8	-72.2	-70	0	0	0	112.6	Y47 A48 A49 M55 R56 R59 P280 S284 N287	Y47-Y51 HydrophobicContact CE1-CE2 4.47Å; Y47-Y51 HydrophobicContact CE2-CE2 4.38Å; Y47-Y51 WeakPolarHBondContact O-CD2 3.34Å; A48-Y51 PolarHBondContact O-N 3.12Å; A49-Y51 VanDerWaalsContact C-N 3.28Å; A49-Y51 PolarHBondContact O-N 3.18Å; Y51-M55 HydrophobicContact CD1-CG 3.73Å; Y51-M55 HydrophobicContact CE1-CG 4.23Å; Y51-M55 HydrophobicContact CG-CG 4.43Å; Y51-R56 PolarHBondContact O-NE 3.1Å; Y51-R56 PolarHBondContact O-NH2 3.15Å; Y51-R59 VanDerWaalsContact CZ-CZ 3.42Å; Y51-R59 VanDerWaalsContact OH-CZ 3.25Å; Y51-R59 PolarHBondContact OH-NH1 3.29Å; Y51-R59 PolarHBondContact OH-NH2 3.29Å; Y51-P280 WeakPolarHBondContact CA-O 3.22Å; Y51-P280 WeakPolarHBondContact CD1-O 3.46Å; Y51-S284 PolarHBondContact OH-N 3.43Å; Y51-S284 VanDerWaalsContact OH-N 3.1Å; Y51-S284 PolarHBondContact OH-OG 3.47Å; Y51-N287 PolarHBondContact OH-OD1 3.17Å
52	S	91	Very high	91.4	Very high	35 Å²	35	37.4 Å²	37.4	25%	0.245	20%	0.204	C	C	.	.			trans	-142.5	168.8	172.9	69.2	0	0	0	0	112.1	R56 P280	S52-R56 PolarHBondContact O-N 2.97Å; S52-P280 PolarHBondContact N-O 3.31Å
53	G	89.1	Confident	91.6	Very high	30 Å²	30	35.5 Å²	35.5	31%	0.309	20%	0.195	S	C	.	.	H	α-helix	trans	63	-147.9	177.9	0	0	0	0	0	114	M55 R56 F81	G53-M55 VanDerWaalsContact C-N 3.27Å; G53-M55 PolarHBondContact O-N 2.95Å; G53-R56 PolarHBondContact O-N 3.32Å; G53-F81 WeakPolarHBondContact O-CE1 3.31Å
54	L	89.7	Confident	91.7	Very high	21 Å²	21	31.3 Å²	31.3	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-35.1	179.3	-69.6	171.4	0	0	0	112.3	R56 I57 E58 L173 L178 Y211	L54-R56 VanDerWaalsContact C-N 3.29Å; L54-R56 PolarHBondContact O-N 3.11Å; L54-I57 HydrophobicContact CD2-CD1 4.35Å; L54-I57 WeakPolarHBondContact O-CA 3.35Å; L54-I57 WeakPolarHBondContact O-CB 3.46Å; L54-I57 PolarHBondContact O-N 3.43Å; L54-E58 PolarHBondContact O-N 3.27Å; L54-L173 HydrophobicContact CD1-CD2 4.35Å; L54-L178 HydrophobicContact CD1-CD2 3.77Å; L54-Y211 HydrophobicContact CB-CD1 4.19Å; L54-Y211 HydrophobicContact CB-CE1 3.71Å; L54-Y211 HydrophobicContact CB-CE2 4.37Å; L54-Y211 HydrophobicContact CD1-CD2 4.31Å; L54-Y211 HydrophobicContact CD1-CE2 4.35Å
55	M	90.9	Very high	91.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-41.1	178	-171.4	58	63.2	0	0	112.6	Y51 G53 I57 R59 V210 Y211 M355 Y356	Y51-M55 HydrophobicContact CD1-CG 3.73Å; Y51-M55 HydrophobicContact CE1-CG 4.23Å; Y51-M55 HydrophobicContact CG-CG 4.43Å; G53-M55 VanDerWaalsContact C-N 3.27Å; G53-M55 PolarHBondContact O-N 2.95Å; M55-I57 VanDerWaalsContact C-N 3.33Å; M55-I57 PolarHBondContact O-N 2.98Å; M55-R59 VanDerWaalsContact O-CB 3.31Å; M55-R59 WeakPolarHBondContact O-CB 3.5Å; M55-R59 WeakPolarHBondContact O-CG 3.43Å; M55-R59 PolarHBondContact O-N 2.92Å; M55-R59 HydrophobicContact SD-CG 4.22Å; M55-V210 HydrophobicContact CE-CG1 4.26Å; M55-Y211 HydrophobicContact CB-CE1 4.17Å; M55-Y211 HydrophobicContact CE-CD1 4.42Å; M55-Y211 HydrophobicContact CE-CE1 3.81Å; M55-M355 HydrophobicContact SD-CE 3.73Å; M55-Y356 HydrophobicContact CE-CE2 3.86Å; M55-Y356 WeakPolarHBondContact CE-OH 3.42Å; M55-Y356 HydrophobicContact SD-CE2 3.7Å
56	R	93.1	Very high	91.8	Very high	48 Å²	48	30 Å²	30	18%	0.181	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-42.5	175.2	-176.8	-172.9	-75.3	-155	-4.7	111.1	A48 A49 Y51 S52 G53 L54 L60 F81	A48-R56 PolarHBondContact O-NE 3.47Å; A48-R56 PolarHBondContact O-NH2 3.46Å; A48-R56 VanDerWaalsContact O-NH2 3.1Å; A49-R56 PolarHBondContact O-NH2 2.9Å; Y51-R56 PolarHBondContact O-NE 3.1Å; Y51-R56 PolarHBondContact O-NH2 3.15Å; S52-R56 PolarHBondContact O-N 2.97Å; G53-R56 PolarHBondContact O-N 3.32Å; L54-R56 VanDerWaalsContact C-N 3.29Å; L54-R56 PolarHBondContact O-N 3.11Å; R56-L60 HydrophobicContact CG-CD1 4.06Å; R56-L60 WeakPolarHBondContact O-CB 3.48Å; R56-L60 WeakPolarHBondContact O-CG 3.36Å; R56-L60 PolarHBondContact O-N 2.88Å; R56-L60 VanDerWaalsContact O-N 3.11Å; R56-F81 HydrophobicContact CB-CE1 4.44Å
57	I	92.3	Very high	91.8	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-69	-45.7	-176.6	-63.1	161.9	0	0	0	110.9	L54 M55 Q61 F81 V82 M90 I94	L54-I57 HydrophobicContact CD2-CD1 4.35Å; L54-I57 WeakPolarHBondContact O-CA 3.35Å; L54-I57 WeakPolarHBondContact O-CB 3.46Å; L54-I57 PolarHBondContact O-N 3.43Å; M55-I57 VanDerWaalsContact C-N 3.33Å; M55-I57 PolarHBondContact O-N 2.98Å; I57-Q61 WeakPolarHBondContact O-CG 3.36Å; I57-Q61 PolarHBondContact O-N 3.42Å; I57-Q61 VanDerWaalsContact O-N 3.11Å; I57-Q61 PolarHBondContact O-NE2 2.74Å; I57-F81 HydrophobicContact CD1-CD1 3.86Å; I57-F81 HydrophobicContact CD1-CE1 3.99Å; I57-F81 HydrophobicContact CG1-CD1 3.6Å; I57-F81 HydrophobicContact CG1-CE1 4.02Å; I57-V82 HydrophobicContact CD1-CG2 3.65Å; I57-V82 HydrophobicContact CG1-CG2 3.83Å; I57-V82 HydrophobicContact CG2-CG2 4.08Å; I57-M90 HydrophobicContact CG2-CE 3.98Å; I57-I94 HydrophobicContact CG2-CD1 3.94Å
58	E	92.1	Very high	91.6	Very high	62 Å²	62	24.7 Å²	24.7	29%	0.29	15%	0.149	S	C	.	.	H	α-helix	trans	-67	-44.1	179.1	-68.9	179.8	160.9	0	0	111.6	L54 L60 Q61 F62 M355	L54-E58 PolarHBondContact O-N 3.27Å; E58-L60 PolarHBondContact O-N 3.45Å; E58-Q61 PolarHBondContact O-N 3Å; E58-F62 WeakPolarHBondContact O-CB 3.41Å; E58-F62 PolarHBondContact O-N 2.9Å; E58-M355 HydrophobicContact CB-CE 4.41Å; E58-M355 HydrophobicContact CB-SD 3.79Å
59	R	94	Very high	91.4	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-41.5	177	-76.7	-175.7	170.9	-107.2	-0.8	112.8	Y47 Y51 M55 F62 I63 N287 Y291 D354 M355	Y47-R59 HydrophobicContact CE1-CB 4.23Å; Y47-R59 PolarHBondContact OH-NH1 3.44Å; Y51-R59 VanDerWaalsContact CZ-CZ 3.42Å; Y51-R59 VanDerWaalsContact OH-CZ 3.25Å; Y51-R59 PolarHBondContact OH-NH1 3.29Å; Y51-R59 PolarHBondContact OH-NH2 3.29Å; M55-R59 VanDerWaalsContact O-CB 3.31Å; M55-R59 WeakPolarHBondContact O-CB 3.5Å; M55-R59 WeakPolarHBondContact O-CG 3.43Å; M55-R59 PolarHBondContact O-N 2.92Å; M55-R59 HydrophobicContact SD-CG 4.22Å; R59-F62 PolarHBondContact O-N 3.34Å; R59-I63 WeakPolarHBondContact O-CG1 3.36Å; R59-I63 PolarHBondContact O-N 3.27Å; R59-I63 VanDerWaalsContact O-N 3.09Å; R59-N287 PolarHBondContact NH1-OD1 3.15Å; R59-Y291 PolarHBondContact NH2-OH 2.9Å; R59-Y291 VanDerWaalsContact NH2-OH 3.17Å; R59-D354 IonicContact CZ-OD2 2.84Å; R59-D354 IonicContact NH1-OD2 2.72Å; R59-D354 PolarHBondContact NH1-OD2 3.48Å; R59-D354 IonicContact NH2-OD2 3.91Å; R59-M355 HydrophobicContact CG-CB 4.2Å; R59-M355 HydrophobicContact CG-CE 4.35Å; R59-M355 HydrophobicContact CG-SD 4.31Å
60	L	94.2	Very high	91.3	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-65.9	-40	176.9	-78	170.7	0	0	0	112.2	A48 R56 E58 I63 A64 A74 M77 A78	A48-L60 HydrophobicContact CB-CD1 4.37Å; A48-L60 HydrophobicContact CB-CD2 4.24Å; R56-L60 HydrophobicContact CG-CD1 4.06Å; R56-L60 WeakPolarHBondContact O-CB 3.48Å; R56-L60 WeakPolarHBondContact O-CG 3.36Å; R56-L60 PolarHBondContact O-N 2.88Å; R56-L60 VanDerWaalsContact O-N 3.11Å; E58-L60 PolarHBondContact O-N 3.45Å; L60-I63 PolarHBondContact O-N 3.23Å; L60-A64 WeakPolarHBondContact O-CB 3.14Å; L60-A64 PolarHBondContact O-N 3.23Å; L60-A74 HydrophobicContact CD2-CB 4.3Å; L60-M77 HydrophobicContact CD1-CB 4.09Å; L60-A78 HydrophobicContact CB-CB 4.01Å; L60-A78 HydrophobicContact CD1-CB 4.01Å
61	Q	93.2	Very high	91.2	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.093	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-40.4	174.1	-79.8	175.7	87.7	0	0	112.3	I57 E58 I63 A64 D65 I94	I57-Q61 WeakPolarHBondContact O-CG 3.36Å; I57-Q61 PolarHBondContact O-N 3.42Å; I57-Q61 VanDerWaalsContact O-N 3.11Å; I57-Q61 PolarHBondContact O-NE2 2.74Å; E58-Q61 PolarHBondContact O-N 3Å; Q61-I63 VanDerWaalsContact C-N 3.3Å; Q61-I63 PolarHBondContact O-N 2.87Å; Q61-A64 WeakPolarHBondContact O-CB 3.2Å; Q61-A64 PolarHBondContact O-N 2.78Å; Q61-A64 VanDerWaalsContact O-N 3.09Å; Q61-D65 VanDerWaalsContact O-CG 3.29Å; Q61-D65 PolarHBondContact O-N 2.99Å; Q61-I94 HydrophobicContact CG-CG1 4.2Å
62	F	93.8	Very high	91.1	Very high	36 Å²	36	30.2 Å²	30.2	16%	0.158	16%	0.164	C	C	.	.	H	α-helix	trans	-57.7	-45.8	176.3	-172.6	-88.4	0	0	0	111.2	E58 R59 A64 D65 H66 L353 M355 A358	E58-F62 WeakPolarHBondContact O-CB 3.41Å; E58-F62 PolarHBondContact O-N 2.9Å; R59-F62 PolarHBondContact O-N 3.34Å; F62-A64 VanDerWaalsContact C-N 3.34Å; F62-A64 PolarHBondContact O-N 3.4Å; F62-D65 PolarHBondContact O-N 3.41Å; F62-H66 AromaticContact CD1-ND1 3.88Å; F62-H66 AromaticContact CD2-CE1 3.68Å; F62-H66 AromaticContact CD2-ND1 3.97Å; F62-H66 AromaticContact CE1-CE1 3.96Å; F62-H66 AromaticContact CE1-ND1 3.75Å; F62-H66 AromaticContact CE2-CE1 3.3Å; F62-H66 WeakPolarHBondContact CE2-CE1 3.33Å; F62-H66 AromaticContact CE2-ND1 3.86Å; F62-H66 AromaticContact CE2-NE2 4Å; F62-H66 AromaticContact CG-ND1 3.98Å; F62-H66 AromaticContact CZ-CE1 3.46Å; F62-H66 VanDerWaalsContact CZ-CE1 3.46Å; F62-H66 WeakPolarHBondContact CZ-CE1 3.37Å; F62-H66 AromaticContact CZ-ND1 3.74Å; F62-H66 AromaticContact CZ-NE2 3.88Å; F62-H66 PolarHBondContact O-N 2.91Å; F62-H66 PolarHBondContact O-ND1 3.46Å; F62-L353 WeakPolarHBondContact CD1-O 3.48Å; F62-M355 HydrophobicContact CB-CB 4.19Å; F62-M355 HydrophobicContact CB-CG 4.26Å; F62-M355 HydrophobicContact CD1-CB 4.2Å; F62-M355 HydrophobicContact CD2-CB 4.19Å; F62-M355 HydrophobicContact CD2-CG 3.9Å; F62-M355 HydrophobicContact CE2-CG 4.47Å; F62-M355 HydrophobicContact CG-CB 3.92Å; F62-M355 HydrophobicContact CG-CG 4.06Å; F62-A358 HydrophobicContact CE1-CB 4.21Å; F62-A358 HydrophobicContact CZ-CB 3.99Å
63	I	93.2	Very high	91	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-43.9	174.9	-64.9	163	0	0	0	110.7	L42 L44 Y47 R59 L60 Q61 D65 H66 C67 L70 L353	L42-I63 HydrophobicContact CD2-CD1 3.86Å; L42-I63 HydrophobicContact CD2-CG1 4.38Å; L42-I63 HydrophobicContact CD2-CG2 4.48Å; L44-I63 HydrophobicContact CD2-CD1 4.25Å; L44-I63 HydrophobicContact CD2-CG2 4.01Å; Y47-I63 HydrophobicContact CD1-CD1 3.78Å; Y47-I63 HydrophobicContact CE1-CD1 3.56Å; R59-I63 WeakPolarHBondContact O-CG1 3.36Å; R59-I63 PolarHBondContact O-N 3.27Å; R59-I63 VanDerWaalsContact O-N 3.09Å; L60-I63 PolarHBondContact O-N 3.23Å; Q61-I63 VanDerWaalsContact C-N 3.3Å; Q61-I63 PolarHBondContact O-N 2.87Å; I63-D65 VanDerWaalsContact C-N 3.3Å; I63-D65 PolarHBondContact O-N 3.31Å; I63-H66 PolarHBondContact O-N 3.33Å; I63-C67 HydrophobicContact CG2-CB 4.24Å; I63-C67 WeakPolarHBondContact O-CA 3.42Å; I63-C67 VanDerWaalsContact O-CB 3.24Å; I63-C67 WeakPolarHBondContact O-CB 3.42Å; I63-C67 PolarHBondContact O-N 2.93Å; I63-L70 HydrophobicContact CG2-CB 4.33Å; I63-L353 HydrophobicContact CG1-CB 4.41Å
64	A	91.6	Very high	91.2	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-36.8	-179.8	0	0	0	0	0	113.2	L60 Q61 F62 R71 A74 L75	L60-A64 WeakPolarHBondContact O-CB 3.14Å; L60-A64 PolarHBondContact O-N 3.23Å; Q61-A64 WeakPolarHBondContact O-CB 3.2Å; Q61-A64 PolarHBondContact O-N 2.78Å; Q61-A64 VanDerWaalsContact O-N 3.09Å; F62-A64 VanDerWaalsContact C-N 3.34Å; F62-A64 PolarHBondContact O-N 3.4Å; A64-R71 HydrophobicContact CB-CG 4.13Å; A64-R71 WeakPolarHBondContact O-CG 3.48Å; A64-R71 PolarHBondContact O-NE 3.43Å; A64-A74 HydrophobicContact CB-CB 4.14Å; A64-L75 HydrophobicContact CB-CD1 4.34Å; A64-L75 HydrophobicContact CB-CD2 3.94Å; A64-L75 HydrophobicContact CB-CG 3.76Å
65	D	91.4	Very high	91.3	Very high	76 Å²	76	30.1 Å²	30.1	41%	0.406	15%	0.151	S	C	.	.	H	α-helix	trans	-70.5	-41.6	179.7	-67.5	-24.4	0	0	0	111.1	Q61 F62 I63 R71 K97	Q61-D65 VanDerWaalsContact O-CG 3.29Å; Q61-D65 PolarHBondContact O-N 2.99Å; F62-D65 PolarHBondContact O-N 3.41Å; I63-D65 VanDerWaalsContact C-N 3.3Å; I63-D65 PolarHBondContact O-N 3.31Å; D65-R71 PolarHBondContact O-NH2 2.99Å; D65-K97 IonicContact OD1-NZ 3.82Å; D65-K97 PolarHBondContact OD1-NZ 3.07Å; D65-K97 IonicContact OD2-NZ 3.17Å; D65-K97 PolarHBondContact OD2-NZ 3.5Å
66	H	90.6	Very high	91.3	Very high	21 Å²	21	34.1 Å²	34.1	10%	0.097	17%	0.169	C	C	.	.	H	α-helix	trans	-93.5	-17.8	-173.7	-61.4	82.7	0	0	0	114.8	Y35 V36 V37 F62 I63 L353	Y35-H66 AromaticContact CE1-CD2 3.92Å; Y35-H66 HydrophobicContact CE2-CB 4.11Å; Y35-H66 AromaticContact CE2-CD2 3.52Å; Y35-H66 AromaticContact CZ-CD2 3.37Å; Y35-H66 AromaticContact CZ-NE2 3.96Å; Y35-H66 PolarHBondContact OH-CD2 3.44Å; V36-H66 WeakPolarHBondContact CA-O 3.25Å; V37-H66 PolarHBondContact N-O 3.47Å; F62-H66 AromaticContact CD1-ND1 3.88Å; F62-H66 AromaticContact CD2-CE1 3.68Å; F62-H66 AromaticContact CD2-ND1 3.97Å; F62-H66 AromaticContact CE1-CE1 3.96Å; F62-H66 AromaticContact CE1-ND1 3.75Å; F62-H66 AromaticContact CE2-CE1 3.3Å; F62-H66 WeakPolarHBondContact CE2-CE1 3.33Å; F62-H66 AromaticContact CE2-ND1 3.86Å; F62-H66 AromaticContact CE2-NE2 4Å; F62-H66 AromaticContact CG-ND1 3.98Å; F62-H66 AromaticContact CZ-CE1 3.46Å; F62-H66 VanDerWaalsContact CZ-CE1 3.46Å; F62-H66 WeakPolarHBondContact CZ-CE1 3.37Å; F62-H66 AromaticContact CZ-ND1 3.74Å; F62-H66 AromaticContact CZ-NE2 3.88Å; F62-H66 PolarHBondContact O-N 2.91Å; F62-H66 PolarHBondContact O-ND1 3.46Å; I63-H66 PolarHBondContact O-N 3.33Å; H66-L353 HydrophobicContact CB-CD2 4.24Å
67	C	90.6	Very high	91.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.			trans	-122.3	104.8	-178.3	-170.6	0	0	0	0	112.1	V37 P40 I63 T69 L70 R71 L353	V37-C67 PolarHBondContact O-SG 2.97Å; P40-C67 VanDerWaalsContact CG-SG 3.57Å; I63-C67 HydrophobicContact CG2-CB 4.24Å; I63-C67 WeakPolarHBondContact O-CA 3.42Å; I63-C67 VanDerWaalsContact O-CB 3.24Å; I63-C67 WeakPolarHBondContact O-CB 3.42Å; I63-C67 PolarHBondContact O-N 2.93Å; C67-T69 PolarHBondContact O-N 2.7Å; C67-T69 PolarHBondContact SG-OG1 3.17Å; C67-L70 HydrophobicContact CB-CB 4.28Å; C67-R71 WeakPolarHBondContact O-CB 3.45Å; C67-R71 PolarHBondContact O-N 2.88Å; C67-R71 VanDerWaalsContact O-N 3.09Å; C67-L353 HydrophobicContact CB-CD1 4.36Å; C67-L353 HydrophobicContact CB-CD2 3.8Å
68	P	87.1	Confident	91.2	Very high	48 Å²	48	33.5 Å²	33.5	31%	0.312	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-35.4	-176.9	25.5	-34	0	0	0	112.9	V36 R71	V36-P68 HydrophobicContact CG1-CG 3.73Å; P68-R71 WeakPolarHBondContact O-CB 3.43Å; P68-R71 PolarHBondContact O-N 3.07Å
69	T	87.4	Confident	91.1	Very high	91 Å²	91	31.3 Å²	31.3	56%	0.558	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-39.4	-178.2	51.6	0	0	0	0	112.1	C67	C67-T69 PolarHBondContact O-N 2.7Å; C67-T69 PolarHBondContact SG-OG1 3.17Å
70	L	88.9	Confident	91	Very high	34 Å²	34	33.5 Å²	33.5	18%	0.178	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-5.9	179.7	-66.1	-175.3	0	0	0	113.8	P40 L42 L44 I63 C67 V72 E73 A74	P40-L70 HydrophobicContact CB-CD1 4.25Å; P40-L70 HydrophobicContact CG-CD1 3.54Å; P40-L70 HydrophobicContact CG-CG 4.01Å; L42-L70 HydrophobicContact CB-CD1 4.22Å; L42-L70 HydrophobicContact CD2-CD1 4.45Å; L44-L70 HydrophobicContact CD1-CB 4Å; L44-L70 HydrophobicContact CD1-CD1 4.33Å; L44-L70 HydrophobicContact CD1-CD2 3.79Å; L44-L70 HydrophobicContact CD1-CG 4.24Å; L44-L70 HydrophobicContact CD2-CB 4.49Å; L44-L70 HydrophobicContact CD2-CD1 4.19Å; L44-L70 HydrophobicContact CG-CD1 4.1Å; L44-L70 HydrophobicContact CG-CD2 4.3Å; I63-L70 HydrophobicContact CG2-CB 4.33Å; C67-L70 HydrophobicContact CB-CB 4.28Å; L70-V72 PolarHBondContact O-N 3.46Å; L70-E73 PolarHBondContact O-N 3.47Å; L70-A74 VanDerWaalsContact O-CB 3.29Å; L70-A74 WeakPolarHBondContact O-CB 3.25Å; L70-A74 PolarHBondContact O-N 3Å
71	R	89.9	Confident	90.8	Very high	72 Å²	72	34.7 Å²	34.7	27%	0.272	18%	0.179	S	C	.	.	H	α-helix	trans	-54.2	-49.5	-173	-177.3	176.1	-65.5	155.8	-0.5	113.6	A64 D65 C67 P68 L75 A101	A64-R71 HydrophobicContact CB-CG 4.13Å; A64-R71 WeakPolarHBondContact O-CG 3.48Å; A64-R71 PolarHBondContact O-NE 3.43Å; D65-R71 PolarHBondContact O-NH2 2.99Å; C67-R71 WeakPolarHBondContact O-CB 3.45Å; C67-R71 PolarHBondContact O-N 2.88Å; C67-R71 VanDerWaalsContact O-N 3.09Å; P68-R71 WeakPolarHBondContact O-CB 3.43Å; P68-R71 PolarHBondContact O-N 3.07Å; R71-L75 HydrophobicContact CG-CD1 3.81Å; R71-L75 WeakPolarHBondContact O-CB 3.3Å; R71-L75 VanDerWaalsContact O-CG 3.24Å; R71-L75 WeakPolarHBondContact O-CG 3.39Å; R71-L75 PolarHBondContact O-N 3.49Å; R71-A101 HydrophobicContact CG-CB 4Å
72	V	88.8	Confident	90.7	Very high	32 Å²	32	33.8 Å²	33.8	19%	0.194	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-46.2	-174.4	176.6	0	0	0	0	110.9	L70 L75 K76 L98	L70-V72 PolarHBondContact O-N 3.46Å; V72-L75 PolarHBondContact O-N 3.04Å; V72-K76 HydrophobicContact CG1-CD 4.27Å; V72-K76 VanDerWaalsContact O-CG 3.31Å; V72-K76 WeakPolarHBondContact O-CG 3.45Å; V72-K76 PolarHBondContact O-N 3.38Å; V72-L98 HydrophobicContact CG1-CD1 4.46Å
73	E	89.4	Confident	90.4	Very high	83 Å²	83	36.4 Å²	36.4	39%	0.388	19%	0.188	S	C	.	.	H	α-helix	trans	-68.8	-41.3	179.7	-65.7	-51.9	125.4	0	0	111.9	L44 L70 L75 K76 M77	L44-E73 HydrophobicContact CD1-CB 3.9Å; L70-E73 PolarHBondContact O-N 3.47Å; E73-L75 PolarHBondContact O-N 3.38Å; E73-K76 PolarHBondContact O-N 3.42Å; E73-K76 IonicContact OE1-NZ 2.88Å; E73-K76 PolarHBondContact OE1-NZ 2.84Å; E73-M77 WeakPolarHBondContact O-CG 3.49Å; E73-M77 PolarHBondContact O-N 3.19Å
74	A	92.2	Very high	90.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-44	175.5	0	0	0	0	0	112.2	L44 L60 A64 L70 M77 A78	L44-A74 HydrophobicContact CD2-CB 4.31Å; L60-A74 HydrophobicContact CD2-CB 4.3Å; A64-A74 HydrophobicContact CB-CB 4.14Å; L70-A74 VanDerWaalsContact O-CB 3.29Å; L70-A74 WeakPolarHBondContact O-CB 3.25Å; L70-A74 PolarHBondContact O-N 3Å; A74-M77 PolarHBondContact O-N 2.99Å; A74-A78 WeakPolarHBondContact O-CB 3.47Å; A74-A78 PolarHBondContact O-N 3.46Å
75	L	92.1	Very high	89.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-37.9	177.5	-70.5	169.7	0	0	0	112.4	A64 R71 V72 E73 A78 L79 I94 K97 L98 A101	A64-L75 HydrophobicContact CB-CD1 4.34Å; A64-L75 HydrophobicContact CB-CD2 3.94Å; A64-L75 HydrophobicContact CB-CG 3.76Å; R71-L75 HydrophobicContact CG-CD1 3.81Å; R71-L75 WeakPolarHBondContact O-CB 3.3Å; R71-L75 VanDerWaalsContact O-CG 3.24Å; R71-L75 WeakPolarHBondContact O-CG 3.39Å; R71-L75 PolarHBondContact O-N 3.49Å; V72-L75 PolarHBondContact O-N 3.04Å; E73-L75 PolarHBondContact O-N 3.38Å; L75-A78 PolarHBondContact O-N 2.67Å; L75-L79 VanDerWaalsContact O-CB 3.32Å; L75-L79 WeakPolarHBondContact O-CB 3.3Å; L75-L79 PolarHBondContact O-N 2.89Å; L75-I94 HydrophobicContact CD2-CG2 4.07Å; L75-K97 HydrophobicContact CD1-CB 4.14Å; L75-K97 HydrophobicContact CD2-CB 4.06Å; L75-L98 HydrophobicContact CB-CB 4.23Å; L75-L98 HydrophobicContact CB-CD1 3.88Å; L75-L98 HydrophobicContact CD1-CB 4.3Å; L75-L98 HydrophobicContact CD1-CD1 4.43Å; L75-A101 HydrophobicContact CD1-CB 4.18Å
76	K	90.7	Very high	89.6	Confident	85 Å²	85	45 Å²	45	37%	0.37	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-46.6	173.5	-75.9	172	-177.4	169.3	0	111.7	V72 E73 L79 S80 L98	V72-K76 HydrophobicContact CG1-CD 4.27Å; V72-K76 VanDerWaalsContact O-CG 3.31Å; V72-K76 WeakPolarHBondContact O-CG 3.45Å; V72-K76 PolarHBondContact O-N 3.38Å; E73-K76 PolarHBondContact O-N 3.42Å; E73-K76 IonicContact OE1-NZ 2.88Å; E73-K76 PolarHBondContact OE1-NZ 2.84Å; K76-L79 PolarHBondContact O-N 3.2Å; K76-S80 PolarHBondContact O-N 3.26Å; K76-L98 HydrophobicContact CG-CD1 4.46Å
77	M	91.3	Very high	89.5	Confident	37 Å²	37	44.2 Å²	44.2	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.7	-69.6	-175.1	-166.8	0	0	111.3	L44 E45 A48 L60 E73 A74 S80 F81	L44-M77 HydrophobicContact CB-CE 4.01Å; L44-M77 HydrophobicContact CB-SD 4.22Å; E45-M77 VanDerWaalsContact CD-CE 3.41Å; E45-M77 HydrophobicContact CG-CE 3.68Å; E45-M77 WeakPolarHBondContact OE1-CE 3.46Å; A48-M77 HydrophobicContact CB-SD 4.36Å; L60-M77 HydrophobicContact CD1-CB 4.09Å; E73-M77 WeakPolarHBondContact O-CG 3.49Å; E73-M77 PolarHBondContact O-N 3.19Å; A74-M77 PolarHBondContact O-N 2.99Å; M77-S80 PolarHBondContact O-N 3.44Å; M77-S80 PolarHBondContact O-OG 2.99Å; M77-F81 PolarHBondContact O-N 3.37Å; M77-F81 VanDerWaalsContact O-N 3.12Å
78	A	92.4	Very high	89.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-45.8	177.2	0	0	0	0	0	111.4	L60 A74 L75 S80 F81 V82 I94	L60-A78 HydrophobicContact CB-CB 4.01Å; L60-A78 HydrophobicContact CD1-CB 4.01Å; A74-A78 WeakPolarHBondContact O-CB 3.47Å; A74-A78 PolarHBondContact O-N 3.46Å; L75-A78 PolarHBondContact O-N 2.67Å; A78-S80 PolarHBondContact O-N 3.31Å; A78-F81 PolarHBondContact O-N 3.09Å; A78-F81 VanDerWaalsContact O-N 3.15Å; A78-V82 WeakPolarHBondContact O-CG2 3.34Å; A78-V82 PolarHBondContact O-N 3.41Å; A78-I94 HydrophobicContact CB-CD1 3.96Å; A78-I94 HydrophobicContact CB-CG2 4.3Å
79	L	91	Very high	89.6	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-45.1	177.8	-166.2	73.6	0	0	0	111.7	L75 K76 F81 V82 Q83 Y91 I94 H95 L98	L75-L79 VanDerWaalsContact O-CB 3.32Å; L75-L79 WeakPolarHBondContact O-CB 3.3Å; L75-L79 PolarHBondContact O-N 2.89Å; K76-L79 PolarHBondContact O-N 3.2Å; L79-F81 PolarHBondContact O-N 2.88Å; L79-V82 PolarHBondContact O-N 3.14Å; L79-Q83 WeakPolarHBondContact O-CG 3.4Å; L79-Q83 PolarHBondContact O-N 3Å; L79-Y91 HydrophobicContact CD1-CD2 3.56Å; L79-Y91 HydrophobicContact CD1-CE2 3.52Å; L79-Y91 HydrophobicContact CG-CD2 4.45Å; L79-Y91 HydrophobicContact CG-CE2 4.14Å; L79-I94 HydrophobicContact CB-CG2 4.05Å; L79-I94 HydrophobicContact CD1-CB 4.41Å; L79-I94 HydrophobicContact CD1-CG2 4.01Å; L79-H95 HydrophobicContact CD1-CB 4.43Å; L79-L98 HydrophobicContact CD2-CD2 4.03Å
80	S	90.8	Very high	89.6	Confident	49 Å²	49	45.3 Å²	45.3	34%	0.343	21%	0.214	S	C	.	.	H	α-helix	trans	-61.6	-31.1	177.8	80.6	0	0	0	0	113	K76 M77 A78	K76-S80 PolarHBondContact O-N 3.26Å; M77-S80 PolarHBondContact O-N 3.44Å; M77-S80 PolarHBondContact O-OG 2.99Å; A78-S80 PolarHBondContact O-N 3.31Å
81	F	91	Very high	89.7	Confident	28 Å²	28	43.9 Å²	43.9	12%	0.123	21%	0.207	C	C	.	.	H	α-helix	trans	-81.2	-42.1	178.5	-174.5	-99	0	0	0	111.6	G53 R56 I57 M77 A78 L79 Q83 R84 T85	G53-F81 WeakPolarHBondContact O-CE1 3.31Å; R56-F81 HydrophobicContact CB-CE1 4.44Å; I57-F81 HydrophobicContact CD1-CD1 3.86Å; I57-F81 HydrophobicContact CD1-CE1 3.99Å; I57-F81 HydrophobicContact CG1-CD1 3.6Å; I57-F81 HydrophobicContact CG1-CE1 4.02Å; M77-F81 PolarHBondContact O-N 3.37Å; M77-F81 VanDerWaalsContact O-N 3.12Å; A78-F81 PolarHBondContact O-N 3.09Å; A78-F81 VanDerWaalsContact O-N 3.15Å; L79-F81 PolarHBondContact O-N 2.88Å; F81-Q83 PolarHBondContact O-N 3.2Å; F81-R84 VanDerWaalsContact O-CB 3.32Å; F81-R84 WeakPolarHBondContact O-CB 3.28Å; F81-R84 PolarHBondContact O-N 3.35Å; F81-T85 HydrophobicContact CE1-CG2 4.24Å
82	V	90.4	Very high	89.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-32.8	176	173.2	0	0	0	0	111.7	I57 A78 L79 R84 T85 N87 M90 Y91 I94	I57-V82 HydrophobicContact CD1-CG2 3.65Å; I57-V82 HydrophobicContact CG1-CG2 3.83Å; I57-V82 HydrophobicContact CG2-CG2 4.08Å; A78-V82 WeakPolarHBondContact O-CG2 3.34Å; A78-V82 PolarHBondContact O-N 3.41Å; L79-V82 PolarHBondContact O-N 3.14Å; V82-R84 PolarHBondContact O-N 3.15Å; V82-R84 VanDerWaalsContact O-N 3.09Å; V82-T85 PolarHBondContact O-N 3.02Å; V82-T85 PolarHBondContact O-OG1 2.76Å; V82-N87 WeakPolarHBondContact CG1-O 3.32Å; V82-M90 HydrophobicContact CG1-CB 4.44Å; V82-M90 HydrophobicContact CG2-CB 4.45Å; V82-Y91 HydrophobicContact CG1-CD2 4.46Å; V82-I94 HydrophobicContact CG2-CD1 3.6Å
83	Q	87.6	Confident	89.9	Confident	91 Å²	91	45.9 Å²	45.9	43%	0.425	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.1	172.9	-76.9	179.9	-23.8	0	0	114.3	L79 F81 Y91 W130	L79-Q83 WeakPolarHBondContact O-CG 3.4Å; L79-Q83 PolarHBondContact O-N 3Å; F81-Q83 PolarHBondContact O-N 3.2Å; Q83-Y91 HydrophobicContact CG-CD2 4.3Å; Q83-Y91 HydrophobicContact CG-CE2 4.01Å; Q83-W130 HydrophobicContact CB-CZ2 4.41Å; Q83-W130 HydrophobicContact CG-CZ2 4.4Å
84	R	88.5	Confident	90	Very high	177 Å²	177	41.9 Å²	41.9	67%	0.668	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-16.2	174.1	-56.9	175.2	-175.2	146.8	5	112.5	F81 V82	F81-R84 VanDerWaalsContact O-CB 3.32Å; F81-R84 WeakPolarHBondContact O-CB 3.28Å; F81-R84 PolarHBondContact O-N 3.35Å; V82-R84 PolarHBondContact O-N 3.15Å; V82-R84 VanDerWaalsContact O-N 3.09Å
85	T	85.6	Confident	89.9	Confident	23 Å²	23	42.7 Å²	42.7	14%	0.141	20%	0.202	C	C	.	.	S	Bend	trans	-99.8	178.7	178.1	71.6	0	0	0	0	110.8	F81 V82	F81-T85 HydrophobicContact CE1-CG2 4.24Å; V82-T85 PolarHBondContact O-N 3.02Å; V82-T85 PolarHBondContact O-OG1 2.76Å
86	F	84.8	Confident	89.8	Confident	58 Å²	58	47.7 Å²	47.7	25%	0.254	22%	0.221	S	C	.	.	S	Bend	trans	-100.5	13.3	177.9	-65.1	-77.7	0	0	0	112.6	V88 T134 K137 A138 D174	F86-V88 PolarHBondContact O-N 3.1Å; F86-T134 HydrophobicContact CB-CG2 4.41Å; F86-T134 HydrophobicContact CD1-CG2 4.04Å; F86-K137 HydrophobicContact CE1-CB 4.28Å; F86-A138 HydrophobicContact CB-CB 4.16Å; F86-A138 HydrophobicContact CD1-CB 4.27Å; F86-A138 HydrophobicContact CG-CB 4.45Å; F86-D174 HydrophobicContact CD2-CB 4.3Å; F86-D174 PolarHBondContact N-O 3.41Å
87	N	88.6	Confident	89.7	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.027	21%	0.211	C	C	.	.			trans	-88.1	97.4	-171.9	-164.1	-34.5	0	0	0	110.9	V82 D89 M90 Y91 D174 G176	V82-N87 WeakPolarHBondContact CG1-O 3.32Å; N87-D89 PolarHBondContact OD1-N 3.42Å; N87-M90 HydrophobicContact CB-CB 4.3Å; N87-M90 HydrophobicContact CB-CG 4.47Å; N87-M90 VanDerWaalsContact CG-CG 3.43Å; N87-M90 VanDerWaalsContact ND2-CG 3.29Å; N87-M90 WeakPolarHBondContact ND2-CG 3.39Å; N87-M90 WeakPolarHBondContact OD1-CB 3.36Å; N87-M90 VanDerWaalsContact OD1-CG 3.3Å; N87-M90 WeakPolarHBondContact OD1-CG 3.32Å; N87-M90 PolarHBondContact OD1-N 3.38Å; N87-Y91 PolarHBondContact O-N 3.11Å; N87-D174 PolarHBondContact N-O 2.99Å; N87-G176 VanDerWaalsContact ND2-CA 3.29Å; N87-G176 WeakPolarHBondContact ND2-CA 3.19Å
88	V	90	Very high	89.6	Confident	11 Å²	11	43.8 Å²	43.8	7%	0.067	20%	0.203	C	C	.	.	H	α-helix	trans	-73.7	-42.2	-179.3	173.8	0	0	0	0	111.3	F86 M90 Y91 E92 V131 T134 R135	F86-V88 PolarHBondContact O-N 3.1Å; V88-M90 VanDerWaalsContact C-N 3.32Å; V88-M90 PolarHBondContact O-N 2.97Å; V88-Y91 WeakPolarHBondContact O-CB 3.3Å; V88-Y91 PolarHBondContact O-N 2.95Å; V88-E92 HydrophobicContact CG1-CG 4.43Å; V88-E92 PolarHBondContact O-N 2.85Å; V88-V131 HydrophobicContact CG1-CB 4.44Å; V88-V131 HydrophobicContact CG1-CG1 3.55Å; V88-V131 HydrophobicContact CG1-CG2 4.35Å; V88-T134 HydrophobicContact CG2-CG2 4.15Å; V88-R135 HydrophobicContact CG2-CB 4.49Å
89	D	90.2	Very high	89.3	Confident	107 Å²	107	44.4 Å²	44.4	57%	0.572	21%	0.207	S	C	*	.	H	α-helix	trans	-62.7	-42.3	-175.9	-59.7	-16.4	0	0	0	110.6	N87 Y91 E92 E93	N87-D89 PolarHBondContact OD1-N 3.42Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 2.79Å; D89-E92 PolarHBondContact O-N 3.28Å; D89-E93 PolarHBondContact O-N 3.33Å; D89-E93 VanDerWaalsContact O-N 3.07Å
90	M	88.6	Confident	89.1	Confident	44 Å²	44	48.2 Å²	48.2	22%	0.217	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-32.3	174.7	-68.1	-53	-45.2	0	0	113	I57 V82 N87 V88 I94	I57-M90 HydrophobicContact CG2-CE 3.98Å; V82-M90 HydrophobicContact CG1-CB 4.44Å; V82-M90 HydrophobicContact CG2-CB 4.45Å; N87-M90 HydrophobicContact CB-CB 4.3Å; N87-M90 HydrophobicContact CB-CG 4.47Å; N87-M90 VanDerWaalsContact CG-CG 3.43Å; N87-M90 VanDerWaalsContact ND2-CG 3.29Å; N87-M90 WeakPolarHBondContact ND2-CG 3.39Å; N87-M90 WeakPolarHBondContact OD1-CB 3.36Å; N87-M90 VanDerWaalsContact OD1-CG 3.3Å; N87-M90 WeakPolarHBondContact OD1-CG 3.32Å; N87-M90 PolarHBondContact OD1-N 3.38Å; V88-M90 VanDerWaalsContact C-N 3.32Å; V88-M90 PolarHBondContact O-N 2.97Å; M90-I94 HydrophobicContact CE-CD1 4.48Å; M90-I94 WeakPolarHBondContact O-CB 3.4Å; M90-I94 WeakPolarHBondContact O-CD1 3.39Å; M90-I94 WeakPolarHBondContact O-CG1 3.29Å; M90-I94 PolarHBondContact O-N 2.82Å
91	Y	90.6	Very high	88.8	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-47.4	176	175.7	-100	0	0	0	111	L79 V82 Q83 N87 V88 D89 E93 H95 L126 D127 W130 V131	L79-Y91 HydrophobicContact CD1-CD2 3.56Å; L79-Y91 HydrophobicContact CD1-CE2 3.52Å; L79-Y91 HydrophobicContact CG-CD2 4.45Å; L79-Y91 HydrophobicContact CG-CE2 4.14Å; V82-Y91 HydrophobicContact CG1-CD2 4.46Å; Q83-Y91 HydrophobicContact CG-CD2 4.3Å; Q83-Y91 HydrophobicContact CG-CE2 4.01Å; N87-Y91 PolarHBondContact O-N 3.11Å; V88-Y91 WeakPolarHBondContact O-CB 3.3Å; V88-Y91 PolarHBondContact O-N 2.95Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 2.79Å; Y91-E93 PolarHBondContact O-N 3.03Å; Y91-H95 WeakPolarHBondContact O-CB 3.39Å; Y91-H95 PolarHBondContact O-N 2.83Å; Y91-L126 HydrophobicContact CD1-CD1 4.12Å; Y91-L126 HydrophobicContact CE1-CD1 3.55Å; Y91-D127 PolarHBondContact OH-N 3.39Å; Y91-W130 AromaticContact CD1-CE3 3.9Å; Y91-W130 HydrophobicContact CD1-CE3 3.9Å; Y91-W130 AromaticContact CD1-CZ3 3.58Å; Y91-W130 HydrophobicContact CD1-CZ3 3.58Å; Y91-W130 HydrophobicContact CD2-CE3 4.22Å; Y91-W130 HydrophobicContact CD2-CH2 4.14Å; Y91-W130 AromaticContact CD2-CZ3 3.68Å; Y91-W130 HydrophobicContact CD2-CZ3 3.68Å; Y91-W130 AromaticContact CE1-CE3 3.89Å; Y91-W130 HydrophobicContact CE1-CE3 3.89Å; Y91-W130 HydrophobicContact CE1-CZ3 4.04Å; Y91-W130 HydrophobicContact CE2-CE3 4.24Å; Y91-W130 HydrophobicContact CE2-CZ3 4.16Å; Y91-W130 HydrophobicContact CG-CE3 4.07Å; Y91-W130 HydrophobicContact CG-CH2 4.1Å; Y91-W130 AromaticContact CG-CZ3 3.37Å; Y91-W130 HydrophobicContact CG-CZ3 3.37Å; Y91-V131 HydrophobicContact CD1-CG2 3.74Å; Y91-V131 HydrophobicContact CE1-CG2 3.78Å
92	E	90.5	Very high	88.4	Confident	84 Å²	84	45.4 Å²	45.4	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-62	-42.6	178.1	-68.7	179.3	169.5	0	0	111.4	V88 D89 H95 R96	V88-E92 HydrophobicContact CG1-CG 4.43Å; V88-E92 PolarHBondContact O-N 2.85Å; D89-E92 PolarHBondContact O-N 3.28Å; E92-H95 PolarHBondContact O-N 3Å; E92-R96 WeakPolarHBondContact O-CB 3.48Å; E92-R96 PolarHBondContact O-N 2.91Å
93	E	91.8	Very high	87.9	Confident	61 Å²	61	52.5 Å²	52.5	29%	0.285	24%	0.235	S	C	.	.	H	α-helix	trans	-67.7	-46.2	179.5	179	56.5	-165.3	0	0	112.8	D89 Y91 H95 R96 K97	D89-E93 PolarHBondContact O-N 3.33Å; D89-E93 VanDerWaalsContact O-N 3.07Å; Y91-E93 PolarHBondContact O-N 3.03Å; E93-H95 VanDerWaalsContact C-N 3.3Å; E93-H95 PolarHBondContact O-N 3.34Å; E93-R96 VanDerWaalsContact CD-NH2 3.33Å; E93-R96 WeakPolarHBondContact O-CB 3.39Å; E93-R96 PolarHBondContact O-N 3.09Å; E93-R96 IonicContact OE1-CZ 3.23Å; E93-R96 IonicContact OE1-NE 3.47Å; E93-R96 IonicContact OE1-NH2 2.78Å; E93-R96 PolarHBondContact OE1-NH2 3.41Å; E93-R96 IonicContact OE2-CZ 3.86Å; E93-R96 IonicContact OE2-NE 2.7Å; E93-R96 PolarHBondContact OE2-NE 3.37Å; E93-R96 IonicContact OE2-NH2 3.65Å; E93-R96 PolarHBondContact OE2-NH2 2.9Å; E93-R96 VanDerWaalsContact OE2-NH2 3.17Å; E93-K97 PolarHBondContact O-N 3.19Å; E93-K97 WeakPolarHBondContact OE1-CE 3.29Å
94	I	91	Very high	87.5	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-39.7	176.8	-67.3	165	0	0	0	110.3	I57 Q61 L75 A78 L79 V82 M90 K97 L98	I57-I94 HydrophobicContact CG2-CD1 3.94Å; Q61-I94 HydrophobicContact CG-CG1 4.2Å; L75-I94 HydrophobicContact CD2-CG2 4.07Å; A78-I94 HydrophobicContact CB-CD1 3.96Å; A78-I94 HydrophobicContact CB-CG2 4.3Å; L79-I94 HydrophobicContact CB-CG2 4.05Å; L79-I94 HydrophobicContact CD1-CB 4.41Å; L79-I94 HydrophobicContact CD1-CG2 4.01Å; V82-I94 HydrophobicContact CG2-CD1 3.6Å; M90-I94 HydrophobicContact CE-CD1 4.48Å; M90-I94 WeakPolarHBondContact O-CB 3.4Å; M90-I94 WeakPolarHBondContact O-CD1 3.39Å; M90-I94 WeakPolarHBondContact O-CG1 3.29Å; M90-I94 PolarHBondContact O-N 2.82Å; I94-K97 PolarHBondContact O-N 3Å; I94-L98 VanDerWaalsContact O-CB 3.28Å; I94-L98 WeakPolarHBondContact O-CB 3.11Å; I94-L98 PolarHBondContact O-N 3.14Å
95	H	89.8	Confident	86.7	Confident	17 Å²	17	43.5 Å²	43.5	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-42.9	177.1	-175	-78.8	0	0	0	112	L79 Y91 E92 E93 L98 S99 P124 L126	L79-H95 HydrophobicContact CD1-CB 4.43Å; Y91-H95 WeakPolarHBondContact O-CB 3.39Å; Y91-H95 PolarHBondContact O-N 2.83Å; E92-H95 PolarHBondContact O-N 3Å; E93-H95 VanDerWaalsContact C-N 3.3Å; E93-H95 PolarHBondContact O-N 3.34Å; H95-L98 PolarHBondContact O-N 2.98Å; H95-S99 PolarHBondContact CE1-OG 3.08Å; H95-S99 WeakPolarHBondContact O-CB 3.44Å; H95-S99 PolarHBondContact O-N 3.28Å; H95-S99 PolarHBondContact O-OG 3.04Å; H95-P124 PolarHBondContact CE1-O 3.43Å; H95-P124 VanDerWaalsContact CE1-O 3.26Å; H95-P124 PolarHBondContact NE2-O 3.09Å; H95-L126 HydrophobicContact CB-CD1 4.04Å; H95-L126 WeakPolarHBondContact NE2-CA 3.48Å; H95-L126 PolarHBondContact NE2-N 2.94Å
96	R	90.5	Very high	85.8	Confident	106 Å²	106	45.7 Å²	45.7	40%	0.4	22%	0.22	S	C	.	.	H	α-helix	trans	-58.4	-52	174	-173.5	-173	69.5	79.5	-2.8	110.9	E92 E93 L98 S99 E100	E92-R96 WeakPolarHBondContact O-CB 3.48Å; E92-R96 PolarHBondContact O-N 2.91Å; E93-R96 VanDerWaalsContact CD-NH2 3.33Å; E93-R96 WeakPolarHBondContact O-CB 3.39Å; E93-R96 PolarHBondContact O-N 3.09Å; E93-R96 IonicContact OE1-CZ 3.23Å; E93-R96 IonicContact OE1-NE 3.47Å; E93-R96 IonicContact OE1-NH2 2.78Å; E93-R96 PolarHBondContact OE1-NH2 3.41Å; E93-R96 IonicContact OE2-CZ 3.86Å; E93-R96 IonicContact OE2-NE 2.7Å; E93-R96 PolarHBondContact OE2-NE 3.37Å; E93-R96 IonicContact OE2-NH2 3.65Å; E93-R96 PolarHBondContact OE2-NH2 2.9Å; E93-R96 VanDerWaalsContact OE2-NH2 3.17Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 2.97Å; R96-S99 PolarHBondContact O-N 3.32Å; R96-E100 IonicContact CZ-OE1 3.42Å; R96-E100 IonicContact NH1-OE1 2.82Å; R96-E100 PolarHBondContact NH1-OE1 2.98Å; R96-E100 IonicContact NH1-OE2 3.54Å; R96-E100 PolarHBondContact NH1-OE2 3.48Å; R96-E100 WeakPolarHBondContact O-CG 3.33Å; R96-E100 PolarHBondContact O-N 3.35Å
97	K	89.7	Confident	84.8	Confident	36 Å²	36	51.7 Å²	51.7	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-40.7	177.1	-73	-172.3	175.1	-168.1	0	112.4	D65 L75 E93 I94 E100 A101	D65-K97 IonicContact OD1-NZ 3.82Å; D65-K97 PolarHBondContact OD1-NZ 3.07Å; D65-K97 IonicContact OD2-NZ 3.17Å; D65-K97 PolarHBondContact OD2-NZ 3.5Å; L75-K97 HydrophobicContact CD1-CB 4.14Å; L75-K97 HydrophobicContact CD2-CB 4.06Å; E93-K97 PolarHBondContact O-N 3.19Å; E93-K97 WeakPolarHBondContact OE1-CE 3.29Å; I94-K97 PolarHBondContact O-N 3Å; K97-E100 PolarHBondContact O-N 3.35Å; K97-A101 VanDerWaalsContact O-CB 3.3Å; K97-A101 WeakPolarHBondContact O-CB 3.37Å; K97-A101 PolarHBondContact O-N 3.09Å
98	L	88.3	Confident	83.7	Confident	3 Å²	3	58 Å²	58	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-68.1	-38.8	178.7	-179.6	62.6	0	0	0	112.2	V72 L75 K76 L79 I94 H95 R96 A101 T102 P124	V72-L98 HydrophobicContact CG1-CD1 4.46Å; L75-L98 HydrophobicContact CB-CB 4.23Å; L75-L98 HydrophobicContact CB-CD1 3.88Å; L75-L98 HydrophobicContact CD1-CB 4.3Å; L75-L98 HydrophobicContact CD1-CD1 4.43Å; K76-L98 HydrophobicContact CG-CD1 4.46Å; L79-L98 HydrophobicContact CD2-CD2 4.03Å; I94-L98 VanDerWaalsContact O-CB 3.28Å; I94-L98 WeakPolarHBondContact O-CB 3.11Å; I94-L98 PolarHBondContact O-N 3.14Å; H95-L98 PolarHBondContact O-N 2.98Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 2.97Å; L98-A101 PolarHBondContact O-N 3.22Å; L98-T102 WeakPolarHBondContact O-CB 3.28Å; L98-T102 PolarHBondContact O-N 2.99Å; L98-T102 PolarHBondContact O-OG1 3.33Å; L98-P124 HydrophobicContact CD2-CG 4.02Å
99	S	86.6	Confident	82.1	Confident	14 Å²	14	62.3 Å²	62.3	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-65.2	-41.5	175.8	-64.1	0	0	0	0	111.3	H95 R96 R103	H95-S99 PolarHBondContact CE1-OG 3.08Å; H95-S99 WeakPolarHBondContact O-CB 3.44Å; H95-S99 PolarHBondContact O-N 3.28Å; H95-S99 PolarHBondContact O-OG 3.04Å; R96-S99 PolarHBondContact O-N 3.32Å; S99-R103 WeakPolarHBondContact O-CB 3.41Å; S99-R103 VanDerWaalsContact O-CG 3.23Å; S99-R103 WeakPolarHBondContact O-CG 3.37Å; S99-R103 PolarHBondContact O-N 3.21Å; S99-R103 VanDerWaalsContact O-N 3.15Å
100	E	86.9	Confident	80.5	Confident	95 Å²	95	65.3 Å²	65.3	44%	0.444	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-47.3	174.3	-72.3	169.7	-166.5	0	0	111.4	R96 K97 R103 S104	R96-E100 IonicContact CZ-OE1 3.42Å; R96-E100 IonicContact NH1-OE1 2.82Å; R96-E100 PolarHBondContact NH1-OE1 2.98Å; R96-E100 IonicContact NH1-OE2 3.54Å; R96-E100 PolarHBondContact NH1-OE2 3.48Å; R96-E100 WeakPolarHBondContact O-CG 3.33Å; R96-E100 PolarHBondContact O-N 3.35Å; K97-E100 PolarHBondContact O-N 3.35Å; E100-R103 PolarHBondContact O-N 3.08Å; E100-S104 PolarHBondContact O-N 2.88Å; E100-S104 PolarHBondContact O-OG 3.38Å
101	A	84.5	Confident	79	Confident	4 Å²	4	69.9 Å²	69.9	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-45	179.6	0	0	0	0	0	112.7	R71 L75 K97 L98 R103 S104 S105	R71-A101 HydrophobicContact CG-CB 4Å; L75-A101 HydrophobicContact CD1-CB 4.18Å; K97-A101 VanDerWaalsContact O-CB 3.3Å; K97-A101 WeakPolarHBondContact O-CB 3.37Å; K97-A101 PolarHBondContact O-N 3.09Å; L98-A101 PolarHBondContact O-N 3.22Å; A101-R103 VanDerWaalsContact C-N 3.32Å; A101-R103 PolarHBondContact O-N 3.33Å; A101-S104 WeakPolarHBondContact CA-OG 3.4Å; A101-S104 PolarHBondContact O-N 3.46Å; A101-S104 PolarHBondContact O-OG 2.99Å; A101-S105 PolarHBondContact O-N 3.45Å; A101-S105 PolarHBondContact O-OG 2.89Å; A101-S105 VanDerWaalsContact O-OG 3.11Å
102	T	81.8	Confident	77.2	Confident	14 Å²	14	71.9 Å²	71.9	9%	0.086	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-41.3	177.5	-51.9	0	0	0	0	110.7	L98 S105 L106 P123	L98-T102 WeakPolarHBondContact O-CB 3.28Å; L98-T102 PolarHBondContact O-N 2.99Å; L98-T102 PolarHBondContact O-OG1 3.33Å; T102-S105 PolarHBondContact O-N 2.99Å; T102-L106 HydrophobicContact CG2-CD1 4.06Å; T102-L106 WeakPolarHBondContact O-CB 3.24Å; T102-L106 WeakPolarHBondContact O-CD1 3.38Å; T102-L106 VanDerWaalsContact O-CG 3.22Å; T102-L106 WeakPolarHBondContact O-CG 3.39Å; T102-L106 PolarHBondContact O-N 3.43Å; T102-P123 HydrophobicContact CG2-CB 4.42Å
103	R	80.3	Confident	75	Confident	149 Å²	149	74 Å²	74	56%	0.562	37%	0.367	S	S	*	.	H	α-helix	trans	-65.4	-39.4	175.7	-75	175	-170.9	161.3	4.7	112.7	S99 E100 A101 R107	S99-R103 WeakPolarHBondContact O-CB 3.41Å; S99-R103 VanDerWaalsContact O-CG 3.23Å; S99-R103 WeakPolarHBondContact O-CG 3.37Å; S99-R103 PolarHBondContact O-N 3.21Å; S99-R103 VanDerWaalsContact O-N 3.15Å; E100-R103 PolarHBondContact O-N 3.08Å; A101-R103 VanDerWaalsContact C-N 3.32Å; A101-R103 PolarHBondContact O-N 3.33Å; R103-R107 WeakPolarHBondContact O-CG 3.39Å; R103-R107 PolarHBondContact O-N 3.23Å; R103-R107 VanDerWaalsContact O-N 3.1Å
104	S	78.3	Confident	72.6	Confident	39 Å²	39	78.6 Å²	78.6	27%	0.273	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-44.3	176.7	50.8	0	0	0	0	111.6	E100 A101 L106 R107 E108	E100-S104 PolarHBondContact O-N 2.88Å; E100-S104 PolarHBondContact O-OG 3.38Å; A101-S104 WeakPolarHBondContact CA-OG 3.4Å; A101-S104 PolarHBondContact O-N 3.46Å; A101-S104 PolarHBondContact O-OG 2.99Å; S104-L106 VanDerWaalsContact C-N 3.35Å; S104-L106 PolarHBondContact O-N 3.42Å; S104-R107 WeakPolarHBondContact O-CB 3.29Å; S104-R107 PolarHBondContact O-N 3Å; S104-R107 VanDerWaalsContact O-N 3.11Å; S104-E108 WeakPolarHBondContact O-CG 3.36Å; S104-E108 PolarHBondContact O-N 3.41Å
105	S	72.5	Confident	70.2	Confident	39 Å²	39	81 Å²	81	27%	0.273	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-39.8	177.7	-61.4	0	0	0	0	112.1	A101 T102 R107 E108 L109	A101-S105 PolarHBondContact O-N 3.45Å; A101-S105 PolarHBondContact O-OG 2.89Å; A101-S105 VanDerWaalsContact O-OG 3.11Å; T102-S105 PolarHBondContact O-N 2.99Å; S105-R107 VanDerWaalsContact C-N 3.34Å; S105-R107 PolarHBondContact O-N 3.39Å; S105-E108 PolarHBondContact O-N 3.29Å; S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 WeakPolarHBondContact O-CD1 3.46Å; S105-L109 PolarHBondContact O-N 2.88Å
106	L	66.4	Low	67.8	Low	69 Å²	69	86.9 Å²	86.9	36%	0.361	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-38.7	173	-73.4	167	0	0	0	112.3	T102 S104 Q110	T102-L106 HydrophobicContact CG2-CD1 4.06Å; T102-L106 WeakPolarHBondContact O-CB 3.24Å; T102-L106 WeakPolarHBondContact O-CD1 3.38Å; T102-L106 VanDerWaalsContact O-CG 3.22Å; T102-L106 WeakPolarHBondContact O-CG 3.39Å; T102-L106 PolarHBondContact O-N 3.43Å; S104-L106 VanDerWaalsContact C-N 3.35Å; S104-L106 PolarHBondContact O-N 3.42Å; L106-Q110 VanDerWaalsContact O-CB 3.29Å; L106-Q110 WeakPolarHBondContact O-CB 3.4Å; L106-Q110 PolarHBondContact O-N 3.18Å
107	R	64.6	Low	65.4	Low	185 Å²	185	88 Å²	88	70%	0.698	47%	0.465	S	S	*	.	H	α-helix	trans	-67.2	-38.7	175.4	-75	177	178.8	-160.6	0.2	112.5	R103 S104 S105 Q110 N111	R103-R107 WeakPolarHBondContact O-CG 3.39Å; R103-R107 PolarHBondContact O-N 3.23Å; R103-R107 VanDerWaalsContact O-N 3.1Å; S104-R107 WeakPolarHBondContact O-CB 3.29Å; S104-R107 PolarHBondContact O-N 3Å; S104-R107 VanDerWaalsContact O-N 3.11Å; S105-R107 VanDerWaalsContact C-N 3.34Å; S105-R107 PolarHBondContact O-N 3.39Å; R107-Q110 PolarHBondContact O-N 3.48Å; R107-N111 PolarHBondContact O-N 3Å; R107-N111 PolarHBondContact O-ND2 3.45Å; R107-N111 VanDerWaalsContact O-ND2 3.12Å
108	E	64	Low	63	Low	136 Å²	136	94.7 Å²	94.7	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-65.7	-43.5	175.7	-71.9	169.5	-170.2	0	0	111.5	S104 S105 Q110 N111 A112	S104-E108 WeakPolarHBondContact O-CG 3.36Å; S104-E108 PolarHBondContact O-N 3.41Å; S105-E108 PolarHBondContact O-N 3.29Å; E108-Q110 VanDerWaalsContact C-N 3.34Å; E108-Q110 PolarHBondContact O-N 3.16Å; E108-N111 PolarHBondContact O-N 2.92Å; E108-A112 PolarHBondContact O-N 3.44Å
109	L	57.3	Low	60.6	Low	102 Å²	102	98.7 Å²	98.7	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-37.1	173.9	-83.9	152.6	0	0	0	112.7	S105 N111 A112	S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 WeakPolarHBondContact O-CD1 3.46Å; S105-L109 PolarHBondContact O-N 2.88Å; L109-N111 VanDerWaalsContact C-N 3.29Å; L109-N111 PolarHBondContact O-N 3.28Å; L109-A112 PolarHBondContact O-N 2.96Å
110	Q	57.3	Low	58.5	Low	170 Å²	170	102.1 Å²	102.1	79%	0.794	56%	0.562	S	S	*	*	H	α-helix	trans	-75.4	-18.3	179.6	-158.8	132.3	31.3	0	0	113.5	L106 R107 E108	L106-Q110 VanDerWaalsContact O-CB 3.29Å; L106-Q110 WeakPolarHBondContact O-CB 3.4Å; L106-Q110 PolarHBondContact O-N 3.18Å; R107-Q110 PolarHBondContact O-N 3.48Å; E108-Q110 VanDerWaalsContact C-N 3.34Å; E108-Q110 PolarHBondContact O-N 3.16Å
111	N	56.4	Low	56.7	Low	140 Å²	140	101 Å²	101	75%	0.749	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-5.8	174.1	-68.7	-26.9	0	0	0	113.1	R107 E108 L109	R107-N111 PolarHBondContact O-N 3Å; R107-N111 PolarHBondContact O-ND2 3.45Å; R107-N111 VanDerWaalsContact O-ND2 3.12Å; E108-N111 PolarHBondContact O-N 2.92Å; L109-N111 VanDerWaalsContact C-N 3.29Å; L109-N111 PolarHBondContact O-N 3.28Å
112	A	52.8	Low	55.1	Low	47 Å²	47	108.9 Å²	108.9	39%	0.388	60%	0.598	S	S	.	*	S	Bend	trans	-85.7	127.6	176.1	0	0	0	0	0	110.8	E108 L109 D114	E108-A112 PolarHBondContact O-N 3.44Å; L109-A112 PolarHBondContact O-N 2.96Å; A112-D114 VanDerWaalsContact C-N 3.25Å; A112-D114 PolarHBondContact O-N 3.34Å; A112-D114 VanDerWaalsContact O-N 3.1Å
113	P	44.8	Very low	54	Low	129 Å²	129	110.1 Å²	110.1	84%	0.838	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-5.6	-167.6	24.6	-32.5	0	0	0	116.3
114	D	41.4	Very low	53.3	Low	156 Å²	156	105.8 Å²	105.8	83%	0.834	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	22.1	-175.2	-78.9	-40.5	0	0	0	114.5	A112 I116	A112-D114 VanDerWaalsContact C-N 3.25Å; A112-D114 PolarHBondContact O-N 3.34Å; A112-D114 VanDerWaalsContact O-N 3.1Å; D114-I116 PolarHBondContact O-N 3.12Å
115	A	40	Very low	53.2	Low	52 Å²	52	108.1 Å²	108.1	43%	0.43	62%	0.619	S	S	.	*			trans	-84.4	112.7	-178.6	0	0	0	0	0	112.9
116	I	38.7	Very low	53.8	Low	139 Å²	139	109.7 Å²	109.7	71%	0.713	62%	0.624	S	S	*	*			trans	-64.3	131.6	166	-56.6	165.6	0	0	0	108.2	D114 E118	D114-I116 PolarHBondContact O-N 3.12Å; I116-E118 HydrophobicContact CG2-CB 4.46Å; I116-E118 HydrophobicContact CG2-CG 4.22Å; I116-E118 PolarHBondContact O-N 3.3Å
117	P	40.8	Very low	54.8	Low	130 Å²	130	109.7 Å²	109.7	84%	0.844	63%	0.625	S	S	*	*	S	Bend	trans	-77.8	65.2	-178.9	32.5	-34.5	0	0	0	111.3
118	E	38.6	Very low	56	Low	177 Å²	177	105 Å²	105	83%	0.827	62%	0.617	S	S	*	*			trans	-126	65.4	173.2	-75.8	-166.6	170	0	0	111	I116	I116-E118 HydrophobicContact CG2-CB 4.46Å; I116-E118 HydrophobicContact CG2-CG 4.22Å; I116-E118 PolarHBondContact O-N 3.3Å
119	S	39.5	Very low	57.3	Low	87 Å²	87	101.7 Å²	101.7	61%	0.608	61%	0.612	S	S	*	*			trans	-157.7	86.1	147.7	-154.4	0	0	0	0	109.4	V121	S119-V121 PolarHBondContact O-N 2.72Å; S119-V121 WeakPolarHBondContact OG-CG2 3.37Å
120	G	41.1	Very low	58.8	Low	86 Å²	86	99.1 Å²	99.1	89%	0.887	60%	0.596	S	S	*	*			trans	-72.4	62.8	173.4	0	0	0	0	0	112	E122	G120-E122 VanDerWaalsContact C-N 3.27Å; G120-E122 PolarHBondContact O-N 3.42Å; G120-E122 VanDerWaalsContact O-N 3.15Å
121	V	49.9	Very low	60.5	Low	72 Å²	72	91.7 Å²	91.7	44%	0.436	56%	0.562	S	S	.	*			trans	-86	80.4	168.8	-160.3	0	0	0	0	107.3	S119	S119-V121 PolarHBondContact O-N 2.72Å; S119-V121 WeakPolarHBondContact OG-CG2 3.37Å
122	E	51	Low	62.2	Low	168 Å²	168	91.9 Å²	91.9	79%	0.785	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-57.9	132.1	168.2	-160.3	157.9	-167.5	0	0	108	G120	G120-E122 VanDerWaalsContact C-N 3.27Å; G120-E122 PolarHBondContact O-N 3.42Å; G120-E122 VanDerWaalsContact O-N 3.15Å
123	P	58.3	Low	64.1	Low	41 Å²	41	91.8 Å²	91.8	27%	0.266	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-55.8	134	-179.3	20.7	-31	0	0	0	108.7	T102 A125	T102-P123 HydrophobicContact CG2-CB 4.42Å; P123-A125 PolarHBondContact O-N 2.81Å
124	P	66.3	Low	66.4	Low	57 Å²	57	86 Å²	86	37%	0.37	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-52.3	129.2	-180	-22.6	30.7	0	0	0	109.1	H95 L98	H95-P124 PolarHBondContact CE1-O 3.43Å; H95-P124 VanDerWaalsContact CE1-O 3.26Å; H95-P124 PolarHBondContact NE2-O 3.09Å; L98-P124 HydrophobicContact CD2-CG 4.02Å
125	A	76.1	Confident	68.9	Low	89 Å²	89	86.3 Å²	86.3	74%	0.736	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-64.6	144.7	173.9	0	0	0	0	0	109.7	P123 D127	P123-A125 PolarHBondContact O-N 2.81Å; A125-D127 PolarHBondContact O-N 3.49Å
126	L	84.1	Confident	71.4	Confident	71 Å²	71	90.7 Å²	90.7	37%	0.372	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-65.8	119.5	174.1	-178	71.6	0	0	0	108.3	Y91 H95 T128	Y91-L126 HydrophobicContact CD1-CD1 4.12Å; Y91-L126 HydrophobicContact CE1-CD1 3.55Å; H95-L126 HydrophobicContact CB-CD1 4.04Å; H95-L126 WeakPolarHBondContact NE2-CA 3.48Å; H95-L126 PolarHBondContact NE2-N 2.94Å; L126-T128 VanDerWaalsContact C-N 3.34Å; L126-T128 HydrophobicContact CD2-CG2 4.2Å; L126-T128 HydrophobicContact CG-CG2 4.39Å; L126-T128 PolarHBondContact O-N 2.96Å
127	D	88.2	Confident	74.1	Confident	70 Å²	70	90.3 Å²	90.3	37%	0.374	51%	0.512	S	S	.	.			trans	-80.7	83.3	179.1	-170.2	-13.2	0	0	0	110.2	Y91 A125 A129 W130 V131	Y91-D127 PolarHBondContact OH-N 3.39Å; A125-D127 PolarHBondContact O-N 3.49Å; D127-A129 PolarHBondContact O-N 3.48Å; D127-A129 PolarHBondContact OD1-N 3.27Å; D127-W130 HydrophobicContact CB-CB 3.91Å; D127-W130 PolarHBondContact O-N 3.01Å; D127-W130 PolarHBondContact OD1-N 3.02Å; D127-W130 WeakPolarHBondContact OD2-CB 3.49Å; D127-V131 WeakPolarHBondContact O-CG2 3.44Å; D127-V131 PolarHBondContact O-N 3.34Å
128	T	88.9	Confident	76.6	Confident	87 Å²	87	84.7 Å²	84.7	53%	0.534	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-29.6	179.1	58.2	0	0	0	0	112.2	L126 V131 E132	L126-T128 VanDerWaalsContact C-N 3.34Å; L126-T128 HydrophobicContact CD2-CG2 4.2Å; L126-T128 HydrophobicContact CG-CG2 4.39Å; L126-T128 PolarHBondContact O-N 2.96Å; T128-V131 PolarHBondContact O-N 3.21Å; T128-E132 WeakPolarHBondContact O-CG 3.45Å; T128-E132 PolarHBondContact O-N 3.46Å
129	A	91.3	Very high	79.2	Confident	65 Å²	65	81 Å²	81	54%	0.537	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-41.2	177	0	0	0	0	0	111.1	D127 A133	D127-A129 PolarHBondContact O-N 3.48Å; D127-A129 PolarHBondContact OD1-N 3.27Å; A129-A133 WeakPolarHBondContact O-CB 3.33Å; A129-A133 PolarHBondContact O-N 3.49Å
130	W	90.4	Very high	81.9	Confident	49 Å²	49	81.5 Å²	81.5	19%	0.186	46%	0.457	C	S	.	.	H	α-helix	trans	-63	-44	171.8	179.7	90.1	0	0	0	111.5	Q83 Y91 D127 E132 A133 T134	Q83-W130 HydrophobicContact CB-CZ2 4.41Å; Q83-W130 HydrophobicContact CG-CZ2 4.4Å; Y91-W130 AromaticContact CD1-CE3 3.9Å; Y91-W130 HydrophobicContact CD1-CE3 3.9Å; Y91-W130 AromaticContact CD1-CZ3 3.58Å; Y91-W130 HydrophobicContact CD1-CZ3 3.58Å; Y91-W130 HydrophobicContact CD2-CE3 4.22Å; Y91-W130 HydrophobicContact CD2-CH2 4.14Å; Y91-W130 AromaticContact CD2-CZ3 3.68Å; Y91-W130 HydrophobicContact CD2-CZ3 3.68Å; Y91-W130 AromaticContact CE1-CE3 3.89Å; Y91-W130 HydrophobicContact CE1-CE3 3.89Å; Y91-W130 HydrophobicContact CE1-CZ3 4.04Å; Y91-W130 HydrophobicContact CE2-CE3 4.24Å; Y91-W130 HydrophobicContact CE2-CZ3 4.16Å; Y91-W130 HydrophobicContact CG-CE3 4.07Å; Y91-W130 HydrophobicContact CG-CH2 4.1Å; Y91-W130 AromaticContact CG-CZ3 3.37Å; Y91-W130 HydrophobicContact CG-CZ3 3.37Å; D127-W130 HydrophobicContact CB-CB 3.91Å; D127-W130 PolarHBondContact O-N 3.01Å; D127-W130 PolarHBondContact OD1-N 3.02Å; D127-W130 WeakPolarHBondContact OD2-CB 3.49Å; W130-E132 PolarHBondContact O-N 2.9Å; W130-A133 PolarHBondContact O-N 3.09Å; W130-T134 VanDerWaalsContact CE2-OG1 3.23Å; W130-T134 HydrophobicContact CH2-CG2 4.15Å; W130-T134 HydrophobicContact CZ2-CG2 4.07Å; W130-T134 PolarHBondContact NE1-OG1 2.88Å; W130-T134 VanDerWaalsContact O-CB 3.25Å; W130-T134 WeakPolarHBondContact O-CB 3.33Å; W130-T134 PolarHBondContact O-N 3.41Å; W130-T134 PolarHBondContact O-OG1 3.36Å
131	V	91.4	Very high	84.4	Confident	13 Å²	13	81.1 Å²	81.1	8%	0.079	43%	0.431	C	S	.	.	H	α-helix	trans	-56.3	-52.2	178	165.7	0	0	0	0	111.5	V88 Y91 D127 T128 A133 T134 R135	V88-V131 HydrophobicContact CG1-CB 4.44Å; V88-V131 HydrophobicContact CG1-CG1 3.55Å; V88-V131 HydrophobicContact CG1-CG2 4.35Å; Y91-V131 HydrophobicContact CD1-CG2 3.74Å; Y91-V131 HydrophobicContact CE1-CG2 3.78Å; D127-V131 WeakPolarHBondContact O-CG2 3.44Å; D127-V131 PolarHBondContact O-N 3.34Å; T128-V131 PolarHBondContact O-N 3.21Å; V131-A133 PolarHBondContact O-N 2.99Å; V131-T134 PolarHBondContact O-N 3.38Å; V131-R135 WeakPolarHBondContact O-CB 3.32Å; V131-R135 PolarHBondContact O-N 3.37Å
132	E	92.6	Very high	86.5	Confident	144 Å²	144	79.4 Å²	79.4	67%	0.673	42%	0.419	S	S	*	.	H	α-helix	trans	-63.8	-43.2	179.3	-71.4	-179	178.9	0	0	112.2	T128 W130 R135 K136	T128-E132 WeakPolarHBondContact O-CG 3.45Å; T128-E132 PolarHBondContact O-N 3.46Å; W130-E132 PolarHBondContact O-N 2.9Å; E132-R135 PolarHBondContact O-N 2.9Å; E132-K136 WeakPolarHBondContact O-CB 3.08Å; E132-K136 PolarHBondContact O-N 3.4Å
133	A	93.4	Very high	88.7	Confident	45 Å²	45	76.2 Å²	76.2	37%	0.372	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-42.1	178.8	0	0	0	0	0	112.1	A129 W130 V131 K136 K137	A129-A133 WeakPolarHBondContact O-CB 3.33Å; A129-A133 PolarHBondContact O-N 3.49Å; W130-A133 PolarHBondContact O-N 3.09Å; V131-A133 PolarHBondContact O-N 2.99Å; A133-K136 PolarHBondContact O-N 2.94Å; A133-K137 WeakPolarHBondContact O-CB 3.48Å; A133-K137 VanDerWaalsContact O-CG 3.29Å; A133-K137 WeakPolarHBondContact O-CG 3.36Å; A133-K137 PolarHBondContact O-N 3.44Å
134	T	93.1	Very high	90.5	Very high	9 Å²	9	80.9 Å²	80.9	6%	0.055	42%	0.42	C	S	.	.	H	α-helix	trans	-68.3	-44.1	178.6	-64.3	0	0	0	0	110.9	F86 V88 W130 V131 K136 K137 A138	F86-T134 HydrophobicContact CB-CG2 4.41Å; F86-T134 HydrophobicContact CD1-CG2 4.04Å; V88-T134 HydrophobicContact CG2-CG2 4.15Å; W130-T134 VanDerWaalsContact CE2-OG1 3.23Å; W130-T134 HydrophobicContact CH2-CG2 4.15Å; W130-T134 HydrophobicContact CZ2-CG2 4.07Å; W130-T134 PolarHBondContact NE1-OG1 2.88Å; W130-T134 VanDerWaalsContact O-CB 3.25Å; W130-T134 WeakPolarHBondContact O-CB 3.33Å; W130-T134 PolarHBondContact O-N 3.41Å; W130-T134 PolarHBondContact O-OG1 3.36Å; V131-T134 PolarHBondContact O-N 3.38Å; T134-K136 VanDerWaalsContact C-N 3.33Å; T134-K136 PolarHBondContact O-N 3.12Å; T134-K137 PolarHBondContact O-N 2.99Å; T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.38Å
135	R	92.6	Very high	91.9	Very high	162 Å²	162	79.8 Å²	79.8	61%	0.611	41%	0.411	S	S	*	.	H	α-helix	trans	-58.2	-45	174.7	-167.4	179.6	-130.9	156.7	8.7	111.7	V88 V131 E132 A138 L139	V88-R135 HydrophobicContact CG2-CB 4.49Å; V131-R135 WeakPolarHBondContact O-CB 3.32Å; V131-R135 PolarHBondContact O-N 3.37Å; E132-R135 PolarHBondContact O-N 2.9Å; R135-A138 PolarHBondContact O-N 3.15Å; R135-L139 PolarHBondContact O-N 3.45Å; R135-L139 VanDerWaalsContact O-N 3.07Å
136	K	94.3	Very high	92.8	Very high	144 Å²	144	78 Å²	78	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-64	-43.7	176.7	-173.1	176.7	-179	177.4	0	112.1	E132 A133 T134 L139 L140	E132-K136 WeakPolarHBondContact O-CB 3.08Å; E132-K136 PolarHBondContact O-N 3.4Å; A133-K136 PolarHBondContact O-N 2.94Å; T134-K136 VanDerWaalsContact C-N 3.33Å; T134-K136 PolarHBondContact O-N 3.12Å; K136-L139 PolarHBondContact O-N 2.74Å; K136-L140 HydrophobicContact CG-CD1 4.22Å; K136-L140 WeakPolarHBondContact O-CG 3.38Å; K136-L140 PolarHBondContact O-N 3.36Å
137	K	93.8	Very high	93.4	Very high	131 Å²	131	78 Å²	78	57%	0.57	39%	0.393	S	S	*	.	H	α-helix	trans	-63.2	-42.7	176.5	-77.1	173.2	-178.6	175.1	0	112.1	F86 A133 T134 L140 K141	F86-K137 HydrophobicContact CE1-CB 4.28Å; A133-K137 WeakPolarHBondContact O-CB 3.48Å; A133-K137 VanDerWaalsContact O-CG 3.29Å; A133-K137 WeakPolarHBondContact O-CG 3.36Å; A133-K137 PolarHBondContact O-N 3.44Å; T134-K137 PolarHBondContact O-N 2.99Å; K137-L140 PolarHBondContact O-N 3.17Å; K137-K141 WeakPolarHBondContact O-CB 3.19Å; K137-K141 PolarHBondContact O-N 3.11Å
138	A	92.9	Very high	93.7	Very high	12 Å²	12	77 Å²	77	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-43.7	178.5	0	0	0	0	0	111.5	F86 T134 R135 K141 L142 H171	F86-A138 HydrophobicContact CB-CB 4.16Å; F86-A138 HydrophobicContact CD1-CB 4.27Å; F86-A138 HydrophobicContact CG-CB 4.45Å; T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.38Å; R135-A138 PolarHBondContact O-N 3.15Å; A138-K141 PolarHBondContact O-N 3.26Å; A138-L142 WeakPolarHBondContact O-CB 3.28Å; A138-L142 PolarHBondContact O-N 3.37Å; A138-H171 PolarHBondContact O-NE2 2.87Å
139	L	94.3	Very high	93.9	Very high	99 Å²	99	73.4 Å²	73.4	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-65.4	-46.7	177.4	-172	67.4	0	0	0	112.1	R135 K136 K141 L142 E143	R135-L139 PolarHBondContact O-N 3.45Å; R135-L139 VanDerWaalsContact O-N 3.07Å; K136-L139 PolarHBondContact O-N 2.74Å; L139-K141 VanDerWaalsContact C-N 3.3Å; L139-K141 PolarHBondContact O-N 3.32Å; L139-L142 WeakPolarHBondContact O-CB 3.27Å; L139-L142 PolarHBondContact O-N 2.89Å; L139-L142 VanDerWaalsContact O-N 3.14Å; L139-E143 WeakPolarHBondContact O-CG 3.41Å; L139-E143 PolarHBondContact O-N 3.21Å
140	L	95.3	Very high	94.1	Very high	98 Å²	98	77.3 Å²	77.3	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-60.9	-38.9	177.1	-73.3	170.9	0	0	0	112.3	K136 K137 K144	K136-L140 HydrophobicContact CG-CD1 4.22Å; K136-L140 WeakPolarHBondContact O-CG 3.38Å; K136-L140 PolarHBondContact O-N 3.36Å; K137-L140 PolarHBondContact O-N 3.17Å; L140-K144 WeakPolarHBondContact O-CB 3.29Å; L140-K144 PolarHBondContact O-N 3.15Å; L140-K144 VanDerWaalsContact O-N 3.09Å
141	K	94.6	Very high	94.4	Very high	78 Å²	78	79 Å²	79	34%	0.339	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175.6	-175.4	173.3	169.2	-144.7	0	111.2	K137 A138 L139 K144 L145 H171	K137-K141 WeakPolarHBondContact O-CB 3.19Å; K137-K141 PolarHBondContact O-N 3.11Å; A138-K141 PolarHBondContact O-N 3.26Å; L139-K141 VanDerWaalsContact C-N 3.3Å; L139-K141 PolarHBondContact O-N 3.32Å; K141-K144 PolarHBondContact O-N 3.14Å; K141-L145 HydrophobicContact CG-CD1 4.18Å; K141-L145 WeakPolarHBondContact O-CG 3.24Å; K141-L145 PolarHBondContact O-N 3.49Å; K141-H171 WeakPolarHBondContact CD-ND1 3.28Å; K141-H171 WeakPolarHBondContact CE-ND1 3.46Å; K141-H171 PolarHBondContact NZ-ND1 3.39Å
142	L	94.8	Very high	94.5	Very high	35 Å²	35	82.3 Å²	82.3	18%	0.183	39%	0.394	C	S	.	.	H	α-helix	trans	-63.4	-48.5	176.1	-169.7	157.2	0	0	0	111.4	A138 L139 K144 L145 D146 Y172	A138-L142 WeakPolarHBondContact O-CB 3.28Å; A138-L142 PolarHBondContact O-N 3.37Å; L139-L142 WeakPolarHBondContact O-CB 3.27Å; L139-L142 PolarHBondContact O-N 2.89Å; L139-L142 VanDerWaalsContact O-N 3.14Å; L142-K144 VanDerWaalsContact C-N 3.26Å; L142-K144 PolarHBondContact O-N 2.98Å; L142-L145 PolarHBondContact O-N 3.36Å; L142-D146 VanDerWaalsContact CD2-OD2 3.25Å; L142-D146 WeakPolarHBondContact CD2-OD2 3.29Å; L142-D146 PolarHBondContact O-N 2.94Å; L142-Y172 HydrophobicContact CD1-CE1 3.75Å
143	E	95.7	Very high	94.5	Very high	102 Å²	102	79.7 Å²	79.7	48%	0.477	38%	0.38	S	S	.	.	H	α-helix	trans	-58.5	-39.4	177.1	-72.8	179.5	169	0	0	112.2	L139 T147	L139-E143 WeakPolarHBondContact O-CG 3.41Å; L139-E143 PolarHBondContact O-N 3.21Å; E143-T147 WeakPolarHBondContact O-CB 3.3Å; E143-T147 PolarHBondContact O-N 3.24Å; E143-T147 PolarHBondContact O-OG1 3.47Å
144	K	96.3	Very high	94.6	Very high	138 Å²	138	80.5 Å²	80.5	60%	0.6	39%	0.392	S	S	*	.	H	α-helix	trans	-63.9	-50.8	175.7	-176.8	179.4	176.9	-177.3	0	111.3	L140 K141 L142 D146 T147 D148	L140-K144 WeakPolarHBondContact O-CB 3.29Å; L140-K144 PolarHBondContact O-N 3.15Å; L140-K144 VanDerWaalsContact O-N 3.09Å; K141-K144 PolarHBondContact O-N 3.14Å; L142-K144 VanDerWaalsContact C-N 3.26Å; L142-K144 PolarHBondContact O-N 2.98Å; K144-D146 VanDerWaalsContact C-N 3.32Å; K144-D146 PolarHBondContact O-N 3.04Å; K144-T147 WeakPolarHBondContact O-CB 3.46Å; K144-T147 PolarHBondContact O-N 3.05Å; K144-T147 VanDerWaalsContact O-N 3.15Å; K144-D148 PolarHBondContact O-N 3Å
145	L	95.9	Very high	94.6	Very high	34 Å²	34	85.4 Å²	85.4	18%	0.178	42%	0.419	C	S	.	.	H	α-helix	trans	-60.9	-39.8	178.9	-72.4	170.1	0	0	0	112	K141 L142 D148 L149 D167 L168 H171	K141-L145 HydrophobicContact CG-CD1 4.18Å; K141-L145 WeakPolarHBondContact O-CG 3.24Å; K141-L145 PolarHBondContact O-N 3.49Å; L142-L145 PolarHBondContact O-N 3.36Å; L145-D148 PolarHBondContact O-N 3.43Å; L145-L149 VanDerWaalsContact O-CB 3.28Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 PolarHBondContact O-N 3.29Å; L145-D167 HydrophobicContact CD2-CB 4.22Å; L145-L168 HydrophobicContact CB-CD1 4.09Å; L145-H171 HydrophobicContact CD1-CB 3.73Å
146	D	94.6	Very high	94.6	Very high	51 Å²	51	82.2 Å²	82.2	27%	0.273	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-37.8	175	-90.3	-30.4	0	0	0	112.6	L142 K144 K150	L142-D146 VanDerWaalsContact CD2-OD2 3.25Å; L142-D146 WeakPolarHBondContact CD2-OD2 3.29Å; L142-D146 PolarHBondContact O-N 2.94Å; K144-D146 VanDerWaalsContact C-N 3.32Å; K144-D146 PolarHBondContact O-N 3.04Å; D146-K150 VanDerWaalsContact O-CG 3.3Å; D146-K150 WeakPolarHBondContact O-CG 3.1Å; D146-K150 PolarHBondContact O-N 2.87Å
147	T	96.4	Very high	94.6	Very high	73 Å²	73	79.5 Å²	79.5	45%	0.448	41%	0.413	S	S	.	.	H	α-helix	trans	-67.2	-46.2	176.1	-58.2	0	0	0	0	110.8	E143 K144 L149 K150 N151	E143-T147 WeakPolarHBondContact O-CB 3.3Å; E143-T147 PolarHBondContact O-N 3.24Å; E143-T147 PolarHBondContact O-OG1 3.47Å; K144-T147 WeakPolarHBondContact O-CB 3.46Å; K144-T147 PolarHBondContact O-N 3.05Å; K144-T147 VanDerWaalsContact O-N 3.15Å; T147-L149 VanDerWaalsContact C-N 3.34Å; T147-L149 PolarHBondContact O-N 3.14Å; T147-K150 WeakPolarHBondContact O-CB 3.42Å; T147-K150 PolarHBondContact O-N 2.95Å; T147-N151 PolarHBondContact O-N 3.2Å; T147-N151 PolarHBondContact O-ND2 3.48Å
148	D	94.8	Very high	94.5	Very high	48 Å²	48	79.1 Å²	79.1	26%	0.257	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-42.7	176.5	-70.6	-26.1	0	0	0	111.1	K144 L145 K150 N151 Y152	K144-D148 PolarHBondContact O-N 3Å; L145-D148 PolarHBondContact O-N 3.43Å; D148-K150 PolarHBondContact O-N 3.49Å; D148-N151 WeakPolarHBondContact O-CB 3.32Å; D148-N151 PolarHBondContact O-N 3.08Å; D148-N151 VanDerWaalsContact O-N 3.16Å; D148-Y152 HydrophobicContact CB-CE2 4.11Å; D148-Y152 VanDerWaalsContact O-CD2 3.29Å; D148-Y152 WeakPolarHBondContact O-CD2 3.25Å; D148-Y152 PolarHBondContact O-N 3.44Å
149	L	94.3	Very high	94.5	Very high	11 Å²	11	81.9 Å²	81.9	6%	0.058	42%	0.422	C	S	.	.	H	α-helix	trans	-63	-39.2	176.2	-175.1	64.2	0	0	0	112.5	L145 T147 Y152 K153 I161 L168	L145-L149 VanDerWaalsContact O-CB 3.28Å; L145-L149 WeakPolarHBondContact O-CB 3.48Å; L145-L149 PolarHBondContact O-N 3.29Å; T147-L149 VanDerWaalsContact C-N 3.34Å; T147-L149 PolarHBondContact O-N 3.14Å; L149-Y152 PolarHBondContact O-N 2.89Å; L149-K153 WeakPolarHBondContact O-CG 3.38Å; L149-K153 PolarHBondContact O-N 3.33Å; L149-I161 HydrophobicContact CD1-CG2 4.32Å; L149-L168 HydrophobicContact CD2-CD2 4.05Å
150	K	95.2	Very high	94.5	Very high	148 Å²	148	79 Å²	79	64%	0.643	41%	0.41	S	S	*	.	H	α-helix	trans	-62.7	-42.4	173.1	-75.6	168.8	-174.2	169.7	0	111.4	D146 T147 D148 K153 G154	D146-K150 VanDerWaalsContact O-CG 3.3Å; D146-K150 WeakPolarHBondContact O-CG 3.1Å; D146-K150 PolarHBondContact O-N 2.87Å; T147-K150 WeakPolarHBondContact O-CB 3.42Å; T147-K150 PolarHBondContact O-N 2.95Å; D148-K150 PolarHBondContact O-N 3.49Å; K150-K153 PolarHBondContact O-N 2.89Å; K150-G154 PolarHBondContact O-N 3.42Å
151	N	95.5	Very high	94.5	Very high	85 Å²	85	74.7 Å²	74.7	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-43.7	175.7	-68.4	-30.4	0	0	0	111.5	T147 D148 K153 G154 N155	T147-N151 PolarHBondContact O-N 3.2Å; T147-N151 PolarHBondContact O-ND2 3.48Å; D148-N151 WeakPolarHBondContact O-CB 3.32Å; D148-N151 PolarHBondContact O-N 3.08Å; D148-N151 VanDerWaalsContact O-N 3.16Å; N151-K153 VanDerWaalsContact C-N 3.31Å; N151-K153 PolarHBondContact O-N 3.45Å; N151-G154 PolarHBondContact O-N 3.3Å; N151-N155 PolarHBondContact O-N 3.16Å; N151-N155 PolarHBondContact O-ND2 2.99Å
152	Y	94.6	Very high	94.5	Very high	81 Å²	81	71.9 Å²	71.9	32%	0.318	37%	0.374	S	S	.	.	H	α-helix	trans	-62.8	-37.1	176.4	-58.8	-27.7	0	0	0	112.6	D148 L149 N155 S156 S160	D148-Y152 HydrophobicContact CB-CE2 4.11Å; D148-Y152 VanDerWaalsContact O-CD2 3.29Å; D148-Y152 WeakPolarHBondContact O-CD2 3.25Å; D148-Y152 PolarHBondContact O-N 3.44Å; L149-Y152 PolarHBondContact O-N 2.89Å; Y152-N155 PolarHBondContact O-N 3.16Å; Y152-S156 PolarHBondContact O-N 3.39Å; Y152-S156 VanDerWaalsContact O-N 3.15Å; Y152-S160 WeakPolarHBondContact CD2-O 3.49Å
153	K	93.3	Very high	94.5	Very high	90 Å²	90	77.3 Å²	77.3	39%	0.391	39%	0.393	S	S	.	.	H	α-helix	trans	-66	-41.8	172.6	-74.1	179.4	178.8	-176.1	0	112.1	L149 K150 N151 N155 S156 I161	L149-K153 WeakPolarHBondContact O-CG 3.38Å; L149-K153 PolarHBondContact O-N 3.33Å; K150-K153 PolarHBondContact O-N 2.89Å; N151-K153 VanDerWaalsContact C-N 3.31Å; N151-K153 PolarHBondContact O-N 3.45Å; K153-N155 VanDerWaalsContact C-N 3.31Å; K153-N155 PolarHBondContact O-N 3.07Å; K153-S156 PolarHBondContact O-N 3.21Å; K153-S156 VanDerWaalsContact O-N 3.12Å; K153-I161 HydrophobicContact CG-CD1 4.17Å; K153-I161 HydrophobicContact CG-CG1 4.04Å; K153-I161 HydrophobicContact CG-CG2 4.22Å
154	G	94.8	Very high	94.5	Very high	61 Å²	61	72.7 Å²	72.7	63%	0.629	37%	0.372	S	S	*	.	H	α-helix	trans	-59.4	-41.6	174.1	0	0	0	0	0	112.6	K150 N151 S156	K150-G154 PolarHBondContact O-N 3.42Å; N151-G154 PolarHBondContact O-N 3.3Å; G154-S156 PolarHBondContact O-N 3.27Å
155	N	93.6	Very high	94.5	Very high	113 Å²	113	66.2 Å²	66.2	60%	0.604	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.8	177.5	-65	-18.4	0	0	0	113.8	N151 Y152 K153 I157	N151-N155 PolarHBondContact O-N 3.16Å; N151-N155 PolarHBondContact O-ND2 2.99Å; Y152-N155 PolarHBondContact O-N 3.16Å; K153-N155 VanDerWaalsContact C-N 3.31Å; K153-N155 PolarHBondContact O-N 3.07Å; N155-I157 VanDerWaalsContact C-N 3.28Å; N155-I157 HydrophobicContact CB-CD1 4.29Å; N155-I157 HydrophobicContact CB-CG1 4.24Å; N155-I157 PolarHBondContact O-N 3.41Å
156	S	92.1	Very high	94.4	Very high	95 Å²	95	65.4 Å²	65.4	66%	0.664	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	32.1	177.6	-60.6	0	0	0	0	115.2	Y152 K153 G154	Y152-S156 PolarHBondContact O-N 3.39Å; Y152-S156 VanDerWaalsContact O-N 3.15Å; K153-S156 PolarHBondContact O-N 3.21Å; K153-S156 VanDerWaalsContact O-N 3.12Å; G154-S156 PolarHBondContact O-N 3.27Å
157	I	93.3	Very high	94.5	Very high	87 Å²	87	66.3 Å²	66.3	45%	0.446	35%	0.345	S	S	.	.			trans	-96.2	109.2	178.6	-55.5	175.8	0	0	0	109.7	N155 E159 S160 I161	N155-I157 VanDerWaalsContact C-N 3.28Å; N155-I157 HydrophobicContact CB-CD1 4.29Å; N155-I157 HydrophobicContact CB-CG1 4.24Å; N155-I157 PolarHBondContact O-N 3.41Å; I157-E159 PolarHBondContact O-N 3.08Å; I157-S160 WeakPolarHBondContact CG2-OG 3.27Å; I157-S160 PolarHBondContact O-N 3.29Å; I157-I161 VanDerWaalsContact O-CG1 3.3Å; I157-I161 WeakPolarHBondContact O-CG1 3.46Å; I157-I161 PolarHBondContact O-N 3.35Å
158	K	92.7	Very high	94.4	Very high	122 Å²	122	63.1 Å²	63.1	53%	0.53	33%	0.325	S	S	.	.	H	α-helix	trans	-55.1	-44.7	-176.3	-66.6	-172.4	178.5	-173.4	0	113.5	I161 R162 Y191 T193	K158-I161 PolarHBondContact O-N 3.06Å; K158-R162 WeakPolarHBondContact O-CB 3.3Å; K158-R162 PolarHBondContact O-N 3.21Å; K158-Y191 HydrophobicContact CG-CD1 4.46Å; K158-T193 HydrophobicContact CD-CG2 4.07Å
159	E	92.3	Very high	94.4	Very high	71 Å²	71	60.8 Å²	60.8	33%	0.332	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-40.4	-178.3	179.6	54.7	-157.8	0	0	112.4	I157 R162 R163 H197	I157-E159 PolarHBondContact O-N 3.08Å; E159-R162 PolarHBondContact O-N 3.26Å; E159-R162 IonicContact OE1-CZ 3.24Å; E159-R162 IonicContact OE1-NE 3.56Å; E159-R162 IonicContact OE1-NH2 2.71Å; E159-R162 PolarHBondContact OE1-NH2 3.48Å; E159-R162 IonicContact OE2-CZ 3.03Å; E159-R162 IonicContact OE2-NE 2.76Å; E159-R162 PolarHBondContact OE2-NE 3.15Å; E159-R162 IonicContact OE2-NH2 3.65Å; E159-R163 WeakPolarHBondContact O-CB 3.47Å; E159-R163 PolarHBondContact O-N 3.39Å; E159-H197 IonicContact OE2-CE1 2.67Å; E159-H197 PolarHBondContact OE2-CE1 3.03Å; E159-H197 IonicContact OE2-NE2 3.45Å
160	S	94.5	Very high	94.4	Very high	38 Å²	38	63.2 Å²	63.2	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-66.3	-40	176.5	-55.3	0	0	0	0	111.9	Y152 I157 G164	Y152-S160 WeakPolarHBondContact CD2-O 3.49Å; I157-S160 WeakPolarHBondContact CG2-OG 3.27Å; I157-S160 PolarHBondContact O-N 3.29Å; S160-G164 PolarHBondContact O-N 3.11Å
161	I	94.8	Very high	94.3	Very high	8 Å²	8	56.3 Å²	56.3	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-42.4	176.4	-60.5	162.3	0	0	0	110.6	L149 K153 I157 K158 G164 H165 Y191	L149-I161 HydrophobicContact CD1-CG2 4.32Å; K153-I161 HydrophobicContact CG-CD1 4.17Å; K153-I161 HydrophobicContact CG-CG1 4.04Å; K153-I161 HydrophobicContact CG-CG2 4.22Å; I157-I161 VanDerWaalsContact O-CG1 3.3Å; I157-I161 WeakPolarHBondContact O-CG1 3.46Å; I157-I161 PolarHBondContact O-N 3.35Å; K158-I161 PolarHBondContact O-N 3.06Å; I161-G164 PolarHBondContact O-N 3.25Å; I161-H165 PolarHBondContact O-CD2 3.09Å; I161-H165 VanDerWaalsContact O-CD2 3.29Å; I161-H165 PolarHBondContact O-N 2.96Å; I161-Y191 HydrophobicContact CB-CD1 4.29Å; I161-Y191 HydrophobicContact CB-CE1 4.41Å; I161-Y191 HydrophobicContact CB-CG 4.36Å; I161-Y191 HydrophobicContact CD1-CD1 4.31Å; I161-Y191 HydrophobicContact CD1-CE1 3.99Å; I161-Y191 HydrophobicContact CG2-CD1 4.06Å; I161-Y191 HydrophobicContact CG2-CD2 3.73Å; I161-Y191 HydrophobicContact CG2-CE1 3.86Å; I161-Y191 HydrophobicContact CG2-CE2 3.51Å; I161-Y191 HydrophobicContact CG2-CG 4Å
162	R	95.7	Very high	94.2	Very high	19 Å²	19	54 Å²	54	7%	0.072	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-51.9	177.7	-168.8	-164.2	67.5	66.2	8.9	111.1	K158 E159 G164 H165 D166 A188	K158-R162 WeakPolarHBondContact O-CB 3.3Å; K158-R162 PolarHBondContact O-N 3.21Å; E159-R162 PolarHBondContact O-N 3.26Å; E159-R162 IonicContact OE1-CZ 3.24Å; E159-R162 IonicContact OE1-NE 3.56Å; E159-R162 IonicContact OE1-NH2 2.71Å; E159-R162 PolarHBondContact OE1-NH2 3.48Å; E159-R162 IonicContact OE2-CZ 3.03Å; E159-R162 IonicContact OE2-NE 2.76Å; E159-R162 PolarHBondContact OE2-NE 3.15Å; E159-R162 IonicContact OE2-NH2 3.65Å; R162-G164 PolarHBondContact O-N 3.23Å; R162-H165 WeakPolarHBondContact O-CB 3.21Å; R162-H165 PolarHBondContact O-N 2.83Å; R162-H165 VanDerWaalsContact O-N 3.16Å; R162-D166 IonicContact CZ-OD2 3.57Å; R162-D166 IonicContact NH1-OD2 2.73Å; R162-D166 PolarHBondContact NH1-OD2 2.81Å; R162-D166 PolarHBondContact O-N 3.24Å; R162-A188 HydrophobicContact CG-CB 4.39Å
163	R	94.3	Very high	94.1	Very high	149 Å²	149	50.5 Å²	50.5	56%	0.562	27%	0.268	S	S	*	.	H	α-helix	trans	-62.1	-41.9	177.5	-175.1	179.6	-72	-134.6	-2.1	111.9	E159 H165 D166 D167	E159-R163 WeakPolarHBondContact O-CB 3.47Å; E159-R163 PolarHBondContact O-N 3.39Å; R163-H165 PolarHBondContact O-N 3.4Å; R163-D166 WeakPolarHBondContact O-CB 3.44Å; R163-D166 PolarHBondContact O-N 2.79Å; R163-D167 VanDerWaalsContact O-CG 3.3Å; R163-D167 PolarHBondContact O-N 3.43Å
164	G	95.4	Very high	93.9	Very high	5 Å²	5	49.5 Å²	49.5	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-32.5	175.6	0	0	0	0	0	113.2	S160 I161 R162 L168	S160-G164 PolarHBondContact O-N 3.11Å; I161-G164 PolarHBondContact O-N 3.25Å; R162-G164 PolarHBondContact O-N 3.23Å; G164-L168 VanDerWaalsContact O-CB 3.28Å; G164-L168 WeakPolarHBondContact O-CB 3.31Å; G164-L168 PolarHBondContact O-N 2.9Å; G164-L168 VanDerWaalsContact O-N 3.14Å
165	H	96.3	Very high	93.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-71.4	-36.3	171.6	-83.6	-56.5	0	0	0	113.2	I161 R162 R163 G169 A188	I161-H165 PolarHBondContact O-CD2 3.09Å; I161-H165 VanDerWaalsContact O-CD2 3.29Å; I161-H165 PolarHBondContact O-N 2.96Å; R162-H165 WeakPolarHBondContact O-CB 3.21Å; R162-H165 PolarHBondContact O-N 2.83Å; R162-H165 VanDerWaalsContact O-N 3.16Å; R163-H165 PolarHBondContact O-N 3.4Å; H165-G169 PolarHBondContact O-N 3.11Å; H165-A188 HydrophobicContact CB-CB 3.81Å
166	D	94.9	Very high	93.4	Very high	18 Å²	18	44.1 Å²	44.1	10%	0.096	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-50.4	173.9	-67.6	-31.6	0	0	0	110.6	R162 R163 L168 G169 D170	R162-D166 IonicContact CZ-OD2 3.57Å; R162-D166 IonicContact NH1-OD2 2.73Å; R162-D166 PolarHBondContact NH1-OD2 2.81Å; R162-D166 PolarHBondContact O-N 3.24Å; R163-D166 WeakPolarHBondContact O-CB 3.44Å; R163-D166 PolarHBondContact O-N 2.79Å; D166-L168 VanDerWaalsContact C-N 3.27Å; D166-L168 PolarHBondContact O-N 3.47Å; D166-G169 WeakPolarHBondContact O-CA 3.16Å; D166-G169 PolarHBondContact O-N 3.03Å; D166-D170 PolarHBondContact O-N 2.98Å
167	D	95.2	Very high	93.4	Very high	69 Å²	69	42.3 Å²	42.3	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-59.9	-37.8	179.8	-63.7	-29.9	0	0	0	111.9	L145 R163 H171	L145-D167 HydrophobicContact CD2-CB 4.22Å; R163-D167 VanDerWaalsContact O-CG 3.3Å; R163-D167 PolarHBondContact O-N 3.43Å; D167-H171 WeakPolarHBondContact O-CB 3.21Å; D167-H171 PolarHBondContact O-N 3.29Å
168	L	95.2	Very high	93.3	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-69.8	-40.1	176	-172.9	64.5	0	0	0	111.5	L145 L149 G164 D166 H171 Y172	L145-L168 HydrophobicContact CB-CD1 4.09Å; L149-L168 HydrophobicContact CD2-CD2 4.05Å; G164-L168 VanDerWaalsContact O-CB 3.28Å; G164-L168 WeakPolarHBondContact O-CB 3.31Å; G164-L168 PolarHBondContact O-N 2.9Å; G164-L168 VanDerWaalsContact O-N 3.14Å; D166-L168 VanDerWaalsContact C-N 3.27Å; D166-L168 PolarHBondContact O-N 3.47Å; L168-H171 PolarHBondContact O-N 3.31Å; L168-Y172 HydrophobicContact CD1-CD2 4.31Å; L168-Y172 HydrophobicContact CD1-CE2 3.8Å; L168-Y172 HydrophobicContact CD2-CE2 4.06Å; L168-Y172 HydrophobicContact CG-CD2 3.96Å; L168-Y172 HydrophobicContact CG-CE2 3.6Å; L168-Y172 WeakPolarHBondContact O-CD2 3.41Å; L168-Y172 PolarHBondContact O-N 3.02Å
169	G	94.8	Very high	93.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-44.6	174.7	0	0	0	0	0	112.4	H165 D166 H171 Y172 L173 Y185	H165-G169 PolarHBondContact O-N 3.11Å; D166-G169 WeakPolarHBondContact O-CA 3.16Å; D166-G169 PolarHBondContact O-N 3.03Å; G169-H171 VanDerWaalsContact C-N 3.35Å; G169-H171 PolarHBondContact O-N 3.49Å; G169-Y172 PolarHBondContact O-N 2.92Å; G169-L173 PolarHBondContact O-N 3.18Å; G169-Y185 VanDerWaalsContact C-OH 3.28Å
170	D	93.1	Very high	93.4	Very high	62 Å²	62	36.2 Å²	36.2	33%	0.332	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-42.4	177.2	-67.9	-12.9	0	0	0	110.9	D166 Y172 L173 D174 Y185	D166-D170 PolarHBondContact O-N 2.98Å; D170-Y172 PolarHBondContact O-N 2.93Å; D170-L173 WeakPolarHBondContact O-CB 3.43Å; D170-L173 PolarHBondContact O-N 3.29Å; D170-D174 PolarHBondContact O-N 3.48Å; D170-Y185 PolarHBondContact N-OH 2.73Å; D170-Y185 PolarHBondContact OD1-OH 3.24Å
171	H	94.1	Very high	93.4	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-38.2	175.1	-175.2	68.8	0	0	0	112.7	A138 K141 L145 D167 L168 G169 L173 D174 C175	A138-H171 PolarHBondContact O-NE2 2.87Å; K141-H171 WeakPolarHBondContact CD-ND1 3.28Å; K141-H171 WeakPolarHBondContact CE-ND1 3.46Å; K141-H171 PolarHBondContact NZ-ND1 3.39Å; L145-H171 HydrophobicContact CD1-CB 3.73Å; D167-H171 WeakPolarHBondContact O-CB 3.21Å; D167-H171 PolarHBondContact O-N 3.29Å; L168-H171 PolarHBondContact O-N 3.31Å; G169-H171 VanDerWaalsContact C-N 3.35Å; G169-H171 PolarHBondContact O-N 3.49Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-D174 PolarHBondContact O-N 3.49Å; H171-C175 PolarHBondContact NE2-SG 3.24Å; H171-C175 PolarHBondContact O-N 3.44Å; H171-C175 PolarHBondContact O-SG 2.88Å
172	Y	94.4	Very high	93.4	Very high	36 Å²	36	35.9 Å²	35.9	14%	0.141	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-38.1	173.4	-81.6	-59.5	0	0	0	112.1	L142 L168 G169 D170 C175 G176 D177 N180	L142-Y172 HydrophobicContact CD1-CE1 3.75Å; L168-Y172 HydrophobicContact CD1-CD2 4.31Å; L168-Y172 HydrophobicContact CD1-CE2 3.8Å; L168-Y172 HydrophobicContact CD2-CE2 4.06Å; L168-Y172 HydrophobicContact CG-CD2 3.96Å; L168-Y172 HydrophobicContact CG-CE2 3.6Å; L168-Y172 WeakPolarHBondContact O-CD2 3.41Å; L168-Y172 PolarHBondContact O-N 3.02Å; G169-Y172 PolarHBondContact O-N 2.92Å; D170-Y172 PolarHBondContact O-N 2.93Å; Y172-C175 PolarHBondContact O-N 3.03Å; Y172-G176 PolarHBondContact O-N 3.3Å; Y172-D177 HydrophobicContact CD1-CB 3.93Å; Y172-D177 PolarHBondContact O-N 3.02Å; Y172-N180 HydrophobicContact CD1-CB 3.91Å; Y172-N180 HydrophobicContact CD2-CB 4.12Å; Y172-N180 HydrophobicContact CE1-CB 3.89Å; Y172-N180 HydrophobicContact CE2-CB 4.11Å; Y172-N180 HydrophobicContact CG-CB 4.04Å
173	L	91.5	Very high	93.4	Very high	9 Å²	9	40 Å²	40	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-43.3	172.9	-73.6	174.4	0	0	0	112.2	L54 G169 D170 H171 C175 G176 L178 A181 Y185 K207 V208 Y211	L54-L173 HydrophobicContact CD1-CD2 4.35Å; G169-L173 PolarHBondContact O-N 3.18Å; D170-L173 WeakPolarHBondContact O-CB 3.43Å; D170-L173 PolarHBondContact O-N 3.29Å; H171-L173 VanDerWaalsContact C-N 3.35Å; L173-C175 PolarHBondContact O-N 2.71Å; L173-G176 PolarHBondContact O-N 3.11Å; L173-G176 VanDerWaalsContact O-N 3.07Å; L173-L178 HydrophobicContact CD2-CD2 3.82Å; L173-A181 HydrophobicContact CD2-CB 3.99Å; L173-A181 HydrophobicContact CG-CB 3.9Å; L173-Y185 HydrophobicContact CD1-CE2 4.25Å; L173-Y185 WeakPolarHBondContact CD1-OH 3.46Å; L173-K207 HydrophobicContact CD1-CD 4.17Å; L173-V208 HydrophobicContact CD1-CG2 4.21Å; L173-V208 HydrophobicContact CD2-CG2 3.99Å; L173-V208 HydrophobicContact CG-CG2 4.44Å; L173-Y211 HydrophobicContact CD2-CD2 4.38Å
174	D	89.6	Confident	93.4	Very high	68 Å²	68	33.1 Å²	33.1	36%	0.364	19%	0.185	S	C	.	.	H	α-helix	trans	-62.5	-30.6	176.1	-71.8	-21.9	0	0	0	112.7	F86 N87 D170 H171	F86-D174 HydrophobicContact CD2-CB 4.3Å; F86-D174 PolarHBondContact N-O 3.41Å; N87-D174 PolarHBondContact N-O 2.99Å; D170-D174 PolarHBondContact O-N 3.48Å; H171-D174 PolarHBondContact O-N 3.49Å
175	C	89.3	Confident	93.4	Very high	32 Å²	32	32.9 Å²	32.9	22%	0.216	18%	0.183	C	C	.	.	H	α-helix	trans	-83	-17	175.5	-62.8	0	0	0	0	113.1	H171 Y172 L173	H171-C175 PolarHBondContact NE2-SG 3.24Å; H171-C175 PolarHBondContact O-N 3.44Å; H171-C175 PolarHBondContact O-SG 2.88Å; Y172-C175 PolarHBondContact O-N 3.03Å; L173-C175 PolarHBondContact O-N 2.71Å
176	G	87.6	Confident	93.3	Very high	30 Å²	30	34.3 Å²	34.3	31%	0.309	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	5.6	-177.1	0	0	0	0	0	115.9	N87 Y172 L173 L178	N87-G176 VanDerWaalsContact ND2-CA 3.29Å; N87-G176 WeakPolarHBondContact ND2-CA 3.19Å; Y172-G176 PolarHBondContact O-N 3.3Å; L173-G176 PolarHBondContact O-N 3.11Å; L173-G176 VanDerWaalsContact O-N 3.07Å; G176-L178 PolarHBondContact O-N 3.48Å
177	D	91.8	Very high	93.2	Very high	57 Å²	57	40.2 Å²	40.2	31%	0.305	21%	0.214	S	C	.	.			trans	-89.2	85	-179.8	-168.6	-26.1	0	0	0	111.6	Y172 S179 N180 A181	Y172-D177 HydrophobicContact CD1-CB 3.93Å; Y172-D177 PolarHBondContact O-N 3.02Å; D177-S179 VanDerWaalsContact C-N 3.31Å; D177-S179 PolarHBondContact O-N 3.15Å; D177-S179 PolarHBondContact OD1-N 3.42Å; D177-N180 WeakPolarHBondContact OD1-CB 3.48Å; D177-N180 PolarHBondContact OD1-N 2.93Å; D177-N180 PolarHBondContact OD1-ND2 3.45Å; D177-N180 PolarHBondContact OD2-ND2 3.24Å; D177-A181 WeakPolarHBondContact O-CB 3.41Å; D177-A181 PolarHBondContact O-N 3.32Å; D177-A181 VanDerWaalsContact O-N 3.09Å
178	L	91.9	Very high	93.1	Very high	34 Å²	34	37 Å²	37	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-35.3	-178	-58.8	179.8	0	0	0	112.9	L54 L173 G176 L182 V208 Y211 L212	L54-L178 HydrophobicContact CD1-CD2 3.77Å; L173-L178 HydrophobicContact CD2-CD2 3.82Å; G176-L178 PolarHBondContact O-N 3.48Å; L178-L182 PolarHBondContact O-N 2.86Å; L178-L182 VanDerWaalsContact O-N 3.14Å; L178-V208 HydrophobicContact CB-CG1 4.38Å; L178-V208 WeakPolarHBondContact O-CG1 3.42Å; L178-Y211 HydrophobicContact CD2-CD2 4.2Å; L178-Y211 HydrophobicContact CD2-CG 4.3Å; L178-L212 HydrophobicContact CB-CD2 3.7Å; L178-L212 HydrophobicContact CB-CG 4.1Å; L178-L212 HydrophobicContact CD1-CD2 3.9Å; L178-L212 HydrophobicContact CD1-CG 4.35Å; L178-L212 HydrophobicContact CG-CD2 4.47Å
179	S	93.8	Very high	93.1	Very high	69 Å²	69	42.1 Å²	42.1	48%	0.483	22%	0.215	S	C	.	.	H	α-helix	trans	-69.8	-43.5	-176.3	-73.2	0	0	0	0	111.9	D177 K183	D177-S179 VanDerWaalsContact C-N 3.31Å; D177-S179 PolarHBondContact O-N 3.15Å; D177-S179 PolarHBondContact OD1-N 3.42Å; S179-K183 WeakPolarHBondContact O-CG 3.47Å; S179-K183 PolarHBondContact O-N 3.22Å
180	N	93.7	Very high	93	Very high	48 Å²	48	47.2 Å²	47.2	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-77.4	-30.7	179.2	-70	-34.5	0	0	0	112.3	Y172 D177 K183 C184	Y172-N180 HydrophobicContact CD1-CB 3.91Å; Y172-N180 HydrophobicContact CD2-CB 4.12Å; Y172-N180 HydrophobicContact CE1-CB 3.89Å; Y172-N180 HydrophobicContact CE2-CB 4.11Å; Y172-N180 HydrophobicContact CG-CB 4.04Å; D177-N180 WeakPolarHBondContact OD1-CB 3.48Å; D177-N180 PolarHBondContact OD1-N 2.93Å; D177-N180 PolarHBondContact OD1-ND2 3.45Å; D177-N180 PolarHBondContact OD2-ND2 3.24Å; N180-K183 PolarHBondContact O-N 3.32Å; N180-K183 PolarHBondContact OD1-NZ 2.67Å; N180-C184 PolarHBondContact O-N 2.58Å; N180-C184 VanDerWaalsContact O-N 3.08Å; N180-C184 PolarHBondContact O-SG 3.23Å
181	A	94.9	Very high	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.6	-50.1	169.4	0	0	0	0	0	111.6	L173 D177 K183 C184 Y185 V208	L173-A181 HydrophobicContact CD2-CB 3.99Å; L173-A181 HydrophobicContact CG-CB 3.9Å; D177-A181 WeakPolarHBondContact O-CB 3.41Å; D177-A181 PolarHBondContact O-N 3.32Å; D177-A181 VanDerWaalsContact O-N 3.09Å; A181-K183 VanDerWaalsContact C-N 3.32Å; A181-K183 PolarHBondContact O-N 3.01Å; A181-C184 WeakPolarHBondContact O-CB 3.35Å; A181-C184 PolarHBondContact O-N 3.07Å; A181-C184 VanDerWaalsContact O-N 3.08Å; A181-Y185 HydrophobicContact CB-CE2 4.39Å; A181-Y185 WeakPolarHBondContact O-CD2 3.46Å; A181-Y185 PolarHBondContact O-N 3.21Å; A181-V208 HydrophobicContact CB-CG1 4.43Å; A181-V208 HydrophobicContact CB-CG2 4.27Å
182	L	94.9	Very high	92.9	Very high	40 Å²	40	48.5 Å²	48.5	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-41.5	179	-174.4	63.4	0	0	0	112.3	L178 C184 Y185 S186 V205 V208 L212	L178-L182 PolarHBondContact O-N 2.86Å; L178-L182 VanDerWaalsContact O-N 3.14Å; L182-C184 VanDerWaalsContact C-N 3.3Å; L182-C184 PolarHBondContact O-N 3.4Å; L182-Y185 PolarHBondContact O-N 3.1Å; L182-S186 WeakPolarHBondContact O-CB 3.4Å; L182-S186 PolarHBondContact O-N 2.95Å; L182-V205 HydrophobicContact CD1-CG1 3.86Å; L182-V205 HydrophobicContact CD1-CG2 4.49Å; L182-V208 HydrophobicContact CB-CG1 3.99Å; L182-V208 HydrophobicContact CD1-CB 4.4Å; L182-L212 HydrophobicContact CD2-CD1 4.01Å
183	K	94.9	Very high	92.7	Very high	106 Å²	106	51.7 Å²	51.7	46%	0.461	27%	0.27	S	S	.	.	H	α-helix	trans	-62.4	-37	176.6	-68.7	171	-163.2	161.8	0	112.1	S179 N180 A181 R187	S179-K183 WeakPolarHBondContact O-CG 3.47Å; S179-K183 PolarHBondContact O-N 3.22Å; N180-K183 PolarHBondContact O-N 3.32Å; N180-K183 PolarHBondContact OD1-NZ 2.67Å; A181-K183 VanDerWaalsContact C-N 3.32Å; A181-K183 PolarHBondContact O-N 3.01Å; K183-R187 VanDerWaalsContact O-CG 3.29Å; K183-R187 WeakPolarHBondContact O-CG 3.4Å; K183-R187 PolarHBondContact O-N 3.39Å
184	C	95.2	Very high	92.7	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.027	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-50.2	179.2	-67.7	0	0	0	0	111.4	N180 A181 L182 S186 R187 A188	N180-C184 PolarHBondContact O-N 2.58Å; N180-C184 VanDerWaalsContact O-N 3.08Å; N180-C184 PolarHBondContact O-SG 3.23Å; A181-C184 WeakPolarHBondContact O-CB 3.35Å; A181-C184 PolarHBondContact O-N 3.07Å; A181-C184 VanDerWaalsContact O-N 3.08Å; L182-C184 VanDerWaalsContact C-N 3.3Å; L182-C184 PolarHBondContact O-N 3.4Å; C184-S186 VanDerWaalsContact C-N 3.32Å; C184-S186 PolarHBondContact O-N 3.06Å; C184-R187 PolarHBondContact O-N 2.91Å; C184-R187 VanDerWaalsContact O-N 3.16Å; C184-A188 PolarHBondContact O-N 2.94Å; C184-A188 VanDerWaalsContact O-N 3.08Å
185	Y	94.8	Very high	92.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-35.8	176.7	-57.7	-57.1	0	0	0	112.3	G169 D170 L173 A181 L182 R187 A188 N204 V208	G169-Y185 VanDerWaalsContact C-OH 3.28Å; D170-Y185 PolarHBondContact N-OH 2.73Å; D170-Y185 PolarHBondContact OD1-OH 3.24Å; L173-Y185 HydrophobicContact CD1-CE2 4.25Å; L173-Y185 WeakPolarHBondContact CD1-OH 3.46Å; A181-Y185 HydrophobicContact CB-CE2 4.39Å; A181-Y185 WeakPolarHBondContact O-CD2 3.46Å; A181-Y185 PolarHBondContact O-N 3.21Å; L182-Y185 PolarHBondContact O-N 3.1Å; Y185-R187 VanDerWaalsContact C-N 3.3Å; Y185-R187 PolarHBondContact O-N 3.23Å; Y185-A188 WeakPolarHBondContact O-CB 3.47Å; Y185-A188 PolarHBondContact O-N 3.06Å; Y185-N204 HydrophobicContact CD1-CB 3.63Å; Y185-N204 HydrophobicContact CD2-CB 4.07Å; Y185-N204 HydrophobicContact CE1-CB 3.67Å; Y185-N204 WeakPolarHBondContact CE1-ND2 3.34Å; Y185-N204 HydrophobicContact CE2-CB 4.1Å; Y185-N204 HydrophobicContact CG-CB 3.83Å; Y185-V208 HydrophobicContact CD2-CG2 3.81Å; Y185-V208 HydrophobicContact CE2-CG2 3.54Å
186	S	93.2	Very high	92.6	Very high	31 Å²	31	54.2 Å²	54.2	22%	0.217	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-34.3	175.1	-175.2	0	0	0	0	112.7	L182 C184 R189	L182-S186 WeakPolarHBondContact O-CB 3.4Å; L182-S186 PolarHBondContact O-N 2.95Å; C184-S186 VanDerWaalsContact C-N 3.32Å; C184-S186 PolarHBondContact O-N 3.06Å; S186-R189 VanDerWaalsContact O-CB 3.26Å; S186-R189 WeakPolarHBondContact O-CB 3.48Å
187	R	93.8	Very high	92.8	Very high	142 Å²	142	54.5 Å²	54.5	54%	0.536	28%	0.276	S	S	.	.	H	α-helix	trans	-74.7	-30.2	175.7	-73.5	171.4	-179	167.3	0	112.3	K183 C184 Y185 R189 Y191	K183-R187 VanDerWaalsContact O-CG 3.29Å; K183-R187 WeakPolarHBondContact O-CG 3.4Å; K183-R187 PolarHBondContact O-N 3.39Å; C184-R187 PolarHBondContact O-N 2.91Å; C184-R187 VanDerWaalsContact O-N 3.16Å; Y185-R187 VanDerWaalsContact C-N 3.3Å; Y185-R187 PolarHBondContact O-N 3.23Å; R187-R189 PolarHBondContact O-N 3.29Å; R187-Y191 WeakPolarHBondContact O-CD2 3.31Å; R187-Y191 WeakPolarHBondContact O-CE2 3.26Å
188	A	93.6	Very high	92.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-26.5	176.1	0	0	0	0	0	112.7	R162 H165 C184 Y185 D190 Y191	R162-A188 HydrophobicContact CG-CB 4.39Å; H165-A188 HydrophobicContact CB-CB 3.81Å; C184-A188 PolarHBondContact O-N 2.94Å; C184-A188 VanDerWaalsContact O-N 3.08Å; Y185-A188 WeakPolarHBondContact O-CB 3.47Å; Y185-A188 PolarHBondContact O-N 3.06Å; A188-D190 VanDerWaalsContact C-N 3.3Å; A188-D190 PolarHBondContact O-N 3.3Å; A188-Y191 PolarHBondContact O-N 3.2Å
189	R	93.6	Very high	92.8	Very high	114 Å²	114	51.9 Å²	51.9	43%	0.43	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-49.9	-44.5	-179.2	-172.5	-171.8	69.4	-175.5	0	113.9	S186 R187 Y191 C192 M201	S186-R189 VanDerWaalsContact O-CB 3.26Å; S186-R189 WeakPolarHBondContact O-CB 3.48Å; R187-R189 PolarHBondContact O-N 3.29Å; R189-Y191 PolarHBondContact O-N 2.92Å; R189-C192 WeakPolarHBondContact O-CB 3.42Å; R189-C192 PolarHBondContact O-N 3.11Å; R189-M201 HydrophobicContact CB-SD 3.6Å; R189-M201 HydrophobicContact CG-SD 3.79Å
190	D	92.5	Very high	92.6	Very high	107 Å²	107	52.1 Å²	52.1	57%	0.572	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-72.5	-12.7	-173.1	-57	-24	0	0	0	112.1	A188	A188-D190 VanDerWaalsContact C-N 3.3Å; A188-D190 PolarHBondContact O-N 3.3Å
191	Y	93.6	Very high	92.7	Very high	64 Å²	64	50 Å²	50	25%	0.251	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-101.5	3.6	178	-52.4	-74.1	0	0	0	112.9	K158 I161 R187 A188 R189	K158-Y191 HydrophobicContact CG-CD1 4.46Å; I161-Y191 HydrophobicContact CB-CD1 4.29Å; I161-Y191 HydrophobicContact CB-CE1 4.41Å; I161-Y191 HydrophobicContact CB-CG 4.36Å; I161-Y191 HydrophobicContact CD1-CD1 4.31Å; I161-Y191 HydrophobicContact CD1-CE1 3.99Å; I161-Y191 HydrophobicContact CG2-CD1 4.06Å; I161-Y191 HydrophobicContact CG2-CD2 3.73Å; I161-Y191 HydrophobicContact CG2-CE1 3.86Å; I161-Y191 HydrophobicContact CG2-CE2 3.51Å; I161-Y191 HydrophobicContact CG2-CG 4Å; R187-Y191 WeakPolarHBondContact O-CD2 3.31Å; R187-Y191 WeakPolarHBondContact O-CE2 3.26Å; A188-Y191 PolarHBondContact O-N 3.2Å; R189-Y191 PolarHBondContact O-N 2.92Å
192	C	91.9	Very high	92.6	Very high	28 Å²	28	50 Å²	50	19%	0.189	25%	0.248	C	C	.	.			trans	-75.2	126.7	174	-62.5	0	0	0	0	111	R189 H197 V198	R189-C192 WeakPolarHBondContact O-CB 3.42Å; R189-C192 PolarHBondContact O-N 3.11Å; C192-H197 HydrophobicContact CB-CB 3.86Å; C192-V198 HydrophobicContact CB-CG2 3.96Å
193	T	91.1	Very high	92.5	Very high	102 Å²	102	49.3 Å²	49.3	63%	0.626	24%	0.244	S	C	*	.			trans	-115.6	-28.6	177.9	51.7	0	0	0	0	113.2	K158 H197	K158-T193 HydrophobicContact CD-CG2 4.07Å; T193-H197 PolarHBondContact OG1-ND1 3.14Å
194	S	90.8	Very high	92.5	Very high	42 Å²	42	45.8 Å²	45.8	29%	0.294	23%	0.23	S	C	.	.	S	Bend	trans	-110.8	154.8	-179.8	174	0	0	0	0	110.8	K196 H197 V198	S194-K196 PolarHBondContact O-N 2.98Å; S194-K196 PolarHBondContact OG-N 3.05Å; S194-H197 WeakPolarHBondContact O-CB 3.37Å; S194-H197 PolarHBondContact O-N 3.44Å; S194-V198 PolarHBondContact O-N 3.15Å
195	A	88.8	Confident	92.5	Very high	18 Å²	18	45.7 Å²	45.7	15%	0.149	23%	0.229	C	C	.	.	H	α-helix	trans	-53.5	-40.6	171.5	0	0	0	0	0	112.5	H197 V198 I199 T228 E230	A195-H197 VanDerWaalsContact C-N 3.27Å; A195-H197 PolarHBondContact O-N 3.43Å; A195-V198 PolarHBondContact O-N 3.4Å; A195-V198 VanDerWaalsContact O-N 3.1Å; A195-I199 WeakPolarHBondContact O-CG1 3.48Å; A195-I199 PolarHBondContact O-N 3.16Å; A195-T228 HydrophobicContact CB-CG2 3.41Å; A195-T228 VanDerWaalsContact CB-CG2 3.41Å; A195-E230 HydrophobicContact CB-CB 3.93Å; A195-E230 VanDerWaalsContact CB-CD 3.5Å; A195-E230 HydrophobicContact CB-CG 3.52Å
196	K	87.9	Confident	92.5	Very high	103 Å²	103	45.8 Å²	45.8	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-57.6	-38.6	175.2	-60.5	-171.1	-179.9	-173	0	112.9	S194 V198 I199 N200 E230	S194-K196 PolarHBondContact O-N 2.98Å; S194-K196 PolarHBondContact OG-N 3.05Å; K196-V198 VanDerWaalsContact C-N 3.35Å; K196-I199 PolarHBondContact O-N 3.18Å; K196-N200 WeakPolarHBondContact O-CB 3.21Å; K196-N200 VanDerWaalsContact O-CG 3.31Å; K196-N200 PolarHBondContact O-N 3.4Å; K196-E230 WeakPolarHBondContact CG-OE2 3.48Å
197	H	91.5	Very high	92.5	Very high	35 Å²	35	45.6 Å²	45.6	16%	0.162	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-40.2	178.4	-59.1	169.4	0	0	0	110.9	E159 C192 T193 S194 A195 M201	E159-H197 IonicContact OE2-CE1 2.67Å; E159-H197 PolarHBondContact OE2-CE1 3.03Å; E159-H197 IonicContact OE2-NE2 3.45Å; C192-H197 HydrophobicContact CB-CB 3.86Å; T193-H197 PolarHBondContact OG1-ND1 3.14Å; S194-H197 WeakPolarHBondContact O-CB 3.37Å; S194-H197 PolarHBondContact O-N 3.44Å; A195-H197 VanDerWaalsContact C-N 3.27Å; A195-H197 PolarHBondContact O-N 3.43Å; H197-M201 VanDerWaalsContact O-CB 3.3Å; H197-M201 WeakPolarHBondContact O-CB 3.45Å; H197-M201 PolarHBondContact O-N 3.03Å; H197-M201 VanDerWaalsContact O-N 3.08Å
198	V	92.3	Very high	92.5	Very high	35 Å²	35	38.8 Å²	38.8	21%	0.212	20%	0.2	C	C	.	.	H	α-helix	trans	-65.7	-44.8	177.1	-179	0	0	0	0	110.6	C192 S194 A195 K196 M201 C202	C192-V198 HydrophobicContact CB-CG2 3.96Å; S194-V198 PolarHBondContact O-N 3.15Å; A195-V198 PolarHBondContact O-N 3.4Å; A195-V198 VanDerWaalsContact O-N 3.1Å; K196-V198 VanDerWaalsContact C-N 3.35Å; V198-M201 PolarHBondContact O-N 3.34Å; V198-C202 WeakPolarHBondContact O-CB 3.45Å; V198-C202 PolarHBondContact O-N 2.83Å; V198-C202 PolarHBondContact O-SG 3.5Å
199	I	91.4	Very high	92.6	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-50.1	179.4	-68.5	161.8	0	0	0	111.2	A195 K196 M201 C202 L203 T228 I231 I244	A195-I199 WeakPolarHBondContact O-CG1 3.48Å; A195-I199 PolarHBondContact O-N 3.16Å; K196-I199 PolarHBondContact O-N 3.18Å; I199-M201 VanDerWaalsContact C-N 3.33Å; I199-M201 PolarHBondContact O-N 3.47Å; I199-C202 WeakPolarHBondContact O-CB 3.31Å; I199-C202 PolarHBondContact O-N 2.69Å; I199-C202 VanDerWaalsContact O-N 3.14Å; I199-L203 HydrophobicContact CG2-CD1 4.2Å; I199-L203 WeakPolarHBondContact O-CG 3.17Å; I199-L203 PolarHBondContact O-N 3.42Å; I199-T228 HydrophobicContact CD1-CG2 4.46Å; I199-T228 HydrophobicContact CG1-CG2 4.43Å; I199-I231 HydrophobicContact CD1-CD1 3.51Å; I199-I231 HydrophobicContact CD1-CG1 3.87Å; I199-I231 HydrophobicContact CG1-CD1 3.84Å; I199-I244 HydrophobicContact CG2-CD1 4.37Å; I199-I244 HydrophobicContact CG2-CG2 3.52Å
200	N	91.3	Very high	92.6	Very high	73 Å²	73	33.5 Å²	33.5	39%	0.39	18%	0.18	S	C	.	.	H	α-helix	trans	-61.1	-42.9	179.4	-71	-14.1	0	0	0	111.6	K196 C202 L203 N204	K196-N200 WeakPolarHBondContact O-CB 3.21Å; K196-N200 VanDerWaalsContact O-CG 3.31Å; K196-N200 PolarHBondContact O-N 3.4Å; N200-C202 PolarHBondContact O-N 3.28Å; N200-L203 PolarHBondContact O-N 2.97Å; N200-N204 PolarHBondContact O-N 3.11Å
201	M	93.9	Very high	92.5	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-43.8	174.3	178.9	-129.8	64	0	0	111.3	R189 H197 V198 I199 L203 N204 V205 Y221	R189-M201 HydrophobicContact CB-SD 3.6Å; R189-M201 HydrophobicContact CG-SD 3.79Å; H197-M201 VanDerWaalsContact O-CB 3.3Å; H197-M201 WeakPolarHBondContact O-CB 3.45Å; H197-M201 PolarHBondContact O-N 3.03Å; H197-M201 VanDerWaalsContact O-N 3.08Å; V198-M201 PolarHBondContact O-N 3.34Å; I199-M201 VanDerWaalsContact C-N 3.33Å; I199-M201 PolarHBondContact O-N 3.47Å; M201-L203 VanDerWaalsContact C-N 3.35Å; M201-L203 PolarHBondContact O-N 3.42Å; M201-N204 PolarHBondContact O-N 2.95Å; M201-V205 WeakPolarHBondContact O-CG2 3.44Å; M201-V205 PolarHBondContact O-N 2.9Å; M201-Y221 HydrophobicContact CE-CD1 4.3Å; M201-Y221 HydrophobicContact CE-CE1 3.87Å
202	C	94.4	Very high	92.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-42.9	176.8	-71.2	0	0	0	0	111.6	V198 I199 N200 V205 I206 Y221 A225	V198-C202 WeakPolarHBondContact O-CB 3.45Å; V198-C202 PolarHBondContact O-N 2.83Å; V198-C202 PolarHBondContact O-SG 3.5Å; I199-C202 WeakPolarHBondContact O-CB 3.31Å; I199-C202 PolarHBondContact O-N 2.69Å; I199-C202 VanDerWaalsContact O-N 3.14Å; N200-C202 PolarHBondContact O-N 3.28Å; C202-V205 PolarHBondContact O-N 3.43Å; C202-I206 WeakPolarHBondContact O-CB 3.02Å; C202-I206 WeakPolarHBondContact O-CD1 3.3Å; C202-I206 WeakPolarHBondContact O-CG1 3.45Å; C202-I206 PolarHBondContact O-N 3.05Å; C202-Y221 HydrophobicContact CB-CD1 4.27Å; C202-A225 HydrophobicContact CB-CB 3.98Å
203	L	92.9	Very high	92.5	Very high	26 Å²	26	34.5 Å²	34.5	14%	0.136	18%	0.182	C	C	.	.	H	α-helix	trans	-62.3	-43	177.6	-71.7	171.2	0	0	0	111.9	I199 N200 M201 I206 K207 K247 L248	I199-L203 HydrophobicContact CG2-CD1 4.2Å; I199-L203 WeakPolarHBondContact O-CG 3.17Å; I199-L203 PolarHBondContact O-N 3.42Å; N200-L203 PolarHBondContact O-N 2.97Å; M201-L203 VanDerWaalsContact C-N 3.35Å; M201-L203 PolarHBondContact O-N 3.42Å; L203-I206 PolarHBondContact O-N 3.24Å; L203-K207 WeakPolarHBondContact O-CB 3.4Å; L203-K207 PolarHBondContact O-N 3.37Å; L203-K247 HydrophobicContact CD2-CB 4.27Å; L203-L248 HydrophobicContact CD2-CD2 3.87Å; L203-L248 HydrophobicContact CD2-CG 4.47Å
204	N	93.8	Very high	92.7	Very high	33 Å²	33	32.9 Å²	32.9	18%	0.176	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-42.7	176.1	-70.7	-13.4	0	0	0	111.6	Y185 N200 M201 K207 V208	Y185-N204 HydrophobicContact CD1-CB 3.63Å; Y185-N204 HydrophobicContact CD2-CB 4.07Å; Y185-N204 HydrophobicContact CE1-CB 3.67Å; Y185-N204 WeakPolarHBondContact CE1-ND2 3.34Å; Y185-N204 HydrophobicContact CE2-CB 4.1Å; Y185-N204 HydrophobicContact CG-CB 3.83Å; N200-N204 PolarHBondContact O-N 3.11Å; M201-N204 PolarHBondContact O-N 2.95Å; N204-K207 WeakPolarHBondContact O-CB 3.41Å; N204-K207 PolarHBondContact O-N 2.57Å; N204-V208 WeakPolarHBondContact O-CG2 3.46Å; N204-V208 PolarHBondContact O-N 3.43Å; N204-V208 VanDerWaalsContact O-N 3.15Å
205	V	95	Very high	92.9	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-46	175.1	172.4	0	0	0	0	111	L182 M201 C202 K207 V208 S209 Y221	L182-V205 HydrophobicContact CD1-CG1 3.86Å; L182-V205 HydrophobicContact CD1-CG2 4.49Å; M201-V205 WeakPolarHBondContact O-CG2 3.44Å; M201-V205 PolarHBondContact O-N 2.9Å; C202-V205 PolarHBondContact O-N 3.43Å; V205-K207 VanDerWaalsContact C-N 3.31Å; V205-K207 PolarHBondContact O-N 3.27Å; V205-V208 PolarHBondContact O-N 3.42Å; V205-S209 WeakPolarHBondContact O-CB 3.37Å; V205-S209 PolarHBondContact O-N 3.47Å; V205-S209 PolarHBondContact O-OG 3.36Å; V205-Y221 HydrophobicContact CG1-CD1 4.4Å; V205-Y221 HydrophobicContact CG1-CD2 3.61Å; V205-Y221 HydrophobicContact CG1-CE1 4.28Å; V205-Y221 HydrophobicContact CG1-CE2 3.47Å; V205-Y221 VanDerWaalsContact CG1-CE2 3.47Å; V205-Y221 HydrophobicContact CG1-CG 4.08Å
206	I	94.8	Very high	93.2	Very high	2 Å²	2	36 Å²	36	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-55.9	-46.6	176.1	-73.8	162.3	0	0	0	110.8	C202 L203 V208 S209 V210 V218 V222 L248 A251	C202-I206 WeakPolarHBondContact O-CB 3.02Å; C202-I206 WeakPolarHBondContact O-CD1 3.3Å; C202-I206 WeakPolarHBondContact O-CG1 3.45Å; C202-I206 PolarHBondContact O-N 3.05Å; L203-I206 PolarHBondContact O-N 3.24Å; I206-V208 PolarHBondContact O-N 2.76Å; I206-S209 PolarHBondContact O-N 3.35Å; I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 VanDerWaalsContact O-CG2 3.22Å; I206-V210 WeakPolarHBondContact O-CG2 3.2Å; I206-V210 PolarHBondContact O-N 3.1Å; I206-V218 HydrophobicContact CG1-CG1 4.43Å; I206-V218 HydrophobicContact CG2-CG1 3.98Å; I206-V222 HydrophobicContact CD1-CG2 3.66Å; I206-V222 HydrophobicContact CG1-CG2 4.46Å; I206-L248 HydrophobicContact CD1-CD2 4.06Å; I206-A251 HydrophobicContact CG2-CB 3.7Å
207	K	93.2	Very high	93.5	Very high	27 Å²	27	33.3 Å²	33.3	12%	0.117	17%	0.172	C	C	.	.	H	α-helix	trans	-54.6	-50.1	177.6	177.5	-174.1	-177.7	175.6	0	111.5	L173 L203 N204 V205 V210 Y211 E281	L173-K207 HydrophobicContact CD1-CD 4.17Å; L203-K207 WeakPolarHBondContact O-CB 3.4Å; L203-K207 PolarHBondContact O-N 3.37Å; N204-K207 WeakPolarHBondContact O-CB 3.41Å; N204-K207 PolarHBondContact O-N 2.57Å; V205-K207 VanDerWaalsContact C-N 3.31Å; V205-K207 PolarHBondContact O-N 3.27Å; K207-V210 PolarHBondContact O-N 3.34Å; K207-Y211 HydrophobicContact CG-CE2 3.79Å; K207-Y211 WeakPolarHBondContact O-CD2 3.42Å; K207-Y211 PolarHBondContact O-N 3.07Å; K207-E281 VanDerWaalsContact CD-OE2 3.28Å; K207-E281 WeakPolarHBondContact CD-OE2 3.22Å; K207-E281 VanDerWaalsContact CE-CD 3.47Å; K207-E281 WeakPolarHBondContact CE-OE2 3.48Å; K207-E281 IonicContact NZ-OE1 2.83Å; K207-E281 PolarHBondContact NZ-OE1 3.26Å; K207-E281 IonicContact NZ-OE2 2.82Å; K207-E281 PolarHBondContact NZ-OE2 2.75Å
208	V	94.5	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.1	-40.5	178.7	-170.5	0	0	0	0	111.9	L173 L178 A181 L182 Y185 N204 V205 I206 V210 Y211 L212	L173-V208 HydrophobicContact CD1-CG2 4.21Å; L173-V208 HydrophobicContact CD2-CG2 3.99Å; L173-V208 HydrophobicContact CG-CG2 4.44Å; L178-V208 HydrophobicContact CB-CG1 4.38Å; L178-V208 WeakPolarHBondContact O-CG1 3.42Å; A181-V208 HydrophobicContact CB-CG1 4.43Å; A181-V208 HydrophobicContact CB-CG2 4.27Å; L182-V208 HydrophobicContact CB-CG1 3.99Å; L182-V208 HydrophobicContact CD1-CB 4.4Å; Y185-V208 HydrophobicContact CD2-CG2 3.81Å; Y185-V208 HydrophobicContact CE2-CG2 3.54Å; N204-V208 WeakPolarHBondContact O-CG2 3.46Å; N204-V208 PolarHBondContact O-N 3.43Å; N204-V208 VanDerWaalsContact O-N 3.15Å; V205-V208 PolarHBondContact O-N 3.42Å; I206-V208 PolarHBondContact O-N 2.76Å; V208-V210 PolarHBondContact O-N 2.7Å; V208-Y211 PolarHBondContact O-N 3.17Å; V208-L212 HydrophobicContact CG1-CD1 4.07Å; V208-L212 HydrophobicContact CG1-CG 4.47Å; V208-L212 PolarHBondContact O-N 3.3Å
209	S	94.9	Very high	93.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-28.1	179.7	-61.9	0	0	0	0	112.7	V205 I206 L212 Q213 N214 H217	V205-S209 WeakPolarHBondContact O-CB 3.37Å; V205-S209 PolarHBondContact O-N 3.47Å; V205-S209 PolarHBondContact O-OG 3.36Å; I206-S209 PolarHBondContact O-N 3.35Å; S209-L212 CarbonylContact O-C 3.6Å; S209-L212 PolarHBondContact O-N 3.15Å; S209-Q213 PolarHBondContact O-N 3.38Å; S209-Q213 VanDerWaalsContact O-N 3.11Å; S209-N214 PolarHBondContact O-N 3.03Å; S209-H217 PolarHBondContact OG-ND1 3.34Å
210	V	93.9	Very high	94.1	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-67.8	-45	172.8	170.3	0	0	0	0	111.1	M55 I206 K207 V208 L212 Q213 W215 V218 L254 L282 Y356	M55-V210 HydrophobicContact CE-CG1 4.26Å; I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 VanDerWaalsContact O-CG2 3.22Å; I206-V210 WeakPolarHBondContact O-CG2 3.2Å; I206-V210 PolarHBondContact O-N 3.1Å; K207-V210 PolarHBondContact O-N 3.34Å; V208-V210 PolarHBondContact O-N 2.7Å; V210-L212 VanDerWaalsContact C-N 3.27Å; V210-L212 PolarHBondContact O-N 3.48Å; V210-Q213 PolarHBondContact O-N 2.87Å; V210-W215 HydrophobicContact CB-CZ3 4.45Å; V210-W215 HydrophobicContact CG1-CH2 4.21Å; V210-W215 HydrophobicContact CG1-CZ3 4.09Å; V210-W215 HydrophobicContact CG2-CZ3 4.22Å; V210-V218 HydrophobicContact CG2-CG2 3.89Å; V210-L254 HydrophobicContact CG1-CD2 4.12Å; V210-L282 HydrophobicContact CB-CD1 3.95Å; V210-L282 HydrophobicContact CG1-CD1 3.66Å; V210-L282 HydrophobicContact CG2-CD1 3.6Å; V210-Y356 WeakPolarHBondContact CG1-OH 3.39Å
211	Y	91.6	Very high	94.2	Very high	16 Å²	16	33.1 Å²	33.1	6%	0.063	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-35	175.3	-62.1	-54.5	0	0	0	112.1	L54 M55 L173 L178 K207 V208 Q213 E281	L54-Y211 HydrophobicContact CB-CD1 4.19Å; L54-Y211 HydrophobicContact CB-CE1 3.71Å; L54-Y211 HydrophobicContact CB-CE2 4.37Å; L54-Y211 HydrophobicContact CD1-CD2 4.31Å; L54-Y211 HydrophobicContact CD1-CE2 4.35Å; M55-Y211 HydrophobicContact CB-CE1 4.17Å; M55-Y211 HydrophobicContact CE-CD1 4.42Å; M55-Y211 HydrophobicContact CE-CE1 3.81Å; L173-Y211 HydrophobicContact CD2-CD2 4.38Å; L178-Y211 HydrophobicContact CD2-CD2 4.2Å; L178-Y211 HydrophobicContact CD2-CG 4.3Å; K207-Y211 HydrophobicContact CG-CE2 3.79Å; K207-Y211 WeakPolarHBondContact O-CD2 3.42Å; K207-Y211 PolarHBondContact O-N 3.07Å; V208-Y211 PolarHBondContact O-N 3.17Å; Y211-Q213 PolarHBondContact O-N 2.94Å; Y211-E281 PolarHBondContact OH-O 3.02Å
212	L	92.5	Very high	94.3	Very high	70 Å²	70	33.2 Å²	33.2	37%	0.366	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-0.3	173.4	-67.4	172.4	0	0	0	113.9	L178 L182 V208 S209 V210 N214	L178-L212 HydrophobicContact CB-CD2 3.7Å; L178-L212 HydrophobicContact CB-CG 4.1Å; L178-L212 HydrophobicContact CD1-CD2 3.9Å; L178-L212 HydrophobicContact CD1-CG 4.35Å; L178-L212 HydrophobicContact CG-CD2 4.47Å; L182-L212 HydrophobicContact CD2-CD1 4.01Å; V208-L212 HydrophobicContact CG1-CD1 4.07Å; V208-L212 HydrophobicContact CG1-CG 4.47Å; V208-L212 PolarHBondContact O-N 3.3Å; S209-L212 CarbonylContact O-C 3.6Å; S209-L212 PolarHBondContact O-N 3.15Å; V210-L212 VanDerWaalsContact C-N 3.27Å; V210-L212 PolarHBondContact O-N 3.48Å; L212-N214 PolarHBondContact O-N 3.16Å; L212-N214 VanDerWaalsContact O-N 3.15Å
213	Q	92.1	Very high	94.3	Very high	135 Å²	135	36.7 Å²	36.7	63%	0.631	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	29.8	-176.2	-56.2	-176.5	-0.5	0	0	114.3	S209 V210 Y211 W215	S209-Q213 PolarHBondContact O-N 3.38Å; S209-Q213 VanDerWaalsContact O-N 3.11Å; V210-Q213 PolarHBondContact O-N 2.87Å; Y211-Q213 PolarHBondContact O-N 2.94Å; Q213-W215 HydrophobicContact CB-CZ2 4.04Å; Q213-W215 HydrophobicContact CG-CZ2 4.14Å; Q213-W215 VanDerWaalsContact O-CD1 3.28Å; Q213-W215 PolarHBondContact O-N 2.94Å; Q213-W215 PolarHBondContact O-NE1 3.34Å
214	N	94.6	Very high	94.3	Very high	68 Å²	68	39.4 Å²	39.4	36%	0.364	21%	0.21	S	C	.	.			trans	-93.3	81.2	178.1	-170.2	-12	0	0	0	111.2	S209 L212 S216 H217 V218	S209-N214 PolarHBondContact O-N 3.03Å; L212-N214 PolarHBondContact O-N 3.16Å; L212-N214 VanDerWaalsContact O-N 3.15Å; N214-S216 PolarHBondContact OD1-OG 3.45Å; N214-S216 VanDerWaalsContact OD1-OG 3.1Å; N214-H217 HydrophobicContact CB-CB 4.23Å; N214-H217 WeakPolarHBondContact O-CB 3.37Å; N214-H217 PolarHBondContact O-N 3.28Å; N214-H217 WeakPolarHBondContact OD1-CB 3.48Å; N214-H217 PolarHBondContact OD1-N 3.37Å; N214-V218 PolarHBondContact O-N 3.36Å
215	W	94.9	Very high	94.2	Very high	46 Å²	46	37.8 Å²	37.8	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-70.4	-32.2	-171.7	-48.9	111.7	0	0	0	114.3	V210 Q213 H217 V218 L219 L254 A255 A258 Y356	V210-W215 HydrophobicContact CB-CZ3 4.45Å; V210-W215 HydrophobicContact CG1-CH2 4.21Å; V210-W215 HydrophobicContact CG1-CZ3 4.09Å; V210-W215 HydrophobicContact CG2-CZ3 4.22Å; Q213-W215 HydrophobicContact CB-CZ2 4.04Å; Q213-W215 HydrophobicContact CG-CZ2 4.14Å; Q213-W215 VanDerWaalsContact O-CD1 3.28Å; Q213-W215 PolarHBondContact O-N 2.94Å; Q213-W215 PolarHBondContact O-NE1 3.34Å; W215-H217 VanDerWaalsContact C-N 3.28Å; W215-H217 PolarHBondContact O-N 3.5Å; W215-V218 PolarHBondContact O-N 3.08Å; W215-L219 WeakPolarHBondContact O-CG 3.3Å; W215-L219 PolarHBondContact O-N 2.81Å; W215-L219 VanDerWaalsContact O-N 3.13Å; W215-L254 HydrophobicContact CZ3-CD2 4.32Å; W215-L254 HydrophobicContact CZ3-CG 4.24Å; W215-A255 HydrophobicContact CB-CB 4.26Å; W215-A255 HydrophobicContact CE3-CB 4.01Å; W215-A258 HydrophobicContact CD2-CB 3.56Å; W215-A258 HydrophobicContact CE3-CB 4.08Å; W215-A258 HydrophobicContact CG-CB 3.96Å; W215-A258 HydrophobicContact CH2-CB 4.15Å; W215-A258 HydrophobicContact CZ2-CB 3.67Å; W215-A258 HydrophobicContact CZ3-CB 4.34Å; W215-Y356 HydrophobicContact CH2-CD1 4.33Å; W215-Y356 AromaticContact CH2-CE1 3.79Å; W215-Y356 HydrophobicContact CH2-CE1 3.79Å; W215-Y356 HydrophobicContact CZ2-CE1 4.36Å
216	S	95	Very high	93.9	Very high	78 Å²	78	40.2 Å²	40.2	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-36.7	176.9	62	0	0	0	0	111.3	N214 S220	N214-S216 PolarHBondContact OD1-OG 3.45Å; N214-S216 VanDerWaalsContact OD1-OG 3.1Å; S216-S220 PolarHBondContact O-N 3.13Å; S216-S220 VanDerWaalsContact O-N 3.08Å; S216-S220 PolarHBondContact O-OG 3.31Å
217	H	94	Very high	93.7	Very high	48 Å²	48	44.2 Å²	44.2	22%	0.222	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-42.1	175.7	-158.3	-148.8	0	0	0	111.7	S209 N214 W215 L219 S220 Y221	S209-H217 PolarHBondContact OG-ND1 3.34Å; N214-H217 HydrophobicContact CB-CB 4.23Å; N214-H217 WeakPolarHBondContact O-CB 3.37Å; N214-H217 PolarHBondContact O-N 3.28Å; N214-H217 WeakPolarHBondContact OD1-CB 3.48Å; N214-H217 PolarHBondContact OD1-N 3.37Å; W215-H217 VanDerWaalsContact C-N 3.28Å; W215-H217 PolarHBondContact O-N 3.5Å; H217-L219 PolarHBondContact O-N 3.01Å; H217-S220 PolarHBondContact O-N 3.3Å; H217-Y221 AromaticContact CD2-CD2 3.87Å; H217-Y221 AromaticContact CD2-CE2 3.57Å; H217-Y221 AromaticContact CE1-CE2 3.64Å; H217-Y221 AromaticContact NE2-CE2 3.31Å; H217-Y221 VanDerWaalsContact NE2-CE2 3.31Å; H217-Y221 WeakPolarHBondContact NE2-CE2 3.09Å; H217-Y221 WeakPolarHBondContact O-CD2 3.38Å; H217-Y221 PolarHBondContact O-N 2.86Å
218	V	95.9	Very high	93.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-52.7	174.9	172.7	0	0	0	0	110.8	I206 V210 N214 W215 S220 Y221 V222 A251 A255	I206-V218 HydrophobicContact CG1-CG1 4.43Å; I206-V218 HydrophobicContact CG2-CG1 3.98Å; V210-V218 HydrophobicContact CG2-CG2 3.89Å; N214-V218 PolarHBondContact O-N 3.36Å; W215-V218 PolarHBondContact O-N 3.08Å; V218-S220 VanDerWaalsContact C-N 3.31Å; V218-S220 PolarHBondContact O-N 2.95Å; V218-Y221 PolarHBondContact O-N 3.46Å; V218-V222 HydrophobicContact CG1-CG2 4.32Å; V218-V222 WeakPolarHBondContact O-CG2 3.32Å; V218-V222 PolarHBondContact O-N 3.29Å; V218-A251 HydrophobicContact CG1-CB 4.43Å; V218-A255 HydrophobicContact CB-CB 4.09Å; V218-A255 HydrophobicContact CG1-CB 3.79Å
219	L	96.1	Very high	92.1	Very high	37 Å²	37	47 Å²	47	19%	0.194	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-37.6	-179.6	-65	172.5	0	0	0	112.8	W215 H217 S223 A252 A255 E256	W215-L219 WeakPolarHBondContact O-CG 3.3Å; W215-L219 PolarHBondContact O-N 2.81Å; W215-L219 VanDerWaalsContact O-N 3.13Å; H217-L219 PolarHBondContact O-N 3.01Å; L219-S223 WeakPolarHBondContact O-CB 3.32Å; L219-S223 PolarHBondContact O-N 2.93Å; L219-S223 PolarHBondContact O-OG 3.48Å; L219-A252 HydrophobicContact CD2-CB 4.18Å; L219-A255 HydrophobicContact CD2-CB 3.9Å; L219-A255 HydrophobicContact CG-CB 3.97Å; L219-E256 HydrophobicContact CD2-CG 3.99Å
220	S	96.1	Very high	90.9	Very high	74 Å²	74	49.8 Å²	49.8	52%	0.517	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-44.4	175.8	-57.5	0	0	0	0	111.8	S216 H217 V218 S223 K224	S216-S220 PolarHBondContact O-N 3.13Å; S216-S220 VanDerWaalsContact O-N 3.08Å; S216-S220 PolarHBondContact O-OG 3.31Å; H217-S220 PolarHBondContact O-N 3.3Å; V218-S220 VanDerWaalsContact C-N 3.31Å; V218-S220 PolarHBondContact O-N 2.95Å; S220-S223 PolarHBondContact O-N 3.08Å; S220-K224 WeakPolarHBondContact O-CB 3.49Å; S220-K224 PolarHBondContact O-N 3.14Å
221	Y	94.7	Very high	89.8	Confident	29 Å²	29	50.3 Å²	50.3	11%	0.114	28%	0.277	C	S	.	.	H	α-helix	trans	-75.2	-31.1	179.1	-85.9	-77.9	0	0	0	113.6	M201 C202 V205 H217 V218 K224 A225	M201-Y221 HydrophobicContact CE-CD1 4.3Å; M201-Y221 HydrophobicContact CE-CE1 3.87Å; C202-Y221 HydrophobicContact CB-CD1 4.27Å; V205-Y221 HydrophobicContact CG1-CD1 4.4Å; V205-Y221 HydrophobicContact CG1-CD2 3.61Å; V205-Y221 HydrophobicContact CG1-CE1 4.28Å; V205-Y221 HydrophobicContact CG1-CE2 3.47Å; V205-Y221 VanDerWaalsContact CG1-CE2 3.47Å; V205-Y221 HydrophobicContact CG1-CG 4.08Å; H217-Y221 AromaticContact CD2-CD2 3.87Å; H217-Y221 AromaticContact CD2-CE2 3.57Å; H217-Y221 AromaticContact CE1-CE2 3.64Å; H217-Y221 AromaticContact NE2-CE2 3.31Å; H217-Y221 VanDerWaalsContact NE2-CE2 3.31Å; H217-Y221 WeakPolarHBondContact NE2-CE2 3.09Å; H217-Y221 WeakPolarHBondContact O-CD2 3.38Å; H217-Y221 PolarHBondContact O-N 2.86Å; V218-Y221 PolarHBondContact O-N 3.46Å; Y221-K224 HydrophobicContact CD1-CD 4.24Å; Y221-K224 HydrophobicContact CE1-CD 4.32Å; Y221-K224 PolarHBondContact O-N 3.47Å; Y221-A225 WeakPolarHBondContact O-CB 3.09Å; Y221-A225 PolarHBondContact O-N 3.2Å
222	V	95.1	Very high	88.5	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.03	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-51.6	169.2	170.5	0	0	0	0	109.6	I206 V218 K224 A225 E226 L248 A251 A252	I206-V222 HydrophobicContact CD1-CG2 3.66Å; I206-V222 HydrophobicContact CG1-CG2 4.46Å; V218-V222 HydrophobicContact CG1-CG2 4.32Å; V218-V222 WeakPolarHBondContact O-CG2 3.32Å; V218-V222 PolarHBondContact O-N 3.29Å; V222-K224 VanDerWaalsContact C-N 3.26Å; V222-K224 PolarHBondContact O-N 2.87Å; V222-A225 PolarHBondContact O-N 3.42Å; V222-A225 VanDerWaalsContact O-N 3.1Å; V222-E226 HydrophobicContact CG1-CG 4.23Å; V222-E226 WeakPolarHBondContact O-CG 3.33Å; V222-E226 PolarHBondContact O-N 3.41Å; V222-L248 HydrophobicContact CG1-CB 4.23Å; V222-L248 HydrophobicContact CG2-CD2 4.37Å; V222-A251 HydrophobicContact CG2-CB 4.27Å; V222-A252 HydrophobicContact CG1-CB 4.09Å; V222-A252 HydrophobicContact CG2-CB 4.34Å
223	S	94.1	Very high	87.1	Confident	74 Å²	74	56.8 Å²	56.8	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-40.6	178.5	-56.4	0	0	0	0	111.8	L219 S220 E226 S227	L219-S223 WeakPolarHBondContact O-CB 3.32Å; L219-S223 PolarHBondContact O-N 2.93Å; L219-S223 PolarHBondContact O-OG 3.48Å; S220-S223 PolarHBondContact O-N 3.08Å; S223-E226 PolarHBondContact O-N 3.38Å; S223-S227 WeakPolarHBondContact O-CB 3.39Å; S223-S227 PolarHBondContact O-N 3.19Å; S223-S227 PolarHBondContact O-OG 2.79Å
224	K	92.7	Very high	85.5	Confident	82 Å²	82	57.1 Å²	57.1	36%	0.357	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-46.4	175.1	-172.9	178.6	-177.4	178.1	0	112.3	S220 Y221 V222 S227 T228	S220-K224 WeakPolarHBondContact O-CB 3.49Å; S220-K224 PolarHBondContact O-N 3.14Å; Y221-K224 HydrophobicContact CD1-CD 4.24Å; Y221-K224 HydrophobicContact CE1-CD 4.32Å; Y221-K224 PolarHBondContact O-N 3.47Å; V222-K224 VanDerWaalsContact C-N 3.26Å; V222-K224 PolarHBondContact O-N 2.87Å; K224-S227 PolarHBondContact O-N 3.37Å; K224-S227 PolarHBondContact O-OG 3.02Å; K224-T228 PolarHBondContact O-N 3.17Å; K224-T228 PolarHBondContact O-OG1 3.29Å; K224-T228 VanDerWaalsContact O-OG1 3.09Å
225	A	91.8	Very high	83.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-45.4	177.6	0	0	0	0	0	111	C202 Y221 V222 S227 T228 I231 L248	C202-A225 HydrophobicContact CB-CB 3.98Å; Y221-A225 WeakPolarHBondContact O-CB 3.09Å; Y221-A225 PolarHBondContact O-N 3.2Å; V222-A225 PolarHBondContact O-N 3.42Å; V222-A225 VanDerWaalsContact O-N 3.1Å; A225-S227 VanDerWaalsContact C-N 3.32Å; A225-S227 PolarHBondContact O-N 3.5Å; A225-T228 VanDerWaalsContact O-CB 3.23Å; A225-T228 WeakPolarHBondContact O-CB 3.42Å; A225-T228 PolarHBondContact O-N 3.39Å; A225-T228 VanDerWaalsContact O-N 3.12Å; A225-T228 PolarHBondContact O-OG1 3.32Å; A225-I231 WeakPolarHBondContact O-CD1 3.47Å; A225-L248 HydrophobicContact CB-CD1 3.85Å; A225-L248 HydrophobicContact CB-CD2 3.75Å; A225-L248 HydrophobicContact CB-CG 4.48Å
226	E	89.9	Confident	81.7	Confident	52 Å²	52	61.1 Å²	61.1	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-63.1	-35.1	178.2	-69.6	-176.8	169	0	0	113	V222 S223 T228 L248 K249	V222-E226 HydrophobicContact CG1-CG 4.23Å; V222-E226 WeakPolarHBondContact O-CG 3.33Å; V222-E226 PolarHBondContact O-N 3.41Å; S223-E226 PolarHBondContact O-N 3.38Å; E226-T228 PolarHBondContact O-N 2.93Å; E226-L248 HydrophobicContact CG-CD1 4.04Å; E226-K249 WeakPolarHBondContact OE1-CE 3.44Å; E226-K249 IonicContact OE1-NZ 2.81Å; E226-K249 PolarHBondContact OE1-NZ 3.38Å; E226-K249 IonicContact OE2-NZ 2.75Å; E226-K249 PolarHBondContact OE2-NZ 3.42Å
227	S	89.2	Confident	79.9	Confident	86 Å²	86	67.5 Å²	67.5	60%	0.601	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-7.1	176.6	71.3	0	0	0	0	114.7	S223 K224 A225	S223-S227 WeakPolarHBondContact O-CB 3.39Å; S223-S227 PolarHBondContact O-N 3.19Å; S223-S227 PolarHBondContact O-OG 2.79Å; K224-S227 PolarHBondContact O-N 3.37Å; K224-S227 PolarHBondContact O-OG 3.02Å; A225-S227 VanDerWaalsContact C-N 3.32Å; A225-S227 PolarHBondContact O-N 3.5Å
228	T	87.1	Confident	78.8	Confident	15 Å²	15	68.8 Å²	68.8	9%	0.092	36%	0.364	C	S	.	.	S	Bend	trans	-74.2	132.9	-178.7	-57.6	0	0	0	0	110	A195 I199 K224 A225 E226 E230 I231 A232	A195-T228 HydrophobicContact CB-CG2 3.41Å; A195-T228 VanDerWaalsContact CB-CG2 3.41Å; I199-T228 HydrophobicContact CD1-CG2 4.46Å; I199-T228 HydrophobicContact CG1-CG2 4.43Å; K224-T228 PolarHBondContact O-N 3.17Å; K224-T228 PolarHBondContact O-OG1 3.29Å; K224-T228 VanDerWaalsContact O-OG1 3.09Å; A225-T228 VanDerWaalsContact O-CB 3.23Å; A225-T228 WeakPolarHBondContact O-CB 3.42Å; A225-T228 PolarHBondContact O-N 3.39Å; A225-T228 VanDerWaalsContact O-N 3.12Å; A225-T228 PolarHBondContact O-OG1 3.32Å; E226-T228 PolarHBondContact O-N 2.93Å; T228-E230 VanDerWaalsContact C-N 3.28Å; T228-E230 PolarHBondContact O-N 3.46Å; T228-I231 PolarHBondContact O-N 3.49Å; T228-A232 PolarHBondContact O-N 3.07Å; T228-A232 VanDerWaalsContact O-N 3.15Å
229	P	67.1	Low	77.9	Confident	70 Å²	70	72.5 Å²	72.5	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-58.6	-28.6	-165	18.5	-32.8	0	0	0	115.6	I231 A232 E233	P229-I231 VanDerWaalsContact C-N 3.27Å; P229-I231 PolarHBondContact O-N 3.27Å; P229-A232 PolarHBondContact O-N 3.42Å; P229-E233 WeakPolarHBondContact O-CB 3.48Å; P229-E233 PolarHBondContact O-N 3.02Å
230	E	70.6	Confident	77	Confident	58 Å²	58	77.2 Å²	77.2	27%	0.271	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-32.3	174.8	-80	-173	179.8	0	0	113.3	A195 K196 T228 R234	A195-E230 HydrophobicContact CB-CB 3.93Å; A195-E230 VanDerWaalsContact CB-CD 3.5Å; A195-E230 HydrophobicContact CB-CG 3.52Å; K196-E230 WeakPolarHBondContact CG-OE2 3.48Å; T228-E230 VanDerWaalsContact C-N 3.28Å; T228-E230 PolarHBondContact O-N 3.46Å; E230-R234 WeakPolarHBondContact O-CB 3.45Å
231	I	71.2	Confident	76.2	Confident	13 Å²	13	74.4 Å²	74.4	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-87.7	-40.2	177.6	-66.3	169.9	0	0	0	110.3	I199 A225 T228 P229 T241 I244 L245 L248	I199-I231 HydrophobicContact CD1-CD1 3.51Å; I199-I231 HydrophobicContact CD1-CG1 3.87Å; I199-I231 HydrophobicContact CG1-CD1 3.84Å; A225-I231 WeakPolarHBondContact O-CD1 3.47Å; T228-I231 PolarHBondContact O-N 3.49Å; P229-I231 VanDerWaalsContact C-N 3.27Å; P229-I231 PolarHBondContact O-N 3.27Å; I231-T241 HydrophobicContact CG1-CG2 4.31Å; I231-I244 HydrophobicContact CD1-CG2 3.88Å; I231-L245 HydrophobicContact CG2-CD1 4.44Å; I231-L245 HydrophobicContact CG2-CD2 3.51Å; I231-L245 HydrophobicContact CG2-CG 4.04Å; I231-L248 HydrophobicContact CD1-CD1 4.02Å
232	A	63.8	Low	75.6	Confident	68 Å²	68	75 Å²	75	56%	0.562	39%	0.394	S	S	*	.	H	α-helix	trans	-70.5	-35	-176.4	0	0	0	0	0	114	T228 P229	T228-A232 PolarHBondContact O-N 3.07Å; T228-A232 VanDerWaalsContact O-N 3.15Å; P229-A232 PolarHBondContact O-N 3.42Å
233	E	62.7	Low	75.1	Confident	155 Å²	155	75.8 Å²	75.8	72%	0.724	40%	0.401	S	S	*	.	H	α-helix	trans	-99.4	-26.4	-173	-62.3	179.9	170.3	0	0	114	P229	P229-E233 WeakPolarHBondContact O-CB 3.48Å; P229-E233 PolarHBondContact O-N 3.02Å
234	R	59.9	Low	74.8	Confident	141 Å²	141	73.8 Å²	73.8	53%	0.532	38%	0.384	S	S	.	.	S	Bend	trans	-101.4	19	-174.1	-60.2	-172.8	174.2	-147.7	0.1	114.5	E230 E236 R237	E230-R234 WeakPolarHBondContact O-CB 3.45Å; R234-E236 PolarHBondContact O-N 3.23Å; R234-R237 PolarHBondContact O-N 3.09Å
235	G	52.5	Low	74.6	Confident	41 Å²	41	71.4 Å²	71.4	42%	0.423	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-29.8	123.2	-178.2	0	0	0	0	0	114.5	R237	G235-R237 VanDerWaalsContact C-N 3.27Å; G235-R237 PolarHBondContact O-N 2.85Å
236	E	55.3	Low	74.6	Confident	157 Å²	157	71.5 Å²	71.5	73%	0.734	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-10.8	167.7	-50.2	-160.2	173.5	0	0	119.9	R234	R234-E236 PolarHBondContact O-N 3.23Å
237	R	59.2	Low	74.6	Confident	212 Å²	212	72.2 Å²	72.2	80%	0.8	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-26.8	-174.4	-68	-170.5	-69.5	171.9	-2.9	115.5	R234 G235	R234-R237 PolarHBondContact O-N 3.09Å; G235-R237 VanDerWaalsContact C-N 3.27Å; G235-R237 PolarHBondContact O-N 2.85Å
238	D	70.6	Confident	74.8	Confident	76 Å²	76	68.1 Å²	68.1	41%	0.406	35%	0.35	S	S	.	.			trans	-102.6	121.2	178.9	-79	-28.1	0	0	0	110.6	Q240 T241 Q242	D238-Q240 PolarHBondContact O-N 3.43Å; D238-T241 WeakPolarHBondContact O-CB 3.28Å; D238-T241 PolarHBondContact O-N 3.23Å; D238-Q242 PolarHBondContact O-N 3.27Å; D238-Q242 VanDerWaalsContact O-N 3.1Å
239	S	77.1	Confident	75.1	Confident	77 Å²	77	69.3 Å²	69.3	54%	0.538	35%	0.354	S	S	.	.	H	α-helix	trans	-55.2	-36.1	177.2	167.2	0	0	0	0	112.4	T241 Q242 A243 H276	S239-T241 VanDerWaalsContact C-N 3.34Å; S239-T241 PolarHBondContact O-N 3.23Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 3.29Å; S239-A243 PolarHBondContact O-N 2.91Å; S239-H276 PolarHBondContact O-NE2 3.48Å; S239-H276 PolarHBondContact OG-CE1 2.99Å; S239-H276 PolarHBondContact OG-NE2 2.86Å
240	Q	76.6	Confident	76.4	Confident	136 Å²	136	66.2 Å²	66.2	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-64.7	-37.1	175.7	-170.2	174.2	19.5	0	0	112.7	D238 A243 I244	D238-Q240 PolarHBondContact O-N 3.43Å; Q240-A243 WeakPolarHBondContact O-CB 3.43Å; Q240-A243 PolarHBondContact O-N 3.13Å; Q240-I244 WeakPolarHBondContact O-CG1 3.47Å; Q240-I244 PolarHBondContact O-N 3.35Å
241	T	79.6	Confident	77.6	Confident	16 Å²	16	63.5 Å²	63.5	10%	0.098	32%	0.321	C	S	.	.	H	α-helix	trans	-70.2	-36.7	177	-53.5	0	0	0	0	110.9	I231 D238 S239 A243 I244 L245	I231-T241 HydrophobicContact CG1-CG2 4.31Å; D238-T241 WeakPolarHBondContact O-CB 3.28Å; D238-T241 PolarHBondContact O-N 3.23Å; S239-T241 VanDerWaalsContact C-N 3.34Å; S239-T241 PolarHBondContact O-N 3.23Å; T241-A243 VanDerWaalsContact C-N 3.31Å; T241-A243 PolarHBondContact O-N 3.38Å; T241-I244 PolarHBondContact O-N 3Å; T241-L245 HydrophobicContact CG2-CD1 4.41Å; T241-L245 WeakPolarHBondContact O-CG 3.49Å; T241-L245 PolarHBondContact O-N 2.49Å
242	Q	81	Confident	78.7	Confident	41 Å²	41	63.2 Å²	63.2	19%	0.192	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-37.5	172.1	-76	-62	-58.8	0	0	112.6	D238 S239 L245 T246	D238-Q242 PolarHBondContact O-N 3.27Å; D238-Q242 VanDerWaalsContact O-N 3.1Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 3.29Å; Q242-L245 PolarHBondContact O-N 3.07Å; Q242-T246 WeakPolarHBondContact O-CB 3.29Å; Q242-T246 PolarHBondContact O-N 3.35Å; Q242-T246 PolarHBondContact O-OG1 3.06Å
243	A	85.8	Confident	80.3	Confident	22 Å²	22	60 Å²	60	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-63.3	-41.8	174.3	0	0	0	0	0	112.9	S239 Q240 T241 T246 K247 H276	S239-A243 PolarHBondContact O-N 2.91Å; Q240-A243 WeakPolarHBondContact O-CB 3.43Å; Q240-A243 PolarHBondContact O-N 3.13Å; T241-A243 VanDerWaalsContact C-N 3.31Å; T241-A243 PolarHBondContact O-N 3.38Å; A243-T246 PolarHBondContact O-N 3.1Å; A243-K247 WeakPolarHBondContact O-CG 3.28Å; A243-K247 PolarHBondContact O-N 3.19Å; A243-K247 VanDerWaalsContact O-N 3.14Å; A243-H276 VanDerWaalsContact CA-CB 3.44Å; A243-H276 HydrophobicContact CB-CB 3.55Å; A243-H276 PolarHBondContact N-CD2 3.4Å
244	I	87.9	Confident	81.8	Confident	31 Å²	31	52.7 Å²	52.7	16%	0.159	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-47.6	177.2	-63.7	162.5	0	0	0	110.4	I199 I231 Q240 T241 T246 K247 L248	I199-I244 HydrophobicContact CG2-CD1 4.37Å; I199-I244 HydrophobicContact CG2-CG2 3.52Å; I231-I244 HydrophobicContact CD1-CG2 3.88Å; Q240-I244 WeakPolarHBondContact O-CG1 3.47Å; Q240-I244 PolarHBondContact O-N 3.35Å; T241-I244 PolarHBondContact O-N 3Å; I244-T246 VanDerWaalsContact C-N 3.29Å; I244-T246 PolarHBondContact O-N 3.34Å; I244-K247 PolarHBondContact O-N 2.88Å; I244-L248 HydrophobicContact CG2-CD1 4.02Å; I244-L248 HydrophobicContact CG2-CG 4.4Å; I244-L248 WeakPolarHBondContact O-CG 3.38Å; I244-L248 PolarHBondContact O-N 2.88Å
245	L	88.4	Confident	83.6	Confident	33 Å²	33	46 Å²	46	17%	0.173	23%	0.234	C	C	.	.	H	α-helix	trans	-57	-44.4	176.9	-80.8	168.4	0	0	0	111.5	I231 T241 Q242 K247 L248 K249	I231-L245 HydrophobicContact CG2-CD1 4.44Å; I231-L245 HydrophobicContact CG2-CD2 3.51Å; I231-L245 HydrophobicContact CG2-CG 4.04Å; T241-L245 HydrophobicContact CG2-CD1 4.41Å; T241-L245 WeakPolarHBondContact O-CG 3.49Å; T241-L245 PolarHBondContact O-N 2.49Å; Q242-L245 PolarHBondContact O-N 3.07Å; L245-K247 PolarHBondContact O-N 3.06Å; L245-L248 PolarHBondContact O-N 3.18Å; L245-K249 WeakPolarHBondContact O-CG 3.36Å; L245-K249 PolarHBondContact O-N 2.97Å
246	T	90.7	Very high	85.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-57	-47.9	176.9	-61.4	0	0	0	0	111.2	Q242 A243 I244 L248 K249 C250 A272 S273 C277	Q242-T246 WeakPolarHBondContact O-CB 3.29Å; Q242-T246 PolarHBondContact O-N 3.35Å; Q242-T246 PolarHBondContact O-OG1 3.06Å; A243-T246 PolarHBondContact O-N 3.1Å; I244-T246 VanDerWaalsContact C-N 3.29Å; I244-T246 PolarHBondContact O-N 3.34Å; T246-L248 PolarHBondContact O-N 3.23Å; T246-K249 PolarHBondContact O-N 2.73Å; T246-C250 PolarHBondContact O-N 3.12Å; T246-C250 PolarHBondContact O-SG 3.33Å; T246-A272 HydrophobicContact CG2-CB 4.07Å; T246-S273 WeakPolarHBondContact CG2-O 2.96Å; T246-S273 PolarHBondContact OG1-N 3.22Å; T246-C277 HydrophobicContact CG2-CB 4.26Å; T246-C277 WeakPolarHBondContact CG2-SG 3.41Å
247	K	91.5	Very high	87.7	Confident	66 Å²	66	37.8 Å²	37.8	29%	0.287	19%	0.185	S	C	.	.	H	α-helix	trans	-61.6	-41.9	176.7	-68.1	178.9	-177	-172.8	0	112.7	L203 A243 I244 L245 C250 A251 F279	L203-K247 HydrophobicContact CD2-CB 4.27Å; A243-K247 WeakPolarHBondContact O-CG 3.28Å; A243-K247 PolarHBondContact O-N 3.19Å; A243-K247 VanDerWaalsContact O-N 3.14Å; I244-K247 PolarHBondContact O-N 2.88Å; L245-K247 PolarHBondContact O-N 3.06Å; K247-C250 PolarHBondContact O-N 2.95Å; K247-A251 WeakPolarHBondContact O-CB 3.45Å; K247-A251 PolarHBondContact O-N 3.25Å; K247-F279 HydrophobicContact CD-CD2 4.39Å; K247-F279 HydrophobicContact CG-CD1 4.35Å; K247-F279 HydrophobicContact CG-CG 4.28Å
248	L	92.7	Very high	89.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.6	-42.7	177.2	-67.9	174	0	0	0	111.8	L203 I206 V222 A225 E226 I231 I244 L245 T246 A251 A252	L203-L248 HydrophobicContact CD2-CD2 3.87Å; L203-L248 HydrophobicContact CD2-CG 4.47Å; I206-L248 HydrophobicContact CD1-CD2 4.06Å; V222-L248 HydrophobicContact CG1-CB 4.23Å; V222-L248 HydrophobicContact CG2-CD2 4.37Å; A225-L248 HydrophobicContact CB-CD1 3.85Å; A225-L248 HydrophobicContact CB-CD2 3.75Å; A225-L248 HydrophobicContact CB-CG 4.48Å; E226-L248 HydrophobicContact CG-CD1 4.04Å; I231-L248 HydrophobicContact CD1-CD1 4.02Å; I244-L248 HydrophobicContact CG2-CD1 4.02Å; I244-L248 HydrophobicContact CG2-CG 4.4Å; I244-L248 WeakPolarHBondContact O-CG 3.38Å; I244-L248 PolarHBondContact O-N 2.88Å; L245-L248 PolarHBondContact O-N 3.18Å; T246-L248 PolarHBondContact O-N 3.23Å; L248-A251 PolarHBondContact O-N 2.98Å; L248-A252 WeakPolarHBondContact O-CB 3.42Å; L248-A252 PolarHBondContact O-N 3.48Å
249	K	93.6	Very high	90.5	Very high	41 Å²	41	27.5 Å²	27.5	18%	0.178	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-39.4	176.7	-67.5	-46.8	-179.2	-166.5	0	112.4	E226 L245 T246 G253 L271	E226-K249 WeakPolarHBondContact OE1-CE 3.44Å; E226-K249 IonicContact OE1-NZ 2.81Å; E226-K249 PolarHBondContact OE1-NZ 3.38Å; E226-K249 IonicContact OE2-NZ 2.75Å; E226-K249 PolarHBondContact OE2-NZ 3.42Å; L245-K249 WeakPolarHBondContact O-CG 3.36Å; L245-K249 PolarHBondContact O-N 2.97Å; T246-K249 PolarHBondContact O-N 2.73Å; K249-G253 PolarHBondContact O-N 3.43Å; K249-L271 HydrophobicContact CG-CB 4.46Å
250	C	94.4	Very high	91.4	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.027	15%	0.152	C	C	.	.	H	α-helix	trans	-62.8	-45.1	172.6	-69.8	0	0	0	0	111.9	T246 K247 G253 L254 L283	T246-C250 PolarHBondContact O-N 3.12Å; T246-C250 PolarHBondContact O-SG 3.33Å; K247-C250 PolarHBondContact O-N 2.95Å; C250-G253 PolarHBondContact O-N 2.87Å; C250-L254 PolarHBondContact O-N 3.43Å; C250-L283 HydrophobicContact CB-CD1 4.46Å
251	A	94.7	Very high	92.4	Very high	2 Å²	2	28.7 Å²	28.7	2%	0.017	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-45.5	177.3	0	0	0	0	0	112.9	I206 V218 V222 K247 L248 G253 L254 A255 L282	I206-A251 HydrophobicContact CG2-CB 3.7Å; V218-A251 HydrophobicContact CG1-CB 4.43Å; V222-A251 HydrophobicContact CG2-CB 4.27Å; K247-A251 WeakPolarHBondContact O-CB 3.45Å; K247-A251 PolarHBondContact O-N 3.25Å; L248-A251 PolarHBondContact O-N 2.98Å; A251-G253 VanDerWaalsContact C-N 3.35Å; A251-L254 PolarHBondContact O-N 2.96Å; A251-A255 PolarHBondContact O-N 3.18Å; A251-L282 HydrophobicContact CB-CD2 3.9Å
252	A	95.8	Very high	93.2	Very high	7 Å²	7	28.5 Å²	28.5	6%	0.058	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-41.4	173.9	0	0	0	0	0	111.9	L219 V222 L248 L254 A255 E256	L219-A252 HydrophobicContact CD2-CB 4.18Å; V222-A252 HydrophobicContact CG1-CB 4.09Å; V222-A252 HydrophobicContact CG2-CB 4.34Å; L248-A252 WeakPolarHBondContact O-CB 3.42Å; L248-A252 PolarHBondContact O-N 3.48Å; A252-L254 VanDerWaalsContact C-N 3.33Å; A252-L254 PolarHBondContact O-N 3.29Å; A252-A255 PolarHBondContact O-N 2.86Å; A252-E256 WeakPolarHBondContact O-CB 3.46Å; A252-E256 VanDerWaalsContact O-CG 3.28Å; A252-E256 WeakPolarHBondContact O-CG 3.36Å; A252-E256 PolarHBondContact O-N 3.3Å
253	G	95.8	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-44.4	176.9	0	0	0	0	0	112.5	K249 C250 A251 L257 A265	K249-G253 PolarHBondContact O-N 3.43Å; C250-G253 PolarHBondContact O-N 2.87Å; A251-G253 VanDerWaalsContact C-N 3.35Å; G253-L257 WeakPolarHBondContact O-CB 3.47Å; G253-L257 PolarHBondContact O-N 3.42Å; G253-A265 WeakPolarHBondContact O-CB 3.47Å
254	L	95.8	Very high	94.5	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-44	175.9	-176	65.5	0	0	0	112.2	V210 W215 C250 A251 A252 E256 L257 A258 L282 L283 Y291 Y356	V210-L254 HydrophobicContact CG1-CD2 4.12Å; W215-L254 HydrophobicContact CZ3-CD2 4.32Å; W215-L254 HydrophobicContact CZ3-CG 4.24Å; C250-L254 PolarHBondContact O-N 3.43Å; A251-L254 PolarHBondContact O-N 2.96Å; A252-L254 VanDerWaalsContact C-N 3.33Å; A252-L254 PolarHBondContact O-N 3.29Å; L254-E256 PolarHBondContact O-N 3.29Å; L254-L257 HydrophobicContact CD1-CD2 4.45Å; L254-L257 WeakPolarHBondContact O-CB 3.36Å; L254-L257 PolarHBondContact O-N 3.02Å; L254-A258 PolarHBondContact O-N 3.03Å; L254-L282 HydrophobicContact CD2-CD1 3.91Å; L254-L282 HydrophobicContact CD2-CD2 4.37Å; L254-L282 HydrophobicContact CD2-CG 4Å; L254-L283 HydrophobicContact CB-CD1 4.02Å; L254-L283 HydrophobicContact CD2-CD1 4.04Å; L254-L283 HydrophobicContact CG-CD1 4.44Å; L254-Y291 HydrophobicContact CD1-CE2 3.98Å; L254-Y356 HydrophobicContact CD1-CD1 4.23Å; L254-Y356 HydrophobicContact CD1-CD2 3.8Å; L254-Y356 HydrophobicContact CD1-CE2 4.33Å; L254-Y356 HydrophobicContact CD1-CG 3.73Å; L254-Y356 HydrophobicContact CD2-CD2 4.26Å; L254-Y356 HydrophobicContact CD2-CE2 3.95Å
255	A	96.6	Very high	94.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-40.5	178.5	0	0	0	0	0	112.6	W215 V218 L219 A251 A252 A259	W215-A255 HydrophobicContact CB-CB 4.26Å; W215-A255 HydrophobicContact CE3-CB 4.01Å; V218-A255 HydrophobicContact CB-CB 4.09Å; V218-A255 HydrophobicContact CG1-CB 3.79Å; L219-A255 HydrophobicContact CD2-CB 3.9Å; L219-A255 HydrophobicContact CG-CB 3.97Å; A251-A255 PolarHBondContact O-N 3.18Å; A252-A255 PolarHBondContact O-N 2.86Å; A255-A259 WeakPolarHBondContact O-CB 3.38Å; A255-A259 PolarHBondContact O-N 3.36Å
256	E	97.3	Very high	95.3	Very high	25 Å²	25	30.3 Å²	30.3	12%	0.117	15%	0.146	C	C	.	.	H	α-helix	trans	-69.2	-34.3	175.1	-67.5	-69.7	-177.4	0	0	112.2	L219 A252 L254 A259 R260 K261 Q264 A265	L219-E256 HydrophobicContact CD2-CG 3.99Å; A252-E256 WeakPolarHBondContact O-CB 3.46Å; A252-E256 VanDerWaalsContact O-CG 3.28Å; A252-E256 WeakPolarHBondContact O-CG 3.36Å; A252-E256 PolarHBondContact O-N 3.3Å; L254-E256 PolarHBondContact O-N 3.29Å; E256-A259 CarbonylContact O-C 3.55Å; E256-A259 PolarHBondContact O-N 2.96Å; E256-R260 PolarHBondContact O-N 3.45Å; E256-K261 HydrophobicContact CB-CB 4.42Å; E256-K261 PolarHBondContact O-N 2.99Å; E256-K261 VanDerWaalsContact OE2-CB 3.29Å; E256-K261 WeakPolarHBondContact OE2-CB 3.38Å; E256-K261 WeakPolarHBondContact OE2-CD 3.45Å; E256-Q264 HydrophobicContact CG-CB 4.31Å; E256-Q264 HydrophobicContact CG-CG 4.01Å; E256-A265 HydrophobicContact CB-CB 3.81Å
257	L	96.4	Very high	95.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61.7	-51.6	173.6	-179.9	71.6	0	0	0	110.4	G253 L254 A259 R260 Y262 A265 Y291 C295 H360	G253-L257 WeakPolarHBondContact O-CB 3.47Å; G253-L257 PolarHBondContact O-N 3.42Å; L254-L257 HydrophobicContact CD1-CD2 4.45Å; L254-L257 WeakPolarHBondContact O-CB 3.36Å; L254-L257 PolarHBondContact O-N 3.02Å; L257-A259 VanDerWaalsContact C-N 3.26Å; L257-A259 PolarHBondContact O-N 2.89Å; L257-R260 WeakPolarHBondContact O-CA 3.45Å; L257-R260 PolarHBondContact O-N 3.27Å; L257-Y262 HydrophobicContact CD1-CD1 3.92Å; L257-Y262 HydrophobicContact CD1-CE1 4.12Å; L257-A265 HydrophobicContact CB-CB 4.27Å; L257-Y291 HydrophobicContact CD2-CD2 3.5Å; L257-Y291 HydrophobicContact CD2-CE2 3.76Å; L257-Y291 HydrophobicContact CD2-CG 4.06Å; L257-C295 VanDerWaalsContact CD1-SG 3.52Å; L257-H360 PolarHBondContact O-CE1 3.38Å; L257-H360 PolarHBondContact O-NE2 3Å
258	A	94.7	Very high	95.7	Very high	29 Å²	29	31.8 Å²	31.8	24%	0.24	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-37.4	178	0	0	0	0	0	111.9	W215 L254 R260	W215-A258 HydrophobicContact CD2-CB 3.56Å; W215-A258 HydrophobicContact CE3-CB 4.08Å; W215-A258 HydrophobicContact CG-CB 3.96Å; W215-A258 HydrophobicContact CH2-CB 4.15Å; W215-A258 HydrophobicContact CZ2-CB 3.67Å; W215-A258 HydrophobicContact CZ3-CB 4.34Å; L254-A258 PolarHBondContact O-N 3.03Å; A258-R260 PolarHBondContact O-N 2.9Å; A258-R260 VanDerWaalsContact O-N 3.16Å
259	A	94.3	Very high	95.8	Very high	44 Å²	44	31.8 Å²	31.8	36%	0.364	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	7.9	172.8	0	0	0	0	0	114.5	A255 E256 L257 K261	A255-A259 WeakPolarHBondContact O-CB 3.38Å; A255-A259 PolarHBondContact O-N 3.36Å; E256-A259 CarbonylContact O-C 3.55Å; E256-A259 PolarHBondContact O-N 2.96Å; L257-A259 VanDerWaalsContact C-N 3.26Å; L257-A259 PolarHBondContact O-N 2.89Å; A259-K261 HydrophobicContact CB-CD 4.36Å; A259-K261 PolarHBondContact O-N 3.2Å
260	R	95.9	Very high	95.8	Very high	118 Å²	118	30.4 Å²	30.4	45%	0.445	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	20.8	-179.7	-55	176.2	-179.8	-176.2	-2.6	114.2	N29 E256 L257 A258 Y262	N29-R260 PolarHBondContact O-NH2 2.88Å; E256-R260 PolarHBondContact O-N 3.45Å; L257-R260 WeakPolarHBondContact O-CA 3.45Å; L257-R260 PolarHBondContact O-N 3.27Å; A258-R260 PolarHBondContact O-N 2.9Å; A258-R260 VanDerWaalsContact O-N 3.16Å; R260-Y262 HydrophobicContact CB-CE2 4.4Å; R260-Y262 WeakPolarHBondContact O-CD2 3.48Å; R260-Y262 WeakPolarHBondContact O-CE2 3.49Å; R260-Y262 PolarHBondContact O-N 2.87Å
261	K	96.8	Very high	95.6	Very high	119 Å²	119	36 Å²	36	52%	0.517	18%	0.178	S	C	.	.			trans	-94.9	63.6	178.6	-72	170	177.4	174.9	0	110.9	E256 A259 K263 Q264 A265	E256-K261 HydrophobicContact CB-CB 4.42Å; E256-K261 PolarHBondContact O-N 2.99Å; E256-K261 VanDerWaalsContact OE2-CB 3.29Å; E256-K261 WeakPolarHBondContact OE2-CB 3.38Å; E256-K261 WeakPolarHBondContact OE2-CD 3.45Å; A259-K261 HydrophobicContact CB-CD 4.36Å; A259-K261 PolarHBondContact O-N 3.2Å; K261-K263 VanDerWaalsContact C-N 3.3Å; K261-K263 PolarHBondContact O-N 2.87Å; K261-K263 VanDerWaalsContact O-N 3.15Å; K261-Q264 PolarHBondContact O-N 3.36Å; K261-Q264 VanDerWaalsContact O-N 3.08Å; K261-A265 PolarHBondContact O-N 2.87Å
262	Y	97.6	Very high	95.4	Very high	12 Å²	12	36 Å²	36	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-37.5	-171.4	-49.3	-62.5	0	0	0	114.4	L257 R260 Q264 A265 A266 C295 H360 T363 L364	L257-Y262 HydrophobicContact CD1-CD1 3.92Å; L257-Y262 HydrophobicContact CD1-CE1 4.12Å; R260-Y262 HydrophobicContact CB-CE2 4.4Å; R260-Y262 WeakPolarHBondContact O-CD2 3.48Å; R260-Y262 WeakPolarHBondContact O-CE2 3.49Å; R260-Y262 PolarHBondContact O-N 2.87Å; Y262-Q264 VanDerWaalsContact C-N 3.35Å; Y262-Q264 PolarHBondContact O-N 3Å; Y262-A265 PolarHBondContact O-N 3.44Å; Y262-A266 WeakPolarHBondContact O-CB 3.4Å; Y262-A266 PolarHBondContact O-N 3.47Å; Y262-C295 WeakPolarHBondContact O-CB 3.44Å; Y262-H360 HydrophobicContact CE1-CB 3.97Å; Y262-H360 AromaticContact CE1-CG 3.92Å; Y262-H360 AromaticContact CE1-ND1 3.73Å; Y262-H360 AromaticContact CZ-ND1 3.91Å; Y262-H360 PolarHBondContact OH-ND1 2.99Å; Y262-T363 HydrophobicContact CE2-CG2 3.67Å; Y262-L364 HydrophobicContact CD1-CD2 3.71Å; Y262-L364 HydrophobicContact CD1-CG 4.32Å; Y262-L364 HydrophobicContact CD2-CD2 4.26Å; Y262-L364 HydrophobicContact CE1-CD2 4.09Å; Y262-L364 HydrophobicContact CE1-CG 4.22Å; Y262-L364 HydrophobicContact CG-CD2 3.81Å
263	K	97	Very high	95.1	Very high	79 Å²	79	36.7 Å²	36.7	34%	0.343	18%	0.182	S	C	.	.	H	α-helix	trans	-66.5	-38	-179.2	-169.5	164.3	-178.2	157	0	112	K261 K267 T299 F300 E304	K261-K263 VanDerWaalsContact C-N 3.3Å; K261-K263 PolarHBondContact O-N 2.87Å; K261-K263 VanDerWaalsContact O-N 3.15Å; K263-K267 WeakPolarHBondContact O-CG 3.48Å; K263-K267 PolarHBondContact O-N 3.38Å; K263-T299 WeakPolarHBondContact CA-OG1 3.35Å; K263-T299 HydrophobicContact CB-CG2 4.07Å; K263-F300 HydrophobicContact CG-CD1 4.2Å; K263-F300 HydrophobicContact CG-CE1 3.95Å; K263-E304 WeakPolarHBondContact CE-OE1 3.34Å; K263-E304 VanDerWaalsContact NZ-CD 3.28Å; K263-E304 IonicContact NZ-OE1 3.32Å; K263-E304 PolarHBondContact NZ-OE1 2.79Å; K263-E304 IonicContact NZ-OE2 2.69Å; K263-E304 PolarHBondContact NZ-OE2 3.04Å
264	Q	96.3	Very high	94.7	Very high	86 Å²	86	39.7 Å²	39.7	40%	0.402	20%	0.195	S	C	.	.	H	α-helix	trans	-77.1	-39.9	178.1	-169.5	57.5	36.5	0	0	110.8	E256 K261 Y262 A266 K267 C268	E256-Q264 HydrophobicContact CG-CB 4.31Å; E256-Q264 HydrophobicContact CG-CG 4.01Å; K261-Q264 PolarHBondContact O-N 3.36Å; K261-Q264 VanDerWaalsContact O-N 3.08Å; Y262-Q264 VanDerWaalsContact C-N 3.35Å; Y262-Q264 PolarHBondContact O-N 3Å; Q264-A266 VanDerWaalsContact C-N 3.35Å; Q264-A266 PolarHBondContact O-N 3.1Å; Q264-K267 PolarHBondContact O-N 3.09Å; Q264-C268 PolarHBondContact O-N 3.48Å
265	A	97.1	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-54.7	-49.2	172.9	0	0	0	0	0	111.8	G253 E256 L257 K261 Y262 K267 C268 L269	G253-A265 WeakPolarHBondContact O-CB 3.47Å; E256-A265 HydrophobicContact CB-CB 3.81Å; L257-A265 HydrophobicContact CB-CB 4.27Å; K261-A265 PolarHBondContact O-N 2.87Å; Y262-A265 PolarHBondContact O-N 3.44Å; A265-K267 PolarHBondContact O-N 3.41Å; A265-C268 PolarHBondContact O-N 3.18Å; A265-L269 WeakPolarHBondContact O-CG 3.43Å; A265-L269 PolarHBondContact O-N 2.95Å
266	A	96.5	Very high	93.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-47.7	176	0	0	0	0	0	112	Y262 Q264 C268 L269 L270 C295 A296 F300	Y262-A266 WeakPolarHBondContact O-CB 3.4Å; Y262-A266 PolarHBondContact O-N 3.47Å; Q264-A266 VanDerWaalsContact C-N 3.35Å; Q264-A266 PolarHBondContact O-N 3.1Å; A266-C268 VanDerWaalsContact C-N 3.32Å; A266-C268 PolarHBondContact O-N 3.3Å; A266-L269 PolarHBondContact O-N 3.29Å; A266-L270 WeakPolarHBondContact O-CB 3.41Å; A266-L270 WeakPolarHBondContact O-CD1 3.23Å; A266-L270 WeakPolarHBondContact O-CG 3.35Å; A266-L270 PolarHBondContact O-N 3.05Å; A266-C295 HydrophobicContact CB-CB 3.78Å; A266-A296 HydrophobicContact CB-CB 4.11Å; A266-F300 HydrophobicContact CB-CE1 4.06Å; A266-F300 HydrophobicContact CB-CZ 4.08Å
267	K	95.6	Very high	92.2	Very high	86 Å²	86	46.4 Å²	46.4	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-41	178.7	-75.6	179.5	178.6	-177.6	0	112.6	K263 Q264 A265 L271 F300	K263-K267 WeakPolarHBondContact O-CG 3.48Å; K263-K267 PolarHBondContact O-N 3.38Å; Q264-K267 PolarHBondContact O-N 3.09Å; A265-K267 PolarHBondContact O-N 3.41Å; K267-L271 WeakPolarHBondContact O-CG 3.33Å; K267-F300 HydrophobicContact CG-CE1 4.07Å; K267-F300 HydrophobicContact CG-CZ 3.75Å
268	C	94.7	Very high	91.3	Very high	13 Å²	13	52.6 Å²	52.6	9%	0.088	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-47	177.7	-71	0	0	0	0	111.6	Q264 A265 A266 L270 L271	Q264-C268 PolarHBondContact O-N 3.48Å; A265-C268 PolarHBondContact O-N 3.18Å; A266-C268 VanDerWaalsContact C-N 3.32Å; A266-C268 PolarHBondContact O-N 3.3Å; C268-L270 PolarHBondContact O-N 3.33Å; C268-L271 PolarHBondContact O-N 3.4Å
269	L	94.5	Very high	90.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.9	-35.9	-177.9	-67.4	168.5	0	0	0	112.9	A265 A266 L271 A272 V288	A265-L269 WeakPolarHBondContact O-CG 3.43Å; A265-L269 PolarHBondContact O-N 2.95Å; A266-L269 PolarHBondContact O-N 3.29Å; L269-L271 PolarHBondContact O-N 2.92Å; L269-A272 VanDerWaalsContact O-CB 3.24Å; L269-A272 WeakPolarHBondContact O-CB 3.34Å; L269-A272 PolarHBondContact O-N 3.19Å; L269-A272 VanDerWaalsContact O-N 3.14Å; L269-V288 HydrophobicContact CB-CG1 4.48Å; L269-V288 HydrophobicContact CD2-CG1 4.22Å
270	L	93.6	Very high	90	Very high	12 Å²	12	52.4 Å²	52.4	6%	0.063	25%	0.254	C	S	.	.	H	α-helix	trans	-67.5	-18.8	177.6	-69.3	168.8	0	0	0	113.6	A266 C268 A296 F300 N308 V309 F315	A266-L270 WeakPolarHBondContact O-CB 3.41Å; A266-L270 WeakPolarHBondContact O-CD1 3.23Å; A266-L270 WeakPolarHBondContact O-CG 3.35Å; A266-L270 PolarHBondContact O-N 3.05Å; C268-L270 PolarHBondContact O-N 3.33Å; L270-A296 HydrophobicContact CD1-CB 4.36Å; L270-F300 HydrophobicContact CD1-CD2 4.49Å; L270-F300 HydrophobicContact CD1-CE2 3.45Å; L270-F300 VanDerWaalsContact CD1-CE2 3.45Å; L270-F300 HydrophobicContact CD1-CZ 3.82Å; L270-N308 HydrophobicContact CD1-CB 4.22Å; L270-V309 HydrophobicContact CD1-CG2 3.91Å; L270-V309 HydrophobicContact CD2-CG1 4.5Å; L270-V309 HydrophobicContact CD2-CG2 3.92Å; L270-F315 HydrophobicContact CD2-CB 4.04Å; L270-F315 HydrophobicContact CD2-CD1 3.44Å; L270-F315 VanDerWaalsContact CD2-CD1 3.44Å; L270-F315 HydrophobicContact CD2-CD2 3.59Å; L270-F315 HydrophobicContact CD2-CE1 3.64Å; L270-F315 HydrophobicContact CD2-CE2 3.8Å; L270-F315 HydrophobicContact CD2-CG 3.39Å; L270-F315 HydrophobicContact CD2-CZ 3.82Å
271	L	90.9	Very high	89.3	Confident	123 Å²	123	49.9 Å²	49.9	64%	0.644	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.8	175.8	-67	171.7	0	0	0	112.8	K249 K267 C268 L269	K249-L271 HydrophobicContact CG-CB 4.46Å; K267-L271 WeakPolarHBondContact O-CG 3.33Å; C268-L271 PolarHBondContact O-N 3.4Å; L269-L271 PolarHBondContact O-N 2.92Å
272	A	90.4	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.			trans	-68	142.4	176	0	0	0	0	0	110.7	T246 L269 F318	T246-A272 HydrophobicContact CG2-CB 4.07Å; L269-A272 VanDerWaalsContact O-CB 3.24Å; L269-A272 WeakPolarHBondContact O-CB 3.34Å; L269-A272 PolarHBondContact O-N 3.19Å; L269-A272 VanDerWaalsContact O-N 3.14Å; A272-F318 HydrophobicContact CB-CZ 4.44Å; A272-F318 WeakPolarHBondContact O-CE2 3.05Å
273	S	88.6	Confident	88.4	Confident	23 Å²	23	43.8 Å²	43.8	16%	0.161	22%	0.221	C	C	.	.			trans	-95.3	136.7	175.3	-173.8	0	0	0	0	111.2	T246 D275	T246-S273 WeakPolarHBondContact CG2-O 2.96Å; T246-S273 PolarHBondContact OG1-N 3.22Å; S273-D275 PolarHBondContact O-N 3.03Å
274	F	87.8	Confident	88.2	Confident	62 Å²	62	40.4 Å²	40.4	27%	0.272	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-62.6	-41.4	-178.1	-173.3	-96.4	0	0	0	113	H276 C277 L317 F318 L321	F274-H276 PolarHBondContact O-N 3.49Å; F274-C277 PolarHBondContact O-N 3.32Å; F274-L317 HydrophobicContact CB-CB 3.74Å; F274-L317 HydrophobicContact CB-CD1 3.73Å; F274-L317 HydrophobicContact CB-CG 4.4Å; F274-L317 HydrophobicContact CD1-CB 4.14Å; F274-L317 HydrophobicContact CD1-CD1 4.35Å; F274-L317 HydrophobicContact CD2-CB 3.82Å; F274-L317 HydrophobicContact CE2-CB 4.47Å; F274-L317 HydrophobicContact CG-CB 3.63Å; F274-L317 HydrophobicContact CG-CD1 4.2Å; F274-F318 HydrophobicContact CB-CD2 4.32Å; F274-F318 HydrophobicContact CB-CE2 3.86Å; F274-F318 HydrophobicContact CB-CZ 4Å; F274-F318 AromaticContact CD2-CD1 3.72Å; F274-F318 HydrophobicContact CD2-CD1 3.72Å; F274-F318 HydrophobicContact CD2-CD2 4.14Å; F274-F318 AromaticContact CD2-CE1 3.79Å; F274-F318 HydrophobicContact CD2-CE1 3.79Å; F274-F318 HydrophobicContact CD2-CE2 4.24Å; F274-F318 AromaticContact CD2-CG 3.92Å; F274-F318 HydrophobicContact CD2-CG 3.92Å; F274-F318 HydrophobicContact CD2-CZ 4.07Å; F274-F318 HydrophobicContact CE2-CD1 4.26Å; F274-L321 HydrophobicContact CE2-CD1 3.45Å; F274-L321 VanDerWaalsContact CE2-CD1 3.45Å; F274-L321 HydrophobicContact CE2-CD2 4.42Å; F274-L321 HydrophobicContact CE2-CG 3.76Å; F274-L321 HydrophobicContact CZ-CD1 3.87Å; F274-L321 HydrophobicContact CZ-CD2 4.17Å; F274-L321 HydrophobicContact CZ-CG 4.01Å
275	D	82.5	Confident	88.1	Confident	117 Å²	117	37.7 Å²	37.7	63%	0.626	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-61.5	-16.1	-172.5	-59.7	-39	0	0	0	114.2	S273	S273-D275 PolarHBondContact O-N 3.03Å
276	H	77.4	Confident	87.8	Confident	46 Å²	46	39.4 Å²	39.4	21%	0.213	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-132.8	19.6	-172.8	-55.6	-39.9	0	0	0	113.3	S239 A243 F274 D278	S239-H276 PolarHBondContact O-NE2 3.48Å; S239-H276 PolarHBondContact OG-CE1 2.99Å; S239-H276 PolarHBondContact OG-NE2 2.86Å; A243-H276 VanDerWaalsContact CA-CB 3.44Å; A243-H276 HydrophobicContact CB-CB 3.55Å; A243-H276 PolarHBondContact N-CD2 3.4Å; F274-H276 PolarHBondContact O-N 3.49Å; H276-D278 VanDerWaalsContact C-N 3.32Å; H276-D278 PolarHBondContact O-N 3.42Å
277	C	77.4	Confident	87.6	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.027	21%	0.212	C	C	.	.			trans	-85.9	1.4	-174.8	-113.9	0	0	0	0	114.7	T246 F274 F279 P285 F318	T246-C277 HydrophobicContact CG2-CB 4.26Å; T246-C277 WeakPolarHBondContact CG2-SG 3.41Å; F274-C277 PolarHBondContact O-N 3.32Å; C277-F279 PolarHBondContact O-N 3.1Å; C277-P285 HydrophobicContact CB-CB 4.26Å; C277-F318 HydrophobicContact CB-CE1 3.8Å; C277-F318 HydrophobicContact CB-CZ 3.9Å; C277-F318 VanDerWaalsContact SG-CE1 3.57Å; C277-F318 WeakPolarHBondContact SG-CZ 3.3Å
278	D	76.9	Confident	87.6	Confident	131 Å²	131	35.9 Å²	35.9	70%	0.701	19%	0.194	S	C	*	.			trans	-66.1	96.4	173.6	-71.7	-23.9	0	0	0	110.2	H276	H276-D278 VanDerWaalsContact C-N 3.32Å; H276-D278 PolarHBondContact O-N 3.42Å
279	F	79.9	Confident	87.6	Confident	20 Å²	20	35.2 Å²	35.2	9%	0.088	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-136.8	70.1	178.9	-166.1	-151.8	0	0	0	111.2	K247 C277 E281 L282 L283	K247-F279 HydrophobicContact CD-CD2 4.39Å; K247-F279 HydrophobicContact CG-CD1 4.35Å; K247-F279 HydrophobicContact CG-CG 4.28Å; C277-F279 PolarHBondContact O-N 3.1Å; F279-E281 HydrophobicContact CD2-CB 4.36Å; F279-E281 HydrophobicContact CE2-CB 3.99Å; F279-E281 PolarHBondContact O-N 3.28Å; F279-L282 HydrophobicContact CD1-CB 3.37Å; F279-L282 HydrophobicContact CD1-CD2 3.95Å; F279-L282 HydrophobicContact CD1-CG 4.27Å; F279-L282 HydrophobicContact CE1-CB 3.26Å; F279-L282 HydrophobicContact CE1-CD2 3.55Å; F279-L282 HydrophobicContact CE1-CG 3.94Å; F279-L282 HydrophobicContact CG-CB 4.11Å; F279-L282 HydrophobicContact CZ-CB 3.91Å; F279-L282 PolarHBondContact O-N 2.94Å; F279-L283 CarbonylContact C-O 3.59Å; F279-L283 PolarHBondContact O-N 3Å
280	P	83.1	Confident	87.7	Confident	49 Å²	49	36.1 Å²	36.1	32%	0.318	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.6	-171.7	29.1	-37.4	0	0	0	113.5	S50 Y51 S52 L282	S50-P280 WeakPolarHBondContact O-CB 3.29Å; Y51-P280 WeakPolarHBondContact CA-O 3.22Å; Y51-P280 WeakPolarHBondContact CD1-O 3.46Å; S52-P280 PolarHBondContact N-O 3.31Å; P280-L282 VanDerWaalsContact C-N 3.29Å
281	E	81.4	Confident	87.8	Confident	65 Å²	65	35.6 Å²	35.6	30%	0.304	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.8	175.9	-53.1	-170.8	147.5	0	0	113	K207 Y211 F279	K207-E281 VanDerWaalsContact CD-OE2 3.28Å; K207-E281 WeakPolarHBondContact CD-OE2 3.22Å; K207-E281 VanDerWaalsContact CE-CD 3.47Å; K207-E281 WeakPolarHBondContact CE-OE2 3.48Å; K207-E281 IonicContact NZ-OE1 2.83Å; K207-E281 PolarHBondContact NZ-OE1 3.26Å; K207-E281 IonicContact NZ-OE2 2.82Å; K207-E281 PolarHBondContact NZ-OE2 2.75Å; Y211-E281 PolarHBondContact OH-O 3.02Å; F279-E281 HydrophobicContact CD2-CB 4.36Å; F279-E281 HydrophobicContact CE2-CB 3.99Å; F279-E281 PolarHBondContact O-N 3.28Å
282	L	86	Confident	88.1	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-64.1	-176.4	-161.7	80.6	0	0	0	114	V210 A251 L254 F279 P280	V210-L282 HydrophobicContact CB-CD1 3.95Å; V210-L282 HydrophobicContact CG1-CD1 3.66Å; V210-L282 HydrophobicContact CG2-CD1 3.6Å; A251-L282 HydrophobicContact CB-CD2 3.9Å; L254-L282 HydrophobicContact CD2-CD1 3.91Å; L254-L282 HydrophobicContact CD2-CD2 4.37Å; L254-L282 HydrophobicContact CD2-CG 4Å; F279-L282 HydrophobicContact CD1-CB 3.37Å; F279-L282 HydrophobicContact CD1-CD2 3.95Å; F279-L282 HydrophobicContact CD1-CG 4.27Å; F279-L282 HydrophobicContact CE1-CB 3.26Å; F279-L282 HydrophobicContact CE1-CD2 3.55Å; F279-L282 HydrophobicContact CE1-CG 3.94Å; F279-L282 HydrophobicContact CG-CB 4.11Å; F279-L282 HydrophobicContact CZ-CB 3.91Å; F279-L282 PolarHBondContact O-N 2.94Å; P280-L282 VanDerWaalsContact C-N 3.29Å
283	L	89.6	Confident	88.3	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-142.6	143.3	-178.6	-67.5	98.2	0	0	0	111.3	C250 L254 F279 V288 Y291	C250-L283 HydrophobicContact CB-CD1 4.46Å; L254-L283 HydrophobicContact CB-CD1 4.02Å; L254-L283 HydrophobicContact CD2-CD1 4.04Å; L254-L283 HydrophobicContact CG-CD1 4.44Å; F279-L283 CarbonylContact C-O 3.59Å; F279-L283 PolarHBondContact O-N 3Å; L283-V288 HydrophobicContact CB-CG2 4.29Å; L283-V288 HydrophobicContact CD2-CG2 4.5Å; L283-Y291 HydrophobicContact CD2-CD2 3.65Å; L283-Y291 HydrophobicContact CD2-CE2 3.57Å
284	S	92.4	Very high	88.7	Confident	8 Å²	8	28.9 Å²	28.9	6%	0.056	16%	0.155	C	C	.	.			trans	-78.7	154.1	165.1	72.8	0	0	0	0	111.6	Y51 S286 N287 V288	Y51-S284 PolarHBondContact OH-N 3.43Å; Y51-S284 VanDerWaalsContact OH-N 3.1Å; Y51-S284 PolarHBondContact OH-OG 3.47Å; S284-S286 VanDerWaalsContact C-N 3.27Å; S284-S286 PolarHBondContact O-N 3.19Å; S284-N287 PolarHBondContact O-N 3.32Å; S284-N287 VanDerWaalsContact O-N 3.07Å; S284-N287 PolarHBondContact OG-N 3.43Å; S284-N287 PolarHBondContact OG-OD1 3.4Å; S284-N287 VanDerWaalsContact OG-OD1 3.07Å; S284-V288 PolarHBondContact O-N 2.99Å; S284-V288 VanDerWaalsContact O-N 3.08Å
285	P	92.8	Very high	89.2	Confident	28 Å²	28	25.9 Å²	25.9	18%	0.182	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-34.6	175.5	22.7	-33.1	0	0	0	112.9	C277 N287 V288 A289 F318 L321	C277-P285 HydrophobicContact CB-CB 4.26Å; P285-N287 VanDerWaalsContact C-N 3.33Å; P285-N287 PolarHBondContact O-N 3.12Å; P285-V288 WeakPolarHBondContact O-CB 3.41Å; P285-V288 PolarHBondContact O-N 3.16Å; P285-A289 PolarHBondContact O-N 3.35Å; P285-A289 VanDerWaalsContact O-N 3.09Å; P285-F318 HydrophobicContact CB-CD1 4.2Å; P285-F318 HydrophobicContact CB-CE1 3.99Å; P285-F318 WeakPolarHBondContact O-CD1 3.21Å; P285-L321 HydrophobicContact CB-CD1 3.94Å; P285-L321 HydrophobicContact CG-CD1 4.17Å
286	S	92.6	Very high	89.9	Confident	36 Å²	36	20.3 Å²	20.3	25%	0.252	11%	0.112	S	C	.	.	H	α-helix	trans	-58.6	-42.9	171.9	-72.9	0	0	0	0	112.1	S284 A289 I290 E322	S284-S286 VanDerWaalsContact C-N 3.27Å; S284-S286 PolarHBondContact O-N 3.19Å; S286-A289 WeakPolarHBondContact O-CB 3.47Å; S286-A289 PolarHBondContact O-N 3.27Å; S286-I290 WeakPolarHBondContact O-CG1 3.38Å; S286-I290 PolarHBondContact O-N 3.37Å; S286-I290 VanDerWaalsContact O-N 3.09Å; S286-E322 WeakPolarHBondContact CB-OE1 3.23Å; S286-E322 PolarHBondContact OG-OE1 3.02Å
287	N	92.4	Very high	90.8	Very high	11 Å²	11	18.2 Å²	18.2	6%	0.059	10%	0.102	C	C	.	.	H	α-helix	trans	-71.3	-30.6	177.7	-68.9	142.1	0	0	0	112.8	Y51 R59 S284 P285 A289 I290 Y291	Y51-N287 PolarHBondContact OH-OD1 3.17Å; R59-N287 PolarHBondContact NH1-OD1 3.15Å; S284-N287 PolarHBondContact O-N 3.32Å; S284-N287 VanDerWaalsContact O-N 3.07Å; S284-N287 PolarHBondContact OG-N 3.43Å; S284-N287 PolarHBondContact OG-OD1 3.4Å; S284-N287 VanDerWaalsContact OG-OD1 3.07Å; P285-N287 VanDerWaalsContact C-N 3.33Å; P285-N287 PolarHBondContact O-N 3.12Å; N287-A289 VanDerWaalsContact C-N 3.3Å; N287-A289 PolarHBondContact O-N 3.47Å; N287-I290 PolarHBondContact O-N 2.79Å; N287-Y291 HydrophobicContact CB-CD1 4.46Å; N287-Y291 HydrophobicContact CB-CE1 4.12Å; N287-Y291 VanDerWaalsContact O-CB 3.28Å; N287-Y291 WeakPolarHBondContact O-CB 3.36Å; N287-Y291 VanDerWaalsContact O-CD1 3.28Å; N287-Y291 WeakPolarHBondContact O-CD1 3.34Å; N287-Y291 VanDerWaalsContact O-CG 3.24Å; N287-Y291 PolarHBondContact O-N 2.85Å
288	V	94.7	Very high	91.7	Very high	1 Å²	1	18 Å²	18	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-59.7	-42.2	169.6	175.5	0	0	0	0	110.9	L269 L283 S284 P285 G292 F318	L269-V288 HydrophobicContact CB-CG1 4.48Å; L269-V288 HydrophobicContact CD2-CG1 4.22Å; L283-V288 HydrophobicContact CB-CG2 4.29Å; L283-V288 HydrophobicContact CD2-CG2 4.5Å; S284-V288 PolarHBondContact O-N 2.99Å; S284-V288 VanDerWaalsContact O-N 3.08Å; P285-V288 WeakPolarHBondContact O-CB 3.41Å; P285-V288 PolarHBondContact O-N 3.16Å; V288-G292 PolarHBondContact O-N 3.4Å; V288-F318 HydrophobicContact CB-CD1 4.21Å; V288-F318 HydrophobicContact CB-CE1 4.14Å; V288-F318 HydrophobicContact CG1-CD1 4.11Å; V288-F318 HydrophobicContact CG1-CE1 3.95Å; V288-F318 HydrophobicContact CG1-CZ 4.3Å
289	A	95.1	Very high	92.7	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-48.6	176.1	0	0	0	0	0	111.9	P285 S286 N287 G293 F318 E322	P285-A289 PolarHBondContact O-N 3.35Å; P285-A289 VanDerWaalsContact O-N 3.09Å; S286-A289 WeakPolarHBondContact O-CB 3.47Å; S286-A289 PolarHBondContact O-N 3.27Å; N287-A289 VanDerWaalsContact C-N 3.3Å; N287-A289 PolarHBondContact O-N 3.47Å; A289-G293 WeakPolarHBondContact O-CA 3.45Å; A289-G293 PolarHBondContact O-N 3.49Å; A289-F318 HydrophobicContact CB-CB 3.86Å; A289-F318 WeakPolarHBondContact CB-O 3.39Å; A289-E322 HydrophobicContact CB-CB 4.17Å; A289-E322 HydrophobicContact CB-CG 4Å
290	I	96.1	Very high	93.4	Very high	19 Å²	19	11.6 Å²	11.6	10%	0.097	7%	0.068	C	C	.	.	H	α-helix	trans	-66	-51.6	-178.9	-65.7	166.7	0	0	0	111	S286 N287 G293 L294 E322 V325 L351 L357	S286-I290 WeakPolarHBondContact O-CG1 3.38Å; S286-I290 PolarHBondContact O-N 3.37Å; S286-I290 VanDerWaalsContact O-N 3.09Å; N287-I290 PolarHBondContact O-N 2.79Å; I290-G293 PolarHBondContact O-N 3.32Å; I290-L294 HydrophobicContact CG2-CD1 3.74Å; I290-L294 HydrophobicContact CG2-CG 4.49Å; I290-L294 WeakPolarHBondContact O-CB 3.48Å; I290-L294 WeakPolarHBondContact O-CG 3.36Å; I290-L294 PolarHBondContact O-N 2.87Å; I290-E322 HydrophobicContact CD1-CG 4.45Å; I290-E322 HydrophobicContact CG1-CG 4.18Å; I290-V325 HydrophobicContact CG1-CG2 3.97Å; I290-L351 HydrophobicContact CD1-CD2 4.48Å; I290-L351 HydrophobicContact CG2-CD2 3.55Å; I290-L357 HydrophobicContact CG2-CD2 3.78Å
291	Y	96.7	Very high	93.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.8	-46.7	-175.8	-69.3	14.5	0	0	0	110.5	R59 L254 L257 L283 N287 C295 D354 L357	R59-Y291 PolarHBondContact NH2-OH 2.9Å; R59-Y291 VanDerWaalsContact NH2-OH 3.17Å; L254-Y291 HydrophobicContact CD1-CE2 3.98Å; L257-Y291 HydrophobicContact CD2-CD2 3.5Å; L257-Y291 HydrophobicContact CD2-CE2 3.76Å; L257-Y291 HydrophobicContact CD2-CG 4.06Å; L283-Y291 HydrophobicContact CD2-CD2 3.65Å; L283-Y291 HydrophobicContact CD2-CE2 3.57Å; N287-Y291 HydrophobicContact CB-CD1 4.46Å; N287-Y291 HydrophobicContact CB-CE1 4.12Å; N287-Y291 VanDerWaalsContact O-CB 3.28Å; N287-Y291 WeakPolarHBondContact O-CB 3.36Å; N287-Y291 VanDerWaalsContact O-CD1 3.28Å; N287-Y291 WeakPolarHBondContact O-CD1 3.34Å; N287-Y291 VanDerWaalsContact O-CG 3.24Å; N287-Y291 PolarHBondContact O-N 2.85Å; Y291-C295 WeakPolarHBondContact O-CB 3.43Å; Y291-C295 PolarHBondContact O-N 3.06Å; Y291-C295 PolarHBondContact O-SG 2.94Å; Y291-D354 PolarHBondContact OH-OD1 3.21Å; Y291-D354 PolarHBondContact OH-OD2 3.45Å; Y291-L357 HydrophobicContact CD1-CB 4.34Å; Y291-L357 HydrophobicContact CD1-CD1 4Å; Y291-L357 HydrophobicContact CD1-CD2 4.05Å; Y291-L357 HydrophobicContact CD1-CG 4.37Å; Y291-L357 HydrophobicContact CE1-CB 3.72Å; Y291-L357 HydrophobicContact CE1-CD1 4.24Å; Y291-L357 HydrophobicContact CE1-CD2 3.99Å; Y291-L357 HydrophobicContact CE1-CG 4.2Å
292	G	95.9	Very high	94.4	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.4	-45.1	177.2	0	0	0	0	0	111.8	V288 A296	V288-G292 PolarHBondContact O-N 3.4Å; G292-A296 WeakPolarHBondContact O-CB 3.22Å; G292-A296 PolarHBondContact O-N 3.26Å
293	G	96	Very high	94.8	Very high	1 Å²	1	21 Å²	21	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-50.2	-179.7	0	0	0	0	0	113.1	A289 I290 A296 L297	A289-G293 WeakPolarHBondContact O-CA 3.45Å; A289-G293 PolarHBondContact O-N 3.49Å; I290-G293 PolarHBondContact O-N 3.32Å; G293-A296 PolarHBondContact O-N 2.94Å; G293-L297 VanDerWaalsContact O-CB 3.26Å; G293-L297 WeakPolarHBondContact O-CB 3.19Å; G293-L297 PolarHBondContact O-N 3.09Å
294	L	97.1	Very high	95	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-67.4	-42.7	179.4	-69.7	171.4	0	0	0	112.2	I290 L297 A298 L344 L351 L357 L364 I368	I290-L294 HydrophobicContact CG2-CD1 3.74Å; I290-L294 HydrophobicContact CG2-CG 4.49Å; I290-L294 WeakPolarHBondContact O-CB 3.48Å; I290-L294 WeakPolarHBondContact O-CG 3.36Å; I290-L294 PolarHBondContact O-N 2.87Å; L294-L297 PolarHBondContact O-N 3.44Å; L294-A298 WeakPolarHBondContact O-CB 3.28Å; L294-A298 PolarHBondContact O-N 3.07Å; L294-L344 HydrophobicContact CD2-CD1 3.73Å; L294-L351 HydrophobicContact CD1-CD1 3.67Å; L294-L357 HydrophobicContact CD1-CD2 4Å; L294-L364 HydrophobicContact CB-CD1 4.45Å; L294-I368 HydrophobicContact CD2-CD1 4.17Å
295	C	97.7	Very high	95.1	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-40.6	177.2	-70	0	0	0	0	111.7	L257 Y262 A266 Y291 T299	L257-C295 VanDerWaalsContact CD1-SG 3.52Å; Y262-C295 WeakPolarHBondContact O-CB 3.44Å; A266-C295 HydrophobicContact CB-CB 3.78Å; Y291-C295 WeakPolarHBondContact O-CB 3.43Å; Y291-C295 PolarHBondContact O-N 3.06Å; Y291-C295 PolarHBondContact O-SG 2.94Å; C295-T299 WeakPolarHBondContact O-CB 3.39Å; C295-T299 PolarHBondContact O-N 3.23Å; C295-T299 VanDerWaalsContact O-N 3.15Å; C295-T299 PolarHBondContact O-OG1 3.34Å
296	A	97.2	Very high	95.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-47	175.2	0	0	0	0	0	110.7	A266 L270 G292 G293 A298 T299 F300 L305 V309	A266-A296 HydrophobicContact CB-CB 4.11Å; L270-A296 HydrophobicContact CD1-CB 4.36Å; G292-A296 WeakPolarHBondContact O-CB 3.22Å; G292-A296 PolarHBondContact O-N 3.26Å; G293-A296 PolarHBondContact O-N 2.94Å; A296-A298 VanDerWaalsContact C-N 3.3Å; A296-A298 PolarHBondContact O-N 3.22Å; A296-T299 PolarHBondContact O-N 3.38Å; A296-F300 HydrophobicContact CB-CD2 4.12Å; A296-F300 HydrophobicContact CB-CE2 4.31Å; A296-F300 HydrophobicContact CB-CG 4.4Å; A296-F300 VanDerWaalsContact O-CB 3.26Å; A296-F300 WeakPolarHBondContact O-CB 3.38Å; A296-F300 PolarHBondContact O-N 3.34Å; A296-L305 HydrophobicContact CB-CD2 4.19Å; A296-V309 HydrophobicContact CB-CG2 3.86Å
297	L	96.7	Very high	95.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-39	179	-169	65	0	0	0	112.7	G293 L294 L305 I328 I329 F332 I368	G293-L297 VanDerWaalsContact O-CB 3.26Å; G293-L297 WeakPolarHBondContact O-CB 3.19Å; G293-L297 PolarHBondContact O-N 3.09Å; L294-L297 PolarHBondContact O-N 3.44Å; L297-L305 HydrophobicContact CD1-CD1 4.23Å; L297-I328 HydrophobicContact CD2-CG2 3.54Å; L297-I329 HydrophobicContact CD1-CG1 4.47Å; L297-F332 HydrophobicContact CD1-CB 3.75Å; L297-F332 HydrophobicContact CD1-CD1 3.71Å; L297-F332 HydrophobicContact CD1-CD2 3.84Å; L297-F332 HydrophobicContact CD1-CE1 4.26Å; L297-F332 HydrophobicContact CD1-CE2 4.34Å; L297-F332 HydrophobicContact CD1-CG 3.5Å; L297-F332 VanDerWaalsContact CD1-CG 3.5Å; L297-F332 HydrophobicContact CG-CD2 4.41Å; L297-I368 HydrophobicContact CB-CD1 4.48Å; L297-I368 HydrophobicContact CB-CG1 4.41Å; L297-I368 HydrophobicContact CD2-CD1 4.09Å; L297-I368 HydrophobicContact CD2-CG1 4.3Å; L297-I368 HydrophobicContact CD2-CG2 4Å; L297-I368 HydrophobicContact CG-CD1 4.4Å; L297-I368 HydrophobicContact CG-CG1 4.17Å; L297-I368 HydrophobicContact CG-CG2 4.19Å
298	A	96.6	Very high	95.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-71.1	-31.2	178.7	0	0	0	0	0	113.3	L294 A296 L364 Q367 I368 R371	L294-A298 WeakPolarHBondContact O-CB 3.28Å; L294-A298 PolarHBondContact O-N 3.07Å; A296-A298 VanDerWaalsContact C-N 3.3Å; A296-A298 PolarHBondContact O-N 3.22Å; A298-L364 HydrophobicContact CB-CD2 3.71Å; A298-Q367 HydrophobicContact CB-CB 4.1Å; A298-I368 HydrophobicContact CB-CD1 4.39Å; A298-I368 HydrophobicContact CB-CG1 3.79Å; A298-R371 PolarHBondContact O-NE 3.09Å; A298-R371 PolarHBondContact O-NH2 3.45Å
299	T	96.1	Very high	95.4	Very high	15 Å²	15	32.7 Å²	32.7	9%	0.092	15%	0.147	C	C	.	.	H	α-helix	trans	-117	-30.2	-166.4	62.6	0	0	0	0	116.3	K263 C295 A296 R371	K263-T299 WeakPolarHBondContact CA-OG1 3.35Å; K263-T299 HydrophobicContact CB-CG2 4.07Å; C295-T299 WeakPolarHBondContact O-CB 3.39Å; C295-T299 PolarHBondContact O-N 3.23Å; C295-T299 VanDerWaalsContact O-N 3.15Å; C295-T299 PolarHBondContact O-OG1 3.34Å; A296-T299 PolarHBondContact O-N 3.38Å; T299-R371 VanDerWaalsContact C-CZ 3.48Å; T299-R371 VanDerWaalsContact CA-NH2 3.32Å; T299-R371 PolarHBondContact O-NH1 3.07Å; T299-R371 PolarHBondContact O-NH2 3.34Å; T299-R371 VanDerWaalsContact O-NH2 3.13Å
300	F	96.3	Very high	95.4	Very high	1 Å²	1	35 Å²	35	0%	0.004	16%	0.159	C	C	.	.			trans	-79.7	145.4	-176.6	-75.2	12.1	0	0	0	111	K263 A266 K267 L270 A296 E304 L305 N308 V309 R371	K263-F300 HydrophobicContact CG-CD1 4.2Å; K263-F300 HydrophobicContact CG-CE1 3.95Å; A266-F300 HydrophobicContact CB-CE1 4.06Å; A266-F300 HydrophobicContact CB-CZ 4.08Å; K267-F300 HydrophobicContact CG-CE1 4.07Å; K267-F300 HydrophobicContact CG-CZ 3.75Å; L270-F300 HydrophobicContact CD1-CD2 4.49Å; L270-F300 HydrophobicContact CD1-CE2 3.45Å; L270-F300 VanDerWaalsContact CD1-CE2 3.45Å; L270-F300 HydrophobicContact CD1-CZ 3.82Å; A296-F300 HydrophobicContact CB-CD2 4.12Å; A296-F300 HydrophobicContact CB-CE2 4.31Å; A296-F300 HydrophobicContact CB-CG 4.4Å; A296-F300 VanDerWaalsContact O-CB 3.26Å; A296-F300 WeakPolarHBondContact O-CB 3.38Å; A296-F300 PolarHBondContact O-N 3.34Å; F300-E304 WeakPolarHBondContact CA-OE2 3.46Å; F300-E304 HydrophobicContact CB-CB 3.7Å; F300-E304 HydrophobicContact CD2-CB 3.87Å; F300-E304 HydrophobicContact CG-CB 3.83Å; F300-L305 HydrophobicContact CB-CD2 4.07Å; F300-L305 HydrophobicContact CB-CG 3.82Å; F300-N308 HydrophobicContact CD2-CB 4.31Å; F300-N308 HydrophobicContact CE2-CB 3.75Å; F300-N308 WeakPolarHBondContact CE2-ND2 3.49Å; F300-V309 HydrophobicContact CD2-CG2 4.38Å; F300-R371 VanDerWaalsContact C-NH1 3.31Å; F300-R371 PolarHBondContact O-NH1 3.1Å
301	D	92.9	Very high	95.3	Very high	70 Å²	70	38 Å²	38	37%	0.374	18%	0.181	S	C	.	.			trans	-75.9	175.4	167.7	68	46.5	0	0	0	111.5	Q303 E304 L305	D301-Q303 VanDerWaalsContact C-N 3.26Å; D301-Q303 PolarHBondContact O-N 2.92Å; D301-Q303 WeakPolarHBondContact OD1-CA 3.48Å; D301-Q303 WeakPolarHBondContact OD1-CB 3.41Å; D301-Q303 PolarHBondContact OD1-N 3.36Å; D301-E304 PolarHBondContact N-OE2 3.5Å; D301-E304 PolarHBondContact O-N 3.36Å; D301-E304 PolarHBondContact OD1-N 3.24Å; D301-L305 WeakPolarHBondContact O-CB 3.43Å; D301-L305 PolarHBondContact O-N 3.04Å
302	R	92	Very high	95.1	Very high	96 Å²	96	39.1 Å²	39.1	36%	0.362	19%	0.189	S	C	.	.	H	α-helix	trans	-58.6	-36.2	-178.3	-172.3	178.7	-179.3	86.3	9.7	112.8	Q306 Y333	R302-Q306 PolarHBondContact O-N 2.83Å; R302-Y333 HydrophobicContact CG-CD2 4.04Å; R302-Y333 HydrophobicContact CG-CE2 3.7Å; R302-Y333 PolarHBondContact NH1-O 3.28Å; R302-Y333 PolarHBondContact NH2-O 3.48Å
303	Q	93.9	Very high	94.8	Very high	148 Å²	148	43.6 Å²	43.6	69%	0.692	22%	0.22	S	C	*	.	H	α-helix	trans	-76.6	-42.9	-179.4	-173.2	-179.7	45.1	0	0	111	D301 Q306 R307	D301-Q303 VanDerWaalsContact C-N 3.26Å; D301-Q303 PolarHBondContact O-N 2.92Å; D301-Q303 WeakPolarHBondContact OD1-CA 3.48Å; D301-Q303 WeakPolarHBondContact OD1-CB 3.41Å; D301-Q303 PolarHBondContact OD1-N 3.36Å; Q303-Q306 PolarHBondContact O-N 3.43Å; Q303-R307 WeakPolarHBondContact O-CB 3.35Å; Q303-R307 PolarHBondContact O-N 3.48Å
304	E	94.6	Very high	94.4	Very high	31 Å²	31	46 Å²	46	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-43.5	174.8	-73.8	-178	145	0	0	111.3	K263 F300 D301 R307 N308	K263-E304 WeakPolarHBondContact CE-OE1 3.34Å; K263-E304 VanDerWaalsContact NZ-CD 3.28Å; K263-E304 IonicContact NZ-OE1 3.32Å; K263-E304 PolarHBondContact NZ-OE1 2.79Å; K263-E304 IonicContact NZ-OE2 2.69Å; K263-E304 PolarHBondContact NZ-OE2 3.04Å; F300-E304 WeakPolarHBondContact CA-OE2 3.46Å; F300-E304 HydrophobicContact CB-CB 3.7Å; F300-E304 HydrophobicContact CD2-CB 3.87Å; F300-E304 HydrophobicContact CG-CB 3.83Å; D301-E304 PolarHBondContact N-OE2 3.5Å; D301-E304 PolarHBondContact O-N 3.36Å; D301-E304 PolarHBondContact OD1-N 3.24Å; E304-R307 PolarHBondContact O-N 3.46Å; E304-N308 VanDerWaalsContact O-CB 3.24Å; E304-N308 WeakPolarHBondContact O-CB 3.46Å; E304-N308 VanDerWaalsContact O-CG 3.3Å; E304-N308 PolarHBondContact O-N 2.88Å; E304-N308 PolarHBondContact O-ND2 3.08Å
305	L	94.9	Very high	94.2	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-45.7	175.7	-82.4	174.1	0	0	0	112	A296 L297 F300 D301 V309 I310 F332	A296-L305 HydrophobicContact CB-CD2 4.19Å; L297-L305 HydrophobicContact CD1-CD1 4.23Å; F300-L305 HydrophobicContact CB-CD2 4.07Å; F300-L305 HydrophobicContact CB-CG 3.82Å; D301-L305 WeakPolarHBondContact O-CB 3.43Å; D301-L305 PolarHBondContact O-N 3.04Å; L305-V309 HydrophobicContact CD2-CG2 3.99Å; L305-V309 WeakPolarHBondContact O-CB 3.36Å; L305-V309 PolarHBondContact O-N 2.94Å; L305-V309 VanDerWaalsContact O-N 3.1Å; L305-I310 PolarHBondContact O-N 3.14Å; L305-F332 HydrophobicContact CD1-CD1 4.18Å; L305-F332 HydrophobicContact CD1-CE1 4.24Å
306	Q	94.7	Very high	94	Very high	95 Å²	95	50.9 Å²	50.9	44%	0.444	26%	0.259	S	S	.	.	I	π-helix	trans	-60.2	-50.2	178.2	-175.1	178.3	-5.6	0	0	111.1	R302 Q303 I310 S311 Y333	R302-Q306 PolarHBondContact O-N 2.83Å; Q303-Q306 PolarHBondContact O-N 3.43Å; Q306-I310 PolarHBondContact O-N 3.27Å; Q306-S311 PolarHBondContact O-N 2.79Å; Q306-S311 PolarHBondContact O-OG 2.92Å; Q306-Y333 HydrophobicContact CB-CE2 3.87Å; Q306-Y333 HydrophobicContact CG-CE2 4.41Å; Q306-Y333 PolarHBondContact OE1-OH 3.36Å
307	R	95.3	Very high	93.9	Very high	165 Å²	165	54.1 Å²	54.1	62%	0.623	28%	0.275	S	S	*	.	I	π-helix	trans	-72	-45.8	-173.5	-171.2	-178.7	69.5	-175.5	-2.1	113.2	Q303 E304 S311	Q303-R307 WeakPolarHBondContact O-CB 3.35Å; Q303-R307 PolarHBondContact O-N 3.48Å; E304-R307 PolarHBondContact O-N 3.46Å; R307-S311 VanDerWaalsContact CA-OG 3.29Å; R307-S311 WeakPolarHBondContact CA-OG 3.48Å; R307-S311 PolarHBondContact O-OG 3.45Å
308	N	93.9	Very high	93.8	Very high	39 Å²	39	54 Å²	54	21%	0.209	28%	0.275	C	S	.	.	I	π-helix	trans	-94.8	-19.7	-167.3	-53.3	-31.4	0	0	0	112.8	L270 F300 E304 S312	L270-N308 HydrophobicContact CD1-CB 4.22Å; F300-N308 HydrophobicContact CD2-CB 4.31Å; F300-N308 HydrophobicContact CE2-CB 3.75Å; F300-N308 WeakPolarHBondContact CE2-ND2 3.49Å; E304-N308 VanDerWaalsContact O-CB 3.24Å; E304-N308 WeakPolarHBondContact O-CB 3.46Å; E304-N308 VanDerWaalsContact O-CG 3.3Å; E304-N308 PolarHBondContact O-N 2.88Å; E304-N308 PolarHBondContact O-ND2 3.08Å; N308-S312 VanDerWaalsContact O-CB 3.25Å; N308-S312 WeakPolarHBondContact O-CB 3.33Å
309	V	94.4	Very high	93.6	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.006	28%	0.277	C	S	.	.	I	π-helix	trans	-116.6	-58.4	-176.8	-170.5	0	0	0	0	110.7	L270 A296 F300 L305 S312 F315 L319 I329	L270-V309 HydrophobicContact CD1-CG2 3.91Å; L270-V309 HydrophobicContact CD2-CG1 4.5Å; L270-V309 HydrophobicContact CD2-CG2 3.92Å; A296-V309 HydrophobicContact CB-CG2 3.86Å; F300-V309 HydrophobicContact CD2-CG2 4.38Å; L305-V309 HydrophobicContact CD2-CG2 3.99Å; L305-V309 WeakPolarHBondContact O-CB 3.36Å; L305-V309 PolarHBondContact O-N 2.94Å; L305-V309 VanDerWaalsContact O-N 3.1Å; V309-S312 PolarHBondContact O-N 3.49Å; V309-F315 HydrophobicContact CG1-CD1 3.81Å; V309-F315 HydrophobicContact CG1-CE1 3.99Å; V309-L319 HydrophobicContact CG1-CD1 4.09Å; V309-I329 HydrophobicContact CG1-CD1 4.1Å; V309-I329 HydrophobicContact CG1-CG2 4.39Å
310	I	93.6	Very high	93.5	Very high	49 Å²	49	58.5 Å²	58.5	25%	0.251	30%	0.295	S	S	.	.	I	π-helix	trans	-70.6	-44.5	-172.6	-61.4	173.6	0	0	0	112	L305 Q306 S312 I329 F330 Y333	L305-I310 PolarHBondContact O-N 3.14Å; Q306-I310 PolarHBondContact O-N 3.27Å; I310-S312 VanDerWaalsContact C-N 3.34Å; I310-I329 HydrophobicContact CG1-CG2 4.26Å; I310-F330 HydrophobicContact CG1-CE1 4.39Å; I310-F330 HydrophobicContact CG2-CE1 3.73Å; I310-F330 HydrophobicContact CG2-CZ 4.28Å; I310-Y333 HydrophobicContact CD1-CD1 4.21Å; I310-Y333 HydrophobicContact CD1-CD2 3.8Å; I310-Y333 HydrophobicContact CD1-CE2 4.37Å; I310-Y333 HydrophobicContact CD1-CG 3.71Å
311	S	93.9	Very high	93.4	Very high	81 Å²	81	62 Å²	62	57%	0.566	31%	0.313	S	S	*	.	S	Bend	trans	-87.2	-0.6	177.6	60.8	0	0	0	0	114.1	Q306 R307 S313	Q306-S311 PolarHBondContact O-N 2.79Å; Q306-S311 PolarHBondContact O-OG 2.92Å; R307-S311 VanDerWaalsContact CA-OG 3.29Å; R307-S311 WeakPolarHBondContact CA-OG 3.48Å; R307-S311 PolarHBondContact O-OG 3.45Å; S311-S313 PolarHBondContact O-N 2.95Å
312	S	92.5	Very high	93.4	Very high	23 Å²	23	60.7 Å²	60.7	16%	0.161	31%	0.305	C	S	.	.			trans	-76.4	113.5	178.6	178.4	0	0	0	0	110.2	N308 V309 I310 S314 F315 K316	N308-S312 VanDerWaalsContact O-CB 3.25Å; N308-S312 WeakPolarHBondContact O-CB 3.33Å; V309-S312 PolarHBondContact O-N 3.49Å; I310-S312 VanDerWaalsContact C-N 3.34Å; S312-S314 VanDerWaalsContact C-N 3.32Å; S312-F315 PolarHBondContact OG-N 3.22Å; S312-K316 WeakPolarHBondContact O-CB 3.41Å; S312-K316 PolarHBondContact O-N 3.46Å; S312-K316 VanDerWaalsContact O-N 3.09Å
313	S	89.8	Confident	93.5	Very high	94 Å²	94	58.8 Å²	58.8	66%	0.657	31%	0.305	S	S	*	.	H	α-helix	trans	-65.5	-36.2	175.4	51.7	0	0	0	0	112.2	S311	S311-S313 PolarHBondContact O-N 2.95Å
314	S	88.4	Confident	93.5	Very high	53 Å²	53	56.1 Å²	56.1	37%	0.371	29%	0.293	S	S	.	.	H	α-helix	trans	-68.1	-45.3	180	-49	0	0	0	0	111.3	S312 K316	S312-S314 VanDerWaalsContact C-N 3.32Å; S314-K316 VanDerWaalsContact C-N 3.34Å
315	F	93.4	Very high	93.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-77.1	-22.4	-178	-160.9	-110.1	0	0	0	113.4	L270 V309 S312 L317 F318 L319	L270-F315 HydrophobicContact CD2-CB 4.04Å; L270-F315 HydrophobicContact CD2-CD1 3.44Å; L270-F315 VanDerWaalsContact CD2-CD1 3.44Å; L270-F315 HydrophobicContact CD2-CD2 3.59Å; L270-F315 HydrophobicContact CD2-CE1 3.64Å; L270-F315 HydrophobicContact CD2-CE2 3.8Å; L270-F315 HydrophobicContact CD2-CG 3.39Å; L270-F315 HydrophobicContact CD2-CZ 3.82Å; V309-F315 HydrophobicContact CG1-CD1 3.81Å; V309-F315 HydrophobicContact CG1-CE1 3.99Å; S312-F315 PolarHBondContact OG-N 3.22Å; F315-L317 PolarHBondContact O-N 3.43Å; F315-F318 HydrophobicContact CD2-CB 4.2Å; F315-F318 AromaticContact CD2-CD2 3.96Å; F315-F318 HydrophobicContact CD2-CD2 3.96Å; F315-F318 HydrophobicContact CD2-CG 4.35Å; F315-F318 HydrophobicContact CE2-CB 4.17Å; F315-F318 HydrophobicContact CE2-CD2 4.48Å; F315-F318 HydrophobicContact CE2-CG 4.47Å; F315-F318 PolarHBondContact O-N 3.26Å; F315-F318 VanDerWaalsContact O-N 3.15Å; F315-L319 HydrophobicContact CD1-CD1 3.8Å; F315-L319 HydrophobicContact CD1-CD2 4.29Å; F315-L319 HydrophobicContact CD1-CG 3.75Å; F315-L319 HydrophobicContact CE1-CD1 4.04Å; F315-L319 HydrophobicContact CE1-CD2 3.72Å; F315-L319 HydrophobicContact CE1-CG 3.7Å; F315-L319 HydrophobicContact CZ-CD2 4.49Å; F315-L319 PolarHBondContact O-N 2.99Å; F315-L319 VanDerWaalsContact O-N 3.11Å
316	K	93.7	Very high	93.6	Very high	106 Å²	106	58.5 Å²	58.5	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-54.7	-39.5	175.3	-176.5	179	173.3	63.1	0	112.5	S312 S314 F318 L319 E320	S312-K316 WeakPolarHBondContact O-CB 3.41Å; S312-K316 PolarHBondContact O-N 3.46Å; S312-K316 VanDerWaalsContact O-N 3.09Å; S314-K316 VanDerWaalsContact C-N 3.34Å; K316-F318 PolarHBondContact O-N 2.93Å; K316-L319 PolarHBondContact O-N 3.31Å; K316-E320 VanDerWaalsContact CE-OE1 3.27Å; K316-E320 WeakPolarHBondContact CE-OE1 3.34Å; K316-E320 IonicContact NZ-OE1 3.41Å; K316-E320 WeakPolarHBondContact O-CG 3.42Å; K316-E320 PolarHBondContact O-N 3.3Å
317	L	93.9	Very high	93.7	Very high	67 Å²	67	56.7 Å²	56.7	35%	0.351	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-40.3	179.2	-64.7	167.8	0	0	0	112	F274 F315 E320 L321	F274-L317 HydrophobicContact CB-CB 3.74Å; F274-L317 HydrophobicContact CB-CD1 3.73Å; F274-L317 HydrophobicContact CB-CG 4.4Å; F274-L317 HydrophobicContact CD1-CB 4.14Å; F274-L317 HydrophobicContact CD1-CD1 4.35Å; F274-L317 HydrophobicContact CD2-CB 3.82Å; F274-L317 HydrophobicContact CE2-CB 4.47Å; F274-L317 HydrophobicContact CG-CB 3.63Å; F274-L317 HydrophobicContact CG-CD1 4.2Å; F315-L317 PolarHBondContact O-N 3.43Å; L317-E320 PolarHBondContact O-N 3.43Å; L317-L321 PolarHBondContact O-N 2.92Å
318	F	94.1	Very high	93.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-40.2	173.8	-67.8	-81.7	0	0	0	112.1	A272 F274 C277 P285 V288 A289 F315 K316 E320 L321 E322	A272-F318 HydrophobicContact CB-CZ 4.44Å; A272-F318 WeakPolarHBondContact O-CE2 3.05Å; F274-F318 HydrophobicContact CB-CD2 4.32Å; F274-F318 HydrophobicContact CB-CE2 3.86Å; F274-F318 HydrophobicContact CB-CZ 4Å; F274-F318 AromaticContact CD2-CD1 3.72Å; F274-F318 HydrophobicContact CD2-CD1 3.72Å; F274-F318 HydrophobicContact CD2-CD2 4.14Å; F274-F318 AromaticContact CD2-CE1 3.79Å; F274-F318 HydrophobicContact CD2-CE1 3.79Å; F274-F318 HydrophobicContact CD2-CE2 4.24Å; F274-F318 AromaticContact CD2-CG 3.92Å; F274-F318 HydrophobicContact CD2-CG 3.92Å; F274-F318 HydrophobicContact CD2-CZ 4.07Å; F274-F318 HydrophobicContact CE2-CD1 4.26Å; C277-F318 HydrophobicContact CB-CE1 3.8Å; C277-F318 HydrophobicContact CB-CZ 3.9Å; C277-F318 VanDerWaalsContact SG-CE1 3.57Å; C277-F318 WeakPolarHBondContact SG-CZ 3.3Å; P285-F318 HydrophobicContact CB-CD1 4.2Å; P285-F318 HydrophobicContact CB-CE1 3.99Å; P285-F318 WeakPolarHBondContact O-CD1 3.21Å; V288-F318 HydrophobicContact CB-CD1 4.21Å; V288-F318 HydrophobicContact CB-CE1 4.14Å; V288-F318 HydrophobicContact CG1-CD1 4.11Å; V288-F318 HydrophobicContact CG1-CE1 3.95Å; V288-F318 HydrophobicContact CG1-CZ 4.3Å; A289-F318 HydrophobicContact CB-CB 3.86Å; A289-F318 WeakPolarHBondContact CB-O 3.39Å; F315-F318 HydrophobicContact CD2-CB 4.2Å; F315-F318 AromaticContact CD2-CD2 3.96Å; F315-F318 HydrophobicContact CD2-CD2 3.96Å; F315-F318 HydrophobicContact CD2-CG 4.35Å; F315-F318 HydrophobicContact CE2-CB 4.17Å; F315-F318 HydrophobicContact CE2-CD2 4.48Å; F315-F318 HydrophobicContact CE2-CG 4.47Å; F315-F318 PolarHBondContact O-N 3.26Å; F315-F318 VanDerWaalsContact O-N 3.15Å; K316-F318 PolarHBondContact O-N 2.93Å; F318-E320 PolarHBondContact O-N 3.44Å; F318-L321 WeakPolarHBondContact O-CB 3.44Å; F318-L321 PolarHBondContact O-N 3.15Å; F318-E322 PolarHBondContact O-N 3.08Å
319	L	94	Very high	93.9	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-19.5	176.4	-70.1	178.5	0	0	0	113.5	V309 F315 K316 E322 V325 R326 I329	V309-L319 HydrophobicContact CG1-CD1 4.09Å; F315-L319 HydrophobicContact CD1-CD1 3.8Å; F315-L319 HydrophobicContact CD1-CD2 4.29Å; F315-L319 HydrophobicContact CD1-CG 3.75Å; F315-L319 HydrophobicContact CE1-CD1 4.04Å; F315-L319 HydrophobicContact CE1-CD2 3.72Å; F315-L319 HydrophobicContact CE1-CG 3.7Å; F315-L319 HydrophobicContact CZ-CD2 4.49Å; F315-L319 PolarHBondContact O-N 2.99Å; F315-L319 VanDerWaalsContact O-N 3.11Å; K316-L319 PolarHBondContact O-N 3.31Å; L319-E322 CarbonylContact O-C 3.42Å; L319-V325 HydrophobicContact CD2-CG1 4.1Å; L319-R326 HydrophobicContact CB-CB 4.03Å; L319-R326 HydrophobicContact CB-CG 4.1Å; L319-R326 HydrophobicContact CD2-CB 4.33Å; L319-I329 HydrophobicContact CD2-CD1 3.92Å
320	E	94.1	Very high	94	Very high	100 Å²	100	50.8 Å²	50.8	47%	0.467	27%	0.271	S	S	.	.	H	α-helix	trans	-77.1	-27.5	173	-76	173.6	-174.2	0	0	112.2	K316 L317 F318	K316-E320 VanDerWaalsContact CE-OE1 3.27Å; K316-E320 WeakPolarHBondContact CE-OE1 3.34Å; K316-E320 IonicContact NZ-OE1 3.41Å; K316-E320 WeakPolarHBondContact O-CG 3.42Å; K316-E320 PolarHBondContact O-N 3.3Å; L317-E320 PolarHBondContact O-N 3.43Å; F318-E320 PolarHBondContact O-N 3.44Å
321	L	92.7	Very high	94.1	Very high	74 Å²	74	50.8 Å²	50.8	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-67.4	-41.5	169.4	-68.1	-174.7	0	0	0	112.1	F274 P285 L317 F318 P323	F274-L321 HydrophobicContact CE2-CD1 3.45Å; F274-L321 VanDerWaalsContact CE2-CD1 3.45Å; F274-L321 HydrophobicContact CE2-CD2 4.42Å; F274-L321 HydrophobicContact CE2-CG 3.76Å; F274-L321 HydrophobicContact CZ-CD1 3.87Å; F274-L321 HydrophobicContact CZ-CD2 4.17Å; F274-L321 HydrophobicContact CZ-CG 4.01Å; P285-L321 HydrophobicContact CB-CD1 3.94Å; P285-L321 HydrophobicContact CG-CD1 4.17Å; L317-L321 PolarHBondContact O-N 2.92Å; F318-L321 WeakPolarHBondContact O-CB 3.44Å; F318-L321 PolarHBondContact O-N 3.15Å; L321-P323 WeakPolarHBondContact O-CD 3.33Å
322	E	93.6	Very high	94.3	Very high	42 Å²	42	47 Å²	47	20%	0.196	24%	0.243	C	C	.	.			trans	-114.6	78	-175.7	-64.9	-59.7	151.5	0	0	111.5	S286 A289 I290 F318 L319 Q324 V325 R326	S286-E322 WeakPolarHBondContact CB-OE1 3.23Å; S286-E322 PolarHBondContact OG-OE1 3.02Å; A289-E322 HydrophobicContact CB-CB 4.17Å; A289-E322 HydrophobicContact CB-CG 4Å; I290-E322 HydrophobicContact CD1-CG 4.45Å; I290-E322 HydrophobicContact CG1-CG 4.18Å; F318-E322 PolarHBondContact O-N 3.08Å; L319-E322 CarbonylContact O-C 3.42Å; E322-Q324 PolarHBondContact O-N 3.2Å; E322-V325 HydrophobicContact CB-CB 4.38Å; E322-V325 HydrophobicContact CB-CG2 4.18Å; E322-V325 PolarHBondContact O-N 2.98Å; E322-R326 PolarHBondContact O-N 3Å
323	P	94.3	Very high	94.4	Very high	56 Å²	56	48.4 Å²	48.4	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-27.6	-173.6	25.4	-35	0	0	0	113.2	L321 R326 D327	L321-P323 WeakPolarHBondContact O-CD 3.33Å; P323-R326 WeakPolarHBondContact O-CB 3.32Å; P323-R326 PolarHBondContact O-N 3.42Å; P323-D327 WeakPolarHBondContact O-CB 3.5Å; P323-D327 PolarHBondContact O-N 3.19Å
324	Q	94	Very high	94.7	Very high	93 Å²	93	48.8 Å²	48.8	44%	0.435	24%	0.236	S	C	.	.	H	α-helix	trans	-63	-47	177	-63.5	-178.6	-54.2	0	0	111.2	E322 R326 D327 I328 M347	E322-Q324 PolarHBondContact O-N 3.2Å; Q324-R326 VanDerWaalsContact C-N 3.33Å; Q324-R326 PolarHBondContact O-N 2.84Å; Q324-D327 PolarHBondContact O-N 2.85Å; Q324-I328 VanDerWaalsContact O-CG1 3.26Å; Q324-I328 WeakPolarHBondContact O-CG1 3.31Å; Q324-I328 PolarHBondContact O-N 3.2Å; Q324-M347 HydrophobicContact CB-CG 4.39Å; Q324-M347 HydrophobicContact CB-SD 3.46Å; Q324-M347 WeakPolarHBondContact CB-SD 3.47Å; Q324-M347 HydrophobicContact CG-SD 4.44Å
325	V	96.1	Very high	95	Very high	5 Å²	5	49 Å²	49	3%	0.03	24%	0.238	C	C	.	.	H	α-helix	trans	-63	-42.4	178.2	179.1	0	0	0	0	110.8	I290 L319 E322 D327 I328 I329 M347	I290-V325 HydrophobicContact CG1-CG2 3.97Å; L319-V325 HydrophobicContact CD2-CG1 4.1Å; E322-V325 HydrophobicContact CB-CB 4.38Å; E322-V325 HydrophobicContact CB-CG2 4.18Å; E322-V325 PolarHBondContact O-N 2.98Å; V325-D327 PolarHBondContact O-N 3.14Å; V325-I328 PolarHBondContact O-N 3.38Å; V325-I329 HydrophobicContact CG1-CD1 3.94Å; V325-I329 WeakPolarHBondContact O-CG1 3.19Å; V325-I329 PolarHBondContact O-N 3.45Å; V325-M347 HydrophobicContact CG2-CE 4.25Å; V325-M347 HydrophobicContact CG2-SD 4.37Å
326	R	96.2	Very high	95.1	Very high	77 Å²	77	54.7 Å²	54.7	29%	0.291	26%	0.263	S	S	.	.	H	α-helix	trans	-56.8	-49.8	175.2	-174.9	-164.6	69.3	-160.8	-5.5	111.6	L319 E322 P323 Q324 I328 I329 F330	L319-R326 HydrophobicContact CB-CB 4.03Å; L319-R326 HydrophobicContact CB-CG 4.1Å; L319-R326 HydrophobicContact CD2-CB 4.33Å; E322-R326 PolarHBondContact O-N 3Å; P323-R326 WeakPolarHBondContact O-CB 3.32Å; P323-R326 PolarHBondContact O-N 3.42Å; Q324-R326 VanDerWaalsContact C-N 3.33Å; Q324-R326 PolarHBondContact O-N 2.84Å; R326-I328 VanDerWaalsContact C-N 3.33Å; R326-I328 PolarHBondContact O-N 3.45Å; R326-I329 PolarHBondContact O-N 2.96Å; R326-F330 HydrophobicContact CG-CD2 3.72Å; R326-F330 HydrophobicContact CG-CE2 3.47Å; R326-F330 VanDerWaalsContact CG-CE2 3.47Å; R326-F330 WeakPolarHBondContact O-CD2 3.38Å; R326-F330 PolarHBondContact O-N 3.23Å
327	D	96.6	Very high	95.2	Very high	57 Å²	57	50 Å²	50	31%	0.305	24%	0.242	S	C	.	.	H	α-helix	trans	-68.2	-33.3	-177.3	-67.5	-2.9	0	0	0	111.9	P323 Q324 V325 K331 M343	P323-D327 WeakPolarHBondContact O-CB 3.5Å; P323-D327 PolarHBondContact O-N 3.19Å; Q324-D327 PolarHBondContact O-N 2.85Å; V325-D327 PolarHBondContact O-N 3.14Å; D327-K331 WeakPolarHBondContact O-CB 3.45Å; D327-K331 VanDerWaalsContact O-CG 3.27Å; D327-K331 WeakPolarHBondContact O-CG 3.4Å; D327-K331 PolarHBondContact O-N 2.92Å; D327-M343 HydrophobicContact CB-CE 3.93Å; D327-M343 HydrophobicContact CB-SD 4.41Å
328	I	97	Very high	95.2	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-51	170.9	-69.7	169.6	0	0	0	110.1	L297 Q324 V325 R326 F330 K331 F332 M343 L344 M347	L297-I328 HydrophobicContact CD2-CG2 3.54Å; Q324-I328 VanDerWaalsContact O-CG1 3.26Å; Q324-I328 WeakPolarHBondContact O-CG1 3.31Å; Q324-I328 PolarHBondContact O-N 3.2Å; V325-I328 PolarHBondContact O-N 3.38Å; R326-I328 VanDerWaalsContact C-N 3.33Å; R326-I328 PolarHBondContact O-N 3.45Å; I328-F330 PolarHBondContact O-N 3.34Å; I328-K331 PolarHBondContact O-N 3.41Å; I328-F332 WeakPolarHBondContact O-CB 3.12Å; I328-F332 PolarHBondContact O-N 3.1Å; I328-M343 HydrophobicContact CB-CE 4.45Å; I328-M343 HydrophobicContact CD1-CB 4.28Å; I328-M343 HydrophobicContact CG1-CB 3.93Å; I328-M343 HydrophobicContact CG1-CE 3.71Å; I328-L344 HydrophobicContact CD1-CB 4.37Å; I328-L344 HydrophobicContact CD1-CD1 4.01Å; I328-L344 HydrophobicContact CG2-CD1 4.42Å; I328-M347 HydrophobicContact CD1-CE 3.28Å; I328-M347 HydrophobicContact CD1-SD 3.7Å
329	I	96.3	Very high	95.3	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-44.7	-178.9	-66.5	161.6	0	0	0	110.9	L297 V309 I310 L319 V325 R326 F332 Y333	L297-I329 HydrophobicContact CD1-CG1 4.47Å; V309-I329 HydrophobicContact CG1-CD1 4.1Å; V309-I329 HydrophobicContact CG1-CG2 4.39Å; I310-I329 HydrophobicContact CG1-CG2 4.26Å; L319-I329 HydrophobicContact CD2-CD1 3.92Å; V325-I329 HydrophobicContact CG1-CD1 3.94Å; V325-I329 WeakPolarHBondContact O-CG1 3.19Å; V325-I329 PolarHBondContact O-N 3.45Å; R326-I329 PolarHBondContact O-N 2.96Å; I329-F332 PolarHBondContact O-N 3.27Å; I329-Y333 PolarHBondContact O-N 3.27Å
330	F	96.3	Very high	95.4	Very high	74 Å²	74	50.3 Å²	50.3	33%	0.325	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.6	-79.1	-62.4	0	0	0	112.4	I310 R326 I328 F332 Y333 E334	I310-F330 HydrophobicContact CG1-CE1 4.39Å; I310-F330 HydrophobicContact CG2-CE1 3.73Å; I310-F330 HydrophobicContact CG2-CZ 4.28Å; R326-F330 HydrophobicContact CG-CD2 3.72Å; R326-F330 HydrophobicContact CG-CE2 3.47Å; R326-F330 VanDerWaalsContact CG-CE2 3.47Å; R326-F330 WeakPolarHBondContact O-CD2 3.38Å; R326-F330 PolarHBondContact O-N 3.23Å; I328-F330 PolarHBondContact O-N 3.34Å; F330-F332 VanDerWaalsContact C-N 3.31Å; F330-F332 PolarHBondContact O-N 3Å; F330-Y333 PolarHBondContact O-N 3.38Å; F330-Y333 VanDerWaalsContact O-N 3.17Å; F330-E334 WeakPolarHBondContact O-CB 3.44Å; F330-E334 WeakPolarHBondContact O-CG 3.41Å; F330-E334 PolarHBondContact O-N 3.23Å
331	K	96.3	Very high	95.4	Very high	49 Å²	49	45.9 Å²	45.9	21%	0.213	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-35.3	178.2	-73	175.6	-169	173.8	0	112.4	D327 I328 E334 S335 K336 S339 C340 M343	D327-K331 WeakPolarHBondContact O-CB 3.45Å; D327-K331 VanDerWaalsContact O-CG 3.27Å; D327-K331 WeakPolarHBondContact O-CG 3.4Å; D327-K331 PolarHBondContact O-N 2.92Å; I328-K331 PolarHBondContact O-N 3.41Å; K331-E334 PolarHBondContact O-N 2.67Å; K331-S335 PolarHBondContact O-N 2.88Å; K331-K336 HydrophobicContact CB-CB 4.21Å; K331-K336 HydrophobicContact CG-CB 4.5Å; K331-K336 PolarHBondContact O-N 3.06Å; K331-S339 WeakPolarHBondContact CD-OG 3.13Å; K331-S339 PolarHBondContact NZ-OG 3.35Å; K331-C340 HydrophobicContact CB-CB 4.05Å; K331-M343 HydrophobicContact CD-CE 3.47Å; K331-M343 VanDerWaalsContact CD-CE 3.47Å; K331-M343 HydrophobicContact CD-SD 4.47Å; K331-M343 PolarHBondContact NZ-SD 3.3Å
332	F	96.5	Very high	95.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-45.2	172.3	-170.6	-84.4	0	0	0	111.3	L297 L305 I328 I329 F330 S335 Y337 I368 R371 A372	L297-F332 HydrophobicContact CD1-CB 3.75Å; L297-F332 HydrophobicContact CD1-CD1 3.71Å; L297-F332 HydrophobicContact CD1-CD2 3.84Å; L297-F332 HydrophobicContact CD1-CE1 4.26Å; L297-F332 HydrophobicContact CD1-CE2 4.34Å; L297-F332 HydrophobicContact CD1-CG 3.5Å; L297-F332 VanDerWaalsContact CD1-CG 3.5Å; L297-F332 HydrophobicContact CG-CD2 4.41Å; L305-F332 HydrophobicContact CD1-CD1 4.18Å; L305-F332 HydrophobicContact CD1-CE1 4.24Å; I328-F332 WeakPolarHBondContact O-CB 3.12Å; I328-F332 PolarHBondContact O-N 3.1Å; I329-F332 PolarHBondContact O-N 3.27Å; F330-F332 VanDerWaalsContact C-N 3.31Å; F330-F332 PolarHBondContact O-N 3Å; F332-S335 PolarHBondContact O-N 3.15Å; F332-Y337 HydrophobicContact CD2-CD1 4.44Å; F332-Y337 HydrophobicContact CD2-CE1 4.4Å; F332-Y337 HydrophobicContact CE2-CE1 4.45Å; F332-I368 HydrophobicContact CE2-CG2 4.23Å; F332-R371 HydrophobicContact CZ-CB 4.33Å; F332-R371 HydrophobicContact CZ-CG 4.03Å; F332-A372 HydrophobicContact CE2-CB 3.77Å; F332-A372 HydrophobicContact CZ-CB 4.43Å
333	Y	95.7	Very high	95.6	Very high	53 Å²	53	47.6 Å²	47.6	21%	0.208	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-38.2	177.1	-171.7	-94.2	0	0	0	112.2	R302 Q306 I310 I329 F330 S335	R302-Y333 HydrophobicContact CG-CD2 4.04Å; R302-Y333 HydrophobicContact CG-CE2 3.7Å; R302-Y333 PolarHBondContact NH1-O 3.28Å; R302-Y333 PolarHBondContact NH2-O 3.48Å; Q306-Y333 HydrophobicContact CB-CE2 3.87Å; Q306-Y333 HydrophobicContact CG-CE2 4.41Å; Q306-Y333 PolarHBondContact OE1-OH 3.36Å; I310-Y333 HydrophobicContact CD1-CD1 4.21Å; I310-Y333 HydrophobicContact CD1-CD2 3.8Å; I310-Y333 HydrophobicContact CD1-CE2 4.37Å; I310-Y333 HydrophobicContact CD1-CG 3.71Å; I329-Y333 PolarHBondContact O-N 3.27Å; F330-Y333 PolarHBondContact O-N 3.38Å; F330-Y333 VanDerWaalsContact O-N 3.17Å; Y333-S335 PolarHBondContact O-N 2.94Å
334	E	95.4	Very high	95.7	Very high	102 Å²	102	45 Å²	45	48%	0.477	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	2.1	175.4	-68.8	177.1	-173	0	0	113.9	F330 K331 K336	F330-E334 WeakPolarHBondContact O-CB 3.44Å; F330-E334 WeakPolarHBondContact O-CG 3.41Å; F330-E334 PolarHBondContact O-N 3.23Å; K331-E334 PolarHBondContact O-N 2.67Å; E334-K336 VanDerWaalsContact C-N 3.25Å; E334-K336 HydrophobicContact CB-CD 4.26Å; E334-K336 HydrophobicContact CB-CG 4.28Å; E334-K336 PolarHBondContact O-N 3.12Å; E334-K336 WeakPolarHBondContact OE2-CE 3.39Å; E334-K336 IonicContact OE2-NZ 2.67Å; E334-K336 PolarHBondContact OE2-NZ 3.42Å
335	S	95.1	Very high	95.6	Very high	58 Å²	58	44.5 Å²	44.5	41%	0.406	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	26.6	-177.4	-46.2	0	0	0	0	114.4	K331 F332 Y333 Y337	K331-S335 PolarHBondContact O-N 2.88Å; F332-S335 PolarHBondContact O-N 3.15Å; Y333-S335 PolarHBondContact O-N 2.94Å; S335-Y337 WeakPolarHBondContact O-CD2 3.44Å; S335-Y337 PolarHBondContact O-N 2.82Å
336	K	95.6	Very high	95.5	Very high	118 Å²	118	49.4 Å²	49.4	51%	0.513	24%	0.243	S	C	.	.			trans	-92.5	63.1	175.7	-67	174.7	-178.8	161.9	0	110.8	K331 E334 A338 S339 C340	K331-K336 HydrophobicContact CB-CB 4.21Å; K331-K336 HydrophobicContact CG-CB 4.5Å; K331-K336 PolarHBondContact O-N 3.06Å; E334-K336 VanDerWaalsContact C-N 3.25Å; E334-K336 HydrophobicContact CB-CD 4.26Å; E334-K336 HydrophobicContact CB-CG 4.28Å; E334-K336 PolarHBondContact O-N 3.12Å; E334-K336 WeakPolarHBondContact OE2-CE 3.39Å; E334-K336 IonicContact OE2-NZ 2.67Å; E334-K336 PolarHBondContact OE2-NZ 3.42Å; K336-A338 PolarHBondContact O-N 2.84Å; K336-S339 PolarHBondContact O-N 2.93Å; K336-C340 WeakPolarHBondContact O-CB 3.36Å; K336-C340 PolarHBondContact O-N 3.41Å; K336-C340 VanDerWaalsContact O-N 3.14Å
337	Y	95.1	Very high	95.3	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.027	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-35.8	-169.5	-53.6	-68.6	0	0	0	114.5	F332 S335 S339 C340 L341 A372 Q375 Y376 A391 F392	F332-Y337 HydrophobicContact CD2-CD1 4.44Å; F332-Y337 HydrophobicContact CD2-CE1 4.4Å; F332-Y337 HydrophobicContact CE2-CE1 4.45Å; S335-Y337 WeakPolarHBondContact O-CD2 3.44Å; S335-Y337 PolarHBondContact O-N 2.82Å; Y337-S339 PolarHBondContact O-N 3.45Å; Y337-C340 WeakPolarHBondContact O-CB 3.45Å; Y337-C340 PolarHBondContact O-N 3.2Å; Y337-L341 WeakPolarHBondContact O-CB 3.24Å; Y337-L341 WeakPolarHBondContact O-CG 3.33Å; Y337-L341 PolarHBondContact O-N 3.02Å; Y337-A372 HydrophobicContact CD1-CB 3.61Å; Y337-A372 HydrophobicContact CE1-CB 3.9Å; Y337-A372 HydrophobicContact CG-CB 4.34Å; Y337-Q375 VanDerWaalsContact OH-CG 3.32Å; Y337-Q375 WeakPolarHBondContact OH-CG 3.43Å; Y337-Q375 PolarHBondContact OH-NE2 2.73Å; Y337-Q375 VanDerWaalsContact OH-NE2 3.1Å; Y337-Y376 AromaticContact CD2-CD2 3.67Å; Y337-Y376 HydrophobicContact CD2-CD2 3.67Å; Y337-Y376 HydrophobicContact CD2-CG 4.36Å; Y337-Y376 AromaticContact CE2-CD2 3.66Å; Y337-Y376 HydrophobicContact CE2-CD2 3.66Å; Y337-Y376 HydrophobicContact CE2-CG 4.18Å; Y337-A391 CarbonylContact C-O 3.57Å; Y337-F392 HydrophobicContact CD2-CZ 4.25Å; Y337-F392 HydrophobicContact CG-CZ 4.18Å
338	A	93.7	Very high	95.1	Very high	35 Å²	35	47.6 Å²	47.6	29%	0.289	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-47.6	-179.4	0	0	0	0	0	112.5	K336 K342 A391 N393	K336-A338 PolarHBondContact O-N 2.84Å; A338-K342 WeakPolarHBondContact O-CB 3.43Å; A338-K342 PolarHBondContact O-N 3.27Å; A338-K342 VanDerWaalsContact O-N 3.14Å; A338-A391 WeakPolarHBondContact CA-O 3.26Å; A338-A391 WeakPolarHBondContact CB-O 3.16Å; A338-A391 PolarHBondContact N-O 2.97Å; A338-N393 PolarHBondContact O-ND2 3.4Å
339	S	95.8	Very high	94.8	Very high	47 Å²	47	51.1 Å²	51.1	33%	0.329	25%	0.254	S	S	.	.	H	α-helix	trans	-74.8	-31.8	177.6	-179.4	0	0	0	0	112.2	K331 K336 Y337 M343	K331-S339 WeakPolarHBondContact CD-OG 3.13Å; K331-S339 PolarHBondContact NZ-OG 3.35Å; K336-S339 PolarHBondContact O-N 2.93Å; Y337-S339 PolarHBondContact O-N 3.45Å; S339-M343 WeakPolarHBondContact O-CG 3.47Å; S339-M343 PolarHBondContact O-N 3.25Å
340	C	96.4	Very high	94.6	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-52.2	174.2	-178.8	0	0	0	0	111.4	K331 K336 Y337 M343 L344	K331-C340 HydrophobicContact CB-CB 4.05Å; K336-C340 WeakPolarHBondContact O-CB 3.36Å; K336-C340 PolarHBondContact O-N 3.41Å; K336-C340 VanDerWaalsContact O-N 3.14Å; Y337-C340 WeakPolarHBondContact O-CB 3.45Å; Y337-C340 PolarHBondContact O-N 3.2Å; C340-M343 PolarHBondContact O-N 2.9Å; C340-L344 WeakPolarHBondContact O-CB 3.47Å; C340-L344 PolarHBondContact O-N 2.92Å
341	L	94.9	Very high	94.4	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-67	-39.1	-178.4	-70.2	168.1	0	0	0	111.6	Y337 M343 L344 D345 F392	Y337-L341 WeakPolarHBondContact O-CB 3.24Å; Y337-L341 WeakPolarHBondContact O-CG 3.33Å; Y337-L341 PolarHBondContact O-N 3.02Å; L341-M343 PolarHBondContact O-N 3.49Å; L341-L344 WeakPolarHBondContact O-CB 3.46Å; L341-L344 PolarHBondContact O-N 3.06Å; L341-L344 VanDerWaalsContact O-N 3.17Å; L341-D345 PolarHBondContact O-N 3.17Å; L341-F392 HydrophobicContact CD1-CB 4.45Å; L341-F392 HydrophobicContact CD1-CD1 3.56Å; L341-F392 HydrophobicContact CD1-CE1 4.16Å; L341-F392 HydrophobicContact CD1-CG 4.35Å
342	K	95.4	Very high	94.3	Very high	123 Å²	123	48.9 Å²	48.9	54%	0.535	25%	0.247	S	C	.	.	H	α-helix	trans	-57.7	-49	175.2	-172.9	-176.3	179.5	-166.1	0	112.1	A338 L344 D345 E346	A338-K342 WeakPolarHBondContact O-CB 3.43Å; A338-K342 PolarHBondContact O-N 3.27Å; A338-K342 VanDerWaalsContact O-N 3.14Å; K342-L344 VanDerWaalsContact C-N 3.3Å; K342-L344 PolarHBondContact O-N 2.89Å; K342-D345 PolarHBondContact O-N 3.47Å; K342-E346 WeakPolarHBondContact CE-OE1 3.48Å; K342-E346 IonicContact NZ-OE1 2.88Å; K342-E346 WeakPolarHBondContact O-CG 3.44Å; K342-E346 PolarHBondContact O-N 3.45Å
343	M	95.3	Very high	94.1	Very high	28 Å²	28	48.9 Å²	48.9	14%	0.138	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-33.2	177.6	-69.9	-172.5	-45	0	0	112.3	D327 I328 K331 S339 C340 L341 E346 M347	D327-M343 HydrophobicContact CB-CE 3.93Å; D327-M343 HydrophobicContact CB-SD 4.41Å; I328-M343 HydrophobicContact CB-CE 4.45Å; I328-M343 HydrophobicContact CD1-CB 4.28Å; I328-M343 HydrophobicContact CG1-CB 3.93Å; I328-M343 HydrophobicContact CG1-CE 3.71Å; K331-M343 HydrophobicContact CD-CE 3.47Å; K331-M343 VanDerWaalsContact CD-CE 3.47Å; K331-M343 HydrophobicContact CD-SD 4.47Å; K331-M343 PolarHBondContact NZ-SD 3.3Å; S339-M343 WeakPolarHBondContact O-CG 3.47Å; S339-M343 PolarHBondContact O-N 3.25Å; C340-M343 PolarHBondContact O-N 2.9Å; L341-M343 PolarHBondContact O-N 3.49Å; M343-E346 PolarHBondContact O-N 3.42Å; M343-M347 WeakPolarHBondContact O-CG 3.49Å; M343-M347 PolarHBondContact O-N 3.47Å
344	L	95	Very high	94	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-45.1	175.5	-167.1	68	0	0	0	110.4	L294 I328 C340 L341 K342 M347 K348 Y365 I368	L294-L344 HydrophobicContact CD2-CD1 3.73Å; I328-L344 HydrophobicContact CD1-CB 4.37Å; I328-L344 HydrophobicContact CD1-CD1 4.01Å; I328-L344 HydrophobicContact CG2-CD1 4.42Å; C340-L344 WeakPolarHBondContact O-CB 3.47Å; C340-L344 PolarHBondContact O-N 2.92Å; L341-L344 WeakPolarHBondContact O-CB 3.46Å; L341-L344 PolarHBondContact O-N 3.06Å; L341-L344 VanDerWaalsContact O-N 3.17Å; K342-L344 VanDerWaalsContact C-N 3.3Å; K342-L344 PolarHBondContact O-N 2.89Å; L344-M347 HydrophobicContact CD1-CE 4.34Å; L344-M347 PolarHBondContact O-N 3.34Å; L344-K348 PolarHBondContact O-N 3.14Å; L344-Y365 HydrophobicContact CD1-CE1 4.39Å; L344-Y365 HydrophobicContact CD1-CE2 4.24Å; L344-Y365 HydrophobicContact CD2-CD1 4.09Å; L344-Y365 HydrophobicContact CD2-CE1 4.11Å; L344-Y365 HydrophobicContact CD2-CG 4.38Å; L344-Y365 HydrophobicContact CG-CD1 4.12Å; L344-Y365 HydrophobicContact CG-CE1 3.61Å; L344-Y365 HydrophobicContact CG-CE2 4.28Å; L344-Y365 PolarHBondContact O-OH 3.29Å; L344-I368 HydrophobicContact CD2-CB 4.46Å; L344-I368 HydrophobicContact CD2-CD1 4.2Å; L344-I368 HydrophobicContact CD2-CG2 3.98Å
345	D	93	Very high	93.9	Very high	83 Å²	83	43.3 Å²	43.3	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-64.9	-38.2	176.4	-68.4	-33.3	0	0	0	112.4	L341 K342 M347 K348	L341-D345 PolarHBondContact O-N 3.17Å; K342-D345 PolarHBondContact O-N 3.47Å; D345-M347 VanDerWaalsContact C-N 3.28Å; D345-M347 PolarHBondContact O-N 2.93Å; D345-K348 VanDerWaalsContact O-CB 3.23Å; D345-K348 WeakPolarHBondContact O-CB 3.35Å; D345-K348 PolarHBondContact O-N 3.18Å; D345-K348 VanDerWaalsContact O-N 3.16Å
346	E	92.9	Very high	93.8	Very high	107 Å²	107	41.5 Å²	41.5	50%	0.5	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-32.2	175.1	-74.2	167	-173.3	0	0	112.9	K342 M343	K342-E346 WeakPolarHBondContact CE-OE1 3.48Å; K342-E346 IonicContact NZ-OE1 2.88Å; K342-E346 WeakPolarHBondContact O-CG 3.44Å; K342-E346 PolarHBondContact O-N 3.45Å; M343-E346 PolarHBondContact O-N 3.42Å
347	M	92.1	Very high	93.8	Very high	10 Å²	10	36 Å²	36	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-83.1	-18.8	177	-65.3	-172.7	-26.3	0	0	113.3	Q324 V325 I328 M343 L344 D345 D349 N350 L351	Q324-M347 HydrophobicContact CB-CG 4.39Å; Q324-M347 HydrophobicContact CB-SD 3.46Å; Q324-M347 WeakPolarHBondContact CB-SD 3.47Å; Q324-M347 HydrophobicContact CG-SD 4.44Å; V325-M347 HydrophobicContact CG2-CE 4.25Å; V325-M347 HydrophobicContact CG2-SD 4.37Å; I328-M347 HydrophobicContact CD1-CE 3.28Å; I328-M347 HydrophobicContact CD1-SD 3.7Å; M343-M347 WeakPolarHBondContact O-CG 3.49Å; M343-M347 PolarHBondContact O-N 3.47Å; L344-M347 HydrophobicContact CD1-CE 4.34Å; L344-M347 PolarHBondContact O-N 3.34Å; D345-M347 VanDerWaalsContact C-N 3.28Å; D345-M347 PolarHBondContact O-N 2.93Å; M347-D349 VanDerWaalsContact C-N 3.31Å; M347-D349 PolarHBondContact O-N 2.66Å; M347-N350 PolarHBondContact O-N 3.02Å; M347-N350 VanDerWaalsContact O-N 3.13Å; M347-L351 HydrophobicContact CB-CD1 4.46Å; M347-L351 HydrophobicContact CB-CG 4.45Å; M347-L351 HydrophobicContact CE-CD1 4.36Å; M347-L351 WeakPolarHBondContact O-CG 3.27Å; M347-L351 PolarHBondContact O-N 2.91Å; M347-L351 VanDerWaalsContact O-N 3.09Å
348	K	92.2	Very high	93.7	Very high	87 Å²	87	35.9 Å²	35.9	38%	0.378	19%	0.185	S	C	.	.	H	α-helix	trans	-54.3	-45.3	-167.5	-174.1	-176.5	173.9	-171.9	0	113	L344 D345 N350 L351 L352 V361 Y365	L344-K348 PolarHBondContact O-N 3.14Å; D345-K348 VanDerWaalsContact O-CB 3.23Å; D345-K348 WeakPolarHBondContact O-CB 3.35Å; D345-K348 PolarHBondContact O-N 3.18Å; D345-K348 VanDerWaalsContact O-N 3.16Å; K348-N350 VanDerWaalsContact C-N 3.32Å; K348-N350 PolarHBondContact O-N 2.96Å; K348-L351 PolarHBondContact O-N 3.08Å; K348-L352 WeakPolarHBondContact O-CB 3.2Å; K348-L352 PolarHBondContact O-N 2.75Å; K348-V361 HydrophobicContact CG-CG1 4.06Å; K348-Y365 VanDerWaalsContact CA-OH 3.32Å; K348-Y365 WeakPolarHBondContact CA-OH 3.45Å; K348-Y365 HydrophobicContact CB-CE1 3.81Å; K348-Y365 HydrophobicContact CD-CD1 4.36Å; K348-Y365 HydrophobicContact CD-CE1 3.99Å; K348-Y365 HydrophobicContact CG-CD1 4.49Å; K348-Y365 HydrophobicContact CG-CE1 3.79Å
349	D	91.1	Very high	93.7	Very high	77 Å²	77	37.2 Å²	37.2	41%	0.412	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-39.6	-176.7	-65.1	-22.4	0	0	0	111.6	V37 M347 L352	V37-D349 HydrophobicContact CG1-CB 3.94Å; M347-D349 VanDerWaalsContact C-N 3.31Å; M347-D349 PolarHBondContact O-N 2.66Å; D349-L352 PolarHBondContact O-N 3.17Å
350	N	91.9	Very high	93.7	Very high	38 Å²	38	35.6 Å²	35.6	20%	0.203	18%	0.178	C	C	.	.	H	α-helix	trans	-69.2	-40.1	175.9	-66.9	-30.9	0	0	0	112.2	S41 M347 K348 L352 L353	S41-N350 PolarHBondContact N-OD1 3.44Å; S41-N350 PolarHBondContact OG-ND2 3.34Å; M347-N350 PolarHBondContact O-N 3.02Å; M347-N350 VanDerWaalsContact O-N 3.13Å; K348-N350 VanDerWaalsContact C-N 3.32Å; K348-N350 PolarHBondContact O-N 2.96Å; N350-L352 PolarHBondContact O-N 3Å; N350-L353 PolarHBondContact O-N 2.85Å; N350-L353 VanDerWaalsContact O-N 3.16Å
351	L	92.5	Very high	93.6	Very high	13 Å²	13	35.7 Å²	35.7	7%	0.068	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-27.2	178	-61.6	-179.2	0	0	0	112.5	I290 L294 M347 K348 L353 D354 L357 V361 Y365	I290-L351 HydrophobicContact CD1-CD2 4.48Å; I290-L351 HydrophobicContact CG2-CD2 3.55Å; L294-L351 HydrophobicContact CD1-CD1 3.67Å; M347-L351 HydrophobicContact CB-CD1 4.46Å; M347-L351 HydrophobicContact CB-CG 4.45Å; M347-L351 HydrophobicContact CE-CD1 4.36Å; M347-L351 WeakPolarHBondContact O-CG 3.27Å; M347-L351 PolarHBondContact O-N 2.91Å; M347-L351 VanDerWaalsContact O-N 3.09Å; K348-L351 PolarHBondContact O-N 3.08Å; L351-L353 PolarHBondContact O-N 3.22Å; L351-D354 PolarHBondContact O-N 3.28Å; L351-L357 HydrophobicContact CB-CD2 4.07Å; L351-L357 HydrophobicContact CD1-CD2 4.4Å; L351-L357 HydrophobicContact CD2-CD2 3.81Å; L351-L357 HydrophobicContact CG-CD2 4.31Å; L351-V361 HydrophobicContact CB-CG2 4.11Å; L351-Y365 HydrophobicContact CD1-CE2 4.09Å; L351-Y365 VanDerWaalsContact CD1-OH 3.3Å; L351-Y365 WeakPolarHBondContact CD1-OH 3.36Å
352	L	93.5	Very high	93.6	Very high	28 Å²	28	43.6 Å²	43.6	15%	0.147	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12	178.4	-152.6	70	0	0	0	112.4	Y35 V37 K348 D349 N350 A358 V361	Y35-L352 HydrophobicContact CD1-CD2 4.4Å; Y35-L352 HydrophobicContact CD2-CD2 3.22Å; Y35-L352 HydrophobicContact CD2-CG 3.75Å; Y35-L352 HydrophobicContact CE1-CD1 4.31Å; Y35-L352 HydrophobicContact CE1-CD2 4.45Å; Y35-L352 HydrophobicContact CE1-CG 4.23Å; Y35-L352 HydrophobicContact CE2-CB 4.25Å; Y35-L352 HydrophobicContact CE2-CD1 4.18Å; Y35-L352 HydrophobicContact CE2-CD2 3.32Å; Y35-L352 HydrophobicContact CE2-CG 3.24Å; Y35-L352 HydrophobicContact CG-CD2 3.83Å; Y35-L352 HydrophobicContact CG-CG 4.45Å; Y35-L352 PolarHBondContact OH-O 3.5Å; V37-L352 HydrophobicContact CG2-CB 4.16Å; V37-L352 HydrophobicContact CG2-CD2 3.88Å; V37-L352 HydrophobicContact CG2-CG 4.37Å; K348-L352 WeakPolarHBondContact O-CB 3.2Å; K348-L352 PolarHBondContact O-N 2.75Å; D349-L352 PolarHBondContact O-N 3.17Å; N350-L352 PolarHBondContact O-N 3Å; L352-A358 HydrophobicContact CD1-CB 4.21Å; L352-A358 VanDerWaalsContact O-CB 3.3Å; L352-A358 WeakPolarHBondContact O-CB 3.29Å; L352-V361 HydrophobicContact CD1-CB 4.08Å; L352-V361 HydrophobicContact CD1-CG1 4.27Å; L352-V361 HydrophobicContact CD1-CG2 4.19Å
353	L	92.6	Very high	93.6	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.2	171.8	-63.6	-175.4	0	0	0	113.8	V37 P40 L42 F62 I63 H66 C67 N350 L351	V37-L353 HydrophobicContact CB-CD2 3.84Å; V37-L353 HydrophobicContact CB-CG 4.38Å; V37-L353 HydrophobicContact CG1-CD1 4.49Å; V37-L353 HydrophobicContact CG1-CD2 4.33Å; V37-L353 HydrophobicContact CG1-CG 4.34Å; V37-L353 HydrophobicContact CG2-CD2 3.86Å; V37-L353 HydrophobicContact CG2-CG 4.41Å; P40-L353 HydrophobicContact CB-CD1 3.43Å; P40-L353 VanDerWaalsContact CB-CD1 3.43Å; P40-L353 HydrophobicContact CG-CD1 4Å; L42-L353 HydrophobicContact CB-CD1 4.44Å; L42-L353 HydrophobicContact CD2-CB 4.41Å; L42-L353 HydrophobicContact CD2-CD1 3.97Å; F62-L353 WeakPolarHBondContact CD1-O 3.48Å; I63-L353 HydrophobicContact CG1-CB 4.41Å; H66-L353 HydrophobicContact CB-CD2 4.24Å; C67-L353 HydrophobicContact CB-CD1 4.36Å; C67-L353 HydrophobicContact CB-CD2 3.8Å; N350-L353 PolarHBondContact O-N 2.85Å; N350-L353 VanDerWaalsContact O-N 3.16Å; L351-L353 PolarHBondContact O-N 3.22Å
354	D	94	Very high	93.6	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.037	19%	0.19	C	C	.	.	S	Bend	trans	-86.9	125.4	176.9	-178.5	-72.3	0	0	0	111.1	Y47 R59 Y291 L351 Y356 L357 A358	Y47-D354 PolarHBondContact OH-OD2 3.47Å; R59-D354 IonicContact CZ-OD2 2.84Å; R59-D354 IonicContact NH1-OD2 2.72Å; R59-D354 PolarHBondContact NH1-OD2 3.48Å; R59-D354 IonicContact NH2-OD2 3.91Å; Y291-D354 PolarHBondContact OH-OD1 3.21Å; Y291-D354 PolarHBondContact OH-OD2 3.45Å; L351-D354 PolarHBondContact O-N 3.28Å; D354-Y356 VanDerWaalsContact C-N 3.34Å; D354-Y356 PolarHBondContact O-N 3.45Å; D354-Y356 PolarHBondContact OD1-N 3.29Å; D354-L357 HydrophobicContact CB-CB 4.01Å; D354-L357 PolarHBondContact O-N 2.99Å; D354-L357 WeakPolarHBondContact OD1-CB 3.25Å; D354-L357 PolarHBondContact OD1-N 3.42Å; D354-A358 WeakPolarHBondContact O-CB 3.32Å; D354-A358 PolarHBondContact O-N 2.72Å
355	M	92.9	Very high	93.7	Very high	31 Å²	31	39.9 Å²	39.9	15%	0.153	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-42.5	-173.4	-175.4	175.2	83.1	0	0	114.3	M55 E58 R59 F62	M55-M355 HydrophobicContact SD-CE 3.73Å; E58-M355 HydrophobicContact CB-CE 4.41Å; E58-M355 HydrophobicContact CB-SD 3.79Å; R59-M355 HydrophobicContact CG-CB 4.2Å; R59-M355 HydrophobicContact CG-CE 4.35Å; R59-M355 HydrophobicContact CG-SD 4.31Å; F62-M355 HydrophobicContact CB-CB 4.19Å; F62-M355 HydrophobicContact CB-CG 4.26Å; F62-M355 HydrophobicContact CD1-CB 4.2Å; F62-M355 HydrophobicContact CD2-CB 4.19Å; F62-M355 HydrophobicContact CD2-CG 3.9Å; F62-M355 HydrophobicContact CE2-CG 4.47Å; F62-M355 HydrophobicContact CG-CB 3.92Å; F62-M355 HydrophobicContact CG-CG 4.06Å
356	Y	93.9	Very high	93.8	Very high	20 Å²	20	39.4 Å²	39.4	8%	0.078	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-30.3	-176.9	-65.5	-63.4	0	0	0	112.2	M55 V210 W215 L254 D354 H360	M55-Y356 HydrophobicContact CE-CE2 3.86Å; M55-Y356 WeakPolarHBondContact CE-OH 3.42Å; M55-Y356 HydrophobicContact SD-CE2 3.7Å; V210-Y356 WeakPolarHBondContact CG1-OH 3.39Å; W215-Y356 HydrophobicContact CH2-CD1 4.33Å; W215-Y356 AromaticContact CH2-CE1 3.79Å; W215-Y356 HydrophobicContact CH2-CE1 3.79Å; W215-Y356 HydrophobicContact CZ2-CE1 4.36Å; L254-Y356 HydrophobicContact CD1-CD1 4.23Å; L254-Y356 HydrophobicContact CD1-CD2 3.8Å; L254-Y356 HydrophobicContact CD1-CE2 4.33Å; L254-Y356 HydrophobicContact CD1-CG 3.73Å; L254-Y356 HydrophobicContact CD2-CD2 4.26Å; L254-Y356 HydrophobicContact CD2-CE2 3.95Å; D354-Y356 VanDerWaalsContact C-N 3.34Å; D354-Y356 PolarHBondContact O-N 3.45Å; D354-Y356 PolarHBondContact OD1-N 3.29Å; Y356-H360 PolarHBondContact O-CD2 3.2Å
357	L	94.6	Very high	93.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-33.9	-175.1	-168.6	64.9	0	0	0	113	I290 Y291 L294 L351 D354 P359 H360 V361 L364	I290-L357 HydrophobicContact CG2-CD2 3.78Å; Y291-L357 HydrophobicContact CD1-CB 4.34Å; Y291-L357 HydrophobicContact CD1-CD1 4Å; Y291-L357 HydrophobicContact CD1-CD2 4.05Å; Y291-L357 HydrophobicContact CD1-CG 4.37Å; Y291-L357 HydrophobicContact CE1-CB 3.72Å; Y291-L357 HydrophobicContact CE1-CD1 4.24Å; Y291-L357 HydrophobicContact CE1-CD2 3.99Å; Y291-L357 HydrophobicContact CE1-CG 4.2Å; L294-L357 HydrophobicContact CD1-CD2 4Å; L351-L357 HydrophobicContact CB-CD2 4.07Å; L351-L357 HydrophobicContact CD1-CD2 4.4Å; L351-L357 HydrophobicContact CD2-CD2 3.81Å; L351-L357 HydrophobicContact CG-CD2 4.31Å; D354-L357 HydrophobicContact CB-CB 4.01Å; D354-L357 PolarHBondContact O-N 2.99Å; D354-L357 WeakPolarHBondContact OD1-CB 3.25Å; D354-L357 PolarHBondContact OD1-N 3.42Å; L357-P359 VanDerWaalsContact C-CD 3.46Å; L357-H360 WeakPolarHBondContact O-CA 3.26Å; L357-H360 WeakPolarHBondContact O-CB 3.26Å; L357-H360 PolarHBondContact O-N 2.81Å; L357-V361 HydrophobicContact CG-CG2 4.34Å; L357-V361 PolarHBondContact O-N 3.39Å; L357-L364 HydrophobicContact CD1-CD1 3.98Å
358	A	93.6	Very high	94.1	Very high	5 Å²	5	37 Å²	37	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-52.8	-44	-172.5	0	0	0	0	0	114.5	Y35 F62 L352 D354 H360 V361	Y35-A358 WeakPolarHBondContact OH-CB 3.21Å; F62-A358 HydrophobicContact CE1-CB 4.21Å; F62-A358 HydrophobicContact CZ-CB 3.99Å; L352-A358 HydrophobicContact CD1-CB 4.21Å; L352-A358 VanDerWaalsContact O-CB 3.3Å; L352-A358 WeakPolarHBondContact O-CB 3.29Å; D354-A358 WeakPolarHBondContact O-CB 3.32Å; D354-A358 PolarHBondContact O-N 2.72Å; A358-H360 PolarHBondContact O-N 2.96Å; A358-H360 VanDerWaalsContact O-N 3.11Å; A358-V361 PolarHBondContact O-N 2.87Å
359	P	94.3	Very high	94.2	Very high	64 Å²	64	35.2 Å²	35.2	42%	0.416	17%	0.174	S	C	.	.	H	α-helix	trans	-61.6	-21.8	176.6	-22.7	34.8	0	0	0	114	L357	L357-P359 VanDerWaalsContact C-CD 3.46Å
360	H	95.6	Very high	94.4	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-97.8	-15.2	-176.9	-54.9	-65	0	0	0	113.5	L257 Y262 Y356 L357 A358 R362 T363 L364	L257-H360 PolarHBondContact O-CE1 3.38Å; L257-H360 PolarHBondContact O-NE2 3Å; Y262-H360 HydrophobicContact CE1-CB 3.97Å; Y262-H360 AromaticContact CE1-CG 3.92Å; Y262-H360 AromaticContact CE1-ND1 3.73Å; Y262-H360 AromaticContact CZ-ND1 3.91Å; Y262-H360 PolarHBondContact OH-ND1 2.99Å; Y356-H360 PolarHBondContact O-CD2 3.2Å; L357-H360 WeakPolarHBondContact O-CA 3.26Å; L357-H360 WeakPolarHBondContact O-CB 3.26Å; L357-H360 PolarHBondContact O-N 2.81Å; A358-H360 PolarHBondContact O-N 2.96Å; A358-H360 VanDerWaalsContact O-N 3.11Å; H360-R362 VanDerWaalsContact C-N 3.34Å; H360-R362 PolarHBondContact O-N 2.93Å; H360-T363 PolarHBondContact O-N 3.45Å; H360-L364 HydrophobicContact CB-CD1 3.97Å; H360-L364 HydrophobicContact CB-CG 4.37Å; H360-L364 WeakPolarHBondContact O-CG 3.15Å; H360-L364 PolarHBondContact O-N 3.21Å
361	V	94.9	Very high	94.5	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-51.9	-50.9	-175.3	170	0	0	0	0	111.2	K348 L351 L352 L357 A358 T363 L364 Y365	K348-V361 HydrophobicContact CG-CG1 4.06Å; L351-V361 HydrophobicContact CB-CG2 4.11Å; L352-V361 HydrophobicContact CD1-CB 4.08Å; L352-V361 HydrophobicContact CD1-CG1 4.27Å; L352-V361 HydrophobicContact CD1-CG2 4.19Å; L357-V361 HydrophobicContact CG-CG2 4.34Å; L357-V361 PolarHBondContact O-N 3.39Å; A358-V361 PolarHBondContact O-N 2.87Å; V361-T363 VanDerWaalsContact C-N 3.34Å; V361-T363 PolarHBondContact O-N 2.93Å; V361-L364 PolarHBondContact O-N 3.38Å; V361-Y365 HydrophobicContact CG1-CD2 3.84Å; V361-Y365 HydrophobicContact CG1-CE2 3.78Å; V361-Y365 HydrophobicContact CG1-CG 4.39Å; V361-Y365 WeakPolarHBondContact O-CB 3.41Å; V361-Y365 WeakPolarHBondContact O-CD2 3.49Å; V361-Y365 PolarHBondContact O-N 3.35Å
362	R	93.9	Very high	94.6	Very high	175 Å²	175	34.1 Å²	34.1	66%	0.66	16%	0.163	S	C	*	.	H	α-helix	trans	-57.6	-45.4	179.2	-177.4	177	178.4	176.9	-2.7	112.5	D32 H360 T366	D32-R362 IonicContact OD2-NH1 3.2Å; D32-R362 PolarHBondContact OD2-NH1 3.02Å; H360-R362 VanDerWaalsContact C-N 3.34Å; H360-R362 PolarHBondContact O-N 2.93Å; R362-T366 WeakPolarHBondContact O-CB 3.45Å; R362-T366 PolarHBondContact O-N 3.28Å; R362-T366 VanDerWaalsContact O-N 3.12Å; R362-T366 PolarHBondContact O-OG1 3.34Å
363	T	95.6	Very high	94.6	Very high	50 Å²	50	32.8 Å²	32.8	31%	0.307	16%	0.156	S	C	.	.	H	α-helix	trans	-67.5	-47.3	-177.9	-57.4	0	0	0	0	111.1	Y262 H360 V361 T366 Q367	Y262-T363 HydrophobicContact CE2-CG2 3.67Å; H360-T363 PolarHBondContact O-N 3.45Å; V361-T363 VanDerWaalsContact C-N 3.34Å; V361-T363 PolarHBondContact O-N 2.93Å; T363-T366 PolarHBondContact O-N 3.28Å; T363-Q367 WeakPolarHBondContact O-CG 3.42Å; T363-Q367 PolarHBondContact O-N 2.93Å
364	L	96.5	Very high	94.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-45.4	179.6	-72.6	169.3	0	0	0	111.4	Y262 L294 A298 L357 H360 V361 T366 Q367 I368	Y262-L364 HydrophobicContact CD1-CD2 3.71Å; Y262-L364 HydrophobicContact CD1-CG 4.32Å; Y262-L364 HydrophobicContact CD2-CD2 4.26Å; Y262-L364 HydrophobicContact CE1-CD2 4.09Å; Y262-L364 HydrophobicContact CE1-CG 4.22Å; Y262-L364 HydrophobicContact CG-CD2 3.81Å; L294-L364 HydrophobicContact CB-CD1 4.45Å; A298-L364 HydrophobicContact CB-CD2 3.71Å; L357-L364 HydrophobicContact CD1-CD1 3.98Å; H360-L364 HydrophobicContact CB-CD1 3.97Å; H360-L364 HydrophobicContact CB-CG 4.37Å; H360-L364 WeakPolarHBondContact O-CG 3.15Å; H360-L364 PolarHBondContact O-N 3.21Å; V361-L364 PolarHBondContact O-N 3.38Å; L364-T366 PolarHBondContact O-N 3.09Å; L364-Q367 PolarHBondContact O-N 3.37Å; L364-I368 WeakPolarHBondContact O-CD1 3.33Å; L364-I368 VanDerWaalsContact O-CG1 3.22Å; L364-I368 WeakPolarHBondContact O-CG1 3.12Å; L364-I368 PolarHBondContact O-N 3.5Å
365	Y	96.1	Very high	94.6	Very high	24 Å²	24	36.8 Å²	36.8	9%	0.094	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-42.4	-179.4	-83.9	-127.8	0	0	0	111.6	L344 K348 L351 V361 I368 R369	L344-Y365 HydrophobicContact CD1-CE1 4.39Å; L344-Y365 HydrophobicContact CD1-CE2 4.24Å; L344-Y365 HydrophobicContact CD2-CD1 4.09Å; L344-Y365 HydrophobicContact CD2-CE1 4.11Å; L344-Y365 HydrophobicContact CD2-CG 4.38Å; L344-Y365 HydrophobicContact CG-CD1 4.12Å; L344-Y365 HydrophobicContact CG-CE1 3.61Å; L344-Y365 HydrophobicContact CG-CE2 4.28Å; L344-Y365 PolarHBondContact O-OH 3.29Å; K348-Y365 VanDerWaalsContact CA-OH 3.32Å; K348-Y365 WeakPolarHBondContact CA-OH 3.45Å; K348-Y365 HydrophobicContact CB-CE1 3.81Å; K348-Y365 HydrophobicContact CD-CD1 4.36Å; K348-Y365 HydrophobicContact CD-CE1 3.99Å; K348-Y365 HydrophobicContact CG-CD1 4.49Å; K348-Y365 HydrophobicContact CG-CE1 3.79Å; L351-Y365 HydrophobicContact CD1-CE2 4.09Å; L351-Y365 VanDerWaalsContact CD1-OH 3.3Å; L351-Y365 WeakPolarHBondContact CD1-OH 3.36Å; V361-Y365 HydrophobicContact CG1-CD2 3.84Å; V361-Y365 HydrophobicContact CG1-CE2 3.78Å; V361-Y365 HydrophobicContact CG1-CG 4.39Å; V361-Y365 WeakPolarHBondContact O-CB 3.41Å; V361-Y365 WeakPolarHBondContact O-CD2 3.49Å; V361-Y365 PolarHBondContact O-N 3.35Å; Y365-I368 PolarHBondContact O-N 2.92Å; Y365-R369 WeakPolarHBondContact O-CB 3.43Å; Y365-R369 PolarHBondContact O-N 3.38Å
366	T	94.4	Very high	94.7	Very high	72 Å²	72	37.2 Å²	37.2	44%	0.442	18%	0.176	S	C	.	.	H	α-helix	trans	-61.9	-45	175.7	-53.3	0	0	0	0	110.8	R362 T363 L364 R369 N370	R362-T366 WeakPolarHBondContact O-CB 3.45Å; R362-T366 PolarHBondContact O-N 3.28Å; R362-T366 VanDerWaalsContact O-N 3.12Å; R362-T366 PolarHBondContact O-OG1 3.34Å; T363-T366 PolarHBondContact O-N 3.28Å; L364-T366 PolarHBondContact O-N 3.09Å; T366-R369 PolarHBondContact O-N 3.2Å; T366-N370 WeakPolarHBondContact O-CB 3.24Å; T366-N370 PolarHBondContact O-N 3.05Å; T366-N370 PolarHBondContact O-OD1 2.96Å
367	Q	94.8	Very high	94.7	Very high	66 Å²	66	36.9 Å²	36.9	31%	0.308	18%	0.175	S	C	.	.	H	α-helix	trans	-64.2	-41.8	177.3	-75	-175.2	38.3	0	0	113	A298 T363 L364 R371	A298-Q367 HydrophobicContact CB-CB 4.1Å; T363-Q367 WeakPolarHBondContact O-CG 3.42Å; T363-Q367 PolarHBondContact O-N 2.93Å; L364-Q367 PolarHBondContact O-N 3.37Å; Q367-R371 VanDerWaalsContact O-CB 3.29Å; Q367-R371 WeakPolarHBondContact O-CB 3.36Å; Q367-R371 PolarHBondContact O-N 3.34Å
368	I	96.3	Very high	94.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-46.1	177.1	-67.8	161.7	0	0	0	110.1	L294 L297 A298 F332 L344 L364 Y365 R371 A372	L294-I368 HydrophobicContact CD2-CD1 4.17Å; L297-I368 HydrophobicContact CB-CD1 4.48Å; L297-I368 HydrophobicContact CB-CG1 4.41Å; L297-I368 HydrophobicContact CD2-CD1 4.09Å; L297-I368 HydrophobicContact CD2-CG1 4.3Å; L297-I368 HydrophobicContact CD2-CG2 4Å; L297-I368 HydrophobicContact CG-CD1 4.4Å; L297-I368 HydrophobicContact CG-CG1 4.17Å; L297-I368 HydrophobicContact CG-CG2 4.19Å; A298-I368 HydrophobicContact CB-CD1 4.39Å; A298-I368 HydrophobicContact CB-CG1 3.79Å; F332-I368 HydrophobicContact CE2-CG2 4.23Å; L344-I368 HydrophobicContact CD2-CB 4.46Å; L344-I368 HydrophobicContact CD2-CD1 4.2Å; L344-I368 HydrophobicContact CD2-CG2 3.98Å; L364-I368 WeakPolarHBondContact O-CD1 3.33Å; L364-I368 VanDerWaalsContact O-CG1 3.22Å; L364-I368 WeakPolarHBondContact O-CG1 3.12Å; L364-I368 PolarHBondContact O-N 3.5Å; Y365-I368 PolarHBondContact O-N 2.92Å; I368-R371 PolarHBondContact O-N 2.89Å; I368-A372 WeakPolarHBondContact O-CB 3.4Å; I368-A372 PolarHBondContact O-N 2.82Å
369	R	95.6	Very high	94.5	Very high	49 Å²	49	46 Å²	46	19%	0.185	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-47.8	179	-174.5	174.1	176.8	88.8	1.9	111.9	Y365 T366 R371 A372 L373 F392 E402	Y365-R369 WeakPolarHBondContact O-CB 3.43Å; Y365-R369 PolarHBondContact O-N 3.38Å; T366-R369 PolarHBondContact O-N 3.2Å; R369-R371 VanDerWaalsContact C-N 3.31Å; R369-R371 PolarHBondContact O-N 3.46Å; R369-A372 WeakPolarHBondContact O-CB 3.48Å; R369-A372 PolarHBondContact O-N 2.91Å; R369-L373 HydrophobicContact CG-CD1 4.27Å; R369-L373 WeakPolarHBondContact O-CG 3.49Å; R369-L373 PolarHBondContact O-N 2.86Å; R369-F392 PolarHBondContact NH1-O 3.35Å; R369-F392 VanDerWaalsContact NH1-O 3.08Å; R369-E402 IonicContact CZ-OE1 2.66Å; R369-E402 IonicContact CZ-OE2 3.69Å; R369-E402 IonicContact NE-OE1 3.21Å; R369-E402 PolarHBondContact NE-OE1 3.35Å; R369-E402 IonicContact NE-OE2 3.61Å; R369-E402 PolarHBondContact NE-OE2 2.91Å; R369-E402 IonicContact NH2-OE1 3.58Å; R369-E402 PolarHBondContact NH2-OE1 3.2Å; R369-E402 IonicContact NH2-OE2 3.73Å; R369-E402 PolarHBondContact NH2-OE2 2.95Å
370	N	94.1	Very high	94.5	Very high	35 Å²	35	48.2 Å²	48.2	19%	0.187	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-43.3	177.2	-71.9	1	0	0	0	111.4	T366 L373 I374 L406	T366-N370 WeakPolarHBondContact O-CB 3.24Å; T366-N370 PolarHBondContact O-N 3.05Å; T366-N370 PolarHBondContact O-OD1 2.96Å; N370-L373 PolarHBondContact O-N 3.13Å; N370-I374 WeakPolarHBondContact O-CD1 3.44Å; N370-I374 VanDerWaalsContact O-CG1 3.25Å; N370-I374 WeakPolarHBondContact O-CG1 3.5Å; N370-I374 PolarHBondContact O-N 3.46Å; N370-L406 HydrophobicContact CB-CD2 3.85Å
371	R	94.4	Very high	94.4	Very high	70 Å²	70	52.6 Å²	52.6	26%	0.264	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-41.6	177.3	-169.6	179.9	-65.8	-91.3	-13	112.3	A298 T299 F300 F332 Q367 I368 R369 L373 I374 Q375	A298-R371 PolarHBondContact O-NE 3.09Å; A298-R371 PolarHBondContact O-NH2 3.45Å; T299-R371 VanDerWaalsContact C-CZ 3.48Å; T299-R371 VanDerWaalsContact CA-NH2 3.32Å; T299-R371 PolarHBondContact O-NH1 3.07Å; T299-R371 PolarHBondContact O-NH2 3.34Å; T299-R371 VanDerWaalsContact O-NH2 3.13Å; F300-R371 VanDerWaalsContact C-NH1 3.31Å; F300-R371 PolarHBondContact O-NH1 3.1Å; F332-R371 HydrophobicContact CZ-CB 4.33Å; F332-R371 HydrophobicContact CZ-CG 4.03Å; Q367-R371 VanDerWaalsContact O-CB 3.29Å; Q367-R371 WeakPolarHBondContact O-CB 3.36Å; Q367-R371 PolarHBondContact O-N 3.34Å; I368-R371 PolarHBondContact O-N 2.89Å; R369-R371 VanDerWaalsContact C-N 3.31Å; R369-R371 PolarHBondContact O-N 3.46Å; R371-L373 VanDerWaalsContact C-N 3.33Å; R371-L373 PolarHBondContact O-N 3.15Å; R371-I374 PolarHBondContact O-N 3.37Å; R371-Q375 WeakPolarHBondContact O-CB 3.33Å; R371-Q375 PolarHBondContact O-N 2.94Å
372	A	94.8	Very high	94.4	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-43.5	174.4	0	0	0	0	0	111.5	F332 Y337 I368 R369 Q375 Y376 F392	F332-A372 HydrophobicContact CE2-CB 3.77Å; F332-A372 HydrophobicContact CZ-CB 4.43Å; Y337-A372 HydrophobicContact CD1-CB 3.61Å; Y337-A372 HydrophobicContact CE1-CB 3.9Å; Y337-A372 HydrophobicContact CG-CB 4.34Å; I368-A372 WeakPolarHBondContact O-CB 3.4Å; I368-A372 PolarHBondContact O-N 2.82Å; R369-A372 WeakPolarHBondContact O-CB 3.48Å; R369-A372 PolarHBondContact O-N 2.91Å; A372-Q375 PolarHBondContact O-N 3.36Å; A372-Y376 VanDerWaalsContact O-CB 3.27Å; A372-Y376 WeakPolarHBondContact O-CB 3.45Å; A372-Y376 PolarHBondContact O-N 2.82Å; A372-F392 HydrophobicContact CB-CE1 3.64Å; A372-F392 HydrophobicContact CB-CZ 4.09Å
373	L	94.5	Very high	94.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-46.6	177.7	-71.2	162.5	0	0	0	111.8	R369 N370 R371 Y376 F377 M388 F392 L399 L406	R369-L373 HydrophobicContact CG-CD1 4.27Å; R369-L373 WeakPolarHBondContact O-CG 3.49Å; R369-L373 PolarHBondContact O-N 2.86Å; N370-L373 PolarHBondContact O-N 3.13Å; R371-L373 VanDerWaalsContact C-N 3.33Å; R371-L373 PolarHBondContact O-N 3.15Å; L373-Y376 PolarHBondContact O-N 2.84Å; L373-F377 PolarHBondContact O-N 2.68Å; L373-M388 HydrophobicContact CB-CE 4.45Å; L373-M388 HydrophobicContact CD2-CE 3.49Å; L373-M388 VanDerWaalsContact CD2-CE 3.49Å; L373-F392 HydrophobicContact CB-CE1 4.42Å; L373-F392 HydrophobicContact CB-CZ 4.36Å; L373-F392 HydrophobicContact CD2-CD1 3.69Å; L373-F392 HydrophobicContact CD2-CD2 3.81Å; L373-F392 HydrophobicContact CD2-CE1 3.59Å; L373-F392 HydrophobicContact CD2-CE2 3.73Å; L373-F392 HydrophobicContact CD2-CG 3.82Å; L373-F392 HydrophobicContact CD2-CZ 3.63Å; L373-F392 HydrophobicContact CG-CD1 4.01Å; L373-F392 HydrophobicContact CG-CE1 3.62Å; L373-F392 HydrophobicContact CG-CZ 3.92Å; L373-L399 HydrophobicContact CD2-CD1 3.85Å; L373-L406 HydrophobicContact CB-CD1 3.87Å; L373-L406 HydrophobicContact CD1-CD1 3.58Å; L373-L406 HydrophobicContact CG-CD1 4.34Å
374	I	93	Very high	94.6	Very high	58 Å²	58	47.5 Å²	47.5	30%	0.297	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-47	177	-62.6	158.7	0	0	0	110.4	N370 R371 F377 S378 L411 I412	N370-I374 WeakPolarHBondContact O-CD1 3.44Å; N370-I374 VanDerWaalsContact O-CG1 3.25Å; N370-I374 WeakPolarHBondContact O-CG1 3.5Å; N370-I374 PolarHBondContact O-N 3.46Å; R371-I374 PolarHBondContact O-N 3.37Å; I374-F377 PolarHBondContact O-N 3.32Å; I374-S378 WeakPolarHBondContact O-CB 3.22Å; I374-S378 PolarHBondContact O-N 3.14Å; I374-L411 HydrophobicContact CD1-CB 3.93Å; I374-L411 HydrophobicContact CD1-CD1 4.4Å; I374-I412 HydrophobicContact CB-CG1 4.47Å; I374-I412 HydrophobicContact CG1-CD1 3.94Å; I374-I412 HydrophobicContact CG1-CG1 3.65Å
375	Q	92.8	Very high	94.5	Very high	35 Å²	35	47.4 Å²	47.4	16%	0.164	25%	0.253	C	S	.	.	H	α-helix	trans	-68.4	-35.5	-178.6	-168.1	179.6	-56.5	0	0	112.3	Y337 R371 A372	Y337-Q375 VanDerWaalsContact OH-CG 3.32Å; Y337-Q375 WeakPolarHBondContact OH-CG 3.43Å; Y337-Q375 PolarHBondContact OH-NE2 2.73Å; Y337-Q375 VanDerWaalsContact OH-NE2 3.1Å; R371-Q375 WeakPolarHBondContact O-CB 3.33Å; R371-Q375 PolarHBondContact O-N 2.94Å; A372-Q375 PolarHBondContact O-N 3.36Å
376	Y	94.4	Very high	94.5	Very high	39 Å²	39	51.3 Å²	51.3	15%	0.153	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-43.4	174.1	180	-91.1	0	0	0	111.3	Y337 A372 L373 P379 Y380 M388 A391 F392	Y337-Y376 AromaticContact CD2-CD2 3.67Å; Y337-Y376 HydrophobicContact CD2-CD2 3.67Å; Y337-Y376 HydrophobicContact CD2-CG 4.36Å; Y337-Y376 AromaticContact CE2-CD2 3.66Å; Y337-Y376 HydrophobicContact CE2-CD2 3.66Å; Y337-Y376 HydrophobicContact CE2-CG 4.18Å; A372-Y376 VanDerWaalsContact O-CB 3.27Å; A372-Y376 WeakPolarHBondContact O-CB 3.45Å; A372-Y376 PolarHBondContact O-N 2.82Å; L373-Y376 PolarHBondContact O-N 2.84Å; Y376-P379 WeakPolarHBondContact O-CD 3.29Å; Y376-Y380 HydrophobicContact CE1-CE2 4.47Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.43Å; Y376-Y380 WeakPolarHBondContact O-CE2 3.37Å; Y376-M388 HydrophobicContact CD1-CE 3.97Å; Y376-M388 HydrophobicContact CD1-CG 3.92Å; Y376-M388 HydrophobicContact CD1-SD 4.01Å; Y376-M388 HydrophobicContact CE1-CB 3.95Å; Y376-M388 HydrophobicContact CE1-CG 3.66Å; Y376-M388 HydrophobicContact CE1-SD 4.03Å; Y376-A391 HydrophobicContact CE2-CB 4.08Å; Y376-F392 HydrophobicContact CD1-CE2 4.14Å; Y376-F392 HydrophobicContact CD2-CE2 4.1Å; Y376-F392 AromaticContact CG-CE2 3.77Å; Y376-F392 HydrophobicContact CG-CE2 3.77Å; Y376-F392 HydrophobicContact CG-CZ 4.27Å
377	F	94.4	Very high	94.6	Very high	13 Å²	13	56.7 Å²	56.7	6%	0.057	28%	0.284	C	S	.	.	H	α-helix	trans	-79.7	-27.7	-176.6	-175.2	-112.2	0	0	0	113.9	L373 I374 P379 Y380 A383 I412 A414 L423 A425	L373-F377 PolarHBondContact O-N 2.68Å; I374-F377 PolarHBondContact O-N 3.32Å; F377-P379 VanDerWaalsContact C-CD 3.44Å; F377-P379 VanDerWaalsContact O-N 3.13Å; F377-Y380 PolarHBondContact O-N 3.43Å; F377-A383 HydrophobicContact CD2-CB 3.98Å; F377-A383 HydrophobicContact CE2-CB 4.02Å; F377-I412 HydrophobicContact CD1-CG2 3.86Å; F377-I412 HydrophobicContact CE1-CG2 4.11Å; F377-A414 HydrophobicContact CE1-CB 3.78Å; F377-A414 HydrophobicContact CZ-CB 3.96Å; F377-L423 HydrophobicContact CD1-CD2 4.45Å; F377-L423 HydrophobicContact CD2-CD2 3.53Å; F377-L423 HydrophobicContact CD2-CG 4.22Å; F377-L423 HydrophobicContact CE1-CD2 4.47Å; F377-L423 HydrophobicContact CE2-CB 4.27Å; F377-L423 HydrophobicContact CE2-CD2 3.55Å; F377-L423 HydrophobicContact CE2-CG 3.7Å; F377-L423 HydrophobicContact CG-CD2 4Å; F377-L423 HydrophobicContact CZ-CD2 4.04Å; F377-L423 HydrophobicContact CZ-CG 3.98Å; F377-A425 HydrophobicContact CE1-CB 4.17Å; F377-A425 HydrophobicContact CZ-CB 3.89Å
378	S	91.4	Very high	94.6	Very high	97 Å²	97	53.5 Å²	53.5	68%	0.678	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.4	-43.7	-177.1	-176.8	0	0	0	0	116.3	I374 Y380	I374-S378 WeakPolarHBondContact O-CB 3.22Å; I374-S378 PolarHBondContact O-N 3.14Å; S378-Y380 VanDerWaalsContact C-N 3.33Å; S378-Y380 PolarHBondContact O-N 3.27Å
379	P	93.2	Very high	94.6	Very high	101 Å²	101	53.6 Å²	53.6	66%	0.656	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.2	178.4	32.2	-35.9	0	0	0	115	Y376 F377	Y376-P379 WeakPolarHBondContact O-CD 3.29Å; F377-P379 VanDerWaalsContact C-CD 3.44Å; F377-P379 VanDerWaalsContact O-N 3.13Å
380	Y	93.7	Very high	94.5	Very high	111 Å²	111	54.7 Å²	54.7	44%	0.435	29%	0.289	S	S	.	.			trans	-107.9	133.9	-174.6	-62.2	-83.6	0	0	0	112.3	Y376 F377 S378 A383	Y376-Y380 HydrophobicContact CE1-CE2 4.47Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.43Å; Y376-Y380 WeakPolarHBondContact O-CE2 3.37Å; F377-Y380 PolarHBondContact O-N 3.43Å; S378-Y380 VanDerWaalsContact C-N 3.33Å; S378-Y380 PolarHBondContact O-N 3.27Å; Y380-A383 HydrophobicContact CG-CB 4.48Å
381	V	94	Very high	94.6	Very high	103 Å²	103	54.1 Å²	54.1	62%	0.624	29%	0.289	S	S	*	.	S	Bend	trans	-83	-26.9	165.8	67.1	0	0	0	0	112	A425	V381-A425 HydrophobicContact CG2-CB 4.32Å; V381-A425 WeakPolarHBondContact O-CB 3.48Å; V381-A425 PolarHBondContact O-N 3.06Å
382	S	94.9	Very high	94.6	Very high	50 Å²	50	50.8 Å²	50.8	35%	0.35	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	125.9	-179.2	179.8	0	0	0	0	108	I422 L423 Y424	S382-I422 VanDerWaalsContact OG-CG2 3.28Å; S382-I422 WeakPolarHBondContact OG-CG2 3.37Å; S382-L423 CarbonylContact C-O 3.43Å; S382-L423 WeakPolarHBondContact CA-O 3.35Å; S382-Y424 VanDerWaalsContact OG-CE1 3.28Å; S382-Y424 WeakPolarHBondContact OG-CE1 3.48Å
383	A	95.9	Very high	94.6	Very high	6 Å²	6	55.1 Å²	55.1	5%	0.05	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136	-178.1	0	0	0	0	0	111.4	F377 Y380 L423	F377-A383 HydrophobicContact CD2-CB 3.98Å; F377-A383 HydrophobicContact CE2-CB 4.02Å; Y380-A383 HydrophobicContact CG-CB 4.48Å; A383-L423 PolarHBondContact N-O 3.01Å; A383-L423 PolarHBondContact O-N 3.21Å
384	D	96.8	Very high	94.7	Very high	65 Å²	65	56.9 Å²	56.9	35%	0.348	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.9	174.7	-177.1	-21	0	0	0	110.1	H386 R387 M388	D384-H386 VanDerWaalsContact C-N 3.27Å; D384-H386 PolarHBondContact O-N 3.3Å; D384-H386 WeakPolarHBondContact OD1-CB 3.4Å; D384-H386 IonicContact OD1-CG 2.79Å; D384-H386 PolarHBondContact OD1-N 3.48Å; D384-H386 IonicContact OD1-ND1 3.43Å; D384-H386 PolarHBondContact OD1-ND1 3.26Å; D384-R387 HydrophobicContact CB-CG 4.37Å; D384-R387 PolarHBondContact O-N 3.14Å; D384-M388 PolarHBondContact O-N 3.3Å; D384-M388 VanDerWaalsContact O-N 3.12Å
385	M	95.4	Very high	94.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-24.4	-177.1	-64.6	178.2	65.9	0	0	113	M388 A389 V396 L399 E400 L403 V416 K421 L423	M385-M388 PolarHBondContact O-N 3.44Å; M385-A389 WeakPolarHBondContact O-CB 3.33Å; M385-A389 PolarHBondContact O-N 3.47Å; M385-V396 HydrophobicContact CB-CG1 4.18Å; M385-V396 HydrophobicContact CE-CG1 4.38Å; M385-L399 HydrophobicContact CB-CD2 4.35Å; M385-L399 WeakPolarHBondContact O-CD2 3.46Å; M385-E400 HydrophobicContact CE-CB 3.73Å; M385-E400 HydrophobicContact CE-CG 4.13Å; M385-L403 HydrophobicContact CE-CD1 4.09Å; M385-V416 HydrophobicContact CE-CG1 4.25Å; M385-V416 HydrophobicContact SD-CG1 3.84Å; M385-K421 HydrophobicContact CB-CB 4.33Å; M385-K421 VanDerWaalsContact CB-O 3.25Å; M385-K421 WeakPolarHBondContact CB-O 3.39Å; M385-K421 VanDerWaalsContact CG-O 3.3Å; M385-K421 WeakPolarHBondContact CG-O 3.19Å; M385-K421 PolarHBondContact N-O 3.42Å; M385-K421 HydrophobicContact SD-CB 4.43Å; M385-L423 HydrophobicContact CG-CB 4.42Å
386	H	96.4	Very high	95	Very high	105 Å²	105	58.3 Å²	58.3	49%	0.486	32%	0.324	S	S	.	.	H	α-helix	trans	-67.7	-44.3	176.8	-61.1	85.8	0	0	0	111.1	D384 M388 A389 A390	D384-H386 VanDerWaalsContact C-N 3.27Å; D384-H386 PolarHBondContact O-N 3.3Å; D384-H386 WeakPolarHBondContact OD1-CB 3.4Å; D384-H386 IonicContact OD1-CG 2.79Å; D384-H386 PolarHBondContact OD1-N 3.48Å; D384-H386 IonicContact OD1-ND1 3.43Å; D384-H386 PolarHBondContact OD1-ND1 3.26Å; H386-M388 VanDerWaalsContact C-N 3.35Å; H386-A389 PolarHBondContact O-N 2.78Å; H386-A390 PolarHBondContact O-N 3Å; H386-A390 VanDerWaalsContact O-N 3.1Å
387	R	95.1	Very high	95.1	Very high	185 Å²	185	59.5 Å²	59.5	70%	0.698	34%	0.342	S	S	*	.	H	α-helix	trans	-67.8	-39.1	177.1	-65.3	-174.2	-179.6	-167	-0.9	111.3	D384 A391	D384-R387 HydrophobicContact CB-CG 4.37Å; D384-R387 PolarHBondContact O-N 3.14Å; R387-A391 WeakPolarHBondContact O-CB 3.42Å; R387-A391 PolarHBondContact O-N 3.43Å
388	M	95.5	Very high	95.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64.4	-45.4	175.6	-169.3	167.5	-179.8	0	0	110.8	L373 Y376 D384 M385 H386 A390 A391 F392 L399 L403 L423	L373-M388 HydrophobicContact CB-CE 4.45Å; L373-M388 HydrophobicContact CD2-CE 3.49Å; L373-M388 VanDerWaalsContact CD2-CE 3.49Å; Y376-M388 HydrophobicContact CD1-CE 3.97Å; Y376-M388 HydrophobicContact CD1-CG 3.92Å; Y376-M388 HydrophobicContact CD1-SD 4.01Å; Y376-M388 HydrophobicContact CE1-CB 3.95Å; Y376-M388 HydrophobicContact CE1-CG 3.66Å; Y376-M388 HydrophobicContact CE1-SD 4.03Å; D384-M388 PolarHBondContact O-N 3.3Å; D384-M388 VanDerWaalsContact O-N 3.12Å; M385-M388 PolarHBondContact O-N 3.44Å; H386-M388 VanDerWaalsContact C-N 3.35Å; M388-A390 VanDerWaalsContact C-N 3.33Å; M388-A390 PolarHBondContact O-N 3.28Å; M388-A391 WeakPolarHBondContact O-CB 3.21Å; M388-A391 PolarHBondContact O-N 2.97Å; M388-F392 HydrophobicContact CE-CE2 4.33Å; M388-F392 HydrophobicContact CG-CD2 4.05Å; M388-F392 HydrophobicContact CG-CE2 4.21Å; M388-F392 VanDerWaalsContact O-CD2 3.31Å; M388-F392 WeakPolarHBondContact O-CD2 3.3Å; M388-F392 PolarHBondContact O-N 3.46Å; M388-F392 VanDerWaalsContact O-N 3.11Å; M388-L399 HydrophobicContact CB-CD2 3.75Å; M388-L399 HydrophobicContact CE-CD1 4.5Å; M388-L399 HydrophobicContact CG-CD1 4.35Å; M388-L399 HydrophobicContact CG-CD2 3.74Å; M388-L399 HydrophobicContact SD-CD2 4.26Å; M388-L403 HydrophobicContact CE-CD2 3.9Å; M388-L403 HydrophobicContact SD-CD1 4.44Å; M388-L423 HydrophobicContact SD-CD2 4.34Å
389	A	95.9	Very high	95.3	Very high	3 Å²	3	55.9 Å²	55.9	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-43.2	178.3	0	0	0	0	0	111.9	M385 H386 A391 F392 N393 T394 V396 L399	M385-A389 WeakPolarHBondContact O-CB 3.33Å; M385-A389 PolarHBondContact O-N 3.47Å; H386-A389 PolarHBondContact O-N 2.78Å; A389-A391 VanDerWaalsContact C-N 3.33Å; A389-A391 PolarHBondContact O-N 3.21Å; A389-F392 CarbonylContact O-C 3.54Å; A389-F392 PolarHBondContact O-N 3.03Å; A389-N393 PolarHBondContact O-N 3.24Å; A389-N393 VanDerWaalsContact O-N 3.17Å; A389-T394 CarbonylContact C-O 3.56Å; A389-T394 HydrophobicContact CB-CG2 4.33Å; A389-T394 PolarHBondContact O-N 2.94Å; A389-V396 HydrophobicContact CB-CG2 3.93Å; A389-L399 HydrophobicContact CB-CB 4.47Å; A389-L399 HydrophobicContact CB-CD2 3.97Å
390	A	94.8	Very high	95.4	Very high	71 Å²	71	53 Å²	53	59%	0.587	30%	0.298	S	S	*	.	H	α-helix	trans	-62.1	-37.2	174	0	0	0	0	0	112.9	H386 M388 F392	H386-A390 PolarHBondContact O-N 3Å; H386-A390 VanDerWaalsContact O-N 3.1Å; M388-A390 VanDerWaalsContact C-N 3.33Å; M388-A390 PolarHBondContact O-N 3.28Å; A390-F392 VanDerWaalsContact C-N 3.27Å; A390-F392 PolarHBondContact O-N 3.1Å
391	A	94.6	Very high	95.5	Very high	23 Å²	23	53.2 Å²	53.2	19%	0.19	31%	0.307	C	S	.	.	H	α-helix	trans	-71.6	-19.7	177.8	0	0	0	0	0	113.8	Y337 A338 Y376 R387 M388 A389	Y337-A391 CarbonylContact C-O 3.57Å; A338-A391 WeakPolarHBondContact CA-O 3.26Å; A338-A391 WeakPolarHBondContact CB-O 3.16Å; A338-A391 PolarHBondContact N-O 2.97Å; Y376-A391 HydrophobicContact CE2-CB 4.08Å; R387-A391 WeakPolarHBondContact O-CB 3.42Å; R387-A391 PolarHBondContact O-N 3.43Å; M388-A391 WeakPolarHBondContact O-CB 3.21Å; M388-A391 PolarHBondContact O-N 2.97Å; A389-A391 VanDerWaalsContact C-N 3.33Å; A389-A391 PolarHBondContact O-N 3.21Å
392	F	95.5	Very high	95.5	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	10.7	-178.5	-78.7	-88.3	0	0	0	113.8	Y337 L341 R369 A372 L373 Y376 M388 A389 A390 T394	Y337-F392 HydrophobicContact CD2-CZ 4.25Å; Y337-F392 HydrophobicContact CG-CZ 4.18Å; L341-F392 HydrophobicContact CD1-CB 4.45Å; L341-F392 HydrophobicContact CD1-CD1 3.56Å; L341-F392 HydrophobicContact CD1-CE1 4.16Å; L341-F392 HydrophobicContact CD1-CG 4.35Å; R369-F392 PolarHBondContact NH1-O 3.35Å; R369-F392 VanDerWaalsContact NH1-O 3.08Å; A372-F392 HydrophobicContact CB-CE1 3.64Å; A372-F392 HydrophobicContact CB-CZ 4.09Å; L373-F392 HydrophobicContact CB-CE1 4.42Å; L373-F392 HydrophobicContact CB-CZ 4.36Å; L373-F392 HydrophobicContact CD2-CD1 3.69Å; L373-F392 HydrophobicContact CD2-CD2 3.81Å; L373-F392 HydrophobicContact CD2-CE1 3.59Å; L373-F392 HydrophobicContact CD2-CE2 3.73Å; L373-F392 HydrophobicContact CD2-CG 3.82Å; L373-F392 HydrophobicContact CD2-CZ 3.63Å; L373-F392 HydrophobicContact CG-CD1 4.01Å; L373-F392 HydrophobicContact CG-CE1 3.62Å; L373-F392 HydrophobicContact CG-CZ 3.92Å; Y376-F392 HydrophobicContact CD1-CE2 4.14Å; Y376-F392 HydrophobicContact CD2-CE2 4.1Å; Y376-F392 AromaticContact CG-CE2 3.77Å; Y376-F392 HydrophobicContact CG-CE2 3.77Å; Y376-F392 HydrophobicContact CG-CZ 4.27Å; M388-F392 HydrophobicContact CE-CE2 4.33Å; M388-F392 HydrophobicContact CG-CD2 4.05Å; M388-F392 HydrophobicContact CG-CE2 4.21Å; M388-F392 VanDerWaalsContact O-CD2 3.31Å; M388-F392 WeakPolarHBondContact O-CD2 3.3Å; M388-F392 PolarHBondContact O-N 3.46Å; M388-F392 VanDerWaalsContact O-N 3.11Å; A389-F392 CarbonylContact O-C 3.54Å; A389-F392 PolarHBondContact O-N 3.03Å; A390-F392 VanDerWaalsContact C-N 3.27Å; A390-F392 PolarHBondContact O-N 3.1Å; F392-T394 HydrophobicContact CB-CG2 4.12Å; F392-T394 PolarHBondContact O-N 3.31Å
393	N	94.6	Very high	95.4	Very high	92 Å²	92	48.4 Å²	48.4	49%	0.492	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	39.8	-178.8	-53.9	-36	0	0	0	112.7	A338 A389	A338-N393 PolarHBondContact O-ND2 3.4Å; A389-N393 PolarHBondContact O-N 3.24Å; A389-N393 VanDerWaalsContact O-N 3.17Å
394	T	95.8	Very high	95.3	Very high	37 Å²	37	51 Å²	51	23%	0.227	29%	0.287	C	S	.	.	S	Bend	trans	-131.2	172.7	-177.3	-168	0	0	0	0	111.8	A389 F392 A398 L399	A389-T394 CarbonylContact C-O 3.56Å; A389-T394 HydrophobicContact CB-CG2 4.33Å; A389-T394 PolarHBondContact O-N 2.94Å; F392-T394 HydrophobicContact CB-CG2 4.12Å; F392-T394 PolarHBondContact O-N 3.31Å; T394-A398 WeakPolarHBondContact OG1-CB 3.31Å; T394-L399 HydrophobicContact CG2-CB 3.92Å; T394-L399 HydrophobicContact CG2-CD1 4.29Å
395	T	96.9	Very high	95.2	Very high	90 Å²	90	52.6 Å²	52.6	55%	0.552	29%	0.293	S	S	*	.			trans	-87.3	156.4	172.8	68.6	0	0	0	0	110.6	A397 A398 L399	T395-A397 VanDerWaalsContact C-N 3.26Å; T395-A397 PolarHBondContact O-N 3.35Å; T395-A398 PolarHBondContact O-N 2.85Å; T395-A398 WeakPolarHBondContact OG1-CB 3.25Å; T395-A398 PolarHBondContact OG1-N 2.99Å; T395-L399 WeakPolarHBondContact O-CB 3.43Å; T395-L399 PolarHBondContact O-N 3.35Å
396	V	96.3	Very high	95.1	Very high	32 Å²	32	52.7 Å²	52.7	19%	0.194	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-37.1	179.3	-179.4	0	0	0	0	111.7	M385 A389 L399 E400 K421	M385-V396 HydrophobicContact CB-CG1 4.18Å; M385-V396 HydrophobicContact CE-CG1 4.38Å; A389-V396 HydrophobicContact CB-CG2 3.93Å; V396-L399 PolarHBondContact O-N 3.39Å; V396-E400 WeakPolarHBondContact O-CB 3.35Å; V396-E400 PolarHBondContact O-N 3.44Å; V396-K421 HydrophobicContact CG1-CD 4.04Å; V396-K421 HydrophobicContact CG1-CG 4.31Å
397	A	95.3	Very high	94.9	Very high	64 Å²	64	49.6 Å²	49.6	53%	0.529	28%	0.28	S	S	.	.	H	α-helix	trans	-65.1	-48.6	177.4	0	0	0	0	0	111.6	T395 L399 E400 D401	T395-A397 VanDerWaalsContact C-N 3.26Å; T395-A397 PolarHBondContact O-N 3.35Å; A397-L399 VanDerWaalsContact C-N 3.31Å; A397-L399 PolarHBondContact O-N 3.03Å; A397-E400 WeakPolarHBondContact O-CB 3.49Å; A397-E400 PolarHBondContact O-N 2.93Å; A397-E400 VanDerWaalsContact O-N 3.12Å; A397-D401 PolarHBondContact O-N 3.38Å; A397-D401 VanDerWaalsContact O-N 3.17Å
398	A	95	Very high	94.8	Very high	34 Å²	34	47.1 Å²	47.1	28%	0.281	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-37	176.9	0	0	0	0	0	112.1	T394 T395 E400 D401 E402	T394-A398 WeakPolarHBondContact OG1-CB 3.31Å; T395-A398 PolarHBondContact O-N 2.85Å; T395-A398 WeakPolarHBondContact OG1-CB 3.25Å; T395-A398 PolarHBondContact OG1-N 2.99Å; A398-E400 VanDerWaalsContact C-N 3.31Å; A398-E400 PolarHBondContact O-N 3.47Å; A398-D401 PolarHBondContact O-N 3.04Å; A398-E402 WeakPolarHBondContact O-CG 3.49Å; A398-E402 PolarHBondContact O-N 2.86Å
399	L	95.8	Very high	94.6	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-37.7	173.7	-176.4	68.4	0	0	0	112	L373 M385 M388 A389 T394 T395 V396 A397 E402 L403	L373-L399 HydrophobicContact CD2-CD1 3.85Å; M385-L399 HydrophobicContact CB-CD2 4.35Å; M385-L399 WeakPolarHBondContact O-CD2 3.46Å; M388-L399 HydrophobicContact CB-CD2 3.75Å; M388-L399 HydrophobicContact CE-CD1 4.5Å; M388-L399 HydrophobicContact CG-CD1 4.35Å; M388-L399 HydrophobicContact CG-CD2 3.74Å; M388-L399 HydrophobicContact SD-CD2 4.26Å; A389-L399 HydrophobicContact CB-CB 4.47Å; A389-L399 HydrophobicContact CB-CD2 3.97Å; T394-L399 HydrophobicContact CG2-CB 3.92Å; T394-L399 HydrophobicContact CG2-CD1 4.29Å; T395-L399 WeakPolarHBondContact O-CB 3.43Å; T395-L399 PolarHBondContact O-N 3.35Å; V396-L399 PolarHBondContact O-N 3.39Å; A397-L399 VanDerWaalsContact C-N 3.31Å; A397-L399 PolarHBondContact O-N 3.03Å; L399-E402 PolarHBondContact O-N 3.42Å; L399-L403 HydrophobicContact CD1-CD1 4.31Å; L399-L403 HydrophobicContact CD1-CG 4.24Å; L399-L403 HydrophobicContact CD2-CD1 4.29Å; L399-L403 HydrophobicContact CG-CD1 3.86Å; L399-L403 HydrophobicContact CG-CG 4.22Å; L399-L403 WeakPolarHBondContact O-CB 3.44Å; L399-L403 VanDerWaalsContact O-CG 3.24Å; L399-L403 WeakPolarHBondContact O-CG 3.37Å; L399-L403 PolarHBondContact O-N 3.47Å
400	E	95.6	Very high	94.1	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.187	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-42.8	177.2	-171.3	165.5	-179	0	0	111.6	M385 V396 A397 A398 T404 V416 S418 K421	M385-E400 HydrophobicContact CE-CB 3.73Å; M385-E400 HydrophobicContact CE-CG 4.13Å; V396-E400 WeakPolarHBondContact O-CB 3.35Å; V396-E400 PolarHBondContact O-N 3.44Å; A397-E400 WeakPolarHBondContact O-CB 3.49Å; A397-E400 PolarHBondContact O-N 2.93Å; A397-E400 VanDerWaalsContact O-N 3.12Å; A398-E400 VanDerWaalsContact C-N 3.31Å; A398-E400 PolarHBondContact O-N 3.47Å; E400-T404 WeakPolarHBondContact O-CB 3.27Å; E400-T404 PolarHBondContact O-N 3.1Å; E400-T404 PolarHBondContact O-OG1 2.87Å; E400-V416 HydrophobicContact CG-CG1 4.18Å; E400-S418 WeakPolarHBondContact OE1-CB 3.25Å; E400-K421 IonicContact OE1-NZ 3.71Å; E400-K421 IonicContact OE2-NZ 3.02Å; E400-K421 PolarHBondContact OE2-NZ 2.9Å
401	D	94.9	Very high	93.7	Very high	117 Å²	117	55.7 Å²	55.7	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-65.1	-45.8	175	-64.7	-31.7	0	0	0	111.5	A397 A398 L403 T404 Q405	A397-D401 PolarHBondContact O-N 3.38Å; A397-D401 VanDerWaalsContact O-N 3.17Å; A398-D401 PolarHBondContact O-N 3.04Å; D401-L403 PolarHBondContact O-N 3.43Å; D401-T404 WeakPolarHBondContact O-CB 3.43Å; D401-T404 PolarHBondContact O-N 3.04Å; D401-Q405 PolarHBondContact O-N 3.04Å
402	E	93.9	Very high	93.5	Very high	51 Å²	51	55 Å²	55	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-45.7	177.1	-74.6	178.5	-150.1	0	0	112.1	R369 A398 L399 T404 Q405 L406	R369-E402 IonicContact CZ-OE1 2.66Å; R369-E402 IonicContact CZ-OE2 3.69Å; R369-E402 IonicContact NE-OE1 3.21Å; R369-E402 PolarHBondContact NE-OE1 3.35Å; R369-E402 IonicContact NE-OE2 3.61Å; R369-E402 PolarHBondContact NE-OE2 2.91Å; R369-E402 IonicContact NH2-OE1 3.58Å; R369-E402 PolarHBondContact NH2-OE1 3.2Å; R369-E402 IonicContact NH2-OE2 3.73Å; R369-E402 PolarHBondContact NH2-OE2 2.95Å; A398-E402 WeakPolarHBondContact O-CG 3.49Å; A398-E402 PolarHBondContact O-N 2.86Å; L399-E402 PolarHBondContact O-N 3.42Å; E402-T404 VanDerWaalsContact C-N 3.33Å; E402-T404 PolarHBondContact O-N 3.42Å; E402-Q405 PolarHBondContact O-N 3.15Å; E402-L406 WeakPolarHBondContact O-CG 3.17Å; E402-L406 PolarHBondContact O-N 3.11Å; E402-L406 VanDerWaalsContact O-N 3.09Å
403	L	94.6	Very high	93.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.1	-37	177.6	-74	171.6	0	0	0	111.7	M385 M388 L399 D401 Q405 L406 I407 I412 V416 L423	M385-L403 HydrophobicContact CE-CD1 4.09Å; M388-L403 HydrophobicContact CE-CD2 3.9Å; M388-L403 HydrophobicContact SD-CD1 4.44Å; L399-L403 HydrophobicContact CD1-CD1 4.31Å; L399-L403 HydrophobicContact CD1-CG 4.24Å; L399-L403 HydrophobicContact CD2-CD1 4.29Å; L399-L403 HydrophobicContact CG-CD1 3.86Å; L399-L403 HydrophobicContact CG-CG 4.22Å; L399-L403 WeakPolarHBondContact O-CB 3.44Å; L399-L403 VanDerWaalsContact O-CG 3.24Å; L399-L403 WeakPolarHBondContact O-CG 3.37Å; L399-L403 PolarHBondContact O-N 3.47Å; D401-L403 PolarHBondContact O-N 3.43Å; L403-Q405 VanDerWaalsContact C-N 3.34Å; L403-Q405 PolarHBondContact O-N 3.22Å; L403-L406 PolarHBondContact O-N 2.99Å; L403-I407 WeakPolarHBondContact O-CB 3.33Å; L403-I407 WeakPolarHBondContact O-CD1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.43Å; L403-I407 PolarHBondContact O-N 3.22Å; L403-I412 HydrophobicContact CD2-CD1 4.25Å; L403-V416 HydrophobicContact CB-CG2 4.46Å; L403-L423 HydrophobicContact CD1-CD1 4.33Å; L403-L423 HydrophobicContact CD1-CD2 4Å; L403-L423 HydrophobicContact CD2-CD2 3.96Å
404	T	93.4	Very high	93.2	Very high	60 Å²	60	53.8 Å²	53.8	37%	0.368	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-46.6	176	-61.7	0	0	0	0	110.5	E400 D401 E402 L406 I407 L408	E400-T404 WeakPolarHBondContact O-CB 3.27Å; E400-T404 PolarHBondContact O-N 3.1Å; E400-T404 PolarHBondContact O-OG1 2.87Å; D401-T404 WeakPolarHBondContact O-CB 3.43Å; D401-T404 PolarHBondContact O-N 3.04Å; E402-T404 VanDerWaalsContact C-N 3.33Å; E402-T404 PolarHBondContact O-N 3.42Å; T404-L406 PolarHBondContact O-N 3.07Å; T404-I407 PolarHBondContact O-N 2.96Å; T404-L408 HydrophobicContact CG2-CD1 4.04Å; T404-L408 HydrophobicContact CG2-CG 4.43Å; T404-L408 WeakPolarHBondContact O-CB 3.34Å; T404-L408 VanDerWaalsContact O-CG 3.27Å; T404-L408 WeakPolarHBondContact O-CG 3.32Å; T404-L408 PolarHBondContact O-N 3.4Å
405	Q	93.4	Very high	93.2	Very high	100 Å²	100	58.1 Å²	58.1	47%	0.467	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-45.6	175.6	-173.4	62.9	26.8	0	0	111.9	D401 E402 L403 I407 L408 E409	D401-Q405 PolarHBondContact O-N 3.04Å; E402-Q405 PolarHBondContact O-N 3.15Å; L403-Q405 VanDerWaalsContact C-N 3.34Å; L403-Q405 PolarHBondContact O-N 3.22Å; Q405-I407 VanDerWaalsContact C-N 3.32Å; Q405-I407 PolarHBondContact O-N 3.3Å; Q405-L408 PolarHBondContact O-N 2.83Å; Q405-E409 PolarHBondContact NE2-OE1 3.35Å; Q405-E409 WeakPolarHBondContact O-CG 3.33Å; Q405-E409 PolarHBondContact O-N 3.5Å
406	L	93.2	Very high	93.1	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-33.2	178.6	-73.8	171.2	0	0	0	113.8	N370 L373 E402 L403 T404 G410 L411 I412	N370-L406 HydrophobicContact CB-CD2 3.85Å; L373-L406 HydrophobicContact CB-CD1 3.87Å; L373-L406 HydrophobicContact CD1-CD1 3.58Å; L373-L406 HydrophobicContact CG-CD1 4.34Å; E402-L406 WeakPolarHBondContact O-CG 3.17Å; E402-L406 PolarHBondContact O-N 3.11Å; E402-L406 VanDerWaalsContact O-N 3.09Å; L403-L406 PolarHBondContact O-N 2.99Å; T404-L406 PolarHBondContact O-N 3.07Å; L406-G410 PolarHBondContact O-N 2.95Å; L406-L411 HydrophobicContact CD2-CB 4.41Å; L406-L411 HydrophobicContact CD2-CD1 3.98Å; L406-L411 PolarHBondContact O-N 2.94Å; L406-L411 VanDerWaalsContact O-N 3.1Å; L406-I412 HydrophobicContact CB-CD1 4.02Å; L406-I412 HydrophobicContact CB-CG1 4.22Å; L406-I412 HydrophobicContact CD1-CD1 3.78Å; L406-I412 HydrophobicContact CG-CD1 4.46Å; L406-I412 PolarHBondContact O-N 3.37Å
407	I	93.6	Very high	93.1	Very high	40 Å²	40	56.8 Å²	56.8	21%	0.205	32%	0.32	C	S	.	.	H	α-helix	trans	-73.1	-40.8	175.2	-67.9	164	0	0	0	110.2	L403 T404 Q405 G410 I412 A414 V416 L423	L403-I407 WeakPolarHBondContact O-CB 3.33Å; L403-I407 WeakPolarHBondContact O-CD1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.43Å; L403-I407 PolarHBondContact O-N 3.22Å; T404-I407 PolarHBondContact O-N 2.96Å; Q405-I407 VanDerWaalsContact C-N 3.32Å; Q405-I407 PolarHBondContact O-N 3.3Å; I407-G410 PolarHBondContact O-N 3.14Å; I407-G410 VanDerWaalsContact O-N 3.07Å; I407-I412 HydrophobicContact CG1-CB 4.47Å; I407-A414 HydrophobicContact CD1-CB 4.31Å; I407-A414 HydrophobicContact CG1-CB 4.5Å; I407-V416 HydrophobicContact CD1-CG2 3.89Å; I407-L423 HydrophobicContact CD1-CD1 4.41Å
408	L	93.4	Very high	93	Very high	133 Å²	133	57 Å²	57	70%	0.696	32%	0.317	S	S	*	.	H	α-helix	trans	-64.2	-39.1	177.3	-72.1	172.2	0	0	0	112.2	T404 Q405 G410	T404-L408 HydrophobicContact CG2-CD1 4.04Å; T404-L408 HydrophobicContact CG2-CG 4.43Å; T404-L408 WeakPolarHBondContact O-CB 3.34Å; T404-L408 VanDerWaalsContact O-CG 3.27Å; T404-L408 WeakPolarHBondContact O-CG 3.32Å; T404-L408 PolarHBondContact O-N 3.4Å; Q405-L408 PolarHBondContact O-N 2.83Å; L408-G410 PolarHBondContact O-N 3.46Å
409	E	91.2	Very high	92.9	Very high	101 Å²	101	63.7 Å²	63.7	47%	0.472	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-10.3	173.7	-70.4	177.4	-167.4	0	0	113.2	Q405 L411	Q405-E409 PolarHBondContact NE2-OE1 3.35Å; Q405-E409 WeakPolarHBondContact O-CG 3.33Å; Q405-E409 PolarHBondContact O-N 3.5Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 HydrophobicContact CB-CD1 4.45Å; E409-L411 HydrophobicContact CB-CG 4.29Å; E409-L411 PolarHBondContact O-N 3.48Å
410	G	85.4	Confident	92.8	Very high	61 Å²	61	66.1 Å²	66.1	63%	0.629	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	13.4	177.7	0	0	0	0	0	114.6	L406 I407 L408	L406-G410 PolarHBondContact O-N 2.95Å; I407-G410 PolarHBondContact O-N 3.14Å; I407-G410 VanDerWaalsContact O-N 3.07Å; L408-G410 PolarHBondContact O-N 3.46Å
411	L	86.5	Confident	92.8	Very high	91 Å²	91	66.9 Å²	66.9	48%	0.476	36%	0.362	S	S	.	.	S	Bend	trans	-77.4	-28	177.9	-64.4	176.4	0	0	0	112.3	I374 L406 E409	I374-L411 HydrophobicContact CD1-CB 3.93Å; I374-L411 HydrophobicContact CD1-CD1 4.4Å; L406-L411 HydrophobicContact CD2-CB 4.41Å; L406-L411 HydrophobicContact CD2-CD1 3.98Å; L406-L411 PolarHBondContact O-N 2.94Å; L406-L411 VanDerWaalsContact O-N 3.1Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 HydrophobicContact CB-CD1 4.45Å; E409-L411 HydrophobicContact CB-CG 4.29Å; E409-L411 PolarHBondContact O-N 3.48Å
412	I	90	Very high	92.9	Very high	8 Å²	8	63.2 Å²	63.2	4%	0.041	34%	0.342	C	S	.	.	S	Bend	trans	-120.7	120.9	175.4	-62.8	-176.8	0	0	0	109.7	I374 F377 L403 L406 I407 A414	I374-I412 HydrophobicContact CB-CG1 4.47Å; I374-I412 HydrophobicContact CG1-CD1 3.94Å; I374-I412 HydrophobicContact CG1-CG1 3.65Å; F377-I412 HydrophobicContact CD1-CG2 3.86Å; F377-I412 HydrophobicContact CE1-CG2 4.11Å; L403-I412 HydrophobicContact CD2-CD1 4.25Å; L406-I412 HydrophobicContact CB-CD1 4.02Å; L406-I412 HydrophobicContact CB-CG1 4.22Å; L406-I412 HydrophobicContact CD1-CD1 3.78Å; L406-I412 HydrophobicContact CG-CD1 4.46Å; L406-I412 PolarHBondContact O-N 3.37Å; I407-I412 HydrophobicContact CG1-CB 4.47Å; I412-A414 HydrophobicContact CG2-CB 3.58Å; I412-A414 PolarHBondContact O-N 3.42Å
413	S	90.3	Very high	93	Very high	69 Å²	69	60.8 Å²	60.8	48%	0.483	33%	0.331	S	S	.	.			trans	-86	81.5	171	-169.6	0	0	0	0	110.2	R426	S413-R426 PolarHBondContact O-N 3.02Å; S413-R426 PolarHBondContact OG-O 3.25Å
414	A	93.9	Very high	93.1	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	172.2	179.9	0	0	0	0	0	113	F377 I407 I412 L423 Y424	F377-A414 HydrophobicContact CE1-CB 3.78Å; F377-A414 HydrophobicContact CZ-CB 3.96Å; I407-A414 HydrophobicContact CD1-CB 4.31Å; I407-A414 HydrophobicContact CG1-CB 4.5Å; I412-A414 HydrophobicContact CG2-CB 3.58Å; I412-A414 PolarHBondContact O-N 3.42Å; A414-L423 HydrophobicContact CB-CD1 3.58Å; A414-L423 HydrophobicContact CB-CD2 4.42Å; A414-L423 HydrophobicContact CB-CG 3.96Å; A414-Y424 CarbonylContact C-O 3.58Å; A414-Y424 WeakPolarHBondContact CA-O 3.33Å; A414-Y424 WeakPolarHBondContact CB-O 3.43Å
415	R	93.9	Very high	93.1	Very high	127 Å²	127	64 Å²	64	48%	0.479	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	129	171.5	-67.5	-64.7	-178.6	-89.6	4.7	108.7	Y424 R426	R415-Y424 PolarHBondContact N-O 2.87Å; R415-Y424 PolarHBondContact O-N 2.99Å; R415-R426 HydrophobicContact CG-CB 4.31Å
416	V	95.6	Very high	92.9	Very high	41 Å²	41	65.1 Å²	65.1	25%	0.248	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.9	175.3	-179.9	0	0	0	0	108.4	M385 E400 L403 I407 L423	M385-V416 HydrophobicContact CE-CG1 4.25Å; M385-V416 HydrophobicContact SD-CG1 3.84Å; E400-V416 HydrophobicContact CG-CG1 4.18Å; L403-V416 HydrophobicContact CB-CG2 4.46Å; I407-V416 HydrophobicContact CD1-CG2 3.89Å; V416-L423 HydrophobicContact CG2-CD1 3.74Å
417	D	95.4	Very high	92.4	Very high	54 Å²	54	71.6 Å²	71.6	29%	0.289	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	99.9	162	-179.8	-8.1	0	0	0	108.3	H419 S420 K421 I422 Y424	D417-H419 VanDerWaalsContact C-N 3.26Å; D417-H419 PolarHBondContact O-N 3.29Å; D417-H419 WeakPolarHBondContact OD1-CB 3.24Å; D417-H419 PolarHBondContact OD1-N 3.48Å; D417-S420 PolarHBondContact OD1-N 2.81Å; D417-S420 VanDerWaalsContact OD1-N 3.15Å; D417-S420 WeakPolarHBondContact OD2-CB 3.47Å; D417-S420 PolarHBondContact OD2-OG 3.36Å; D417-K421 WeakPolarHBondContact O-CA 3.37Å; D417-K421 PolarHBondContact O-N 3.41Å; D417-I422 WeakPolarHBondContact CB-O 3.34Å; D417-I422 PolarHBondContact N-O 3.05Å; D417-I422 PolarHBondContact O-N 3.4Å; D417-Y424 HydrophobicContact CB-CD2 4.14Å; D417-Y424 HydrophobicContact CB-CE2 3.87Å
418	S	93.6	Very high	91.8	Very high	67 Å²	67	73.9 Å²	73.9	47%	0.469	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.8	-177.9	63.4	0	0	0	0	113.4	E400 K421	E400-S418 WeakPolarHBondContact OE1-CB 3.25Å; S418-K421 WeakPolarHBondContact O-CD 3.31Å; S418-K421 WeakPolarHBondContact O-CE 3.38Å; S418-K421 PolarHBondContact O-NZ 3.44Å
419	H	94.1	Very high	91.5	Very high	176 Å²	176	71.6 Å²	71.6	82%	0.815	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-48.8	178.6	178.9	-152.7	0	0	0	110.8	D417	D417-H419 VanDerWaalsContact C-N 3.26Å; D417-H419 PolarHBondContact O-N 3.29Å; D417-H419 WeakPolarHBondContact OD1-CB 3.24Å; D417-H419 PolarHBondContact OD1-N 3.48Å
420	S	93.6	Very high	91.4	Very high	51 Å²	51	73.5 Å²	73.5	36%	0.357	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-9.7	178.4	68.6	0	0	0	0	114	D417	D417-S420 PolarHBondContact OD1-N 2.81Å; D417-S420 VanDerWaalsContact OD1-N 3.15Å; D417-S420 WeakPolarHBondContact OD2-CB 3.47Å; D417-S420 PolarHBondContact OD2-OG 3.36Å
421	K	95.9	Very high	91.8	Very high	55 Å²	55	78.8 Å²	78.8	24%	0.239	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	47.6	-173.7	-59	-58.1	-175.8	-165.3	0	112.2	M385 V396 E400 D417 S418	M385-K421 HydrophobicContact CB-CB 4.33Å; M385-K421 VanDerWaalsContact CB-O 3.25Å; M385-K421 WeakPolarHBondContact CB-O 3.39Å; M385-K421 VanDerWaalsContact CG-O 3.3Å; M385-K421 WeakPolarHBondContact CG-O 3.19Å; M385-K421 PolarHBondContact N-O 3.42Å; M385-K421 HydrophobicContact SD-CB 4.43Å; V396-K421 HydrophobicContact CG1-CD 4.04Å; V396-K421 HydrophobicContact CG1-CG 4.31Å; E400-K421 IonicContact OE1-NZ 3.71Å; E400-K421 IonicContact OE2-NZ 3.02Å; E400-K421 PolarHBondContact OE2-NZ 2.9Å; D417-K421 WeakPolarHBondContact O-CA 3.37Å; D417-K421 PolarHBondContact O-N 3.41Å; S418-K421 WeakPolarHBondContact O-CD 3.31Å; S418-K421 WeakPolarHBondContact O-CE 3.38Å; S418-K421 PolarHBondContact O-NZ 3.44Å
422	I	96.4	Very high	92.1	Very high	41 Å²	41	77.8 Å²	77.8	21%	0.21	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.3	177.7	-60.3	175.5	0	0	0	109.5	S382 D417 Y424	S382-I422 VanDerWaalsContact OG-CG2 3.28Å; S382-I422 WeakPolarHBondContact OG-CG2 3.37Å; D417-I422 WeakPolarHBondContact CB-O 3.34Å; D417-I422 PolarHBondContact N-O 3.05Å; D417-I422 PolarHBondContact O-N 3.4Å; I422-Y424 HydrophobicContact CB-CE2 3.9Å; I422-Y424 HydrophobicContact CG2-CD1 4.24Å; I422-Y424 HydrophobicContact CG2-CD2 4.13Å; I422-Y424 HydrophobicContact CG2-CE1 3.79Å; I422-Y424 HydrophobicContact CG2-CE2 3.68Å; I422-Y424 HydrophobicContact CG2-CG 4.39Å; I422-Y424 VanDerWaalsContact CG2-CZ 3.5Å
423	L	96.4	Very high	92.2	Very high	0 Å²	0	78.9 Å²	78.9	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	114.8	173.2	-176.2	68.3	0	0	0	109.5	F377 S382 A383 M385 M388 L403 I407 A414 V416	F377-L423 HydrophobicContact CD1-CD2 4.45Å; F377-L423 HydrophobicContact CD2-CD2 3.53Å; F377-L423 HydrophobicContact CD2-CG 4.22Å; F377-L423 HydrophobicContact CE1-CD2 4.47Å; F377-L423 HydrophobicContact CE2-CB 4.27Å; F377-L423 HydrophobicContact CE2-CD2 3.55Å; F377-L423 HydrophobicContact CE2-CG 3.7Å; F377-L423 HydrophobicContact CG-CD2 4Å; F377-L423 HydrophobicContact CZ-CD2 4.04Å; F377-L423 HydrophobicContact CZ-CG 3.98Å; S382-L423 CarbonylContact C-O 3.43Å; S382-L423 WeakPolarHBondContact CA-O 3.35Å; A383-L423 PolarHBondContact N-O 3.01Å; A383-L423 PolarHBondContact O-N 3.21Å; M385-L423 HydrophobicContact CG-CB 4.42Å; M388-L423 HydrophobicContact SD-CD2 4.34Å; L403-L423 HydrophobicContact CD1-CD1 4.33Å; L403-L423 HydrophobicContact CD1-CD2 4Å; L403-L423 HydrophobicContact CD2-CD2 3.96Å; I407-L423 HydrophobicContact CD1-CD1 4.41Å; A414-L423 HydrophobicContact CB-CD1 3.58Å; A414-L423 HydrophobicContact CB-CD2 4.42Å; A414-L423 HydrophobicContact CB-CG 3.96Å; V416-L423 HydrophobicContact CG2-CD1 3.74Å
424	Y	95.2	Very high	92.3	Very high	99 Å²	99	78.7 Å²	78.7	39%	0.388	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.3	178.2	-68.2	-73.9	0	0	0	111.4	S382 A414 R415 D417 I422 R426	S382-Y424 VanDerWaalsContact OG-CE1 3.28Å; S382-Y424 WeakPolarHBondContact OG-CE1 3.48Å; A414-Y424 CarbonylContact C-O 3.58Å; A414-Y424 WeakPolarHBondContact CA-O 3.33Å; A414-Y424 WeakPolarHBondContact CB-O 3.43Å; R415-Y424 PolarHBondContact N-O 2.87Å; R415-Y424 PolarHBondContact O-N 2.99Å; D417-Y424 HydrophobicContact CB-CD2 4.14Å; D417-Y424 HydrophobicContact CB-CE2 3.87Å; I422-Y424 HydrophobicContact CB-CE2 3.9Å; I422-Y424 HydrophobicContact CG2-CD1 4.24Å; I422-Y424 HydrophobicContact CG2-CD2 4.13Å; I422-Y424 HydrophobicContact CG2-CE1 3.79Å; I422-Y424 HydrophobicContact CG2-CE2 3.68Å; I422-Y424 HydrophobicContact CG2-CG 4.39Å; I422-Y424 VanDerWaalsContact CG2-CZ 3.5Å; Y424-R426 PolarHBondContact O-N 3.25Å
425	A	93.6	Very high	92.4	Very high	29 Å²	29	84.9 Å²	84.9	24%	0.24	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134.5	172.3	0	0	0	0	0	109.4	F377 V381	F377-A425 HydrophobicContact CE1-CB 4.17Å; F377-A425 HydrophobicContact CZ-CB 3.89Å; V381-A425 HydrophobicContact CG2-CB 4.32Å; V381-A425 WeakPolarHBondContact O-CB 3.48Å; V381-A425 PolarHBondContact O-N 3.06Å
426	R	90.1	Very high	92.4	Very high	123 Å²	123	85 Å²	85	46%	0.464	43%	0.428	S	S	.	.			trans	-95	104.1	177.2	-179.1	62.9	179.6	-168.6	2.8	108.8	S413 R415 Y424 V428	S413-R426 PolarHBondContact O-N 3.02Å; S413-R426 PolarHBondContact OG-O 3.25Å; R415-R426 HydrophobicContact CG-CB 4.31Å; Y424-R426 PolarHBondContact O-N 3.25Å; R426-V428 HydrophobicContact CG-CG2 4.15Å; R426-V428 PolarHBondContact O-N 3.22Å
427	D	82.8	Confident	92.4	Very high	137 Å²	137	89.9 Å²	89.9	73%	0.733	45%	0.447	S	S	*	.			trans	-79.7	117.5	165.8	-66.4	-35.4	0	0	0	109.3
428	V	81.5	Confident	92.5	Very high	88 Å²	88	90.8 Å²	90.8	53%	0.533	46%	0.457	S	S	.	.			trans	-96.3	130.6	172.6	-168	0	0	0	0	107.6	R426 Q430 T433	R426-V428 HydrophobicContact CG-CG2 4.15Å; R426-V428 PolarHBondContact O-N 3.22Å; V428-Q430 PolarHBondContact O-N 3.11Å; V428-T433 WeakPolarHBondContact CG1-OG1 3.4Å
429	D	87	Confident	92.6	Very high	86 Å²	86	93 Å²	93	46%	0.46	46%	0.463	S	S	.	.			trans	-61	113.9	174.2	173.6	28.7	0	0	0	110.1	R431 S432 T433	D429-R431 PolarHBondContact O-N 3.5Å; D429-R431 WeakPolarHBondContact OD1-CB 3.19Å; D429-R431 PolarHBondContact OD1-N 3.15Å; D429-R431 VanDerWaalsContact OD1-N 3.09Å; D429-S432 PolarHBondContact O-N 3.39Å; D429-S432 VanDerWaalsContact OD2-CB 3.26Å; D429-S432 WeakPolarHBondContact OD2-CB 3.48Å; D429-S432 PolarHBondContact OD2-N 3.09Å; D429-S432 PolarHBondContact OD2-OG 3.18Å; D429-T433 PolarHBondContact O-N 2.86Å; D429-T433 PolarHBondContact O-OG1 3.2Å
430	Q	88.8	Confident	92.8	Very high	140 Å²	140	89.4 Å²	89.4	65%	0.654	45%	0.449	S	S	*	.	H	α-helix	trans	-59.3	-34.9	-178.7	-173.8	61.1	48.4	0	0	111.1	V428 T434	V428-Q430 PolarHBondContact O-N 3.11Å; Q430-T434 PolarHBondContact NE2-OG1 2.91Å; Q430-T434 WeakPolarHBondContact O-CB 3.46Å; Q430-T434 PolarHBondContact O-N 3.27Å; Q430-T434 VanDerWaalsContact O-N 3.08Å; Q430-T434 PolarHBondContact O-OG1 2.76Å
431	R	92.4	Very high	92.9	Very high	173 Å²	173	92.9 Å²	92.9	65%	0.653	46%	0.462	S	S	*	.	H	α-helix	trans	-65.9	-59	178.4	-177.1	179	178.6	162.9	0	109.9	D429 T433 T434 F435	D429-R431 PolarHBondContact O-N 3.5Å; D429-R431 WeakPolarHBondContact OD1-CB 3.19Å; D429-R431 PolarHBondContact OD1-N 3.15Å; D429-R431 VanDerWaalsContact OD1-N 3.09Å; R431-T433 VanDerWaalsContact C-N 3.27Å; R431-T433 PolarHBondContact O-N 3.21Å; R431-T434 PolarHBondContact O-N 3.22Å; R431-F435 HydrophobicContact CG-CD2 3.61Å; R431-F435 HydrophobicContact CG-CE2 3.6Å; R431-F435 WeakPolarHBondContact O-CD2 3.28Å; R431-F435 PolarHBondContact O-N 3.33Å
432	S	92.8	Very high	93	Very high	69 Å²	69	91.6 Å²	91.6	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-52.7	-45.7	-179.7	-64.7	0	0	0	0	112.2	D429 T434 F435 E436	D429-S432 PolarHBondContact O-N 3.39Å; D429-S432 VanDerWaalsContact OD2-CB 3.26Å; D429-S432 WeakPolarHBondContact OD2-CB 3.48Å; D429-S432 PolarHBondContact OD2-N 3.09Å; D429-S432 PolarHBondContact OD2-OG 3.18Å; S432-T434 PolarHBondContact O-N 3.23Å; S432-F435 PolarHBondContact O-N 3Å; S432-E436 WeakPolarHBondContact O-CB 3.17Å; S432-E436 PolarHBondContact O-N 3.03Å
433	T	92.1	Very high	93.1	Very high	31 Å²	31	95.9 Å²	95.9	19%	0.19	48%	0.481	C	S	.	.	H	α-helix	trans	-60.6	-43.1	177.8	-52.4	0	0	0	0	112.5	V428 D429 R431 K437	V428-T433 WeakPolarHBondContact CG1-OG1 3.4Å; D429-T433 PolarHBondContact O-N 2.86Å; D429-T433 PolarHBondContact O-OG1 3.2Å; R431-T433 VanDerWaalsContact C-N 3.27Å; R431-T433 PolarHBondContact O-N 3.21Å; T433-K437 HydrophobicContact CG2-CD 4.15Å; T433-K437 WeakPolarHBondContact O-CB 3.11Å; T433-K437 VanDerWaalsContact O-CG 3.31Å; T433-K437 WeakPolarHBondContact O-CG 3.39Å; T433-K437 PolarHBondContact O-N 3.46Å
434	T	93.5	Very high	93.2	Very high	66 Å²	66	98.3 Å²	98.3	41%	0.405	49%	0.492	S	S	.	.	H	α-helix	trans	-68.5	-41.7	-179.3	-55.3	0	0	0	0	111.1	Q430 R431 S432 S438	Q430-T434 PolarHBondContact NE2-OG1 2.91Å; Q430-T434 WeakPolarHBondContact O-CB 3.46Å; Q430-T434 PolarHBondContact O-N 3.27Å; Q430-T434 VanDerWaalsContact O-N 3.08Å; Q430-T434 PolarHBondContact O-OG1 2.76Å; R431-T434 PolarHBondContact O-N 3.22Å; S432-T434 PolarHBondContact O-N 3.23Å; T434-S438 VanDerWaalsContact O-CB 3.28Å; T434-S438 WeakPolarHBondContact O-CB 3.36Å; T434-S438 PolarHBondContact O-N 2.83Å; T434-S438 PolarHBondContact O-OG 2.88Å
435	F	95.5	Very high	93.3	Very high	130 Å²	130	100.3 Å²	100.3	57%	0.57	50%	0.503	S	S	*	.	H	α-helix	trans	-63.8	-46.7	176.9	-89.5	-85.6	0	0	0	111.8	R431 S432 S438 L439	R431-F435 HydrophobicContact CG-CD2 3.61Å; R431-F435 HydrophobicContact CG-CE2 3.6Å; R431-F435 WeakPolarHBondContact O-CD2 3.28Å; R431-F435 PolarHBondContact O-N 3.33Å; S432-F435 PolarHBondContact O-N 3Å; F435-S438 PolarHBondContact O-N 3.5Å; F435-L439 WeakPolarHBondContact O-CB 3.32Å; F435-L439 PolarHBondContact O-N 2.91Å
436	E	94.8	Very high	93.5	Very high	128 Å²	128	104.5 Å²	104.5	60%	0.598	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-48.3	179.1	-173.4	174.4	-166.7	0	0	111.7	S432 S438 L439 L440	S432-E436 WeakPolarHBondContact O-CB 3.17Å; S432-E436 PolarHBondContact O-N 3.03Å; E436-S438 VanDerWaalsContact C-N 3.32Å; E436-S438 PolarHBondContact O-N 2.94Å; E436-L439 PolarHBondContact O-N 3.24Å; E436-L440 HydrophobicContact CG-CD1 4.2Å; E436-L440 WeakPolarHBondContact O-CG 3.35Å; E436-L440 PolarHBondContact O-N 3.39Å
437	K	95.1	Very high	93.8	Very high	145 Å²	145	106 Å²	106	63%	0.63	52%	0.523	S	S	*	.	H	α-helix	trans	-58.7	-43.7	176.2	-75.6	-179.7	-179.7	180	0	112	T433 L440 M441	T433-K437 HydrophobicContact CG2-CD 4.15Å; T433-K437 WeakPolarHBondContact O-CB 3.11Å; T433-K437 VanDerWaalsContact O-CG 3.31Å; T433-K437 WeakPolarHBondContact O-CG 3.39Å; T433-K437 PolarHBondContact O-N 3.46Å; K437-L440 PolarHBondContact O-N 2.95Å; K437-M441 WeakPolarHBondContact O-CB 3.44Å; K437-M441 PolarHBondContact O-N 2.83Å
438	S	96.7	Very high	94.5	Very high	73 Å²	73	106.5 Å²	106.5	51%	0.51	52%	0.515	S	S	.	.	H	α-helix	trans	-65.7	-40.3	179.3	-58.9	0	0	0	0	111.9	T434 F435 E436 M441 G442	T434-S438 VanDerWaalsContact O-CB 3.28Å; T434-S438 WeakPolarHBondContact O-CB 3.36Å; T434-S438 PolarHBondContact O-N 2.83Å; T434-S438 PolarHBondContact O-OG 2.88Å; F435-S438 PolarHBondContact O-N 3.5Å; E436-S438 VanDerWaalsContact C-N 3.32Å; E436-S438 PolarHBondContact O-N 2.94Å; S438-M441 PolarHBondContact O-N 2.96Å; S438-G442 PolarHBondContact O-N 3.36Å
439	L	97.2	Very high	95.3	Very high	113 Å²	113	104 Å²	104	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-67.7	-41.4	178.5	-170.5	66.9	0	0	0	111.9	F435 E436 G442 K443	F435-L439 WeakPolarHBondContact O-CB 3.32Å; F435-L439 PolarHBondContact O-N 2.91Å; E436-L439 PolarHBondContact O-N 3.24Å; L439-G442 PolarHBondContact O-N 2.9Å; L439-K443 PolarHBondContact O-N 3.46Å
440	L	97.3	Very high	95.8	Very high	101 Å²	101	106.2 Å²	106.2	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-62.8	-46.3	174.3	-72.8	171.7	0	0	0	111.4	E436 K437 G442 K443 E444	E436-L440 HydrophobicContact CG-CD1 4.2Å; E436-L440 WeakPolarHBondContact O-CG 3.35Å; E436-L440 PolarHBondContact O-N 3.39Å; K437-L440 PolarHBondContact O-N 2.95Å; L440-G442 VanDerWaalsContact C-N 3.3Å; L440-G442 PolarHBondContact O-N 3.36Å; L440-K443 PolarHBondContact O-N 2.62Å; L440-E444 WeakPolarHBondContact O-CB 3.27Å; L440-E444 PolarHBondContact O-N 3Å
441	M	97	Very high	96.2	Very high	124 Å²	124	102.1 Å²	102.1	61%	0.611	50%	0.499	S	S	*	.	H	α-helix	trans	-59.8	-41.4	175.6	-175.1	61.4	170.9	0	0	111.5	K437 S438 E444 F445	K437-M441 WeakPolarHBondContact O-CB 3.44Å; K437-M441 PolarHBondContact O-N 2.83Å; S438-M441 PolarHBondContact O-N 2.96Å; M441-E444 PolarHBondContact O-N 3.12Å; M441-F445 VanDerWaalsContact O-CB 3.29Å; M441-F445 WeakPolarHBondContact O-CB 3.39Å; M441-F445 PolarHBondContact O-N 3.44Å
442	G	98	Very high	96.4	Very high	28 Å²	28	100.6 Å²	100.6	29%	0.289	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-43.6	175.5	0	0	0	0	0	113.1	S438 L439 L440 F445 Q446	S438-G442 PolarHBondContact O-N 3.36Å; L439-G442 PolarHBondContact O-N 2.9Å; L440-G442 VanDerWaalsContact C-N 3.3Å; L440-G442 PolarHBondContact O-N 3.36Å; G442-F445 PolarHBondContact O-N 3.33Å; G442-Q446 WeakPolarHBondContact O-CG 3.46Å; G442-Q446 PolarHBondContact O-N 2.88Å
443	K	97.8	Very high	96.5	Very high	130 Å²	130	103.8 Å²	103.8	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-45.7	174.7	-77.8	-179.3	178.8	177.8	0	111.6	L439 L440 Q446 R447	L439-K443 PolarHBondContact O-N 3.46Å; L440-K443 PolarHBondContact O-N 2.62Å; K443-Q446 PolarHBondContact O-N 2.88Å; K443-R447 PolarHBondContact O-N 3.33Å
444	E	97.3	Very high	96.7	Very high	52 Å²	52	108.1 Å²	108.1	24%	0.243	53%	0.532	C	S	.	.	H	α-helix	trans	-67.1	-38.9	-179.4	-177.9	57	-164.4	0	0	111.8	L440 M441 R447 R448	L440-E444 WeakPolarHBondContact O-CB 3.27Å; L440-E444 PolarHBondContact O-N 3Å; M441-E444 PolarHBondContact O-N 3.12Å; E444-R447 PolarHBondContact O-N 3.1Å; E444-R447 IonicContact OE1-CZ 3.75Å; E444-R447 IonicContact OE1-NE 3.57Å; E444-R447 IonicContact OE1-NH2 2.79Å; E444-R447 PolarHBondContact OE1-NH2 3.19Å; E444-R447 IonicContact OE2-CZ 3.04Å; E444-R447 IonicContact OE2-NE 2.83Å; E444-R447 PolarHBondContact OE2-NE 3.37Å; E444-R447 IonicContact OE2-NH2 3.58Å; E444-R447 PolarHBondContact OE2-NH2 3.21Å; E444-R448 WeakPolarHBondContact O-CG 3.45Å; E444-R448 PolarHBondContact O-N 2.85Å; E444-R448 IonicContact OE1-CZ 3.72Å; E444-R448 IonicContact OE1-NE 3.47Å; E444-R448 PolarHBondContact OE1-NE 2.74Å; E444-R448 IonicContact OE1-NH2 3.67Å; E444-R448 PolarHBondContact OE1-NH2 2.77Å
445	F	97.8	Very high	96.8	Very high	141 Å²	141	112.5 Å²	112.5	62%	0.618	54%	0.541	S	S	*	.	H	α-helix	trans	-59	-48.9	172.5	176	-98.1	0	0	0	111.9	M441 G442 R447 R448 A449	M441-F445 VanDerWaalsContact O-CB 3.29Å; M441-F445 WeakPolarHBondContact O-CB 3.39Å; M441-F445 PolarHBondContact O-N 3.44Å; G442-F445 PolarHBondContact O-N 3.33Å; F445-R447 VanDerWaalsContact C-N 3.3Å; F445-R447 PolarHBondContact O-N 3.21Å; F445-R448 PolarHBondContact O-N 2.84Å; F445-A449 WeakPolarHBondContact O-CB 3.29Å; F445-A449 PolarHBondContact O-N 3.17Å
446	Q	97.5	Very high	96.7	Very high	117 Å²	117	109 Å²	109	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-40.2	177.4	-71.5	177.3	27.7	0	0	112	G442 K443 A449 K450	G442-Q446 WeakPolarHBondContact O-CG 3.46Å; G442-Q446 PolarHBondContact O-N 2.88Å; K443-Q446 PolarHBondContact O-N 2.88Å; Q446-A449 PolarHBondContact O-N 2.8Å; Q446-K450 WeakPolarHBondContact O-CB 3.14Å; Q446-K450 WeakPolarHBondContact O-CG 3.4Å; Q446-K450 PolarHBondContact O-N 3.5Å
447	R	97.8	Very high	96.8	Very high	153 Å²	153	104.4 Å²	104.4	58%	0.577	52%	0.52	S	S	*	.	H	α-helix	trans	-61.8	-47.8	176.5	-169	-173.5	73.3	91.7	1.5	111.2	K443 E444 F445 K450 A451	K443-R447 PolarHBondContact O-N 3.33Å; E444-R447 PolarHBondContact O-N 3.1Å; E444-R447 IonicContact OE1-CZ 3.75Å; E444-R447 IonicContact OE1-NE 3.57Å; E444-R447 IonicContact OE1-NH2 2.79Å; E444-R447 PolarHBondContact OE1-NH2 3.19Å; E444-R447 IonicContact OE2-CZ 3.04Å; E444-R447 IonicContact OE2-NE 2.83Å; E444-R447 PolarHBondContact OE2-NE 3.37Å; E444-R447 IonicContact OE2-NH2 3.58Å; E444-R447 PolarHBondContact OE2-NH2 3.21Å; F445-R447 VanDerWaalsContact C-N 3.3Å; F445-R447 PolarHBondContact O-N 3.21Å; R447-K450 PolarHBondContact O-N 2.86Å; R447-A451 WeakPolarHBondContact O-CB 3.28Å; R447-A451 PolarHBondContact O-N 2.95Å
448	R	97.3	Very high	96.8	Very high	148 Å²	148	99.8 Å²	99.8	56%	0.558	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-42.3	178.2	-71.3	175.8	-171.2	-178	3.1	112.1	E444 F445 A451 M452	E444-R448 WeakPolarHBondContact O-CG 3.45Å; E444-R448 PolarHBondContact O-N 2.85Å; E444-R448 IonicContact OE1-CZ 3.72Å; E444-R448 IonicContact OE1-NE 3.47Å; E444-R448 PolarHBondContact OE1-NE 2.74Å; E444-R448 IonicContact OE1-NH2 3.67Å; E444-R448 PolarHBondContact OE1-NH2 2.77Å; F445-R448 PolarHBondContact O-N 2.84Å; R448-A451 PolarHBondContact O-N 3.24Å; R448-M452 WeakPolarHBondContact O-CB 3.39Å; R448-M452 PolarHBondContact O-N 3.1Å
449	A	97.4	Very high	96.6	Very high	37 Å²	37	101 Å²	101	31%	0.306	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-48.3	176.6	0	0	0	0	0	111.5	F445 Q446 A451 M452 M453	F445-A449 WeakPolarHBondContact O-CB 3.29Å; F445-A449 PolarHBondContact O-N 3.17Å; Q446-A449 PolarHBondContact O-N 2.8Å; A449-A451 PolarHBondContact O-N 3.37Å; A449-M452 PolarHBondContact O-N 3.05Å; A449-M453 VanDerWaalsContact O-CG 3.31Å; A449-M453 WeakPolarHBondContact O-CG 3.36Å; A449-M453 PolarHBondContact O-N 3.45Å
450	K	97.3	Very high	96.4	Very high	132 Å²	132	105.2 Å²	105.2	57%	0.574	51%	0.512	S	S	*	.	H	α-helix	trans	-61.6	-42.9	176.3	-71	175.1	-177.1	179	0	112	Q446 R447 M452 M453 L454	Q446-K450 WeakPolarHBondContact O-CB 3.14Å; Q446-K450 WeakPolarHBondContact O-CG 3.4Å; Q446-K450 PolarHBondContact O-N 3.5Å; R447-K450 PolarHBondContact O-N 2.86Å; K450-M452 VanDerWaalsContact C-N 3.34Å; K450-M452 PolarHBondContact O-N 2.89Å; K450-M453 PolarHBondContact O-N 3.42Å; K450-L454 WeakPolarHBondContact O-CG 3.28Å; K450-L454 PolarHBondContact O-N 2.94Å
451	A	97.2	Very high	96.3	Very high	53 Å²	53	105.3 Å²	105.3	44%	0.438	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176.2	0	0	0	0	0	112	R447 R448 A449 L454 R455	R447-A451 WeakPolarHBondContact O-CB 3.28Å; R447-A451 PolarHBondContact O-N 2.95Å; R448-A451 PolarHBondContact O-N 3.24Å; A449-A451 PolarHBondContact O-N 3.37Å; A451-L454 PolarHBondContact O-N 3.33Å; A451-R455 WeakPolarHBondContact O-CB 3.32Å; A451-R455 PolarHBondContact O-N 3.28Å
452	M	96.8	Very high	96	Very high	142 Å²	142	106.3 Å²	106.3	70%	0.7	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-42.9	175.6	-176.6	-173.8	-69.6	0	0	111.9	R448 A449 K450 L454 R455 A456	R448-M452 WeakPolarHBondContact O-CB 3.39Å; R448-M452 PolarHBondContact O-N 3.1Å; A449-M452 PolarHBondContact O-N 3.05Å; K450-M452 VanDerWaalsContact C-N 3.34Å; K450-M452 PolarHBondContact O-N 2.89Å; M452-L454 PolarHBondContact O-N 2.85Å; M452-R455 WeakPolarHBondContact O-CB 3.4Å; M452-R455 PolarHBondContact O-N 2.77Å; M452-A456 PolarHBondContact O-N 2.88Å
453	M	95.8	Very high	95.7	Very high	136 Å²	136	110.1 Å²	110.1	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-61	-43.8	176.2	-70.2	173	72.4	0	0	111.7	A449 K450 R455 A456 A457	A449-M453 VanDerWaalsContact O-CG 3.31Å; A449-M453 WeakPolarHBondContact O-CG 3.36Å; A449-M453 PolarHBondContact O-N 3.45Å; K450-M453 PolarHBondContact O-N 3.42Å; M453-R455 VanDerWaalsContact C-N 3.33Å; M453-A456 PolarHBondContact O-N 3.33Å; M453-A457 WeakPolarHBondContact O-CB 3.48Å; M453-A457 PolarHBondContact O-N 2.87Å
454	L	96.1	Very high	95.3	Very high	121 Å²	121	109.6 Å²	109.6	63%	0.634	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-41	174.7	-69.8	173.4	0	0	0	111.3	K450 A451 M452 A456 A457 V458	K450-L454 WeakPolarHBondContact O-CG 3.28Å; K450-L454 PolarHBondContact O-N 2.94Å; A451-L454 PolarHBondContact O-N 3.33Å; M452-L454 PolarHBondContact O-N 2.85Å; L454-A456 PolarHBondContact O-N 3.48Å; L454-A457 PolarHBondContact O-N 2.86Å; L454-V458 PolarHBondContact O-N 2.85Å
455	R	94.8	Very high	94.9	Very high	159 Å²	159	114 Å²	114	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-61.9	-42.2	175.4	-175.6	57.6	176.7	-178.9	1.1	112.1	A451 M452 M453 A457 V458 L459	A451-R455 WeakPolarHBondContact O-CB 3.32Å; A451-R455 PolarHBondContact O-N 3.28Å; M452-R455 WeakPolarHBondContact O-CB 3.4Å; M452-R455 PolarHBondContact O-N 2.77Å; M453-R455 VanDerWaalsContact C-N 3.33Å; R455-A457 VanDerWaalsContact C-N 3.33Å; R455-V458 WeakPolarHBondContact O-CG2 3.35Å; R455-L459 HydrophobicContact CG-CD1 4.38Å; R455-L459 VanDerWaalsContact O-CG 3.32Å; R455-L459 WeakPolarHBondContact O-CG 3.32Å; R455-L459 PolarHBondContact O-N 3.26Å
456	A	94.9	Very high	94.2	Very high	56 Å²	56	114.9 Å²	114.9	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-38.3	175.4	0	0	0	0	0	111.8	M452 M453 L454 L459 R460	M452-A456 PolarHBondContact O-N 2.88Å; M453-A456 PolarHBondContact O-N 3.33Å; L454-A456 PolarHBondContact O-N 3.48Å; A456-L459 PolarHBondContact O-N 2.9Å; A456-R460 WeakPolarHBondContact O-CB 3.26Å; A456-R460 PolarHBondContact O-N 3.34Å
457	A	95.4	Very high	93.1	Very high	32 Å²	32	114.5 Å²	114.5	26%	0.264	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-43.7	178	0	0	0	0	0	112.6	M453 L454 R455 L459 R460 N461	M453-A457 WeakPolarHBondContact O-CB 3.48Å; M453-A457 PolarHBondContact O-N 2.87Å; L454-A457 PolarHBondContact O-N 2.86Å; R455-A457 VanDerWaalsContact C-N 3.33Å; A457-L459 VanDerWaalsContact C-N 3.34Å; A457-L459 PolarHBondContact O-N 2.93Å; A457-R460 PolarHBondContact O-N 2.95Å; A457-N461 PolarHBondContact O-N 3.44Å; A457-N461 VanDerWaalsContact O-N 3.1Å; A457-N461 PolarHBondContact O-ND2 3Å
458	V	95.3	Very high	92.1	Very high	48 Å²	48	112.6 Å²	112.6	29%	0.291	58%	0.579	S	S	.	*	H	α-helix	trans	-65.7	-37.5	176.8	-61.9	0	0	0	0	112	L454 R455 N461 Q462 I463	L454-V458 PolarHBondContact O-N 2.85Å; R455-V458 WeakPolarHBondContact O-CG2 3.35Å; V458-N461 CarbonylContact O-C 3.56Å; V458-N461 PolarHBondContact O-N 2.8Å; V458-Q462 PolarHBondContact O-N 3.05Å; V458-I463 HydrophobicContact CB-CB 4.18Å; V458-I463 PolarHBondContact O-N 3.05Å
459	L	92.8	Very high	90.5	Very high	98 Å²	98	111.2 Å²	111.2	51%	0.513	59%	0.59	S	S	.	*	H	α-helix	trans	-65.2	-44.2	175.1	-71.5	172.3	0	0	0	111.7	R455 A456 A457 N461 Q462	R455-L459 HydrophobicContact CG-CD1 4.38Å; R455-L459 VanDerWaalsContact O-CG 3.32Å; R455-L459 WeakPolarHBondContact O-CG 3.32Å; R455-L459 PolarHBondContact O-N 3.26Å; A456-L459 PolarHBondContact O-N 2.9Å; A457-L459 VanDerWaalsContact C-N 3.34Å; A457-L459 PolarHBondContact O-N 2.93Å; L459-N461 PolarHBondContact O-N 3.41Å; L459-Q462 PolarHBondContact O-N 2.71Å; L459-Q462 VanDerWaalsContact O-N 3.07Å
460	R	94.1	Very high	88.6	Confident	201 Å²	201	120.8 Å²	120.8	76%	0.758	62%	0.618	S	S	*	*	H	α-helix	trans	-59.1	-37.8	176.6	-176.1	173.2	67.4	-177	0.3	112.2	A456 A457 Q462	A456-R460 WeakPolarHBondContact O-CB 3.26Å; A456-R460 PolarHBondContact O-N 3.34Å; A457-R460 PolarHBondContact O-N 2.95Å; R460-Q462 VanDerWaalsContact C-N 3.29Å; R460-Q462 PolarHBondContact O-N 2.99Å
461	N	94.6	Very high	86.6	Confident	103 Å²	103	124.1 Å²	124.1	55%	0.551	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	8.9	-179.9	-63.7	-19.9	0	0	0	113.2	A457 V458 L459 I463	A457-N461 PolarHBondContact O-N 3.44Å; A457-N461 VanDerWaalsContact O-N 3.1Å; A457-N461 PolarHBondContact O-ND2 3Å; V458-N461 CarbonylContact O-C 3.56Å; V458-N461 PolarHBondContact O-N 2.8Å; L459-N461 PolarHBondContact O-N 3.41Å; N461-I463 HydrophobicContact CB-CD1 4.05Å; N461-I463 HydrophobicContact CB-CG1 3.97Å; N461-I463 PolarHBondContact O-N 3.37Å; N461-I463 VanDerWaalsContact O-N 3.11Å
462	Q	90.1	Very high	84.5	Confident	146 Å²	146	125 Å²	125	68%	0.682	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.8	25.6	-178.7	-61.8	-66.9	-14.7	0	0	114.3	V458 L459 R460 H464	V458-Q462 PolarHBondContact O-N 3.05Å; L459-Q462 PolarHBondContact O-N 2.71Å; L459-Q462 VanDerWaalsContact O-N 3.07Å; R460-Q462 VanDerWaalsContact C-N 3.29Å; R460-Q462 PolarHBondContact O-N 2.99Å; Q462-H464 PolarHBondContact O-N 2.69Å; Q462-H464 PolarHBondContact O-ND1 3.46Å
463	I	92.3	Very high	81.9	Confident	108 Å²	108	124 Å²	124	55%	0.554	66%	0.657	S	S	*	*			trans	-80.1	91.5	175.5	-55.2	176.2	0	0	0	107.4	V458 N461	V458-I463 HydrophobicContact CB-CB 4.18Å; V458-I463 PolarHBondContact O-N 3.05Å; N461-I463 HydrophobicContact CB-CD1 4.05Å; N461-I463 HydrophobicContact CB-CG1 3.97Å; N461-I463 PolarHBondContact O-N 3.37Å; N461-I463 VanDerWaalsContact O-N 3.11Å
464	H	89.3	Confident	79.6	Confident	118 Å²	118	127.3 Å²	127.3	55%	0.546	67%	0.67	S	S	.	*			trans	-112.7	148.3	174.2	62.3	-79.8	0	0	0	110	Q462 K466	Q462-H464 PolarHBondContact O-N 2.69Å; Q462-H464 PolarHBondContact O-ND1 3.46Å; H464-K466 PolarHBondContact O-N 2.75Å; H464-K466 VanDerWaalsContact O-N 3.11Å
465	V	88.3	Confident	76.9	Confident	144 Å²	144	125 Å²	125	87%	0.873	68%	0.676	S	S	*	*			trans	-69.2	109.9	171.6	-178.6	0	0	0	0	106.7
466	K	83.7	Confident	74.1	Confident	161 Å²	161	127 Å²	127	70%	0.7	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70.3	132	170.7	-67	-174.5	179	-176.7	0	107.8	H464	H464-K466 PolarHBondContact O-N 2.75Å; H464-K466 VanDerWaalsContact O-N 3.11Å
467	S	74.7	Confident	71.8	Confident	109 Å²	109	132.5 Å²	132.5	76%	0.762	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-54.1	133.3	169.3	-57.8	0	0	0	0	108.5
468	P	76.8	Confident	68.8	Low	112 Å²	112	137 Å²	137	73%	0.727	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-57.5	142.2	172.9	24.1	-31.3	0	0	0	108.4	R470	P468-R470 PolarHBondContact O-N 3.03Å
469	P	62.8	Low	66.4	Low	120 Å²	120	141.1 Å²	141.1	78%	0.779	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56	127.3	173.6	-16.8	28.2	0	0	0	108.2	E471	P469-E471 PolarHBondContact O-N 2.59Å
470	R	57.8	Low	63.6	Low	238 Å²	238	140.7 Å²	140.7	90%	0.898	78%	0.775	S	S	*	*			trans	-60.1	110.3	160.1	-89.8	-179.7	166.2	166.6	-4.5	105.8	P468 G472	P468-R470 PolarHBondContact O-N 3.03Å; R470-G472 PolarHBondContact O-N 3Å
471	E	55.1	Low	61.2	Low	201 Å²	201	138.9 Å²	138.9	94%	0.939	78%	0.781	S	S	*	*	S	Bend	trans	-56.5	113.9	168.6	-77.9	-174.3	150.5	0	0	107.8	P469	P469-E471 PolarHBondContact O-N 2.59Å
472	G	54.1	Low	58.4	Low	72 Å²	72	139.3 Å²	139.3	74%	0.742	79%	0.792	S	S	*	*	S	Bend	trans	117.3	56	176.5	0	0	0	0	0	115.7	R470	R470-G472 PolarHBondContact O-N 3Å
473	S	42	Very low	56.1	Low	120 Å²	120	141.1 Å²	141.1	84%	0.839	80%	0.8	S	S	*	*			trans	-162.5	107.7	140.5	-124.9	0	0	0	0	110.5
474	Q	46.2	Very low	53.3	Low	206 Å²	206	141.2 Å²	141.2	96%	0.963	81%	0.81	S	S	*	*			trans	-70.5	134.9	164.4	-71.9	176.3	-11.3	0	0	108.7
475	G	39.3	Very low	50.8	Low	72 Å²	72	146.6 Å²	146.6	74%	0.742	83%	0.826	S	S	*	*			trans	156.8	91.2	167.1	0	0	0	0	0	115.3
476	E	37.4	Very low	48.1	Very low	201 Å²	201	148.4 Å²	148.4	94%	0.939	83%	0.827	S	S	*	*			trans	55.9	130.5	149.4	-70.9	-179.1	152.4	0	0	122.7
477	L	45.4	Very low	45.6	Very low	173 Å²	173	146 Å²	146	91%	0.906	83%	0.831	S	S	*	*			trans	-71	129.1	175.2	-69.6	147.7	0	0	0	111.8
478	T	33.6	Very low	43.8	Very low	127 Å²	127	147 Å²	147	78%	0.779	83%	0.832	S	S	*	*			trans	-138.5	136.8	144.4	45.8	0	0	0	0	109.6	A480	T478-A480 PolarHBondContact O-N 3.35Å
479	P	45	Very low	41.8	Very low	133 Å²	133	149.2 Å²	149.2	86%	0.864	84%	0.838	S	S	*	*			trans	-87.9	98.2	176.3	32.9	-27	0	0	0	109.1
480	A	33.3	Very low	40.5	Very low	89 Å²	89	156 Å²	156	74%	0.736	86%	0.863	S	S	*	*			trans	-89.9	104.7	169.2	0	0	0	0	0	109.8	T478 S482	T478-A480 PolarHBondContact O-N 3.35Å; A480-S482 PolarHBondContact O-N 3.09Å
481	N	43.9	Very low	39.6	Very low	163 Å²	163	151.9 Å²	151.9	87%	0.872	86%	0.861	S	S	*	*			trans	-48.8	120.2	161.4	-100.6	-18.1	0	0	0	110.3
482	S	35.7	Very low	38.8	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	86%	0.857	S	S	*	*			trans	-123.4	83.3	161.4	52.3	0	0	0	0	109.8	A480 S484	A480-S482 PolarHBondContact O-N 3.09Å; S482-S484 PolarHBondContact O-N 3.27Å
483	Q	40.6	Very low	38	Very low	184 Å²	184	153.6 Å²	153.6	86%	0.86	86%	0.863	S	S	*	*			trans	-65.7	101.7	153.4	-76	-178.1	-15.1	0	0	108
484	S	35.3	Very low	37.7	Very low	109 Å²	109	155.6 Å²	155.6	76%	0.762	86%	0.864	S	S	*	*			trans	-94	100.9	160	63.3	0	0	0	0	108.7	S482 M486	S482-S484 PolarHBondContact O-N 3.27Å; S484-M486 PolarHBondContact O-N 3.08Å
485	R	35.1	Very low	37.2	Very low	231 Å²	231	152.4 Å²	152.4	87%	0.872	86%	0.858	S	S	*	*			trans	-50.1	120.1	164.5	-78.9	175.7	168	179.5	-4.4	109.3	S487	R485-S487 PolarHBondContact O-N 2.68Å
486	M	32.5	Very low	37.1	Very low	182 Å²	182	157.8 Å²	157.8	90%	0.897	87%	0.866	S	S	*	*			trans	-79	108.8	158.8	-79.2	-169.4	178.5	0	0	107.9	S484 T488	S484-M486 PolarHBondContact O-N 3.08Å; M486-T488 PolarHBondContact O-N 3.37Å
487	S	31.4	Very low	37.1	Very low	111 Å²	111	154.7 Å²	154.7	78%	0.776	86%	0.861	S	S	*	*			trans	-71.8	108.8	164.1	-60.3	0	0	0	0	108.5	R485	R485-S487 PolarHBondContact O-N 2.68Å
488	T	37.5	Very low	36.4	Very low	130 Å²	130	153.3 Å²	153.3	80%	0.798	86%	0.857	S	S	*	*			trans	-76.3	113.7	159.4	42.2	0	0	0	0	108.2	M486	M486-T488 PolarHBondContact O-N 3.37Å
489	N	34.7	Very low	36.6	Very low	158 Å²	158	155.5 Å²	155.5	85%	0.845	86%	0.864	S	S	*	*			trans	-94.9	122.5	156.5	-83.1	-6.3	0	0	0	107.9
490	M	34.9	Very low	35.9	Very low	263 Å²	263	157.5 Å²	157.5	100%	1.296	86%	0.864	S	S	*	*			trans	-63.4	0	151	-79.2	-177.2	-172.9	0	0	110

Retrieved 490 of 490 residues in 2257.8 ms (Link to these results)

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