A0A3Q0KU11_SCHMA Loading...

Putative amyloid binding protein

AlphaFold DB (A0A5K4EYD4), UniProt , Accession A0A3Q0KU11, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 800 aa.

						>A0A3Q0KU11_SCHMA|A0A3Q0KU11
MFRKELSLSNSCLLSLIENPPPNFTTHCLLGLPSALFQQFIIISFCIYWLPMTHVLYHRTVPEEGNSGALQTVFSFLADPHVFNKLYETCRDVQVFVYSWMQHSHFYGVSGANTEVNQYINIVFKHSDYSPLVEPHALSNNLVLNLHEVLTRAPRLKRNAAPEVIAAALLGLKVSNFLCECSEYVHACKAARSVHETVRSFFTLTKFHRAQQRLEYDAMCIMLRAMNAHNMYLEPEDQQVFHHEAPSLLKSMWKSRLLMTKSMNKNNFEYSLLPVSLENTSQNAFVSIGLSASRSSDEISEGISSPSISIVGPAGDESPCVLETPTTRPASLISDSYFPTVYSTSEVVLNLLDGNLDICLSTSAYMSAQLATYHYSMCHYQIAFHFTVLAIEQLEICFNQGTPPSPHVTVEVLRIMCKVCIIKRKYSLGLRIIKHALMYTRSVYGYRNLIYANLLIEYGCLMLNTDKTHKAAEIYRIALALILNYLPGASIMVALALEAIAYAHYVLEYTSGDFAYALNCAEIAGLMLRRLNYGVCMQAASANRVKALIIEEIAIDDNDPSRTRSDLKLARDLHMESLELCERTYGLWNIQTAKHFGNLGRLYQSMQNNKEAEIMHLRAIEIKERLLGPTDFEVGLSVGHLASLYNYDMDRFKEAEQLYLRSVQISLNLFGPTYSGLEYDYRGLQRVYHELGNYSEMQRYQGLFDYWSKERQRLRSLEPCESSDSLEFSDENNIIGLTEQSQLLMELLKEYKYQFKSIFESLHVDYNNENMVNTATTTQDTLNMNFGGSSTMEASRSTGY
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	45.7	Very low	69.4	Low	210 Å²	210	112.5 Å²	112.5	100%	1.034	55%	0.554	S	S	*	*				0	-61.3	0	-75.2	166.1	66.4	0	0	112.4	R3 K4	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 2.83Å; M1-K4 PolarHBondContact O-N 3.05Å
2	F	54.2	Low	70.7	Confident	134 Å²	134	109.6 Å²	109.6	59%	0.588	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-23.3	-52.8	-171.5	-64.9	-69.9	0	0	0	118.9	K4 E5 L6 I47	F2-K4 PolarHBondContact O-N 3.4Å; F2-E5 PolarHBondContact O-N 2.8Å; F2-L6 WeakPolarHBondContact O-CD2 3.47Å; F2-L6 WeakPolarHBondContact O-CG 3.24Å; F2-I47 HydrophobicContact CB-CD1 3.91Å; F2-I47 HydrophobicContact CD2-CD1 4.46Å; F2-I47 HydrophobicContact CG-CD1 4.35Å
3	R	57.3	Low	71.8	Confident	142 Å²	142	102.2 Å²	102.2	54%	0.536	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-57.4	-20.8	-178.3	-70	-168.5	-172.8	-123.1	-0.8	115.7	M1 L14 E18	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 2.83Å; R3-L14 HydrophobicContact CG-CD2 4.25Å; R3-E18 IonicContact CZ-OE1 3.05Å; R3-E18 IonicContact NH1-OE1 2.66Å; R3-E18 PolarHBondContact NH1-OE1 2.88Å; R3-E18 IonicContact NH1-OE2 2.7Å; R3-E18 IonicContact NH2-OE1 3.29Å; R3-E18 PolarHBondContact NH2-OE1 3.13Å
4	K	58.5	Low	72.8	Confident	196 Å²	196	95.6 Å²	95.6	85%	0.852	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-78.5	-18.7	-175.9	-77.2	-168.1	172.7	-173.8	0	115.2	M1 F2	M1-K4 PolarHBondContact O-N 3.05Å; F2-K4 PolarHBondContact O-N 3.4Å
5	E	67	Low	73.7	Confident	175 Å²	175	93.7 Å²	93.7	82%	0.818	48%	0.48	S	S	*	.	S	Bend	trans	-131.7	23.6	-169.3	-66.6	173	-178.5	0	0	112.2	F2	F2-E5 PolarHBondContact O-N 2.8Å
6	L	71	Confident	74.4	Confident	45 Å²	45	90.6 Å²	90.6	24%	0.236	47%	0.465	C	S	.	.			trans	-69.7	135.5	178.3	-63.1	-178.3	0	0	0	111.2	F2 N10 S11 L14	F2-L6 WeakPolarHBondContact O-CD2 3.47Å; F2-L6 WeakPolarHBondContact O-CG 3.24Å; L6-N10 HydrophobicContact CB-CB 4.11Å; L6-N10 HydrophobicContact CD2-CB 4.07Å; L6-S11 WeakPolarHBondContact CB-OG 3.32Å; L6-L14 HydrophobicContact CD1-CB 4.49Å; L6-L14 HydrophobicContact CD1-CD2 3.64Å
7	S	80.9	Confident	75.1	Confident	56 Å²	56	87.2 Å²	87.2	39%	0.392	45%	0.447	S	S	.	.			trans	-60.2	162.9	165.8	75.9	0	0	0	0	110.8	S9 N10 S11	S7-S9 PolarHBondContact O-N 2.98Å; S7-S9 PolarHBondContact OG-N 3.19Å; S7-N10 PolarHBondContact O-N 3.19Å; S7-N10 VanDerWaalsContact OG-CG 3.22Å; S7-N10 PolarHBondContact OG-N 3.49Å; S7-N10 PolarHBondContact OG-OD1 3.18Å; S7-S11 WeakPolarHBondContact O-CB 3.28Å; S7-S11 PolarHBondContact O-N 2.8Å; S7-S11 PolarHBondContact O-OG 3.41Å
8	L	82.5	Confident	75.6	Confident	140 Å²	140	86.9 Å²	86.9	73%	0.733	44%	0.444	S	S	*	.	H	α-helix	trans	-58.8	-37.9	173.9	-176.9	61	0	0	0	111.6	S11 C12	L8-S11 PolarHBondContact O-N 2.95Å; L8-C12 WeakPolarHBondContact O-CB 3.45Å; L8-C12 PolarHBondContact O-N 3.22Å; L8-C12 PolarHBondContact O-SG 3.44Å
9	S	80.7	Confident	76.2	Confident	45 Å²	45	88.7 Å²	88.7	32%	0.315	45%	0.454	S	S	.	.	H	α-helix	trans	-58.6	-52.3	173.7	-167.4	0	0	0	0	111.3	S7 S11 C12 L13 Q39	S7-S9 PolarHBondContact O-N 2.98Å; S7-S9 PolarHBondContact OG-N 3.19Å; S9-S11 VanDerWaalsContact C-N 3.27Å; S9-S11 PolarHBondContact O-N 2.82Å; S9-C12 PolarHBondContact O-N 2.92Å; S9-L13 WeakPolarHBondContact O-CB 3.48Å; S9-L13 WeakPolarHBondContact O-CG 3.29Å; S9-L13 PolarHBondContact O-N 3.12Å; S9-Q39 PolarHBondContact OG-OE1 3.43Å
10	N	82.6	Confident	76.5	Confident	45 Å²	45	87.7 Å²	87.7	24%	0.241	45%	0.454	C	S	.	.	H	α-helix	trans	-67	-30.7	-177.9	-62.3	16.3	0	0	0	111.8	L6 S7 L14 I43	L6-N10 HydrophobicContact CB-CB 4.11Å; L6-N10 HydrophobicContact CD2-CB 4.07Å; S7-N10 PolarHBondContact O-N 3.19Å; S7-N10 VanDerWaalsContact OG-CG 3.22Å; S7-N10 PolarHBondContact OG-N 3.49Å; S7-N10 PolarHBondContact OG-OD1 3.18Å; N10-L14 VanDerWaalsContact O-CB 3.26Å; N10-L14 WeakPolarHBondContact O-CB 3.35Å; N10-L14 PolarHBondContact O-N 3.12Å; N10-I43 HydrophobicContact CB-CD1 3.84Å
11	S	83.5	Confident	76.9	Confident	50 Å²	50	87 Å²	87	35%	0.35	46%	0.455	S	S	.	.	H	α-helix	trans	-70.2	-43.3	175.7	-56.9	0	0	0	0	111.7	L6 S7 L8 S9 L14 S15	L6-S11 WeakPolarHBondContact CB-OG 3.32Å; S7-S11 WeakPolarHBondContact O-CB 3.28Å; S7-S11 PolarHBondContact O-N 2.8Å; S7-S11 PolarHBondContact O-OG 3.41Å; L8-S11 PolarHBondContact O-N 2.95Å; S9-S11 VanDerWaalsContact C-N 3.27Å; S9-S11 PolarHBondContact O-N 2.82Å; S11-L14 PolarHBondContact O-N 2.92Å; S11-S15 WeakPolarHBondContact O-CB 3.27Å; S11-S15 PolarHBondContact O-N 3.06Å
12	C	85	Confident	78.6	Confident	77 Å²	77	83.2 Å²	83.2	52%	0.52	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-41.1	173.4	-69.1	0	0	0	0	112	L8 S9 S15 L16	L8-C12 WeakPolarHBondContact O-CB 3.45Å; L8-C12 PolarHBondContact O-N 3.22Å; L8-C12 PolarHBondContact O-SG 3.44Å; S9-C12 PolarHBondContact O-N 2.92Å; C12-S15 PolarHBondContact O-N 2.67Å; C12-L16 WeakPolarHBondContact O-CB 3.33Å; C12-L16 PolarHBondContact O-N 2.91Å
13	L	85.1	Confident	79.8	Confident	13 Å²	13	83.3 Å²	83.3	7%	0.068	45%	0.453	C	S	.	.	H	α-helix	trans	-66.3	-40.9	175.3	-72.2	171.7	0	0	0	112.1	S9 L16 I17 L36 Q39 F40 I43	S9-L13 WeakPolarHBondContact O-CB 3.48Å; S9-L13 WeakPolarHBondContact O-CG 3.29Å; S9-L13 PolarHBondContact O-N 3.12Å; L13-L16 HydrophobicContact CD2-CD2 4.48Å; L13-L16 WeakPolarHBondContact O-CB 3.39Å; L13-L16 PolarHBondContact O-N 3.48Å; L13-I17 WeakPolarHBondContact O-CD1 3.49Å; L13-I17 VanDerWaalsContact O-CG1 3.29Å; L13-I17 WeakPolarHBondContact O-CG1 3.3Å; L13-I17 PolarHBondContact O-N 3.16Å; L13-L36 HydrophobicContact CD1-CD2 4.4Å; L13-Q39 HydrophobicContact CD1-CB 3.43Å; L13-Q39 VanDerWaalsContact CD1-CB 3.43Å; L13-Q39 HydrophobicContact CD1-CG 4.48Å; L13-F40 HydrophobicContact CD2-CB 4.44Å; L13-F40 HydrophobicContact CD2-CD2 4.41Å; L13-I43 HydrophobicContact CB-CD1 3.76Å; L13-I43 HydrophobicContact CD1-CD1 4.05Å
14	L	85.3	Confident	80.9	Confident	10 Å²	10	79.1 Å²	79.1	5%	0.052	44%	0.439	C	S	.	.	H	α-helix	trans	-61.5	-45.2	173.3	-178.7	62.3	0	0	0	111.1	R3 L6 N10 S11 L16 I17 E18 I43 I47 Y48	R3-L14 HydrophobicContact CG-CD2 4.25Å; L6-L14 HydrophobicContact CD1-CB 4.49Å; L6-L14 HydrophobicContact CD1-CD2 3.64Å; N10-L14 VanDerWaalsContact O-CB 3.26Å; N10-L14 WeakPolarHBondContact O-CB 3.35Å; N10-L14 PolarHBondContact O-N 3.12Å; S11-L14 PolarHBondContact O-N 2.92Å; L14-L16 VanDerWaalsContact C-N 3.26Å; L14-L16 PolarHBondContact O-N 3.21Å; L14-I17 PolarHBondContact O-N 3.32Å; L14-I17 VanDerWaalsContact O-N 3.11Å; L14-E18 HydrophobicContact CD1-CG 4.36Å; L14-E18 WeakPolarHBondContact O-CG 3.49Å; L14-E18 PolarHBondContact O-N 2.94Å; L14-I43 HydrophobicContact CB-CG2 4.41Å; L14-I43 HydrophobicContact CD1-CG2 4.14Å; L14-I47 HydrophobicContact CD1-CG1 4.5Å; L14-I47 HydrophobicContact CD1-CG2 4.15Å; L14-Y48 HydrophobicContact CD1-CE2 3.94Å; L14-Y48 VanDerWaalsContact CD1-OH 3.27Å; L14-Y48 WeakPolarHBondContact CD1-OH 3.33Å
15	S	86	Confident	82.2	Confident	67 Å²	67	73.5 Å²	73.5	47%	0.469	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-34.6	175.5	-172.5	0	0	0	0	112.8	S11 C12 N19	S11-S15 WeakPolarHBondContact O-CB 3.27Å; S11-S15 PolarHBondContact O-N 3.06Å; C12-S15 PolarHBondContact O-N 2.67Å; S15-N19 PolarHBondContact O-N 3.28Å
16	L	85.1	Confident	83	Confident	44 Å²	44	68.1 Å²	68.1	23%	0.23	40%	0.4	C	S	.	.	H	α-helix	trans	-71	-31.6	175.2	179.3	65	0	0	0	112.6	C12 L13 L14 P20 P21 F24	C12-L16 WeakPolarHBondContact O-CB 3.33Å; C12-L16 PolarHBondContact O-N 2.91Å; L13-L16 HydrophobicContact CD2-CD2 4.48Å; L13-L16 WeakPolarHBondContact O-CB 3.39Å; L13-L16 PolarHBondContact O-N 3.48Å; L14-L16 VanDerWaalsContact C-N 3.26Å; L14-L16 PolarHBondContact O-N 3.21Å; L16-P20 VanDerWaalsContact O-CA 3.28Å; L16-P20 WeakPolarHBondContact O-CA 3.4Å; L16-P20 WeakPolarHBondContact O-CB 3.46Å; L16-P21 HydrophobicContact CD1-CG 4.44Å; L16-F24 HydrophobicContact CD1-CD2 4.24Å; L16-F24 HydrophobicContact CD1-CE2 4.29Å; L16-F24 HydrophobicContact CD1-CG 4.44Å; L16-F24 HydrophobicContact CD2-CE2 4.05Å; L16-F24 HydrophobicContact CD2-CZ 3.95Å; L16-F24 HydrophobicContact CG-CE2 4.49Å; L16-F24 HydrophobicContact CG-CZ 4.31Å
17	I	85.8	Confident	83.6	Confident	34 Å²	34	71.7 Å²	71.7	17%	0.174	42%	0.415	C	S	.	.	H	α-helix	trans	-75.8	-39.3	174.4	-65.3	159.3	0	0	0	110.8	L13 L14 F40 I43 Y48	L13-I17 WeakPolarHBondContact O-CD1 3.49Å; L13-I17 VanDerWaalsContact O-CG1 3.29Å; L13-I17 WeakPolarHBondContact O-CG1 3.3Å; L13-I17 PolarHBondContact O-N 3.16Å; L14-I17 PolarHBondContact O-N 3.32Å; L14-I17 VanDerWaalsContact O-N 3.11Å; I17-F40 HydrophobicContact CD1-CD2 4.07Å; I17-F40 HydrophobicContact CD1-CE2 4.09Å; I17-F40 HydrophobicContact CD1-CG 4.42Å; I17-F40 HydrophobicContact CD1-CZ 4.45Å; I17-F40 HydrophobicContact CG1-CD2 3.82Å; I17-F40 HydrophobicContact CG1-CE1 4.45Å; I17-F40 HydrophobicContact CG1-CE2 3.36Å; I17-F40 HydrophobicContact CG1-CZ 3.72Å; I17-I43 HydrophobicContact CD1-CB 4.06Å; I17-I43 HydrophobicContact CD1-CG2 3.66Å; I17-Y48 HydrophobicContact CB-CE2 4.36Å; I17-Y48 HydrophobicContact CG2-CD2 3.85Å; I17-Y48 HydrophobicContact CG2-CE2 3.44Å; I17-Y48 VanDerWaalsContact CG2-CE2 3.44Å
18	E	85.3	Confident	83.8	Confident	82 Å²	82	71.5 Å²	71.5	38%	0.383	41%	0.413	S	S	.	.	H	α-helix	trans	-72.3	-39.1	177.9	-70.5	-173.7	142	0	0	113.1	R3 L14 Y48	R3-E18 IonicContact CZ-OE1 3.05Å; R3-E18 IonicContact NH1-OE1 2.66Å; R3-E18 PolarHBondContact NH1-OE1 2.88Å; R3-E18 IonicContact NH1-OE2 2.7Å; R3-E18 IonicContact NH2-OE1 3.29Å; R3-E18 PolarHBondContact NH2-OE1 3.13Å; L14-E18 HydrophobicContact CD1-CG 4.36Å; L14-E18 WeakPolarHBondContact O-CG 3.49Å; L14-E18 PolarHBondContact O-N 2.94Å; E18-Y48 WeakPolarHBondContact CG-OH 3.34Å; E18-Y48 PolarHBondContact OE1-OH 3.43Å
19	N	86.2	Confident	84.1	Confident	120 Å²	120	65.2 Å²	65.2	64%	0.642	38%	0.38	S	S	*	.	S	Bend	trans	-134.7	66.3	-174.9	-63.2	-90.6	0	0	0	110.5	S15	S15-N19 PolarHBondContact O-N 3.28Å
20	P	82.7	Confident	84.5	Confident	68 Å²	68	64.5 Å²	64.5	44%	0.442	37%	0.373	S	S	.	.			trans	-62.2	133.9	177	25.5	-33.6	0	0	0	110.4	L16 F24	L16-P20 VanDerWaalsContact O-CA 3.28Å; L16-P20 WeakPolarHBondContact O-CA 3.4Å; L16-P20 WeakPolarHBondContact O-CB 3.46Å; P20-F24 HydrophobicContact CB-CB 4.15Å; P20-F24 HydrophobicContact CB-CD1 4.08Å; P20-F24 HydrophobicContact CB-CG 4.44Å
21	P	83.9	Confident	84.7	Confident	73 Å²	73	65.4 Å²	65.4	47%	0.474	39%	0.393	S	S	.	.			trans	-64.1	150.5	174.2	25.5	-30.6	0	0	0	109.8	L16 N23 F24	L16-P21 HydrophobicContact CD1-CG 4.44Å; P21-N23 PolarHBondContact O-N 3.14Å; P21-F24 HydrophobicContact CG-CB 4.07Å; P21-F24 VanDerWaalsContact O-CB 3.24Å; P21-F24 WeakPolarHBondContact O-CB 3.05Å; P21-F24 PolarHBondContact O-N 2.7Å
22	P	81.3	Confident	85	Confident	132 Å²	132	64.7 Å²	64.7	86%	0.857	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.9	-164.4	22.3	-34.6	0	0	0	115.8
23	N	79.5	Confident	85.3	Confident	135 Å²	135	65 Å²	65	72%	0.722	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	5.5	176.5	-61.5	-14.8	0	0	0	113.3	P21 T25 C28	P21-N23 PolarHBondContact O-N 3.14Å; N23-T25 PolarHBondContact O-N 3.16Å; N23-C28 PolarHBondContact O-SG 2.69Å; N23-C28 VanDerWaalsContact O-SG 3.4Å
24	F	81.7	Confident	85.6	Confident	55 Å²	55	67.5 Å²	67.5	24%	0.241	40%	0.404	C	S	.	.			trans	-77.3	92.5	-179.2	-169.1	-104.1	0	0	0	110.8	L16 P20 P21 C28 L29 F40	L16-F24 HydrophobicContact CD1-CD2 4.24Å; L16-F24 HydrophobicContact CD1-CE2 4.29Å; L16-F24 HydrophobicContact CD1-CG 4.44Å; L16-F24 HydrophobicContact CD2-CE2 4.05Å; L16-F24 HydrophobicContact CD2-CZ 3.95Å; L16-F24 HydrophobicContact CG-CE2 4.49Å; L16-F24 HydrophobicContact CG-CZ 4.31Å; P20-F24 HydrophobicContact CB-CB 4.15Å; P20-F24 HydrophobicContact CB-CD1 4.08Å; P20-F24 HydrophobicContact CB-CG 4.44Å; P21-F24 HydrophobicContact CG-CB 4.07Å; P21-F24 VanDerWaalsContact O-CB 3.24Å; P21-F24 WeakPolarHBondContact O-CB 3.05Å; P21-F24 PolarHBondContact O-N 2.7Å; F24-C28 HydrophobicContact CD2-CB 3.76Å; F24-C28 HydrophobicContact CE2-CB 3.95Å; F24-C28 HydrophobicContact CG-CB 4.49Å; F24-L29 HydrophobicContact CE1-CD1 4.37Å; F24-L29 HydrophobicContact CZ-CB 4.22Å; F24-L29 HydrophobicContact CZ-CD1 3.94Å; F24-F40 HydrophobicContact CE1-CE2 4.08Å; F24-F40 HydrophobicContact CE1-CZ 4.25Å; F24-F40 HydrophobicContact CZ-CE2 4.23Å
25	T	84.8	Confident	85.7	Confident	77 Å²	77	69.9 Å²	69.9	47%	0.472	43%	0.425	S	S	.	.			trans	-99	170.3	-179.2	58.9	0	0	0	0	111.7	N23 H27 C28 L29	N23-T25 PolarHBondContact O-N 3.16Å; T25-H27 PolarHBondContact O-N 3.05Å; T25-H27 VanDerWaalsContact O-N 3.12Å; T25-H27 WeakPolarHBondContact OG1-CB 3.44Å; T25-H27 PolarHBondContact OG1-N 3.48Å; T25-C28 WeakPolarHBondContact O-CA 3.27Å; T25-C28 WeakPolarHBondContact O-CB 3.47Å; T25-C28 PolarHBondContact O-N 3.46Å; T25-L29 PolarHBondContact O-N 2.66Å; T25-L29 VanDerWaalsContact O-N 3.12Å
26	T	83.6	Confident	85.9	Confident	63 Å²	63	69.7 Å²	69.7	39%	0.387	42%	0.419	S	S	.	.	H	α-helix	trans	-51.8	-32.7	168.5	-43.7	0	0	0	0	112.1	L29 L30 F76 V82	T26-L29 PolarHBondContact O-N 3.41Å; T26-L30 HydrophobicContact CG2-CD1 4.15Å; T26-L30 HydrophobicContact CG2-CG 4.31Å; T26-L30 WeakPolarHBondContact O-CB 3.44Å; T26-L30 VanDerWaalsContact O-CG 3.22Å; T26-L30 WeakPolarHBondContact O-CG 3.32Å; T26-L30 PolarHBondContact O-N 3.25Å; T26-F76 HydrophobicContact CG2-CE2 4.3Å; T26-V82 HydrophobicContact CG2-CG2 3.62Å
27	H	83.6	Confident	86.2	Confident	120 Å²	120	67.6 Å²	67.6	56%	0.556	41%	0.408	S	S	*	.	H	α-helix	trans	-59.7	-46.7	172.7	-168.9	-84.6	0	0	0	112.4	T25 L29 L30 G31 Y337	T25-H27 PolarHBondContact O-N 3.05Å; T25-H27 VanDerWaalsContact O-N 3.12Å; T25-H27 WeakPolarHBondContact OG1-CB 3.44Å; T25-H27 PolarHBondContact OG1-N 3.48Å; H27-L29 VanDerWaalsContact C-N 3.29Å; H27-L29 PolarHBondContact O-N 2.88Å; H27-L30 PolarHBondContact O-N 3.06Å; H27-G31 PolarHBondContact O-N 2.67Å; H27-Y337 WeakPolarHBondContact CA-OH 3.39Å; H27-Y337 VanDerWaalsContact CB-OH 3.29Å; H27-Y337 WeakPolarHBondContact CB-OH 3.43Å; H27-Y337 PolarHBondContact CD2-OH 3.2Å
28	C	86.5	Confident	86.5	Confident	52 Å²	52	68.6 Å²	68.6	35%	0.351	41%	0.412	S	S	.	.	H	α-helix	trans	-61.6	-39.2	177.3	-57.9	0	0	0	0	111.5	N23 F24 T25 G31	N23-C28 PolarHBondContact O-SG 2.69Å; N23-C28 VanDerWaalsContact O-SG 3.4Å; F24-C28 HydrophobicContact CD2-CB 3.76Å; F24-C28 HydrophobicContact CE2-CB 3.95Å; F24-C28 HydrophobicContact CG-CB 4.49Å; T25-C28 WeakPolarHBondContact O-CA 3.27Å; T25-C28 WeakPolarHBondContact O-CB 3.47Å; T25-C28 PolarHBondContact O-N 3.46Å; C28-G31 PolarHBondContact O-N 3.44Å
29	L	87.5	Confident	86.7	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.037	41%	0.408	C	S	.	.	H	α-helix	trans	-68	-47.4	177.7	-173	70.9	0	0	0	112.3	F24 T25 T26 H27 G31 L32 F37 F40 F76	F24-L29 HydrophobicContact CE1-CD1 4.37Å; F24-L29 HydrophobicContact CZ-CB 4.22Å; F24-L29 HydrophobicContact CZ-CD1 3.94Å; T25-L29 PolarHBondContact O-N 2.66Å; T25-L29 VanDerWaalsContact O-N 3.12Å; T26-L29 PolarHBondContact O-N 3.41Å; H27-L29 VanDerWaalsContact C-N 3.29Å; H27-L29 PolarHBondContact O-N 2.88Å; L29-G31 PolarHBondContact O-N 2.88Å; L29-L32 HydrophobicContact CD1-CD1 3.81Å; L29-L32 WeakPolarHBondContact O-CB 3.45Å; L29-L32 WeakPolarHBondContact O-CG 3.43Å; L29-L32 PolarHBondContact O-N 3.08Å; L29-F37 HydrophobicContact CD1-CD2 4.36Å; L29-F37 HydrophobicContact CD2-CE2 4.12Å; L29-F37 HydrophobicContact CG-CD2 4.01Å; L29-F37 HydrophobicContact CG-CE2 3.89Å; L29-F37 WeakPolarHBondContact O-CD2 3.32Å; L29-F40 HydrophobicContact CD1-CB 4.38Å; L29-F40 HydrophobicContact CD1-CD1 3.48Å; L29-F40 VanDerWaalsContact CD1-CD1 3.48Å; L29-F40 HydrophobicContact CD1-CD2 3.8Å; L29-F40 HydrophobicContact CD1-CE1 3.55Å; L29-F40 HydrophobicContact CD1-CE2 3.84Å; L29-F40 HydrophobicContact CD1-CG 3.62Å; L29-F40 HydrophobicContact CD1-CZ 3.73Å; L29-F40 HydrophobicContact CD2-CD1 4.2Å; L29-F40 HydrophobicContact CD2-CE1 3.83Å; L29-F40 HydrophobicContact CD2-CZ 4.41Å; L29-F40 HydrophobicContact CG-CD1 4.46Å; L29-F40 HydrophobicContact CG-CE1 4.37Å; L29-F76 HydrophobicContact CD2-CE2 3.72Å; L29-F76 HydrophobicContact CD2-CZ 3.59Å
30	L	89.1	Confident	86.9	Confident	31 Å²	31	62.9 Å²	62.9	16%	0.162	38%	0.381	C	S	.	.	H	α-helix	trans	-60.8	-31.4	176.8	-68.7	170.5	0	0	0	112.1	T26 H27 L32 H81 V82 K85 Y337	T26-L30 HydrophobicContact CG2-CD1 4.15Å; T26-L30 HydrophobicContact CG2-CG 4.31Å; T26-L30 WeakPolarHBondContact O-CB 3.44Å; T26-L30 VanDerWaalsContact O-CG 3.22Å; T26-L30 WeakPolarHBondContact O-CG 3.32Å; T26-L30 PolarHBondContact O-N 3.25Å; H27-L30 PolarHBondContact O-N 3.06Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L30-L32 PolarHBondContact O-N 3.11Å; L30-H81 HydrophobicContact CD1-CB 3.91Å; L30-V82 HydrophobicContact CD2-CG2 4.33Å; L30-K85 HydrophobicContact CD2-CB 3.53Å; L30-K85 HydrophobicContact CD2-CG 3.88Å; L30-K85 WeakPolarHBondContact O-CE 3.4Å; L30-K85 PolarHBondContact O-NZ 3.41Å; L30-Y337 HydrophobicContact CD1-CE1 4.34Å
31	G	88.3	Confident	87.4	Confident	64 Å²	64	59.8 Å²	59.8	66%	0.66	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-8.3	174.6	0	0	0	0	0	115.7	H27 C28 L29	H27-G31 PolarHBondContact O-N 2.67Å; C28-G31 PolarHBondContact O-N 3.44Å; L29-G31 PolarHBondContact O-N 2.88Å
32	L	88.7	Confident	87.8	Confident	35 Å²	35	59.4 Å²	59.4	18%	0.183	35%	0.354	C	S	.	.	S	Bend	trans	-66.9	146.2	178.7	-68.4	-176.2	0	0	0	112.5	L29 L30 F37 K85	L29-L32 HydrophobicContact CD1-CD1 3.81Å; L29-L32 WeakPolarHBondContact O-CB 3.45Å; L29-L32 WeakPolarHBondContact O-CG 3.43Å; L29-L32 PolarHBondContact O-N 3.08Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L30-L32 PolarHBondContact O-N 3.11Å; L32-F37 HydrophobicContact CB-CB 4.23Å; L32-K85 PolarHBondContact O-NZ 3.35Å
33	P	91.3	Very high	88.3	Confident	84 Å²	84	53.7 Å²	53.7	55%	0.545	32%	0.316	S	S	.	.			trans	-52.8	141.5	165.4	-25	34.2	0	0	0	111.7	A35 L36 F37	P33-A35 VanDerWaalsContact C-N 3.3Å; P33-A35 PolarHBondContact O-N 3.33Å; P33-A35 VanDerWaalsContact O-N 3.13Å; P33-L36 HydrophobicContact CG-CD1 4.32Å; P33-L36 PolarHBondContact O-N 2.98Å; P33-F37 PolarHBondContact O-N 3.39Å
34	S	90.6	Very high	88.9	Confident	65 Å²	65	47.5 Å²	47.5	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-51.9	-42.9	-169.3	-50.9	0	0	0	0	114.1	L36 F37 Q38 T89	S34-L36 PolarHBondContact O-N 2.96Å; S34-F37 PolarHBondContact O-N 3.28Å; S34-Q38 WeakPolarHBondContact O-CB 3.38Å; S34-Q38 PolarHBondContact O-N 2.99Å; S34-T89 WeakPolarHBondContact OG-CG2 3.27Å
35	A	88.7	Confident	89.4	Confident	59 Å²	59	45.5 Å²	45.5	49%	0.488	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-35.8	178.3	0	0	0	0	0	113.6	P33 Q39	P33-A35 VanDerWaalsContact C-N 3.3Å; P33-A35 PolarHBondContact O-N 3.33Å; P33-A35 VanDerWaalsContact O-N 3.13Å; A35-Q39 WeakPolarHBondContact O-CB 3.46Å; A35-Q39 VanDerWaalsContact O-CG 3.28Å; A35-Q39 WeakPolarHBondContact O-CG 3.41Å; A35-Q39 PolarHBondContact O-N 3.28Å
36	L	89.4	Confident	89.6	Confident	63 Å²	63	43.7 Å²	43.7	33%	0.33	26%	0.264	S	S	.	.	H	α-helix	trans	-75.1	-35	176	-68.4	178.4	0	0	0	111.5	L13 P33 S34 F40	L13-L36 HydrophobicContact CD1-CD2 4.4Å; P33-L36 HydrophobicContact CG-CD1 4.32Å; P33-L36 PolarHBondContact O-N 2.98Å; S34-L36 PolarHBondContact O-N 2.96Å; L36-F40 VanDerWaalsContact O-CB 3.31Å; L36-F40 WeakPolarHBondContact O-CB 3.26Å; L36-F40 PolarHBondContact O-N 3.23Å
37	F	91.2	Very high	89.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-47.4	171.9	-177.3	-93.4	0	0	0	111.3	L29 L32 P33 S34 Q39 F40 I41 K85 L86 T89	L29-F37 HydrophobicContact CD1-CD2 4.36Å; L29-F37 HydrophobicContact CD2-CE2 4.12Å; L29-F37 HydrophobicContact CG-CD2 4.01Å; L29-F37 HydrophobicContact CG-CE2 3.89Å; L29-F37 WeakPolarHBondContact O-CD2 3.32Å; L32-F37 HydrophobicContact CB-CB 4.23Å; P33-F37 PolarHBondContact O-N 3.39Å; S34-F37 PolarHBondContact O-N 3.28Å; F37-Q39 PolarHBondContact O-N 2.9Å; F37-F40 WeakPolarHBondContact O-CB 3.33Å; F37-F40 PolarHBondContact O-N 3.3Å; F37-I41 HydrophobicContact CD1-CG1 4.17Å; F37-I41 HydrophobicContact CE1-CD1 4.36Å; F37-I41 HydrophobicContact CE1-CG1 3.81Å; F37-I41 HydrophobicContact CE2-CD1 4.44Å; F37-I41 HydrophobicContact CE2-CG1 4.46Å; F37-I41 HydrophobicContact CZ-CD1 4.03Å; F37-I41 HydrophobicContact CZ-CG1 3.97Å; F37-I41 WeakPolarHBondContact O-CG1 3.39Å; F37-I41 PolarHBondContact O-N 3.04Å; F37-K85 HydrophobicContact CD1-CG 3.85Å; F37-K85 HydrophobicContact CD2-CG 4.01Å; F37-K85 HydrophobicContact CE1-CB 4.31Å; F37-K85 HydrophobicContact CE1-CG 3.5Å; F37-K85 HydrophobicContact CE2-CG 3.68Å; F37-K85 HydrophobicContact CG-CG 4.09Å; F37-K85 HydrophobicContact CZ-CB 4.06Å; F37-K85 HydrophobicContact CZ-CG 3.41Å; F37-K85 VanDerWaalsContact CZ-CG 3.41Å; F37-L86 HydrophobicContact CE1-CD2 3.85Å; F37-L86 HydrophobicContact CE1-CG 4.1Å; F37-L86 HydrophobicContact CZ-CD2 4.22Å; F37-L86 HydrophobicContact CZ-CG 4.21Å; F37-T89 VanDerWaalsContact CD1-OG1 3.26Å; F37-T89 WeakPolarHBondContact CD1-OG1 3.44Å
38	Q	91.7	Very high	90	Very high	55 Å²	55	39.6 Å²	39.6	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-45	176.5	-165.3	-173.2	24.5	0	0	111.7	S34 F40 I41 I42 C90 D92	S34-Q38 WeakPolarHBondContact O-CB 3.38Å; S34-Q38 PolarHBondContact O-N 2.99Å; Q38-F40 PolarHBondContact O-N 3.43Å; Q38-I41 PolarHBondContact O-N 3.28Å; Q38-I42 HydrophobicContact CG-CD1 4.02Å; Q38-I42 VanDerWaalsContact O-CG1 3.29Å; Q38-I42 WeakPolarHBondContact O-CG1 3.22Å; Q38-I42 PolarHBondContact O-N 3.31Å; Q38-C90 VanDerWaalsContact CA-SG 3.59Å; Q38-C90 HydrophobicContact CG-CB 4.4Å; Q38-D92 PolarHBondContact NE2-OD1 3.42Å; Q38-D92 PolarHBondContact NE2-OD2 3.09Å
39	Q	90.1	Very high	90.2	Very high	64 Å²	64	38.2 Å²	38.2	30%	0.299	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-43.3	173.8	-74.3	175.5	12.9	0	0	112.3	S9 L13 A35 F37 I41 I42 I43	S9-Q39 PolarHBondContact OG-OE1 3.43Å; L13-Q39 HydrophobicContact CD1-CB 3.43Å; L13-Q39 VanDerWaalsContact CD1-CB 3.43Å; L13-Q39 HydrophobicContact CD1-CG 4.48Å; A35-Q39 WeakPolarHBondContact O-CB 3.46Å; A35-Q39 VanDerWaalsContact O-CG 3.28Å; A35-Q39 WeakPolarHBondContact O-CG 3.41Å; A35-Q39 PolarHBondContact O-N 3.28Å; F37-Q39 PolarHBondContact O-N 2.9Å; Q39-I41 PolarHBondContact O-N 3.4Å; Q39-I42 PolarHBondContact O-N 3.27Å; Q39-I43 WeakPolarHBondContact O-CB 3.29Å; Q39-I43 WeakPolarHBondContact O-CD1 3.39Å; Q39-I43 WeakPolarHBondContact O-CG1 3.38Å; Q39-I43 PolarHBondContact O-N 3.33Å
40	F	91.5	Very high	90.2	Very high	19 Å²	19	40.5 Å²	40.5	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-45.8	176.8	-177.8	-78.9	0	0	0	111.7	L13 I17 F24 L29 L36 F37 Q38 I43 S44	L13-F40 HydrophobicContact CD2-CB 4.44Å; L13-F40 HydrophobicContact CD2-CD2 4.41Å; I17-F40 HydrophobicContact CD1-CD2 4.07Å; I17-F40 HydrophobicContact CD1-CE2 4.09Å; I17-F40 HydrophobicContact CD1-CG 4.42Å; I17-F40 HydrophobicContact CD1-CZ 4.45Å; I17-F40 HydrophobicContact CG1-CD2 3.82Å; I17-F40 HydrophobicContact CG1-CE1 4.45Å; I17-F40 HydrophobicContact CG1-CE2 3.36Å; I17-F40 HydrophobicContact CG1-CZ 3.72Å; F24-F40 HydrophobicContact CE1-CE2 4.08Å; F24-F40 HydrophobicContact CE1-CZ 4.25Å; F24-F40 HydrophobicContact CZ-CE2 4.23Å; L29-F40 HydrophobicContact CD1-CB 4.38Å; L29-F40 HydrophobicContact CD1-CD1 3.48Å; L29-F40 VanDerWaalsContact CD1-CD1 3.48Å; L29-F40 HydrophobicContact CD1-CD2 3.8Å; L29-F40 HydrophobicContact CD1-CE1 3.55Å; L29-F40 HydrophobicContact CD1-CE2 3.84Å; L29-F40 HydrophobicContact CD1-CG 3.62Å; L29-F40 HydrophobicContact CD1-CZ 3.73Å; L29-F40 HydrophobicContact CD2-CD1 4.2Å; L29-F40 HydrophobicContact CD2-CE1 3.83Å; L29-F40 HydrophobicContact CD2-CZ 4.41Å; L29-F40 HydrophobicContact CG-CD1 4.46Å; L29-F40 HydrophobicContact CG-CE1 4.37Å; L36-F40 VanDerWaalsContact O-CB 3.31Å; L36-F40 WeakPolarHBondContact O-CB 3.26Å; L36-F40 PolarHBondContact O-N 3.23Å; F37-F40 WeakPolarHBondContact O-CB 3.33Å; F37-F40 PolarHBondContact O-N 3.3Å; Q38-F40 PolarHBondContact O-N 3.43Å; F40-I43 PolarHBondContact O-N 3.48Å; F40-S44 WeakPolarHBondContact CE1-OG 3.48Å; F40-S44 VanDerWaalsContact O-CB 3.27Å; F40-S44 WeakPolarHBondContact O-CB 3.49Å; F40-S44 PolarHBondContact O-N 3.2Å; F40-S44 PolarHBondContact O-OG 2.95Å
41	I	93.5	Very high	90	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-64.9	-45.2	179.1	-65.1	-66.5	0	0	0	111.2	F37 Q38 Q39 I43 S44 F45 W49 F76 L86	F37-I41 HydrophobicContact CD1-CG1 4.17Å; F37-I41 HydrophobicContact CE1-CD1 4.36Å; F37-I41 HydrophobicContact CE1-CG1 3.81Å; F37-I41 HydrophobicContact CE2-CD1 4.44Å; F37-I41 HydrophobicContact CE2-CG1 4.46Å; F37-I41 HydrophobicContact CZ-CD1 4.03Å; F37-I41 HydrophobicContact CZ-CG1 3.97Å; F37-I41 WeakPolarHBondContact O-CG1 3.39Å; F37-I41 PolarHBondContact O-N 3.04Å; Q38-I41 PolarHBondContact O-N 3.28Å; Q39-I41 PolarHBondContact O-N 3.4Å; I41-I43 PolarHBondContact O-N 3.16Å; I41-S44 PolarHBondContact O-N 3.35Å; I41-F45 WeakPolarHBondContact O-CB 3.34Å; I41-F45 PolarHBondContact O-N 2.94Å; I41-W49 HydrophobicContact CD1-CH2 3.97Å; I41-W49 HydrophobicContact CG2-CH2 4.43Å; I41-W49 HydrophobicContact CG2-CZ3 4.31Å; I41-F76 HydrophobicContact CD1-CE1 3.96Å; I41-F76 HydrophobicContact CD1-CZ 4.12Å; I41-L86 HydrophobicContact CB-CD2 4.42Å; I41-L86 HydrophobicContact CD1-CD2 4Å; I41-L86 HydrophobicContact CG1-CD2 3.83Å; I41-L86 HydrophobicContact CG2-CD2 3.89Å
42	I	91.7	Very high	89.7	Confident	64 Å²	64	39.4 Å²	39.4	33%	0.328	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-44.8	177.6	-68.8	164.5	0	0	0	111.1	Q38 Q39 F45 C46 V93	Q38-I42 HydrophobicContact CG-CD1 4.02Å; Q38-I42 VanDerWaalsContact O-CG1 3.29Å; Q38-I42 WeakPolarHBondContact O-CG1 3.22Å; Q38-I42 PolarHBondContact O-N 3.31Å; Q39-I42 PolarHBondContact O-N 3.27Å; I42-F45 PolarHBondContact O-N 3.43Å; I42-C46 WeakPolarHBondContact O-CB 3.5Å; I42-C46 PolarHBondContact O-N 2.85Å; I42-C46 PolarHBondContact O-SG 2.94Å; I42-C46 VanDerWaalsContact O-SG 3.37Å; I42-V93 HydrophobicContact CD1-CG2 4.26Å; I42-V93 HydrophobicContact CG1-CG1 4.11Å; I42-V93 HydrophobicContact CG1-CG2 4.37Å
43	I	90.8	Very high	89.2	Confident	13 Å²	13	37.8 Å²	37.8	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-41.9	178.1	-65.4	164.1	0	0	0	110.6	N10 L13 L14 I17 Q39 F40 I41 F45 I47	N10-I43 HydrophobicContact CB-CD1 3.84Å; L13-I43 HydrophobicContact CB-CD1 3.76Å; L13-I43 HydrophobicContact CD1-CD1 4.05Å; L14-I43 HydrophobicContact CB-CG2 4.41Å; L14-I43 HydrophobicContact CD1-CG2 4.14Å; I17-I43 HydrophobicContact CD1-CB 4.06Å; I17-I43 HydrophobicContact CD1-CG2 3.66Å; Q39-I43 WeakPolarHBondContact O-CB 3.29Å; Q39-I43 WeakPolarHBondContact O-CD1 3.39Å; Q39-I43 WeakPolarHBondContact O-CG1 3.38Å; Q39-I43 PolarHBondContact O-N 3.33Å; F40-I43 PolarHBondContact O-N 3.48Å; I41-I43 PolarHBondContact O-N 3.16Å; I43-F45 PolarHBondContact O-N 3.5Å; I43-I47 HydrophobicContact CG2-CG1 4.15Å; I43-I47 WeakPolarHBondContact O-CB 3.48Å; I43-I47 WeakPolarHBondContact O-CG1 3.4Å; I43-I47 PolarHBondContact O-N 3.42Å
44	S	92.5	Very high	88.4	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.028	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-46.4	177.4	-60.4	0	0	0	0	111.7	F40 I41 Y48 W49	F40-S44 WeakPolarHBondContact CE1-OG 3.48Å; F40-S44 VanDerWaalsContact O-CB 3.27Å; F40-S44 WeakPolarHBondContact O-CB 3.49Å; F40-S44 PolarHBondContact O-N 3.2Å; F40-S44 PolarHBondContact O-OG 2.95Å; I41-S44 PolarHBondContact O-N 3.35Å; S44-Y48 WeakPolarHBondContact O-CA 3.35Å; S44-Y48 WeakPolarHBondContact O-CB 3.23Å; S44-Y48 PolarHBondContact O-N 2.88Å; S44-W49 VanDerWaalsContact CB-CZ2 3.48Å; S44-W49 PolarHBondContact O-N 3.25Å
45	F	92.7	Very high	87.3	Confident	13 Å²	13	34.3 Å²	34.3	6%	0.057	18%	0.182	C	C	.	.	I	π-helix	trans	-62.5	-57.6	175.4	174.5	-104.8	0	0	0	111.9	I41 I42 I43 I47 W49 L50 F96 V97 W100 M101	I41-F45 WeakPolarHBondContact O-CB 3.34Å; I41-F45 PolarHBondContact O-N 2.94Å; I42-F45 PolarHBondContact O-N 3.43Å; I43-F45 PolarHBondContact O-N 3.5Å; F45-I47 VanDerWaalsContact C-N 3.31Å; F45-I47 PolarHBondContact O-N 3.26Å; F45-W49 HydrophobicContact CB-CD2 4.46Å; F45-W49 HydrophobicContact CB-CE3 3.81Å; F45-W49 HydrophobicContact CB-CZ3 4.33Å; F45-W49 HydrophobicContact CD2-CB 4.27Å; F45-W49 HydrophobicContact CD2-CE3 4.23Å; F45-W49 PolarHBondContact O-N 3.13Å; F45-L50 HydrophobicContact CE1-CB 4.48Å; F45-L50 HydrophobicContact CE2-CB 4.31Å; F45-L50 HydrophobicContact CZ-CB 4.24Å; F45-L50 HydrophobicContact CZ-CD1 4.48Å; F45-L50 VanDerWaalsContact O-CB 3.24Å; F45-L50 WeakPolarHBondContact O-CB 3.45Å; F45-L50 PolarHBondContact O-N 3.15Å; F45-F96 HydrophobicContact CE1-CD1 4.35Å; F45-F96 AromaticContact CE1-CE1 3.86Å; F45-F96 HydrophobicContact CE1-CE1 3.86Å; F45-F96 HydrophobicContact CZ-CD1 4.41Å; F45-F96 AromaticContact CZ-CE1 3.93Å; F45-F96 HydrophobicContact CZ-CE1 3.93Å; F45-V97 HydrophobicContact CB-CG2 4.16Å; F45-V97 HydrophobicContact CD1-CG2 4Å; F45-V97 HydrophobicContact CD2-CB 4.31Å; F45-V97 HydrophobicContact CD2-CG1 3.8Å; F45-V97 HydrophobicContact CD2-CG2 3.92Å; F45-V97 HydrophobicContact CE1-CG2 4.41Å; F45-V97 HydrophobicContact CE2-CG1 4.35Å; F45-V97 HydrophobicContact CE2-CG2 4.32Å; F45-V97 HydrophobicContact CG-CG1 4.29Å; F45-V97 HydrophobicContact CG-CG2 3.74Å; F45-W100 HydrophobicContact CE2-CB 4.07Å; F45-W100 AromaticContact CE2-CD1 3.92Å; F45-W100 AromaticContact CE2-CG 3.98Å; F45-W100 HydrophobicContact CE2-CG 3.98Å; F45-W100 HydrophobicContact CZ-CB 4.01Å; F45-W100 AromaticContact CZ-CD1 3.99Å; F45-W100 HydrophobicContact CZ-CD2 4.19Å; F45-W100 AromaticContact CZ-CG 3.76Å; F45-W100 HydrophobicContact CZ-CG 3.76Å; F45-M101 HydrophobicContact CD2-CG 4.27Å; F45-M101 HydrophobicContact CD2-SD 4.1Å; F45-M101 HydrophobicContact CE2-CG 4.18Å; F45-M101 HydrophobicContact CE2-SD 3.96Å
46	C	89	Confident	86.4	Confident	39 Å²	39	35.1 Å²	35.1	26%	0.264	18%	0.178	S	C	.	.	I	π-helix	trans	-66.4	-27.5	-172.1	-70.1	0	0	0	0	114.5	I42	I42-C46 WeakPolarHBondContact O-CB 3.5Å; I42-C46 PolarHBondContact O-N 2.85Å; I42-C46 PolarHBondContact O-SG 2.94Å; I42-C46 VanDerWaalsContact O-SG 3.37Å
47	I	87.3	Confident	85.6	Confident	37 Å²	37	35.3 Å²	35.3	19%	0.19	18%	0.175	C	C	.	.	I	π-helix	trans	-101.6	-30.1	-176.2	-54.4	-61.2	0	0	0	112.8	F2 L14 I43 F45	F2-I47 HydrophobicContact CB-CD1 3.91Å; F2-I47 HydrophobicContact CD2-CD1 4.46Å; F2-I47 HydrophobicContact CG-CD1 4.35Å; L14-I47 HydrophobicContact CD1-CG1 4.5Å; L14-I47 HydrophobicContact CD1-CG2 4.15Å; I43-I47 HydrophobicContact CG2-CG1 4.15Å; I43-I47 WeakPolarHBondContact O-CB 3.48Å; I43-I47 WeakPolarHBondContact O-CG1 3.4Å; I43-I47 PolarHBondContact O-N 3.42Å; F45-I47 VanDerWaalsContact C-N 3.31Å; F45-I47 PolarHBondContact O-N 3.26Å
48	Y	87.7	Confident	84.5	Confident	61 Å²	61	37.1 Å²	37.1	24%	0.239	18%	0.183	C	C	.	.	I	π-helix	trans	-122.1	-53.1	-172.5	-56.7	-85.2	0	0	0	113.5	L14 I17 E18 S44 P51 M52	L14-Y48 HydrophobicContact CD1-CE2 3.94Å; L14-Y48 VanDerWaalsContact CD1-OH 3.27Å; L14-Y48 WeakPolarHBondContact CD1-OH 3.33Å; I17-Y48 HydrophobicContact CB-CE2 4.36Å; I17-Y48 HydrophobicContact CG2-CD2 3.85Å; I17-Y48 HydrophobicContact CG2-CE2 3.44Å; I17-Y48 VanDerWaalsContact CG2-CE2 3.44Å; E18-Y48 WeakPolarHBondContact CG-OH 3.34Å; E18-Y48 PolarHBondContact OE1-OH 3.43Å; S44-Y48 WeakPolarHBondContact O-CA 3.35Å; S44-Y48 WeakPolarHBondContact O-CB 3.23Å; S44-Y48 PolarHBondContact O-N 2.88Å; Y48-P51 WeakPolarHBondContact O-CD 3.02Å; Y48-M52 WeakPolarHBondContact O-CG 3.33Å; Y48-M52 PolarHBondContact O-N 2.82Å
49	W	91	Very high	83.2	Confident	23 Å²	23	39.3 Å²	39.3	9%	0.087	19%	0.189	C	C	.	.	I	π-helix	trans	-75	-38.3	-171.7	-45.8	-23.2	0	0	0	112.8	I41 S44 F45 M52 V73 F76 L77 V97 M101	I41-W49 HydrophobicContact CD1-CH2 3.97Å; I41-W49 HydrophobicContact CG2-CH2 4.43Å; I41-W49 HydrophobicContact CG2-CZ3 4.31Å; S44-W49 VanDerWaalsContact CB-CZ2 3.48Å; S44-W49 PolarHBondContact O-N 3.25Å; F45-W49 HydrophobicContact CB-CD2 4.46Å; F45-W49 HydrophobicContact CB-CE3 3.81Å; F45-W49 HydrophobicContact CB-CZ3 4.33Å; F45-W49 HydrophobicContact CD2-CB 4.27Å; F45-W49 HydrophobicContact CD2-CE3 4.23Å; F45-W49 PolarHBondContact O-N 3.13Å; W49-M52 WeakPolarHBondContact O-CB 3.39Å; W49-M52 PolarHBondContact O-N 3Å; W49-M52 VanDerWaalsContact O-N 3.09Å; W49-V73 HydrophobicContact CB-CG1 4.37Å; W49-V73 HydrophobicContact CD2-CG1 3.77Å; W49-V73 HydrophobicContact CE3-CG1 4.24Å; W49-V73 HydrophobicContact CG-CG1 3.83Å; W49-V73 HydrophobicContact CG-CG2 4.15Å; W49-F76 HydrophobicContact CH2-CD1 4.26Å; W49-F76 AromaticContact CH2-CE1 3.91Å; W49-F76 HydrophobicContact CH2-CE1 3.91Å; W49-F76 HydrophobicContact CZ2-CD1 4.26Å; W49-F76 HydrophobicContact CZ2-CE1 4.12Å; W49-L77 HydrophobicContact CH2-CD2 4.16Å; W49-L77 HydrophobicContact CZ3-CD1 4.46Å; W49-L77 HydrophobicContact CZ3-CD2 4.02Å; W49-V97 HydrophobicContact CE3-CG1 4.1Å; W49-V97 HydrophobicContact CZ3-CG1 4.05Å; W49-M101 HydrophobicContact CB-CE 3.89Å; W49-M101 HydrophobicContact CB-SD 3.56Å; W49-M101 VanDerWaalsContact CB-SD 3.56Å
50	L	87.3	Confident	81.6	Confident	55 Å²	55	41.4 Å²	41.4	29%	0.288	21%	0.206	S	C	.	.	H	α-helix	trans	-56.6	-50.9	175.3	168.7	62	0	0	0	111.6	F45 M52 T53 W100	F45-L50 HydrophobicContact CE1-CB 4.48Å; F45-L50 HydrophobicContact CE2-CB 4.31Å; F45-L50 HydrophobicContact CZ-CB 4.24Å; F45-L50 HydrophobicContact CZ-CD1 4.48Å; F45-L50 VanDerWaalsContact O-CB 3.24Å; F45-L50 WeakPolarHBondContact O-CB 3.45Å; F45-L50 PolarHBondContact O-N 3.15Å; L50-M52 VanDerWaalsContact C-N 3.3Å; L50-M52 PolarHBondContact O-N 2.89Å; L50-T53 PolarHBondContact O-N 3.05Å; L50-T53 VanDerWaalsContact O-N 3.12Å; L50-T53 PolarHBondContact O-OG1 2.75Å; L50-W100 HydrophobicContact CD1-CD2 4.29Å; L50-W100 HydrophobicContact CD1-CH2 4.38Å; L50-W100 HydrophobicContact CD1-CZ2 3.46Å; L50-W100 VanDerWaalsContact CD1-CZ2 3.46Å; L50-W100 VanDerWaalsContact CD1-NE1 3.32Å
51	P	85	Confident	79.6	Confident	53 Å²	53	43.6 Å²	43.6	34%	0.344	22%	0.221	S	C	.	.	H	α-helix	trans	-52.5	-38.3	170.4	-31.3	36	0	0	0	115.6	Y48 T53 H54 Y57	Y48-P51 WeakPolarHBondContact O-CD 3.02Å; P51-T53 PolarHBondContact O-N 3.4Å; P51-T53 VanDerWaalsContact O-N 3.12Å; P51-H54 PolarHBondContact O-N 2.85Å; P51-H54 VanDerWaalsContact O-N 3.14Å; P51-Y57 HydrophobicContact CB-CD2 4.03Å; P51-Y57 HydrophobicContact CB-CE2 4.48Å; P51-Y57 WeakPolarHBondContact O-CB 3.32Å
52	M	82.9	Confident	77.6	Confident	19 Å²	19	48.7 Å²	48.7	9%	0.094	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-18	179.7	-64.8	165.5	-174.7	0	0	113.5	Y48 W49 L50 H54 Y57 H58 L70 V73	Y48-M52 WeakPolarHBondContact O-CG 3.33Å; Y48-M52 PolarHBondContact O-N 2.82Å; W49-M52 WeakPolarHBondContact O-CB 3.39Å; W49-M52 PolarHBondContact O-N 3Å; W49-M52 VanDerWaalsContact O-N 3.09Å; L50-M52 VanDerWaalsContact C-N 3.3Å; L50-M52 PolarHBondContact O-N 2.89Å; M52-H54 VanDerWaalsContact C-N 3.3Å; M52-H54 PolarHBondContact O-N 2.64Å; M52-Y57 HydrophobicContact CB-CE1 4.48Å; M52-Y57 HydrophobicContact CG-CD1 4.34Å; M52-Y57 HydrophobicContact CG-CD2 4.3Å; M52-Y57 HydrophobicContact CG-CE1 3.86Å; M52-Y57 HydrophobicContact CG-CE2 3.79Å; M52-H58 PolarHBondContact O-NE2 3.48Å; M52-L70 HydrophobicContact CB-CD1 4.21Å; M52-V73 HydrophobicContact SD-CG2 3.9Å
53	T	76.8	Confident	75.7	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.2	177.4	65.1	0	0	0	0	114.2	L50 P51 W100 M101 H105 F106	L50-T53 PolarHBondContact O-N 3.05Å; L50-T53 VanDerWaalsContact O-N 3.12Å; L50-T53 PolarHBondContact O-OG1 2.75Å; P51-T53 PolarHBondContact O-N 3.4Å; P51-T53 VanDerWaalsContact O-N 3.12Å; T53-W100 PolarHBondContact OG1-NE1 2.8Å; T53-M101 HydrophobicContact CG2-CE 3.87Å; T53-M101 HydrophobicContact CG2-SD 3.76Å; T53-H105 WeakPolarHBondContact O-CA 3.49Å; T53-F106 PolarHBondContact O-N 3.08Å
54	H	75.1	Confident	73.6	Confident	64 Å²	64	63.5 Å²	63.5	30%	0.296	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-105.6	133	-173.9	-170.5	-96.4	0	0	0	112.9	P51 M52 L56 Y57 F106	P51-H54 PolarHBondContact O-N 2.85Å; P51-H54 VanDerWaalsContact O-N 3.14Å; M52-H54 VanDerWaalsContact C-N 3.3Å; M52-H54 PolarHBondContact O-N 2.64Å; H54-L56 PolarHBondContact ND1-N 3.4Å; H54-L56 PolarHBondContact O-N 3.41Å; H54-Y57 VanDerWaalsContact O-CB 3.26Å; H54-Y57 WeakPolarHBondContact O-CB 3.26Å; H54-Y57 PolarHBondContact O-N 2.88Å; H54-F106 HydrophobicContact CB-CD2 4.24Å; H54-F106 AromaticContact CD2-CD2 3.77Å; H54-F106 AromaticContact CD2-CG 3.71Å
55	V	68	Low	71.5	Confident	11 Å²	11	65.9 Å²	65.9	7%	0.067	35%	0.347	C	S	.	.	H	α-helix	trans	-44.7	-42.3	-179.5	53.5	0	0	0	0	114.4	Y57 H58 R59	V55-Y57 PolarHBondContact O-N 3.5Å; V55-H58 PolarHBondContact O-N 3.06Å; V55-R59 HydrophobicContact CG2-CG 4.15Å; V55-R59 PolarHBondContact O-N 3.01Å; V55-R59 VanDerWaalsContact O-N 3.09Å
56	L	69.5	Low	69.5	Low	76 Å²	76	65.8 Å²	65.8	40%	0.398	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-24.8	-177.5	-69.7	179	0	0	0	113.6	H54 H58 R59 T60 V116	H54-L56 PolarHBondContact ND1-N 3.4Å; H54-L56 PolarHBondContact O-N 3.41Å; L56-H58 VanDerWaalsContact C-N 3.29Å; L56-H58 PolarHBondContact O-N 3.14Å; L56-R59 PolarHBondContact O-N 3.27Å; L56-T60 VanDerWaalsContact O-CG2 3.32Å; L56-T60 WeakPolarHBondContact O-CG2 3.29Å; L56-T60 PolarHBondContact O-N 2.99Å; L56-T60 PolarHBondContact O-OG1 3.42Å; L56-V116 HydrophobicContact CD2-CG2 4.06Å
57	Y	72.7	Confident	68.2	Low	68 Å²	68	68.4 Å²	68.4	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-38.8	172.8	-175.6	-79.7	0	0	0	111.3	P51 M52 H54 V55	P51-Y57 HydrophobicContact CB-CD2 4.03Å; P51-Y57 HydrophobicContact CB-CE2 4.48Å; P51-Y57 WeakPolarHBondContact O-CB 3.32Å; M52-Y57 HydrophobicContact CB-CE1 4.48Å; M52-Y57 HydrophobicContact CG-CD1 4.34Å; M52-Y57 HydrophobicContact CG-CD2 4.3Å; M52-Y57 HydrophobicContact CG-CE1 3.86Å; M52-Y57 HydrophobicContact CG-CE2 3.79Å; H54-Y57 VanDerWaalsContact O-CB 3.26Å; H54-Y57 WeakPolarHBondContact O-CB 3.26Å; H54-Y57 PolarHBondContact O-N 2.88Å; V55-Y57 PolarHBondContact O-N 3.5Å
58	H	67.9	Low	67.5	Low	37 Å²	37	68.3 Å²	68.3	17%	0.171	37%	0.374	C	S	.	.	H	α-helix	trans	-82.7	-25.4	-178.3	-63.5	-81.1	0	0	0	112.8	M52 V55 L56 N66 L132	M52-H58 PolarHBondContact O-NE2 3.48Å; V55-H58 PolarHBondContact O-N 3.06Å; L56-H58 VanDerWaalsContact C-N 3.29Å; L56-H58 PolarHBondContact O-N 3.14Å; H58-N66 WeakPolarHBondContact CA-ND2 3.39Å; H58-N66 PolarHBondContact CE1-O 2.95Å; H58-N66 PolarHBondContact O-ND2 3.5Å; H58-L132 WeakPolarHBondContact NE2-CD2 3.47Å
59	R	63.4	Low	67.1	Low	102 Å²	102	66.8 Å²	66.8	39%	0.385	37%	0.374	S	S	.	.	H	α-helix	trans	-76.4	-23.9	174.2	-78.3	-176.4	166.1	-150	-6.9	114.7	V55 L56 V109 G111	V55-R59 HydrophobicContact CG2-CG 4.15Å; V55-R59 PolarHBondContact O-N 3.01Å; V55-R59 VanDerWaalsContact O-N 3.09Å; L56-R59 PolarHBondContact O-N 3.27Å; R59-V109 PolarHBondContact NH2-O 3.11Å; R59-G111 PolarHBondContact NH2-O 3.05Å
60	T	57.2	Low	66.6	Low	108 Å²	108	66 Å²	66	66%	0.663	37%	0.372	S	S	*	.	S	Bend	trans	-98.7	-3.5	-172	54.4	0	0	0	0	115	L56	L56-T60 VanDerWaalsContact O-CG2 3.32Å; L56-T60 WeakPolarHBondContact O-CG2 3.29Å; L56-T60 PolarHBondContact O-N 2.99Å; L56-T60 PolarHBondContact O-OG1 3.42Å
61	V	50.6	Low	66.5	Low	65 Å²	65	67.6 Å²	67.6	39%	0.394	38%	0.378	S	S	.	.	S	Bend	trans	-129.4	135.3	-175	174.9	0	0	0	0	108.3	N66	V61-N66 WeakPolarHBondContact CB-ND2 3.49Å; V61-N66 PolarHBondContact O-ND2 3.48Å
62	P	50.5	Low	66.7	Low	110 Å²	110	69.6 Å²	69.6	71%	0.714	39%	0.389	S	S	*	.			trans	-60.2	145	-168.2	20.8	-33.3	0	0	0	114.4	E64 G65	P62-E64 PolarHBondContact O-N 2.8Å; P62-G65 PolarHBondContact O-N 2.9Å
63	E	51.9	Low	67.1	Low	186 Å²	186	69.2 Å²	69.2	87%	0.869	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-59.5	-38.8	-158.6	-60.1	178.6	140.5	0	0	114.3	G65	E63-G65 VanDerWaalsContact C-N 3.28Å; E63-G65 PolarHBondContact O-N 3.23Å
64	E	47	Very low	67.8	Low	202 Å²	202	69.3 Å²	69.3	94%	0.944	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-67	-20.8	-171.8	-61.3	-173.6	144.5	0	0	114.8	P62	P62-E64 PolarHBondContact O-N 2.8Å
65	G	47.9	Very low	68.7	Low	54 Å²	54	69 Å²	69	56%	0.557	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-99.8	-15.9	-175.1	0	0	0	0	0	115.8	P62 E63	P62-G65 PolarHBondContact O-N 2.9Å; E63-G65 VanDerWaalsContact C-N 3.28Å; E63-G65 PolarHBondContact O-N 3.23Å
66	N	51.9	Low	69.9	Low	11 Å²	11	70.3 Å²	70.3	6%	0.059	40%	0.398	C	S	.	.	H	α-helix	trans	-83.9	-38.3	-149.9	-125.1	-13.2	0	0	0	114.8	H58 V61 G68 A69	H58-N66 WeakPolarHBondContact CA-ND2 3.39Å; H58-N66 PolarHBondContact CE1-O 2.95Å; H58-N66 PolarHBondContact O-ND2 3.5Å; V61-N66 WeakPolarHBondContact CB-ND2 3.49Å; V61-N66 PolarHBondContact O-ND2 3.48Å; N66-G68 PolarHBondContact O-N 2.96Å; N66-A69 PolarHBondContact O-N 2.73Å
67	S	60	Low	71.1	Confident	93 Å²	93	67.1 Å²	67.1	65%	0.65	38%	0.382	S	S	*	.	H	α-helix	trans	-61.7	-33.1	175.1	57.8	0	0	0	0	112.2	A69 L70 Q71	S67-A69 VanDerWaalsContact C-N 3.28Å; S67-A69 PolarHBondContact O-N 3.27Å; S67-L70 PolarHBondContact O-N 2.96Å; S67-Q71 VanDerWaalsContact O-CB 3.27Å; S67-Q71 WeakPolarHBondContact O-CB 3.41Å; S67-Q71 PolarHBondContact O-N 2.87Å
68	G	72.4	Confident	72.2	Confident	35 Å²	35	63.9 Å²	63.9	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-33.2	178.2	0	0	0	0	0	113.8	N66 T72	N66-G68 PolarHBondContact O-N 2.96Å; G68-T72 VanDerWaalsContact O-CB 3.3Å; G68-T72 WeakPolarHBondContact O-CB 3.35Å; G68-T72 PolarHBondContact O-N 3.02Å; G68-T72 PolarHBondContact O-OG1 3.5Å
69	A	79.6	Confident	73.4	Confident	30 Å²	30	63.9 Å²	63.9	25%	0.248	37%	0.37	C	S	.	.	H	α-helix	trans	-67.7	-50.2	179	0	0	0	0	0	111.8	N66 S67 T72 V73	N66-A69 PolarHBondContact O-N 2.73Å; S67-A69 VanDerWaalsContact C-N 3.28Å; S67-A69 PolarHBondContact O-N 3.27Å; A69-T72 WeakPolarHBondContact O-CB 3.41Å; A69-T72 PolarHBondContact O-N 3.34Å; A69-V73 PolarHBondContact O-N 3.5Å
70	L	82	Confident	74.8	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-67.8	-41	178.7	-173.4	54.3	0	0	0	111.3	M52 S67 T72 V73 F74 M101 L132 V133	M52-L70 HydrophobicContact CB-CD1 4.21Å; S67-L70 PolarHBondContact O-N 2.96Å; L70-T72 VanDerWaalsContact C-N 3.27Å; L70-T72 PolarHBondContact O-N 3.37Å; L70-V73 PolarHBondContact O-N 2.93Å; L70-V73 VanDerWaalsContact O-N 3.16Å; L70-F74 HydrophobicContact CD1-CD1 4.01Å; L70-F74 HydrophobicContact CD1-CE1 3.68Å; L70-F74 HydrophobicContact CG-CD1 4.26Å; L70-F74 HydrophobicContact CG-CE1 4.03Å; L70-F74 WeakPolarHBondContact O-CD1 3.4Å; L70-F74 PolarHBondContact O-N 2.81Å; L70-M101 HydrophobicContact CD1-CE 3.59Å; L70-L132 HydrophobicContact CD2-CD2 3.8Å; L70-L132 HydrophobicContact CD2-CG 4.2Å; L70-V133 HydrophobicContact CD2-CG2 3.45Å; L70-V133 VanDerWaalsContact CD2-CG2 3.45Å; L70-V133 HydrophobicContact CG-CG2 4.22Å
71	Q	84.8	Confident	76.3	Confident	87 Å²	87	55 Å²	55	41%	0.407	33%	0.326	S	S	.	.	H	α-helix	trans	-61.4	-33.8	173.3	-176.5	55.4	58.8	0	0	112.4	S67 F74 S75	S67-Q71 VanDerWaalsContact O-CB 3.27Å; S67-Q71 WeakPolarHBondContact O-CB 3.41Å; S67-Q71 PolarHBondContact O-N 2.87Å; Q71-F74 PolarHBondContact O-N 3.02Å; Q71-S75 PolarHBondContact NE2-OG 2.86Å; Q71-S75 VanDerWaalsContact NE2-OG 3.13Å; Q71-S75 WeakPolarHBondContact O-CB 3.5Å; Q71-S75 PolarHBondContact O-N 3.46Å; Q71-S75 PolarHBondContact O-OG 2.95Å
72	T	88.8	Confident	78.3	Confident	96 Å²	96	52 Å²	52	59%	0.589	31%	0.307	S	S	*	.	H	α-helix	trans	-65	-43.2	174.1	-62.4	0	0	0	0	111.4	G68 A69 L70 F74 S75 F76	G68-T72 VanDerWaalsContact O-CB 3.3Å; G68-T72 WeakPolarHBondContact O-CB 3.35Å; G68-T72 PolarHBondContact O-N 3.02Å; G68-T72 PolarHBondContact O-OG1 3.5Å; A69-T72 WeakPolarHBondContact O-CB 3.41Å; A69-T72 PolarHBondContact O-N 3.34Å; L70-T72 VanDerWaalsContact C-N 3.27Å; L70-T72 PolarHBondContact O-N 3.37Å; T72-F74 VanDerWaalsContact C-N 3.33Å; T72-F74 PolarHBondContact O-N 3.28Å; T72-S75 PolarHBondContact O-N 2.87Å; T72-F76 WeakPolarHBondContact O-CB 3.27Å; T72-F76 PolarHBondContact O-N 2.9Å
73	V	90.6	Very high	80.4	Confident	10 Å²	10	46.7 Å²	46.7	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-41.1	174.1	178.8	0	0	0	0	111	W49 M52 A69 L70 F76 L77 M101	W49-V73 HydrophobicContact CB-CG1 4.37Å; W49-V73 HydrophobicContact CD2-CG1 3.77Å; W49-V73 HydrophobicContact CE3-CG1 4.24Å; W49-V73 HydrophobicContact CG-CG1 3.83Å; W49-V73 HydrophobicContact CG-CG2 4.15Å; M52-V73 HydrophobicContact SD-CG2 3.9Å; A69-V73 PolarHBondContact O-N 3.5Å; L70-V73 PolarHBondContact O-N 2.93Å; L70-V73 VanDerWaalsContact O-N 3.16Å; V73-F76 PolarHBondContact O-N 3.19Å; V73-L77 HydrophobicContact CG1-CD1 3.99Å; V73-L77 HydrophobicContact CG1-CG 4.37Å; V73-L77 WeakPolarHBondContact O-CG 3.47Å; V73-L77 PolarHBondContact O-N 3.45Å; V73-M101 HydrophobicContact CG1-CE 4.29Å
74	F	92.5	Very high	82.3	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-45.4	177.3	-86.4	48.2	0	0	0	112	L70 Q71 T72 F76 L77 A78 M101 V133 A137 L138	L70-F74 HydrophobicContact CD1-CD1 4.01Å; L70-F74 HydrophobicContact CD1-CE1 3.68Å; L70-F74 HydrophobicContact CG-CD1 4.26Å; L70-F74 HydrophobicContact CG-CE1 4.03Å; L70-F74 WeakPolarHBondContact O-CD1 3.4Å; L70-F74 PolarHBondContact O-N 2.81Å; Q71-F74 PolarHBondContact O-N 3.02Å; T72-F74 VanDerWaalsContact C-N 3.33Å; T72-F74 PolarHBondContact O-N 3.28Å; F74-F76 VanDerWaalsContact C-N 3.29Å; F74-F76 PolarHBondContact O-N 3.07Å; F74-L77 PolarHBondContact O-N 3.32Å; F74-A78 WeakPolarHBondContact O-CB 3.31Å; F74-A78 PolarHBondContact O-N 2.88Å; F74-M101 HydrophobicContact CE1-CE 4.41Å; F74-M101 VanDerWaalsContact CE1-O 3.24Å; F74-M101 WeakPolarHBondContact CE1-O 3.37Å; F74-M101 WeakPolarHBondContact CZ-O 3.43Å; F74-V133 HydrophobicContact CD2-CG1 4.48Å; F74-V133 HydrophobicContact CE2-CG1 3.71Å; F74-V133 HydrophobicContact CZ-CB 4.49Å; F74-V133 HydrophobicContact CZ-CG1 4.05Å; F74-V133 HydrophobicContact CZ-CG2 4.32Å; F74-A137 HydrophobicContact CD2-CB 4.35Å; F74-A137 HydrophobicContact CE2-CB 4.07Å; F74-L138 HydrophobicContact CB-CD1 4.29Å; F74-L138 HydrophobicContact CD2-CB 3.75Å; F74-L138 HydrophobicContact CD2-CD1 4.35Å; F74-L138 HydrophobicContact CE2-CB 3.77Å; F74-L138 HydrophobicContact CG-CB 4.45Å; F74-L138 HydrophobicContact CG-CD1 4.31Å; F74-L138 HydrophobicContact CZ-CB 4.5Å; F74-L138 VanDerWaalsContact O-CD1 3.31Å; F74-L138 WeakPolarHBondContact O-CD1 3.44Å
75	S	92.8	Very high	84.4	Confident	59 Å²	59	30.3 Å²	30.3	41%	0.413	20%	0.196	S	C	.	.	H	α-helix	trans	-63.6	-33.6	175.3	-67.5	0	0	0	0	112.6	Q71 T72 D79	Q71-S75 PolarHBondContact NE2-OG 2.86Å; Q71-S75 VanDerWaalsContact NE2-OG 3.13Å; Q71-S75 WeakPolarHBondContact O-CB 3.5Å; Q71-S75 PolarHBondContact O-N 3.46Å; Q71-S75 PolarHBondContact O-OG 2.95Å; T72-S75 PolarHBondContact O-N 2.87Å; S75-D79 PolarHBondContact O-N 2.7Å
76	F	93.8	Very high	86.6	Confident	38 Å²	38	28 Å²	28	17%	0.167	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-48.8	173	172.5	-97.3	0	0	0	112.2	T26 L29 I41 W49 T72 V73 F74 A78 D79 V82	T26-F76 HydrophobicContact CG2-CE2 4.3Å; L29-F76 HydrophobicContact CD2-CE2 3.72Å; L29-F76 HydrophobicContact CD2-CZ 3.59Å; I41-F76 HydrophobicContact CD1-CE1 3.96Å; I41-F76 HydrophobicContact CD1-CZ 4.12Å; W49-F76 HydrophobicContact CH2-CD1 4.26Å; W49-F76 AromaticContact CH2-CE1 3.91Å; W49-F76 HydrophobicContact CH2-CE1 3.91Å; W49-F76 HydrophobicContact CZ2-CD1 4.26Å; W49-F76 HydrophobicContact CZ2-CE1 4.12Å; T72-F76 WeakPolarHBondContact O-CB 3.27Å; T72-F76 PolarHBondContact O-N 2.9Å; V73-F76 PolarHBondContact O-N 3.19Å; F74-F76 VanDerWaalsContact C-N 3.29Å; F74-F76 PolarHBondContact O-N 3.07Å; F76-A78 VanDerWaalsContact C-N 3.28Å; F76-A78 PolarHBondContact O-N 3.48Å; F76-D79 PolarHBondContact O-N 2.91Å; F76-V82 HydrophobicContact CD1-CG1 4.09Å; F76-V82 HydrophobicContact CD2-CG1 4.31Å; F76-V82 HydrophobicContact CD2-CG2 4.01Å; F76-V82 HydrophobicContact CE1-CG1 3.65Å; F76-V82 HydrophobicContact CE2-CG1 3.9Å; F76-V82 HydrophobicContact CE2-CG2 3.74Å; F76-V82 HydrophobicContact CG-CG1 4.4Å; F76-V82 HydrophobicContact CZ-CG1 3.54Å; F76-V82 HydrophobicContact CZ-CG2 4.22Å; F76-V82 WeakPolarHBondContact O-CB 3.22Å; F76-V82 WeakPolarHBondContact O-CG1 3.38Å
77	L	94.6	Very high	88.5	Confident	9 Å²	9	28.9 Å²	28.9	5%	0.047	17%	0.174	C	C	.	.	H	α-helix	trans	-69.9	-24	179.7	-68.7	177	0	0	0	113.2	W49 V73 F74 L86 M101 L138	W49-L77 HydrophobicContact CH2-CD2 4.16Å; W49-L77 HydrophobicContact CZ3-CD1 4.46Å; W49-L77 HydrophobicContact CZ3-CD2 4.02Å; V73-L77 HydrophobicContact CG1-CD1 3.99Å; V73-L77 HydrophobicContact CG1-CG 4.37Å; V73-L77 WeakPolarHBondContact O-CG 3.47Å; V73-L77 PolarHBondContact O-N 3.45Å; F74-L77 PolarHBondContact O-N 3.32Å; L77-L86 HydrophobicContact CD2-CD1 3.88Å; L77-M101 HydrophobicContact CD1-CG 4.39Å; L77-L138 HydrophobicContact CB-CD1 3.78Å; L77-L138 HydrophobicContact CB-CD2 4.26Å; L77-L138 HydrophobicContact CD1-CD2 4.21Å
78	A	96	Very high	89.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.3	174.8	0	0	0	0	0	114.6	F74 F76 L138 N141 L142 N145	F74-A78 WeakPolarHBondContact O-CB 3.31Å; F74-A78 PolarHBondContact O-N 2.88Å; F76-A78 VanDerWaalsContact C-N 3.28Å; F76-A78 PolarHBondContact O-N 3.48Å; A78-L138 HydrophobicContact CB-CD1 4.05Å; A78-N141 HydrophobicContact CB-CB 3.54Å; A78-L142 HydrophobicContact CB-CB 4.34Å; A78-N145 PolarHBondContact O-ND2 3.32Å
79	D	93.7	Very high	90.6	Very high	37 Å²	37	29.4 Å²	29.4	20%	0.198	16%	0.158	C	C	.	.			trans	-65.4	128.8	176	173.6	-84.3	0	0	0	109.9	S75 F76 H81 V82 F83	S75-D79 PolarHBondContact O-N 2.7Å; F76-D79 PolarHBondContact O-N 2.91Å; D79-H81 PolarHBondContact O-N 3.23Å; D79-H81 VanDerWaalsContact O-N 3.16Å; D79-H81 WeakPolarHBondContact OD1-CA 3.43Å; D79-H81 VanDerWaalsContact OD1-CB 3.26Å; D79-H81 WeakPolarHBondContact OD1-CB 3.35Å; D79-H81 IonicContact OD1-CD2 2.69Å; D79-H81 IonicContact OD1-CG 3.29Å; D79-H81 PolarHBondContact OD1-N 2.73Å; D79-H81 IonicContact OD2-CD2 3.8Å; D79-V82 HydrophobicContact CB-CB 4.03Å; D79-V82 HydrophobicContact CB-CG2 3.9Å; D79-V82 PolarHBondContact O-N 2.88Å; D79-V82 PolarHBondContact OD1-N 3.03Å; D79-F83 WeakPolarHBondContact O-CB 3.45Å; D79-F83 PolarHBondContact O-N 3.06Å
80	P	91.9	Very high	91.1	Very high	3 Å²	3	28 Å²	28	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-63.5	-24.3	-174.2	-24.8	35.4	0	0	0	114.7	N84 N145 V149 L170	P80-N84 WeakPolarHBondContact O-CB 3.39Å; P80-N84 PolarHBondContact O-N 2.98Å; P80-N84 VanDerWaalsContact O-N 3.09Å; P80-N145 HydrophobicContact CG-CB 3.8Å; P80-V149 HydrophobicContact CB-CG2 4.28Å; P80-V149 HydrophobicContact CG-CG2 3.98Å; P80-L170 HydrophobicContact CB-CD2 4Å
81	H	88.3	Confident	91.2	Very high	21 Å²	21	32.5 Å²	32.5	10%	0.097	16%	0.163	C	C	.	.	H	α-helix	trans	-83.8	-40.5	178.8	-51.1	-79.2	0	0	0	111.2	L30 D79 N84 K85 Y337	L30-H81 HydrophobicContact CD1-CB 3.91Å; D79-H81 PolarHBondContact O-N 3.23Å; D79-H81 VanDerWaalsContact O-N 3.16Å; D79-H81 WeakPolarHBondContact OD1-CA 3.43Å; D79-H81 VanDerWaalsContact OD1-CB 3.26Å; D79-H81 WeakPolarHBondContact OD1-CB 3.35Å; D79-H81 IonicContact OD1-CD2 2.69Å; D79-H81 IonicContact OD1-CG 3.29Å; D79-H81 PolarHBondContact OD1-N 2.73Å; D79-H81 IonicContact OD2-CD2 3.8Å; H81-N84 PolarHBondContact O-N 1.94Å; H81-K85 WeakPolarHBondContact O-CB 3.34Å; H81-K85 PolarHBondContact O-N 3.5Å; H81-Y337 AromaticContact CD2-CD1 3.72Å; H81-Y337 PolarHBondContact CE1-O 3.28Å; H81-Y337 AromaticContact CG-CD1 3.94Å; H81-Y337 AromaticContact NE2-CD1 3.81Å
82	V	92.9	Very high	90.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-47.1	169.8	178.4	0	0	0	0	110.2	T26 L30 F76 D79 N84 K85 L86	T26-V82 HydrophobicContact CG2-CG2 3.62Å; L30-V82 HydrophobicContact CD2-CG2 4.33Å; F76-V82 HydrophobicContact CD1-CG1 4.09Å; F76-V82 HydrophobicContact CD2-CG1 4.31Å; F76-V82 HydrophobicContact CD2-CG2 4.01Å; F76-V82 HydrophobicContact CE1-CG1 3.65Å; F76-V82 HydrophobicContact CE2-CG1 3.9Å; F76-V82 HydrophobicContact CE2-CG2 3.74Å; F76-V82 HydrophobicContact CG-CG1 4.4Å; F76-V82 HydrophobicContact CZ-CG1 3.54Å; F76-V82 HydrophobicContact CZ-CG2 4.22Å; F76-V82 WeakPolarHBondContact O-CB 3.22Å; F76-V82 WeakPolarHBondContact O-CG1 3.38Å; D79-V82 HydrophobicContact CB-CB 4.03Å; D79-V82 HydrophobicContact CB-CG2 3.9Å; D79-V82 PolarHBondContact O-N 2.88Å; D79-V82 PolarHBondContact OD1-N 3.03Å; V82-N84 PolarHBondContact O-N 3.09Å; V82-K85 PolarHBondContact O-N 3.12Å; V82-L86 HydrophobicContact CG1-CD1 3.85Å; V82-L86 HydrophobicContact CG1-CG 4.37Å; V82-L86 WeakPolarHBondContact O-CB 3.26Å; V82-L86 VanDerWaalsContact O-CG 3.3Å; V82-L86 WeakPolarHBondContact O-CG 3.34Å; V82-L86 PolarHBondContact O-N 3.14Å
83	F	94.6	Very high	90.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-54	-51.6	173.3	171.1	-92.4	0	0	0	111.8	D79 K85 L86 Y87 Q94 L142 L170 K173 V174 F177	D79-F83 WeakPolarHBondContact O-CB 3.45Å; D79-F83 PolarHBondContact O-N 3.06Å; F83-K85 PolarHBondContact O-N 2.78Å; F83-L86 WeakPolarHBondContact O-CB 3.3Å; F83-L86 PolarHBondContact O-N 2.92Å; F83-Y87 AromaticContact CZ-CD2 3.86Å; F83-Y87 HydrophobicContact CZ-CD2 3.86Å; F83-Y87 HydrophobicContact CZ-CG 4.3Å; F83-Y87 WeakPolarHBondContact O-CB 3.31Å; F83-Y87 PolarHBondContact O-N 3.45Å; F83-Q94 VanDerWaalsContact CD2-NE2 3.35Å; F83-L142 HydrophobicContact CB-CD1 3.97Å; F83-L142 HydrophobicContact CD2-CD1 4.12Å; F83-L142 HydrophobicContact CD2-CD2 3.87Å; F83-L142 HydrophobicContact CE2-CD2 4.19Å; F83-L142 HydrophobicContact CG-CD1 3.97Å; F83-L170 HydrophobicContact CD1-CD1 4.11Å; F83-L170 HydrophobicContact CE1-CD1 4.43Å; F83-K173 HydrophobicContact CE1-CB 4.07Å; F83-V174 HydrophobicContact CD1-CG2 3.52Å; F83-V174 HydrophobicContact CE1-CB 4.19Å; F83-V174 HydrophobicContact CE1-CG2 3.35Å; F83-V174 HydrophobicContact CE2-CG2 4.48Å; F83-V174 HydrophobicContact CG-CG2 4.2Å; F83-V174 HydrophobicContact CZ-CB 4.34Å; F83-V174 HydrophobicContact CZ-CG2 3.89Å; F83-F177 HydrophobicContact CE2-CB 3.9Å; F83-F177 AromaticContact CE2-CD1 3.56Å; F83-F177 HydrophobicContact CE2-CD1 3.56Å; F83-F177 HydrophobicContact CE2-CD2 4.2Å; F83-F177 HydrophobicContact CE2-CE1 4.11Å; F83-F177 AromaticContact CE2-CG 3.6Å; F83-F177 HydrophobicContact CE2-CG 3.6Å; F83-F177 HydrophobicContact CZ-CB 3.76Å; F83-F177 HydrophobicContact CZ-CD1 4.29Å; F83-F177 AromaticContact CZ-CG 3.98Å; F83-F177 HydrophobicContact CZ-CG 3.98Å
84	N	91.5	Very high	90.9	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-39.3	-178.3	-171.7	64	0	0	0	111.6	P80 H81 V82 Y87 E88 L170 K173 Y342	P80-N84 WeakPolarHBondContact O-CB 3.39Å; P80-N84 PolarHBondContact O-N 2.98Å; P80-N84 VanDerWaalsContact O-N 3.09Å; H81-N84 PolarHBondContact O-N 1.94Å; V82-N84 PolarHBondContact O-N 3.09Å; N84-Y87 PolarHBondContact O-N 3.24Å; N84-E88 VanDerWaalsContact O-CG 3.3Å; N84-E88 WeakPolarHBondContact O-CG 3.41Å; N84-E88 PolarHBondContact O-N 3.4Å; N84-L170 HydrophobicContact CB-CD1 3.77Å; N84-K173 WeakPolarHBondContact OD1-CD 3.32Å; N84-K173 PolarHBondContact OD1-NZ 3.41Å; N84-Y342 PolarHBondContact ND2-OH 3.25Å
85	K	91.6	Very high	90.9	Very high	36 Å²	36	30.4 Å²	30.4	16%	0.157	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-43.1	174.4	-179.5	75.6	178.5	-157.7	0	111.7	L30 L32 F37 H81 V82 F83 E88 T89	L30-K85 HydrophobicContact CD2-CB 3.53Å; L30-K85 HydrophobicContact CD2-CG 3.88Å; L30-K85 WeakPolarHBondContact O-CE 3.4Å; L30-K85 PolarHBondContact O-NZ 3.41Å; L32-K85 PolarHBondContact O-NZ 3.35Å; F37-K85 HydrophobicContact CD1-CG 3.85Å; F37-K85 HydrophobicContact CD2-CG 4.01Å; F37-K85 HydrophobicContact CE1-CB 4.31Å; F37-K85 HydrophobicContact CE1-CG 3.5Å; F37-K85 HydrophobicContact CE2-CG 3.68Å; F37-K85 HydrophobicContact CG-CG 4.09Å; F37-K85 HydrophobicContact CZ-CB 4.06Å; F37-K85 HydrophobicContact CZ-CG 3.41Å; F37-K85 VanDerWaalsContact CZ-CG 3.41Å; H81-K85 WeakPolarHBondContact O-CB 3.34Å; H81-K85 PolarHBondContact O-N 3.5Å; V82-K85 PolarHBondContact O-N 3.12Å; F83-K85 PolarHBondContact O-N 2.78Å; K85-E88 PolarHBondContact O-N 3.36Å; K85-T89 HydrophobicContact CD-CG2 4.3Å; K85-T89 WeakPolarHBondContact O-CB 3.33Å; K85-T89 PolarHBondContact O-N 2.78Å; K85-T89 VanDerWaalsContact O-N 3.12Å; K85-T89 PolarHBondContact O-OG1 3.27Å
86	L	94.1	Very high	90.8	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-45.7	174.1	-74.5	164.5	0	0	0	111.3	F37 I41 L77 V82 F83 E88 T89 C90 R91 Q94	F37-L86 HydrophobicContact CE1-CD2 3.85Å; F37-L86 HydrophobicContact CE1-CG 4.1Å; F37-L86 HydrophobicContact CZ-CD2 4.22Å; F37-L86 HydrophobicContact CZ-CG 4.21Å; I41-L86 HydrophobicContact CB-CD2 4.42Å; I41-L86 HydrophobicContact CD1-CD2 4Å; I41-L86 HydrophobicContact CG1-CD2 3.83Å; I41-L86 HydrophobicContact CG2-CD2 3.89Å; L77-L86 HydrophobicContact CD2-CD1 3.88Å; V82-L86 HydrophobicContact CG1-CD1 3.85Å; V82-L86 HydrophobicContact CG1-CG 4.37Å; V82-L86 WeakPolarHBondContact O-CB 3.26Å; V82-L86 VanDerWaalsContact O-CG 3.3Å; V82-L86 WeakPolarHBondContact O-CG 3.34Å; V82-L86 PolarHBondContact O-N 3.14Å; F83-L86 WeakPolarHBondContact O-CB 3.3Å; F83-L86 PolarHBondContact O-N 2.92Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 2.81Å; L86-T89 PolarHBondContact O-N 3.33Å; L86-C90 HydrophobicContact CD2-CB 4.03Å; L86-C90 CarbonylContact O-C 3.47Å; L86-C90 WeakPolarHBondContact O-CA 3.43Å; L86-C90 WeakPolarHBondContact O-CB 3.34Å; L86-C90 PolarHBondContact O-N 2.87Å; L86-R91 PolarHBondContact O-N 3.3Å; L86-Q94 HydrophobicContact CB-CG 3.94Å; L86-Q94 HydrophobicContact CD1-CG 4.49Å
87	Y	91.7	Very high	90.8	Very high	30 Å²	30	28.8 Å²	28.8	12%	0.118	14%	0.138	C	C	.	.	H	α-helix	trans	-62.9	-35.4	-179.5	-168.2	-90.4	0	0	0	112.9	F83 N84 Q94 K173 N176 F177	F83-Y87 AromaticContact CZ-CD2 3.86Å; F83-Y87 HydrophobicContact CZ-CD2 3.86Å; F83-Y87 HydrophobicContact CZ-CG 4.3Å; F83-Y87 WeakPolarHBondContact O-CB 3.31Å; F83-Y87 PolarHBondContact O-N 3.45Å; N84-Y87 PolarHBondContact O-N 3.24Å; Y87-Q94 VanDerWaalsContact CA-OE1 3.24Å; Y87-K173 HydrophobicContact CD1-CB 4.21Å; Y87-K173 HydrophobicContact CD1-CD 3.77Å; Y87-K173 HydrophobicContact CD1-CG 4.02Å; Y87-K173 HydrophobicContact CE1-CB 4.07Å; Y87-K173 HydrophobicContact CE1-CD 3.96Å; Y87-K173 HydrophobicContact CE1-CG 3.73Å; Y87-K173 HydrophobicContact CE2-CB 4.43Å; Y87-K173 HydrophobicContact CG-CB 4.44Å; Y87-K173 HydrophobicContact CG-CD 4.5Å; Y87-N176 PolarHBondContact OH-ND2 2.91Å; Y87-F177 HydrophobicContact CD2-CB 4.15Å; Y87-F177 HydrophobicContact CD2-CD2 4.21Å; Y87-F177 HydrophobicContact CE2-CB 3.98Å; Y87-F177 HydrophobicContact CE2-CD2 4.49Å
88	E	88.1	Confident	90.8	Very high	115 Å²	115	28.7 Å²	28.7	54%	0.537	14%	0.137	S	C	.	.	H	α-helix	trans	-82.1	-17.5	177.4	-63.3	-59.8	128.8	0	0	114.4	N84 K85 L86 K173	N84-E88 VanDerWaalsContact O-CG 3.3Å; N84-E88 WeakPolarHBondContact O-CG 3.41Å; N84-E88 PolarHBondContact O-N 3.4Å; K85-E88 PolarHBondContact O-N 3.36Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 2.81Å; E88-K173 WeakPolarHBondContact OE1-CE 3.19Å; E88-K173 IonicContact OE1-NZ 3.55Å; E88-K173 PolarHBondContact OE1-NZ 3.29Å
89	T	89.3	Confident	90.6	Very high	24 Å²	24	28.8 Å²	28.8	15%	0.147	14%	0.137	C	C	.	.	H	α-helix	trans	-134.2	-10.3	-168.1	65.6	0	0	0	0	116.4	S34 F37 K85 L86	S34-T89 WeakPolarHBondContact OG-CG2 3.27Å; F37-T89 VanDerWaalsContact CD1-OG1 3.26Å; F37-T89 WeakPolarHBondContact CD1-OG1 3.44Å; K85-T89 HydrophobicContact CD-CG2 4.3Å; K85-T89 WeakPolarHBondContact O-CB 3.33Å; K85-T89 PolarHBondContact O-N 2.78Å; K85-T89 VanDerWaalsContact O-N 3.12Å; K85-T89 PolarHBondContact O-OG1 3.27Å; L86-T89 PolarHBondContact O-N 3.33Å
90	C	89.3	Confident	90.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.			trans	-144.2	15.8	-171.7	-53.8	0	0	0	0	113	Q38 L86 D92 V93 Q94	Q38-C90 VanDerWaalsContact CA-SG 3.59Å; Q38-C90 HydrophobicContact CG-CB 4.4Å; L86-C90 HydrophobicContact CD2-CB 4.03Å; L86-C90 CarbonylContact O-C 3.47Å; L86-C90 WeakPolarHBondContact O-CA 3.43Å; L86-C90 WeakPolarHBondContact O-CB 3.34Å; L86-C90 PolarHBondContact O-N 2.87Å; C90-D92 PolarHBondContact O-N 3.16Å; C90-D92 VanDerWaalsContact O-N 3.1Å; C90-V93 CarbonylContact O-C 3.59Å; C90-V93 PolarHBondContact O-N 3.09Å; C90-Q94 WeakPolarHBondContact O-CB 3.26Å; C90-Q94 PolarHBondContact O-N 3.38Å
91	R	84.9	Confident	90.4	Very high	103 Å²	103	29.3 Å²	29.3	39%	0.389	14%	0.136	S	C	.	.	H	α-helix	trans	-55.4	-32.8	-168.5	-173.2	174	174.1	-168.8	-0.2	114.2	L86 V93 N176 E180	L86-R91 PolarHBondContact O-N 3.3Å; R91-V93 VanDerWaalsContact C-N 3.35Å; R91-N176 PolarHBondContact NH2-ND2 3.28Å; R91-E180 IonicContact CZ-OE1 3.6Å; R91-E180 IonicContact CZ-OE2 2.98Å; R91-E180 IonicContact NE-OE2 2.74Å; R91-E180 PolarHBondContact NE-OE2 2.91Å; R91-E180 IonicContact NH2-OE1 3.82Å; R91-E180 PolarHBondContact NH2-OE1 2.94Å; R91-E180 IonicContact NH2-OE2 3.66Å; R91-E180 PolarHBondContact NH2-OE2 3.05Å
92	D	75.5	Confident	90.4	Very high	100 Å²	100	28.6 Å²	28.6	54%	0.535	13%	0.133	S	C	.	.	H	α-helix	trans	-59.4	-40.5	174	60.8	-31.6	0	0	0	113.1	Q38 C90	Q38-D92 PolarHBondContact NE2-OD1 3.42Å; Q38-D92 PolarHBondContact NE2-OD2 3.09Å; C90-D92 PolarHBondContact O-N 3.16Å; C90-D92 VanDerWaalsContact O-N 3.1Å
93	V	87.5	Confident	90	Very high	33 Å²	33	29.7 Å²	29.7	20%	0.2	14%	0.138	C	C	.	.	H	α-helix	trans	-94.2	-27.4	179.2	175	0	0	0	0	112	I42 C90 R91 V95 F96 V97	I42-V93 HydrophobicContact CD1-CG2 4.26Å; I42-V93 HydrophobicContact CG1-CG1 4.11Å; I42-V93 HydrophobicContact CG1-CG2 4.37Å; C90-V93 CarbonylContact O-C 3.59Å; C90-V93 PolarHBondContact O-N 3.09Å; R91-V93 VanDerWaalsContact C-N 3.35Å; V93-V95 PolarHBondContact O-N 2.98Å; V93-F96 PolarHBondContact O-N 3.33Å; V93-V97 HydrophobicContact CG1-CG2 3.62Å; V93-V97 WeakPolarHBondContact O-CG2 3.18Å; V93-V97 PolarHBondContact O-N 2.97Å
94	Q	93.5	Very high	89.2	Confident	10 Å²	10	30 Å²	30	5%	0.047	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-45.1	-172.4	-170	-171.1	5.8	0	0	111.7	F83 L86 Y87 C90 V97 Y98 F177	F83-Q94 VanDerWaalsContact CD2-NE2 3.35Å; L86-Q94 HydrophobicContact CB-CG 3.94Å; L86-Q94 HydrophobicContact CD1-CG 4.49Å; Y87-Q94 VanDerWaalsContact CA-OE1 3.24Å; C90-Q94 WeakPolarHBondContact O-CB 3.26Å; C90-Q94 PolarHBondContact O-N 3.38Å; Q94-V97 PolarHBondContact O-N 3.37Å; Q94-Y98 WeakPolarHBondContact O-CB 3.43Å; Q94-Y98 PolarHBondContact O-N 3.48Å; Q94-F177 HydrophobicContact CB-CE2 4Å; Q94-F177 HydrophobicContact CG-CD2 4.5Å; Q94-F177 HydrophobicContact CG-CE2 3.49Å; Q94-F177 VanDerWaalsContact CG-CE2 3.49Å; Q94-F177 HydrophobicContact CG-CZ 3.69Å
95	V	92.5	Very high	88	Confident	8 Å²	8	30.8 Å²	30.8	5%	0.048	14%	0.143	C	C	.	.	H	α-helix	trans	-61.8	-44.8	178.6	177.7	0	0	0	0	110.9	V93 Y98 S99 F177 E180 L486	V93-V95 PolarHBondContact O-N 2.98Å; V95-Y98 PolarHBondContact O-N 3.44Å; V95-S99 WeakPolarHBondContact O-CB 3.36Å; V95-S99 PolarHBondContact O-N 3.06Å; V95-F177 HydrophobicContact CG2-CD2 4.19Å; V95-F177 HydrophobicContact CG2-CE2 3.71Å; V95-E180 HydrophobicContact CG2-CB 4.37Å; V95-L486 HydrophobicContact CG1-CD2 3.64Å
96	F	92.6	Very high	86.2	Confident	59 Å²	59	31.4 Å²	31.4	26%	0.259	15%	0.146	S	C	.	.	H	α-helix	trans	-62.9	-48.9	178	-179.7	-86.2	0	0	0	112.1	F45 V93 Y98 W100 N484 Y485 P487	F45-F96 HydrophobicContact CE1-CD1 4.35Å; F45-F96 AromaticContact CE1-CE1 3.86Å; F45-F96 HydrophobicContact CE1-CE1 3.86Å; F45-F96 HydrophobicContact CZ-CD1 4.41Å; F45-F96 AromaticContact CZ-CE1 3.93Å; F45-F96 HydrophobicContact CZ-CE1 3.93Å; V93-F96 PolarHBondContact O-N 3.33Å; F96-Y98 VanDerWaalsContact C-N 3.33Å; F96-Y98 PolarHBondContact O-N 3.09Å; F96-W100 HydrophobicContact CE1-CE3 4.03Å; F96-W100 HydrophobicContact CE2-CE3 4.42Å; F96-W100 AromaticContact CZ-CE3 3.65Å; F96-W100 HydrophobicContact CZ-CE3 3.65Å; F96-W100 HydrophobicContact CZ-CZ3 4.12Å; F96-W100 VanDerWaalsContact O-CB 3.29Å; F96-W100 WeakPolarHBondContact O-CB 3.41Å; F96-W100 PolarHBondContact O-N 2.97Å; F96-N484 WeakPolarHBondContact CD2-O 3.47Å; F96-Y485 WeakPolarHBondContact CA-O 3.48Å; F96-P487 HydrophobicContact CD2-CG 3.76Å; F96-P487 HydrophobicContact CE2-CB 4.17Å; F96-P487 HydrophobicContact CE2-CG 3.66Å; F96-P487 HydrophobicContact CG-CG 4.29Å; F96-P487 HydrophobicContact CZ-CG 4.1Å
97	V	93.5	Very high	84.1	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-40.7	178.8	169.9	0	0	0	0	110.9	F45 W49 V93 Q94 M101	F45-V97 HydrophobicContact CB-CG2 4.16Å; F45-V97 HydrophobicContact CD1-CG2 4Å; F45-V97 HydrophobicContact CD2-CB 4.31Å; F45-V97 HydrophobicContact CD2-CG1 3.8Å; F45-V97 HydrophobicContact CD2-CG2 3.92Å; F45-V97 HydrophobicContact CE1-CG2 4.41Å; F45-V97 HydrophobicContact CE2-CG1 4.35Å; F45-V97 HydrophobicContact CE2-CG2 4.32Å; F45-V97 HydrophobicContact CG-CG1 4.29Å; F45-V97 HydrophobicContact CG-CG2 3.74Å; W49-V97 HydrophobicContact CE3-CG1 4.1Å; W49-V97 HydrophobicContact CZ3-CG1 4.05Å; V93-V97 HydrophobicContact CG1-CG2 3.62Å; V93-V97 WeakPolarHBondContact O-CG2 3.18Å; V93-V97 PolarHBondContact O-N 2.97Å; Q94-V97 PolarHBondContact O-N 3.37Å; V97-M101 HydrophobicContact CG1-CG 4.15Å; V97-M101 VanDerWaalsContact O-CB 3.23Å; V97-M101 WeakPolarHBondContact O-CB 3.46Å; V97-M101 WeakPolarHBondContact O-CG 3.32Å; V97-M101 PolarHBondContact O-N 2.68Å
98	Y	94	Very high	81.8	Confident	7 Å²	7	33.7 Å²	33.7	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-50.1	179.1	-166.5	-84.6	0	0	0	112	Q94 V95 F96 W100 M101 Q102 L138 S139 L142 F177 L178 C181 E183	Q94-Y98 WeakPolarHBondContact O-CB 3.43Å; Q94-Y98 PolarHBondContact O-N 3.48Å; V95-Y98 PolarHBondContact O-N 3.44Å; F96-Y98 VanDerWaalsContact C-N 3.33Å; F96-Y98 PolarHBondContact O-N 3.09Å; Y98-W100 PolarHBondContact O-N 3.44Å; Y98-M101 PolarHBondContact O-N 2.95Å; Y98-Q102 WeakPolarHBondContact O-CB 3.35Å; Y98-Q102 PolarHBondContact O-N 2.95Å; Y98-Q102 VanDerWaalsContact O-N 3.13Å; Y98-L138 HydrophobicContact CD1-CD2 4.42Å; Y98-L138 HydrophobicContact CD2-CD2 3.45Å; Y98-L138 VanDerWaalsContact CD2-CD2 3.45Å; Y98-L138 HydrophobicContact CD2-CG 4.09Å; Y98-L138 HydrophobicContact CE1-CD2 4.38Å; Y98-L138 HydrophobicContact CE2-CD1 4.42Å; Y98-L138 HydrophobicContact CE2-CD2 3.42Å; Y98-L138 VanDerWaalsContact CE2-CD2 3.42Å; Y98-L138 HydrophobicContact CE2-CG 3.5Å; Y98-L138 VanDerWaalsContact CE2-CG 3.5Å; Y98-L138 HydrophobicContact CG-CD2 3.99Å; Y98-S139 WeakPolarHBondContact OH-CA 3.26Å; Y98-S139 PolarHBondContact OH-N 3.28Å; Y98-S139 PolarHBondContact OH-OG 3.29Å; Y98-S139 VanDerWaalsContact OH-OG 3.09Å; Y98-L142 HydrophobicContact CE2-CD2 4.2Å; Y98-F177 HydrophobicContact CD1-CE1 4.05Å; Y98-F177 HydrophobicContact CD1-CZ 4.4Å; Y98-F177 AromaticContact CD2-CE1 3.56Å; Y98-F177 HydrophobicContact CD2-CE1 3.56Å; Y98-F177 AromaticContact CD2-CZ 3.83Å; Y98-F177 HydrophobicContact CD2-CZ 3.83Å; Y98-F177 HydrophobicContact CE1-CE1 4.25Å; Y98-F177 AromaticContact CE2-CE1 3.76Å; Y98-F177 HydrophobicContact CE2-CE1 3.76Å; Y98-F177 HydrophobicContact CE2-CZ 4.48Å; Y98-F177 AromaticContact CG-CE1 3.7Å; Y98-F177 HydrophobicContact CG-CE1 3.7Å; Y98-F177 AromaticContact CG-CZ 3.77Å; Y98-F177 HydrophobicContact CG-CZ 3.77Å; Y98-L178 HydrophobicContact CE1-CD2 4.33Å; Y98-L178 WeakPolarHBondContact OH-CD2 3.22Å; Y98-C181 HydrophobicContact CD1-CB 4.12Å; Y98-C181 HydrophobicContact CE1-CB 4.41Å; Y98-E183 HydrophobicContact CE1-CG 4.3Å
99	S	91.4	Very high	79.4	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-44	175.8	-168.9	0	0	0	0	111.2	V95 Q102 H103 L486 P487	V95-S99 WeakPolarHBondContact O-CB 3.36Å; V95-S99 PolarHBondContact O-N 3.06Å; S99-Q102 PolarHBondContact O-N 3.43Å; S99-H103 WeakPolarHBondContact O-CA 3.12Å; S99-H103 WeakPolarHBondContact O-CB 3.29Å; S99-H103 PolarHBondContact O-N 3.41Å; S99-L486 WeakPolarHBondContact OG-CA 3.3Å; S99-P487 PolarHBondContact OG-O 2.96Å
100	W	90.7	Very high	77	Confident	51 Å²	51	32.6 Å²	32.6	19%	0.193	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-49.7	177.9	-168.8	-68.3	0	0	0	111.8	F45 L50 T53 F96 Y98 Q102 S104 F106 P487	F45-W100 HydrophobicContact CE2-CB 4.07Å; F45-W100 AromaticContact CE2-CD1 3.92Å; F45-W100 AromaticContact CE2-CG 3.98Å; F45-W100 HydrophobicContact CE2-CG 3.98Å; F45-W100 HydrophobicContact CZ-CB 4.01Å; F45-W100 AromaticContact CZ-CD1 3.99Å; F45-W100 HydrophobicContact CZ-CD2 4.19Å; F45-W100 AromaticContact CZ-CG 3.76Å; F45-W100 HydrophobicContact CZ-CG 3.76Å; L50-W100 HydrophobicContact CD1-CD2 4.29Å; L50-W100 HydrophobicContact CD1-CH2 4.38Å; L50-W100 HydrophobicContact CD1-CZ2 3.46Å; L50-W100 VanDerWaalsContact CD1-CZ2 3.46Å; L50-W100 VanDerWaalsContact CD1-NE1 3.32Å; T53-W100 PolarHBondContact OG1-NE1 2.8Å; F96-W100 HydrophobicContact CE1-CE3 4.03Å; F96-W100 HydrophobicContact CE2-CE3 4.42Å; F96-W100 AromaticContact CZ-CE3 3.65Å; F96-W100 HydrophobicContact CZ-CE3 3.65Å; F96-W100 HydrophobicContact CZ-CZ3 4.12Å; F96-W100 VanDerWaalsContact O-CB 3.29Å; F96-W100 WeakPolarHBondContact O-CB 3.41Å; F96-W100 PolarHBondContact O-N 2.97Å; Y98-W100 PolarHBondContact O-N 3.44Å; W100-Q102 PolarHBondContact O-N 2.97Å; W100-S104 WeakPolarHBondContact O-CB 3.34Å; W100-S104 PolarHBondContact O-N 3.39Å; W100-S104 VanDerWaalsContact O-N 3.09Å; W100-F106 HydrophobicContact CZ2-CE2 4.19Å; W100-F106 HydrophobicContact CZ2-CZ 4.32Å; W100-P487 HydrophobicContact CB-CG 3.92Å; W100-P487 HydrophobicContact CD2-CB 4.47Å; W100-P487 HydrophobicContact CD2-CG 4.47Å; W100-P487 HydrophobicContact CE3-CB 3.57Å; W100-P487 HydrophobicContact CE3-CG 3.77Å; W100-P487 HydrophobicContact CZ3-CB 4.03Å
101	M	90.3	Very high	74.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.2	-17	-175.6	-72.1	-52.3	-53.6	0	0	113.7	F45 W49 T53 L70 V73 F74 L77 V97 Y98 H105	F45-M101 HydrophobicContact CD2-CG 4.27Å; F45-M101 HydrophobicContact CD2-SD 4.1Å; F45-M101 HydrophobicContact CE2-CG 4.18Å; F45-M101 HydrophobicContact CE2-SD 3.96Å; W49-M101 HydrophobicContact CB-CE 3.89Å; W49-M101 HydrophobicContact CB-SD 3.56Å; W49-M101 VanDerWaalsContact CB-SD 3.56Å; T53-M101 HydrophobicContact CG2-CE 3.87Å; T53-M101 HydrophobicContact CG2-SD 3.76Å; L70-M101 HydrophobicContact CD1-CE 3.59Å; V73-M101 HydrophobicContact CG1-CE 4.29Å; F74-M101 HydrophobicContact CE1-CE 4.41Å; F74-M101 VanDerWaalsContact CE1-O 3.24Å; F74-M101 WeakPolarHBondContact CE1-O 3.37Å; F74-M101 WeakPolarHBondContact CZ-O 3.43Å; L77-M101 HydrophobicContact CD1-CG 4.39Å; V97-M101 HydrophobicContact CG1-CG 4.15Å; V97-M101 VanDerWaalsContact O-CB 3.23Å; V97-M101 WeakPolarHBondContact O-CB 3.46Å; V97-M101 WeakPolarHBondContact O-CG 3.32Å; V97-M101 PolarHBondContact O-N 2.68Å; Y98-M101 PolarHBondContact O-N 2.95Å; M101-H105 PolarHBondContact O-CE1 3.49Å; M101-H105 PolarHBondContact O-NE2 3.24Å; M101-H105 VanDerWaalsContact O-NE2 3.11Å
102	Q	88.4	Confident	72.9	Confident	7 Å²	7	34.4 Å²	34.4	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-104.4	-34.4	177	-171.5	167.5	-109.5	0	0	113.8	Y98 S99 W100 H105 H136 L138 S139 E183	Y98-Q102 WeakPolarHBondContact O-CB 3.35Å; Y98-Q102 PolarHBondContact O-N 2.95Å; Y98-Q102 VanDerWaalsContact O-N 3.13Å; S99-Q102 PolarHBondContact O-N 3.43Å; W100-Q102 PolarHBondContact O-N 2.97Å; Q102-H105 PolarHBondContact O-CD2 3.04Å; Q102-H136 PolarHBondContact OE1-O 3.32Å; Q102-L138 HydrophobicContact CG-CB 4.5Å; Q102-L138 VanDerWaalsContact OE1-CB 3.27Å; Q102-S139 PolarHBondContact NE2-OG 2.95Å; Q102-S139 PolarHBondContact OE1-OG 3.5Å; Q102-E183 PolarHBondContact NE2-OE1 2.89Å; Q102-E183 PolarHBondContact NE2-OE2 3.39Å
103	H	85.8	Confident	71.4	Confident	23 Å²	23	37.2 Å²	37.2	11%	0.106	23%	0.225	C	C	.	.	H	α-helix	trans	-124.1	-1.8	-165.6	-60.2	-50.8	0	0	0	115.4	S99 H136 E183 G488 A489 L531	S99-H103 WeakPolarHBondContact O-CA 3.12Å; S99-H103 WeakPolarHBondContact O-CB 3.29Å; S99-H103 PolarHBondContact O-N 3.41Å; H103-H136 AromaticContact CE1-CE1 3.87Å; H103-H136 AromaticContact CE1-ND1 3.9Å; H103-E183 IonicContact CD2-OE1 2.67Å; H103-E183 IonicContact CE1-OE1 3.97Å; H103-E183 PolarHBondContact CE1-OE1 3.42Å; H103-E183 IonicContact NE2-OE1 2.87Å; H103-E183 PolarHBondContact NE2-OE1 3.09Å; H103-G488 WeakPolarHBondContact O-CA 3.27Å; H103-A489 VanDerWaalsContact CB-O 3.31Å; H103-A489 WeakPolarHBondContact CB-O 3.43Å; H103-A489 PolarHBondContact CD2-O 2.92Å; H103-A489 VanDerWaalsContact CD2-O 3.25Å; H103-A489 VanDerWaalsContact CG-O 3.27Å; H103-A489 PolarHBondContact O-N 2.97Å; H103-L531 WeakPolarHBondContact CE1-CD2 3.35Å
104	S	76.2	Confident	69.2	Low	5 Å²	5	39 Å²	39	4%	0.035	24%	0.237	C	C	.	.			trans	-105.8	24.8	177.8	-63.1	0	0	0	0	114	W100 F106 P487 G488	W100-S104 WeakPolarHBondContact O-CB 3.34Å; W100-S104 PolarHBondContact O-N 3.39Å; W100-S104 VanDerWaalsContact O-N 3.09Å; S104-F106 WeakPolarHBondContact O-CD2 3.5Å; S104-F106 WeakPolarHBondContact O-CE2 3.47Å; S104-P487 PolarHBondContact OG-O 3.13Å; S104-G488 WeakPolarHBondContact OG-CA 3.34Å; S104-G488 PolarHBondContact OG-N 3.45Å
105	H	67.3	Low	66.8	Low	24 Å²	24	47 Å²	47	11%	0.111	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-68.2	131.9	177	-62.4	-62.4	0	0	0	112.1	T53 M101 Q102 L132	T53-H105 WeakPolarHBondContact O-CA 3.49Å; M101-H105 PolarHBondContact O-CE1 3.49Å; M101-H105 PolarHBondContact O-NE2 3.24Å; M101-H105 VanDerWaalsContact O-NE2 3.11Å; Q102-H105 PolarHBondContact O-CD2 3.04Å; H105-L132 HydrophobicContact CB-CB 4.34Å
106	F	54.3	Low	64.3	Low	49 Å²	49	48.3 Å²	48.3	22%	0.215	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-90.5	121	178.6	-61.1	-92.1	0	0	0	110.7	T53 H54 W100 S104 I120	T53-F106 PolarHBondContact O-N 3.08Å; H54-F106 HydrophobicContact CB-CD2 4.24Å; H54-F106 AromaticContact CD2-CD2 3.77Å; H54-F106 AromaticContact CD2-CG 3.71Å; W100-F106 HydrophobicContact CZ2-CE2 4.19Å; W100-F106 HydrophobicContact CZ2-CZ 4.32Å; S104-F106 WeakPolarHBondContact O-CD2 3.5Å; S104-F106 WeakPolarHBondContact O-CE2 3.47Å; F106-I120 HydrophobicContact CD1-CG2 4.27Å; F106-I120 WeakPolarHBondContact CD1-O 3.43Å
107	Y	49.4	Very low	61.7	Low	51 Å²	51	51.6 Å²	51.6	20%	0.2	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-56.4	142.7	-171.6	-76.2	-81.8	0	0	0	114.7	V109 Y129 P131 R530	Y107-V109 PolarHBondContact O-N 3.2Å; Y107-Y129 VanDerWaalsContact CE1-O 3.23Å; Y107-Y129 WeakPolarHBondContact CE1-O 3.29Å; Y107-P131 HydrophobicContact CE1-CB 4.33Å; Y107-R530 VanDerWaalsContact OH-CD 3.23Å; Y107-R530 WeakPolarHBondContact OH-CD 3.36Å; Y107-R530 WeakPolarHBondContact OH-CG 3.45Å; Y107-R530 PolarHBondContact OH-NE 3.01Å
108	G	42.9	Very low	59.1	Low	33 Å²	33	59.9 Å²	59.9	34%	0.34	34%	0.341	S	S	.	.			trans	-83.8	111.7	177.8	0	0	0	0	0	112.8	S110 Y129	G108-S110 PolarHBondContact O-N 2.71Å; G108-S110 VanDerWaalsContact O-N 3.15Å; G108-Y129 WeakPolarHBondContact O-CD1 3.41Å
109	V	37.3	Very low	56.2	Low	32 Å²	32	68.3 Å²	68.3	19%	0.194	37%	0.374	C	S	.	.			trans	-52.9	119	161.8	173.1	0	0	0	0	108.6	R59 Y107 T114	R59-V109 PolarHBondContact NH2-O 3.11Å; Y107-V109 PolarHBondContact O-N 3.2Å; V109-T114 VanDerWaalsContact CG1-CB 3.48Å; V109-T114 VanDerWaalsContact CG1-OG1 3.25Å; V109-T114 WeakPolarHBondContact CG1-OG1 3.21Å
110	S	39.5	Very low	53.6	Low	83 Å²	83	70.4 Å²	70.4	58%	0.58	38%	0.384	S	S	*	.			trans	-82.2	142	168.6	72.4	0	0	0	0	109.3	G108 T114	G108-S110 PolarHBondContact O-N 2.71Å; G108-S110 VanDerWaalsContact O-N 3.15Å; S110-T114 PolarHBondContact O-OG1 3.5Å
111	G	40.3	Very low	51.2	Low	45 Å²	45	73 Å²	73	46%	0.464	40%	0.402	S	S	.	.	S	Bend	trans	104	132.7	-171.1	0	0	0	0	0	113.5	R59 N113 T114	R59-G111 PolarHBondContact NH2-O 3.05Å; G111-N113 VanDerWaalsContact C-N 3.35Å; G111-T114 PolarHBondContact O-OG1 3.46Å
112	A	47.7	Very low	49	Very low	96 Å²	96	76.2 Å²	76.2	79%	0.793	42%	0.419	S	S	*	.	S	Bend	trans	-72.3	-26.7	-178.8	0	0	0	0	0	113.4
113	N	44.4	Very low	46.8	Very low	159 Å²	159	78.7 Å²	78.7	85%	0.85	43%	0.434	S	S	*	.	S	Bend	trans	-109.2	-1.1	-171.6	-65.2	2.6	0	0	0	113.9	G111	G111-N113 VanDerWaalsContact C-N 3.35Å
114	T	40.9	Very low	44.7	Very low	72 Å²	72	83.2 Å²	83.2	44%	0.442	45%	0.454	S	S	.	.	S	Bend	trans	-80.6	122.3	176.3	18.3	0	0	0	0	109.6	V109 S110 G111	V109-T114 VanDerWaalsContact CG1-CB 3.48Å; V109-T114 VanDerWaalsContact CG1-OG1 3.25Å; V109-T114 WeakPolarHBondContact CG1-OG1 3.21Å; S110-T114 PolarHBondContact O-OG1 3.5Å; G111-T114 PolarHBondContact O-OG1 3.46Å
115	E	42.7	Very low	43.2	Very low	178 Å²	178	88 Å²	88	83%	0.832	47%	0.474	S	S	*	.			trans	-60.4	140.4	179.6	-63.6	-171.5	145.3	0	0	110.8	N117	E115-N117 PolarHBondContact O-N 3.26Å
116	V	41.6	Very low	41.9	Very low	35 Å²	35	93 Å²	93	21%	0.212	50%	0.497	C	S	.	.			trans	-75.2	97.9	173.6	179.4	0	0	0	0	107.6	L56 Q118	L56-V116 HydrophobicContact CD2-CG2 4.06Å; V116-Q118 WeakPolarHBondContact O-CG 3.35Å; V116-Q118 PolarHBondContact O-N 3.49Å
117	N	38.2	Very low	41.5	Very low	128 Å²	128	94.4 Å²	94.4	68%	0.684	51%	0.513	S	S	*	.			trans	-49.1	110.4	169.3	-98.6	-28.5	0	0	0	108.8	E115 Y119 I120	E115-N117 PolarHBondContact O-N 3.26Å; N117-Y119 PolarHBondContact O-N 2.85Å; N117-I120 WeakPolarHBondContact O-CG1 3.24Å
118	Q	38	Very low	41.4	Very low	178 Å²	178	98.5 Å²	98.5	83%	0.832	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.8	-166.4	-60.3	-175.7	2.1	0	0	113.7	V116	V116-Q118 WeakPolarHBondContact O-CG 3.35Å; V116-Q118 PolarHBondContact O-N 3.49Å
119	Y	33.9	Very low	41.7	Very low	184 Å²	184	101.2 Å²	101.2	72%	0.722	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	40.3	-176.1	-60.9	-82.1	0	0	0	113	N117 N121	N117-Y119 PolarHBondContact O-N 2.85Å; Y119-N121 PolarHBondContact O-N 3.03Å
120	I	36.2	Very low	42.6	Very low	45 Å²	45	104.4 Å²	104.4	23%	0.231	56%	0.562	C	S	.	*			trans	-71	71	166.9	-56.1	166.4	0	0	0	109.1	F106 N117	F106-I120 HydrophobicContact CD1-CG2 4.27Å; F106-I120 WeakPolarHBondContact CD1-O 3.43Å; N117-I120 WeakPolarHBondContact O-CG1 3.24Å
121	N	40.9	Very low	43.7	Very low	107 Å²	107	102.3 Å²	102.3	57%	0.572	55%	0.547	S	S	*	.			trans	-65.1	149	157.3	-81.5	-51.8	0	0	0	108.9	Y119 V123 F124	Y119-N121 PolarHBondContact O-N 3.03Å; N121-V123 PolarHBondContact O-N 2.91Å; N121-F124 PolarHBondContact O-N 3.03Å
122	I	43.3	Very low	45.1	Very low	67 Å²	67	103.7 Å²	103.7	34%	0.344	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-24	179.1	-63.6	165.5	0	0	0	112.9	M527 R530	I122-M527 HydrophobicContact CG2-CE 3.6Å; I122-R530 PolarHBondContact O-NH1 3.4Å
123	V	42.4	Very low	46.3	Very low	58 Å²	58	100.4 Å²	100.4	35%	0.352	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-25.8	-172.4	164.6	0	0	0	0	116	N121 I523	N121-V123 PolarHBondContact O-N 2.91Å; V123-I523 HydrophobicContact CB-CD1 4.34Å; V123-I523 HydrophobicContact CG1-CD1 3.67Å; V123-I523 HydrophobicContact CG1-CG1 3.94Å; V123-I523 HydrophobicContact CG2-CD1 3.97Å; V123-I523 HydrophobicContact CG2-CG1 4.47Å
124	F	40.6	Very low	47.9	Very low	119 Å²	119	98.6 Å²	98.6	52%	0.522	50%	0.5	S	S	.	.			trans	-68	143.1	-163.6	-99.2	-77.3	0	0	0	115.6	N121 H126 R530	N121-F124 PolarHBondContact O-N 3.03Å; F124-H126 PolarHBondContact O-N 2.9Å; F124-R530 PolarHBondContact O-NH2 3.17Å
125	K	45.9	Very low	50	Low	104 Å²	104	95.9 Å²	95.9	45%	0.452	48%	0.483	S	S	.	.			trans	-74.2	-11.4	-162.1	-71	-169.1	175.1	-167.2	0	117.5	S127 E522 L526	K125-S127 PolarHBondContact O-N 3.38Å; K125-S127 VanDerWaalsContact O-N 3.15Å; K125-E522 WeakPolarHBondContact CE-OE2 3.43Å; K125-E522 IonicContact NZ-OE1 2.71Å; K125-E522 PolarHBondContact NZ-OE1 3.3Å; K125-E522 VanDerWaalsContact NZ-OE1 3.12Å; K125-E522 IonicContact NZ-OE2 3.66Å; K125-E522 PolarHBondContact NZ-OE2 2.75Å; K125-L526 HydrophobicContact CG-CD1 4.35Å
126	H	39.8	Very low	52.3	Low	129 Å²	129	87.9 Å²	87.9	60%	0.597	45%	0.446	S	S	*	.			trans	-70.3	114.1	-171.2	-63.6	-70.8	0	0	0	111.3	F124 Y129	F124-H126 PolarHBondContact O-N 2.9Å; H126-Y129 HydrophobicContact CB-CD2 4.4Å; H126-Y129 HydrophobicContact CB-CE2 4.33Å
127	S	45.6	Very low	54.7	Low	80 Å²	80	87 Å²	87	56%	0.559	44%	0.442	S	S	*	.			trans	-84.1	-19.7	-171.4	36	0	0	0	0	114.7	K125 Y129	K125-S127 PolarHBondContact O-N 3.38Å; K125-S127 VanDerWaalsContact O-N 3.15Å; S127-Y129 VanDerWaalsContact C-N 3.31Å; S127-Y129 PolarHBondContact O-N 3.05Å
128	D	47.2	Very low	57.4	Low	136 Å²	136	80.9 Å²	80.9	73%	0.727	41%	0.409	S	S	*	.			trans	-95.1	13.8	-153.6	-42.2	-28.2	0	0	0	113.3
129	Y	49.7	Very low	60.2	Low	91 Å²	91	72.4 Å²	72.4	36%	0.357	37%	0.37	S	S	.	.	S	Bend	trans	-111.2	123.4	178.9	-63.8	-80.6	0	0	0	109.6	Y107 G108 H126 S127	Y107-Y129 VanDerWaalsContact CE1-O 3.23Å; Y107-Y129 WeakPolarHBondContact CE1-O 3.29Å; G108-Y129 WeakPolarHBondContact O-CD1 3.41Å; H126-Y129 HydrophobicContact CB-CD2 4.4Å; H126-Y129 HydrophobicContact CB-CE2 4.33Å; S127-Y129 VanDerWaalsContact C-N 3.31Å; S127-Y129 PolarHBondContact O-N 3.05Å
130	S	55.5	Low	63.1	Low	98 Å²	98	66.8 Å²	66.8	69%	0.685	35%	0.353	S	S	*	.			trans	-61.3	145.6	169.8	50.6	0	0	0	0	110.6
131	P	63.6	Low	66	Low	40 Å²	40	66.6 Å²	66.6	26%	0.26	35%	0.352	S	S	.	.			trans	-67.2	155.9	172.1	31.5	-35.2	0	0	0	110.3	Y107 V133	Y107-P131 HydrophobicContact CE1-CB 4.33Å; P131-V133 WeakPolarHBondContact CB-O 3.28Å; P131-V133 WeakPolarHBondContact CG-O 3.45Å; P131-V133 PolarHBondContact O-N 3.03Å
132	L	68.4	Low	68.7	Low	73 Å²	73	61.5 Å²	61.5	38%	0.382	32%	0.324	S	S	.	.	S	Bend	trans	-60.2	-28.3	176.8	176.3	66.9	0	0	0	112.7	H58 L70 H105	H58-L132 WeakPolarHBondContact NE2-CD2 3.47Å; L70-L132 HydrophobicContact CD2-CD2 3.8Å; L70-L132 HydrophobicContact CD2-CG 4.2Å; H105-L132 HydrophobicContact CB-CB 4.34Å
133	V	72.6	Confident	71.3	Confident	27 Å²	27	59.2 Å²	59.2	16%	0.164	31%	0.314	C	S	.	.	S	Bend	trans	-138.3	141.4	177.1	-172.2	0	0	0	0	107.6	L70 F74 P131 A137	L70-V133 HydrophobicContact CD2-CG2 3.45Å; L70-V133 VanDerWaalsContact CD2-CG2 3.45Å; L70-V133 HydrophobicContact CG-CG2 4.22Å; F74-V133 HydrophobicContact CD2-CG1 4.48Å; F74-V133 HydrophobicContact CE2-CG1 3.71Å; F74-V133 HydrophobicContact CZ-CB 4.49Å; F74-V133 HydrophobicContact CZ-CG1 4.05Å; F74-V133 HydrophobicContact CZ-CG2 4.32Å; P131-V133 WeakPolarHBondContact CB-O 3.28Å; P131-V133 WeakPolarHBondContact CG-O 3.45Å; P131-V133 PolarHBondContact O-N 3.03Å; V133-A137 HydrophobicContact CG1-CB 3.64Å
134	E	80	Confident	73.9	Confident	121 Å²	121	61.7 Å²	61.7	57%	0.565	32%	0.324	S	S	*	.			trans	-56.5	141.2	176.1	-74.1	-57.6	140.3	0	0	112.4	H136 A137	E134-H136 PolarHBondContact O-N 3.06Å; E134-A137 VanDerWaalsContact O-CB 3.26Å; E134-A137 WeakPolarHBondContact O-CB 3.35Å; E134-A137 PolarHBondContact O-N 2.88Å
135	P	83.6	Confident	76.5	Confident	15 Å²	15	57.7 Å²	57.7	10%	0.097	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	139.9	176.1	-26.8	37.1	0	0	0	111.6	A137 R530	P135-A137 PolarHBondContact O-N 3.19Å; P135-R530 WeakPolarHBondContact CG-O 3.25Å
136	H	92	Very high	78.9	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.046	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	15.2	179.5	-48.5	-70.7	0	0	0	115.8	Q102 H103 E134 L138 S139 N140 E183 H186 L531 Y533	Q102-H136 PolarHBondContact OE1-O 3.32Å; H103-H136 AromaticContact CE1-CE1 3.87Å; H103-H136 AromaticContact CE1-ND1 3.9Å; E134-H136 PolarHBondContact O-N 3.06Å; H136-L138 VanDerWaalsContact C-N 3.34Å; H136-L138 PolarHBondContact O-N 3.34Å; H136-S139 CarbonylContact O-C 3.58Å; H136-S139 WeakPolarHBondContact O-CB 3.44Å; H136-S139 PolarHBondContact O-N 3.02Å; H136-S139 VanDerWaalsContact O-N 3.14Å; H136-N140 WeakPolarHBondContact O-CB 3.47Å; H136-N140 PolarHBondContact O-N 2.91Å; H136-N140 PolarHBondContact O-ND2 3.45Å; H136-E183 IonicContact CE1-OE1 3.24Å; H136-E183 PolarHBondContact CE1-OE1 3.11Å; H136-E183 IonicContact CE1-OE2 2.71Å; H136-E183 IonicContact CG-OE2 3.07Å; H136-E183 VanDerWaalsContact ND1-CD 3.27Å; H136-E183 IonicContact ND1-OE1 2.71Å; H136-E183 PolarHBondContact ND1-OE1 3.4Å; H136-E183 VanDerWaalsContact ND1-OE1 3.11Å; H136-E183 IonicContact ND1-OE2 3.79Å; H136-E183 PolarHBondContact ND1-OE2 3.36Å; H136-H186 WeakPolarHBondContact CB-CE1 3.43Å; H136-H186 AromaticContact CG-CE1 3.6Å; H136-L531 PolarHBondContact NE2-O 3.2Å; H136-L531 VanDerWaalsContact NE2-O 3.12Å; H136-Y533 AromaticContact CE1-CE2 3.81Å; H136-Y533 AromaticContact NE2-CE2 3.39Å; H136-Y533 WeakPolarHBondContact NE2-CE2 3.45Å; H136-Y533 AromaticContact NE2-CZ 3.55Å; H136-Y533 PolarHBondContact NE2-OH 3.01Å
137	A	91.3	Very high	81.5	Confident	16 Å²	16	51.2 Å²	51.2	13%	0.132	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-35.3	-178.6	0	0	0	0	0	114.4	F74 V133 E134 P135 N141	F74-A137 HydrophobicContact CD2-CB 4.35Å; F74-A137 HydrophobicContact CE2-CB 4.07Å; V133-A137 HydrophobicContact CG1-CB 3.64Å; E134-A137 VanDerWaalsContact O-CB 3.26Å; E134-A137 WeakPolarHBondContact O-CB 3.35Å; E134-A137 PolarHBondContact O-N 2.88Å; P135-A137 PolarHBondContact O-N 3.19Å; A137-N141 PolarHBondContact O-N 2.84Å; A137-N141 VanDerWaalsContact O-N 3.09Å; A137-N141 PolarHBondContact O-ND2 3.41Å
138	L	94.1	Very high	83.8	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.5	-38.2	174.8	-178.8	58.4	0	0	0	111.1	F74 L77 A78 Y98 Q102 H136 N141 L142	F74-L138 HydrophobicContact CB-CD1 4.29Å; F74-L138 HydrophobicContact CD2-CB 3.75Å; F74-L138 HydrophobicContact CD2-CD1 4.35Å; F74-L138 HydrophobicContact CE2-CB 3.77Å; F74-L138 HydrophobicContact CG-CB 4.45Å; F74-L138 HydrophobicContact CG-CD1 4.31Å; F74-L138 HydrophobicContact CZ-CB 4.5Å; F74-L138 VanDerWaalsContact O-CD1 3.31Å; F74-L138 WeakPolarHBondContact O-CD1 3.44Å; L77-L138 HydrophobicContact CB-CD1 3.78Å; L77-L138 HydrophobicContact CB-CD2 4.26Å; L77-L138 HydrophobicContact CD1-CD2 4.21Å; A78-L138 HydrophobicContact CB-CD1 4.05Å; Y98-L138 HydrophobicContact CD1-CD2 4.42Å; Y98-L138 HydrophobicContact CD2-CD2 3.45Å; Y98-L138 VanDerWaalsContact CD2-CD2 3.45Å; Y98-L138 HydrophobicContact CD2-CG 4.09Å; Y98-L138 HydrophobicContact CE1-CD2 4.38Å; Y98-L138 HydrophobicContact CE2-CD1 4.42Å; Y98-L138 HydrophobicContact CE2-CD2 3.42Å; Y98-L138 VanDerWaalsContact CE2-CD2 3.42Å; Y98-L138 HydrophobicContact CE2-CG 3.5Å; Y98-L138 VanDerWaalsContact CE2-CG 3.5Å; Y98-L138 HydrophobicContact CG-CD2 3.99Å; Q102-L138 HydrophobicContact CG-CB 4.5Å; Q102-L138 VanDerWaalsContact OE1-CB 3.27Å; H136-L138 VanDerWaalsContact C-N 3.34Å; H136-L138 PolarHBondContact O-N 3.34Å; L138-N141 PolarHBondContact O-N 3.37Å; L138-L142 WeakPolarHBondContact O-CB 3.24Å; L138-L142 PolarHBondContact O-N 3Å
139	S	96.8	Very high	86	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-41.7	173.6	-55.3	0	0	0	0	112.7	Y98 Q102 H136 L142 V143 E183 H186	Y98-S139 WeakPolarHBondContact OH-CA 3.26Å; Y98-S139 PolarHBondContact OH-N 3.28Å; Y98-S139 PolarHBondContact OH-OG 3.29Å; Y98-S139 VanDerWaalsContact OH-OG 3.09Å; Q102-S139 PolarHBondContact NE2-OG 2.95Å; Q102-S139 PolarHBondContact OE1-OG 3.5Å; H136-S139 CarbonylContact O-C 3.58Å; H136-S139 WeakPolarHBondContact O-CB 3.44Å; H136-S139 PolarHBondContact O-N 3.02Å; H136-S139 VanDerWaalsContact O-N 3.14Å; S139-L142 PolarHBondContact O-N 3.48Å; S139-V143 WeakPolarHBondContact O-CB 3.19Å; S139-V143 VanDerWaalsContact O-CG2 3.28Å; S139-V143 WeakPolarHBondContact O-CG2 3.09Å; S139-V143 PolarHBondContact O-N 2.88Å; S139-E183 VanDerWaalsContact CB-OE2 3.3Å; S139-E183 WeakPolarHBondContact CB-OE2 3.41Å; S139-E183 PolarHBondContact OG-OE2 3.49Å; S139-H186 WeakPolarHBondContact CB-CD2 3.17Å
140	N	96.7	Very high	88.1	Confident	67 Å²	67	38.3 Å²	38.3	36%	0.358	21%	0.21	S	C	.	.	H	α-helix	trans	-58.2	-49.6	173.8	-70.8	-31.6	0	0	0	110.3	H136 L142 V143 L144 H186	H136-N140 WeakPolarHBondContact O-CB 3.47Å; H136-N140 PolarHBondContact O-N 2.91Å; H136-N140 PolarHBondContact O-ND2 3.45Å; N140-L142 PolarHBondContact O-N 3.37Å; N140-V143 PolarHBondContact O-N 3.5Å; N140-L144 WeakPolarHBondContact O-CB 3.37Å; N140-L144 VanDerWaalsContact O-CG 3.22Å; N140-L144 WeakPolarHBondContact O-CG 3.23Å; N140-L144 PolarHBondContact O-N 3.19Å; N140-H186 PolarHBondContact OD1-CD2 2.91Å; N140-H186 PolarHBondContact OD1-NE2 2.92Å
141	N	96.3	Very high	89.9	Confident	40 Å²	40	35.8 Å²	35.8	21%	0.214	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-44.6	178	-69.7	-31.1	0	0	0	112.3	A78 A137 L138 L144 N145	A78-N141 HydrophobicContact CB-CB 3.54Å; A137-N141 PolarHBondContact O-N 2.84Å; A137-N141 VanDerWaalsContact O-N 3.09Å; A137-N141 PolarHBondContact O-ND2 3.41Å; L138-N141 PolarHBondContact O-N 3.37Å; N141-L144 PolarHBondContact O-N 2.95Å; N141-N145 WeakPolarHBondContact O-CB 3.33Å; N141-N145 PolarHBondContact O-N 3.48Å; N141-N145 PolarHBondContact O-ND2 3Å
142	L	97.1	Very high	91.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-40.8	179.9	-178.3	60.7	0	0	0	112.2	A78 F83 Y98 L138 S139 N140 L146 V174	A78-L142 HydrophobicContact CB-CB 4.34Å; F83-L142 HydrophobicContact CB-CD1 3.97Å; F83-L142 HydrophobicContact CD2-CD1 4.12Å; F83-L142 HydrophobicContact CD2-CD2 3.87Å; F83-L142 HydrophobicContact CE2-CD2 4.19Å; F83-L142 HydrophobicContact CG-CD1 3.97Å; Y98-L142 HydrophobicContact CE2-CD2 4.2Å; L138-L142 WeakPolarHBondContact O-CB 3.24Å; L138-L142 PolarHBondContact O-N 3Å; S139-L142 PolarHBondContact O-N 3.48Å; N140-L142 PolarHBondContact O-N 3.37Å; L142-L146 WeakPolarHBondContact O-CB 3.23Å; L142-L146 PolarHBondContact O-N 2.96Å; L142-V174 HydrophobicContact CD1-CG2 4.31Å; L142-V174 HydrophobicContact CD2-CG1 3.97Å; L142-V174 HydrophobicContact CG-CG1 3.9Å
143	V	98.1	Very high	92.2	Very high	19 Å²	19	32.8 Å²	32.8	12%	0.115	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-41.1	176.3	173.6	0	0	0	0	111.5	S139 N140 L146 H147 L178 H186 K189 A190	S139-V143 WeakPolarHBondContact O-CB 3.19Å; S139-V143 VanDerWaalsContact O-CG2 3.28Å; S139-V143 WeakPolarHBondContact O-CG2 3.09Å; S139-V143 PolarHBondContact O-N 2.88Å; N140-V143 PolarHBondContact O-N 3.5Å; V143-L146 PolarHBondContact O-N 2.93Å; V143-H147 WeakPolarHBondContact O-CB 3.5Å; V143-H147 PolarHBondContact O-N 3.46Å; V143-L178 HydrophobicContact CG2-CD1 3.94Å; V143-H186 HydrophobicContact CG2-CB 3.97Å; V143-K189 HydrophobicContact CG1-CB 4.27Å; V143-A190 HydrophobicContact CG2-CB 4.33Å
144	L	96.7	Very high	93	Very high	110 Å²	110	33.5 Å²	33.5	58%	0.576	17%	0.174	S	C	*	.	H	α-helix	trans	-63.4	-44.6	176.3	-73.3	168.1	0	0	0	111.9	N140 N141 H147 E148	N140-L144 WeakPolarHBondContact O-CB 3.37Å; N140-L144 VanDerWaalsContact O-CG 3.22Å; N140-L144 WeakPolarHBondContact O-CG 3.23Å; N140-L144 PolarHBondContact O-N 3.19Å; N141-L144 PolarHBondContact O-N 2.95Å; L144-H147 PolarHBondContact O-N 3.03Å; L144-E148 PolarHBondContact O-N 3.01Å
145	N	95.9	Very high	93.4	Very high	35 Å²	35	37 Å²	37	19%	0.187	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-39.8	176.9	-70.5	-17.1	0	0	0	111.7	A78 P80 N141 E148 V149	A78-N145 PolarHBondContact O-ND2 3.32Å; P80-N145 HydrophobicContact CG-CB 3.8Å; N141-N145 WeakPolarHBondContact O-CB 3.33Å; N141-N145 PolarHBondContact O-N 3.48Å; N141-N145 PolarHBondContact O-ND2 3Å; N145-E148 PolarHBondContact O-N 3Å; N145-V149 WeakPolarHBondContact O-CG2 3.32Å; N145-V149 PolarHBondContact O-N 3.46Å; N145-V149 VanDerWaalsContact O-N 3.14Å
146	L	95.5	Very high	93.4	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-43.8	172.2	173.3	63.5	0	0	0	112	L142 V143 E148 V149 L150 G171 V174 A190	L142-L146 WeakPolarHBondContact O-CB 3.23Å; L142-L146 PolarHBondContact O-N 2.96Å; V143-L146 PolarHBondContact O-N 2.93Å; L146-E148 VanDerWaalsContact C-N 3.3Å; L146-E148 PolarHBondContact O-N 2.96Å; L146-V149 WeakPolarHBondContact O-CB 3.14Å; L146-V149 PolarHBondContact O-N 2.87Å; L146-V149 VanDerWaalsContact O-N 3.11Å; L146-L150 HydrophobicContact CD1-CD1 4.04Å; L146-L150 HydrophobicContact CD1-CG 4.08Å; L146-L150 HydrophobicContact CD2-CD1 4.38Å; L146-L150 HydrophobicContact CG-CD1 3.86Å; L146-L150 HydrophobicContact CG-CG 4.35Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.11Å; L146-G171 VanDerWaalsContact CD1-CA 3.44Å; L146-V174 HydrophobicContact CD2-CB 4Å; L146-V174 HydrophobicContact CD2-CG1 3.89Å; L146-V174 HydrophobicContact CD2-CG2 4.42Å; L146-A190 HydrophobicContact CD2-CB 3.78Å
147	H	95.6	Very high	93.1	Very high	96 Å²	96	43.6 Å²	43.6	44%	0.444	21%	0.211	S	C	.	.	H	α-helix	trans	-62.7	-36.3	179.1	-177.4	86.7	0	0	0	112	V143 L144 L150 T151	V143-H147 WeakPolarHBondContact O-CB 3.5Å; V143-H147 PolarHBondContact O-N 3.46Å; L144-H147 PolarHBondContact O-N 3.03Å; H147-L150 PolarHBondContact O-N 2.87Å; H147-T151 PolarHBondContact NE2-OG1 3.36Å; H147-T151 VanDerWaalsContact O-CB 3.23Å; H147-T151 WeakPolarHBondContact O-CB 3.43Å; H147-T151 PolarHBondContact O-N 3.13Å; H147-T151 PolarHBondContact O-OG1 2.64Å
148	E	93.3	Very high	92.4	Very high	33 Å²	33	55.4 Å²	55.4	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-40.1	171.4	-179.3	154.8	-165	0	0	112.3	L144 N145 L146 T151 R152 R328	L144-E148 PolarHBondContact O-N 3.01Å; N145-E148 PolarHBondContact O-N 3Å; L146-E148 VanDerWaalsContact C-N 3.3Å; L146-E148 PolarHBondContact O-N 2.96Å; E148-T151 PolarHBondContact O-N 2.68Å; E148-R152 HydrophobicContact CG-CG 4.4Å; E148-R152 WeakPolarHBondContact O-CB 3.3Å; E148-R152 WeakPolarHBondContact O-CG 3.42Å; E148-R152 PolarHBondContact O-N 3.23Å; E148-R152 IonicContact OE1-CZ 3.1Å; E148-R152 VanDerWaalsContact OE1-CZ 3.29Å; E148-R152 IonicContact OE1-NE 2.69Å; E148-R152 PolarHBondContact OE1-NE 3.12Å; E148-R152 IonicContact OE1-NH2 2.7Å; E148-R152 PolarHBondContact OE1-NH2 3.44Å; E148-R328 IonicContact OE2-CZ 3.99Å; E148-R328 IonicContact OE2-NH1 3.4Å; E148-R328 PolarHBondContact OE2-NH1 2.72Å; E148-R328 VanDerWaalsContact OE2-NH1 3.16Å; E148-R328 IonicContact OE2-NH2 2.82Å; E148-R328 PolarHBondContact OE2-NH2 3.19Å
149	V	93	Very high	92	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-47.1	174.2	174	0	0	0	0	111.6	P80 N145 L146 T151 R152 A153 A167 L170 I333 F338 P339	P80-V149 HydrophobicContact CB-CG2 4.28Å; P80-V149 HydrophobicContact CG-CG2 3.98Å; N145-V149 WeakPolarHBondContact O-CG2 3.32Å; N145-V149 PolarHBondContact O-N 3.46Å; N145-V149 VanDerWaalsContact O-N 3.14Å; L146-V149 WeakPolarHBondContact O-CB 3.14Å; L146-V149 PolarHBondContact O-N 2.87Å; L146-V149 VanDerWaalsContact O-N 3.11Å; V149-T151 PolarHBondContact O-N 3.15Å; V149-R152 PolarHBondContact O-N 3.5Å; V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 3.21Å; V149-A167 HydrophobicContact CG1-CB 3.98Å; V149-L170 HydrophobicContact CG1-CD2 4.49Å; V149-I333 HydrophobicContact CG2-CD1 4.19Å; V149-F338 HydrophobicContact CB-CE1 4.33Å; V149-F338 HydrophobicContact CB-CZ 4.44Å; V149-F338 HydrophobicContact CG1-CE1 4.06Å; V149-F338 HydrophobicContact CG2-CE1 4.49Å; V149-F338 HydrophobicContact CG2-CZ 4.24Å; V149-F338 WeakPolarHBondContact O-CE1 3.48Å; V149-P339 HydrophobicContact CG1-CG 4.27Å
150	L	94	Very high	91.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-39.6	177.5	-71.3	169.2	0	0	0	112.2	L146 H147 P154 A167 V194 T197	L146-L150 HydrophobicContact CD1-CD1 4.04Å; L146-L150 HydrophobicContact CD1-CG 4.08Å; L146-L150 HydrophobicContact CD2-CD1 4.38Å; L146-L150 HydrophobicContact CG-CD1 3.86Å; L146-L150 HydrophobicContact CG-CG 4.35Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.11Å; H147-L150 PolarHBondContact O-N 2.87Å; L150-P154 WeakPolarHBondContact O-CD 3.3Å; L150-A167 HydrophobicContact CD2-CB 4.07Å; L150-V194 HydrophobicContact CD1-CG2 3.98Å; L150-V194 HydrophobicContact CD2-CG2 4.27Å; L150-T197 HydrophobicContact CB-CG2 4.18Å; L150-T197 HydrophobicContact CD2-CG2 4.13Å
151	T	92.6	Very high	91.4	Very high	45 Å²	45	57.5 Å²	57.5	28%	0.276	26%	0.264	S	S	.	.	H	α-helix	trans	-71.7	-36.1	-179.4	-63.6	0	0	0	0	113.1	H147 E148 V149 R155	H147-T151 PolarHBondContact NE2-OG1 3.36Å; H147-T151 VanDerWaalsContact O-CB 3.23Å; H147-T151 WeakPolarHBondContact O-CB 3.43Å; H147-T151 PolarHBondContact O-N 3.13Å; H147-T151 PolarHBondContact O-OG1 2.64Å; E148-T151 PolarHBondContact O-N 2.68Å; V149-T151 PolarHBondContact O-N 3.15Å; T151-R155 PolarHBondContact O-NE 3.41Å
152	R	90.4	Very high	91.1	Very high	50 Å²	50	57 Å²	57	19%	0.189	26%	0.263	C	S	.	.	H	α-helix	trans	-80.5	-35.2	178.7	-75.9	-172.3	-173.9	-160.1	17.5	113	E148 V149 R155 L156 S331 I333 D335 F338	E148-R152 HydrophobicContact CG-CG 4.4Å; E148-R152 WeakPolarHBondContact O-CB 3.3Å; E148-R152 WeakPolarHBondContact O-CG 3.42Å; E148-R152 PolarHBondContact O-N 3.23Å; E148-R152 IonicContact OE1-CZ 3.1Å; E148-R152 VanDerWaalsContact OE1-CZ 3.29Å; E148-R152 IonicContact OE1-NE 2.69Å; E148-R152 PolarHBondContact OE1-NE 3.12Å; E148-R152 IonicContact OE1-NH2 2.7Å; E148-R152 PolarHBondContact OE1-NH2 3.44Å; V149-R152 PolarHBondContact O-N 3.5Å; R152-R155 WeakPolarHBondContact O-CA 3.46Å; R152-R155 WeakPolarHBondContact O-CB 3.35Å; R152-R155 PolarHBondContact O-N 3.07Å; R152-L156 PolarHBondContact O-N 3.21Å; R152-S331 VanDerWaalsContact NH2-CB 3.29Å; R152-S331 PolarHBondContact NH2-OG 3.46Å; R152-I333 PolarHBondContact NH1-O 3.15Å; R152-I333 VanDerWaalsContact NH1-O 3.13Å; R152-D335 IonicContact CZ-OD1 3.27Å; R152-D335 IonicContact NH1-OD1 3.65Å; R152-D335 PolarHBondContact NH1-OD1 3.43Å; R152-F338 HydrophobicContact CB-CD1 4.43Å; R152-F338 HydrophobicContact CB-CE1 3.52Å; R152-F338 HydrophobicContact CB-CE2 4.15Å; R152-F338 HydrophobicContact CB-CZ 3.38Å; R152-F338 VanDerWaalsContact CD-CE2 3.45Å; R152-F338 VanDerWaalsContact CD-CZ 3.4Å; R152-F338 HydrophobicContact CG-CE2 4.46Å; R152-F338 HydrophobicContact CG-CZ 3.97Å
153	A	89.7	Confident	90.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-53.5	-45.5	-173	0	0	0	0	0	114.6	V149 R155 L156 A160 V164 A167	V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 3.21Å; A153-R155 PolarHBondContact O-N 3.37Å; A153-R155 VanDerWaalsContact O-N 3.08Å; A153-L156 PolarHBondContact O-N 3.28Å; A153-A160 WeakPolarHBondContact O-CB 3.39Å; A153-V164 HydrophobicContact CB-CG2 4.27Å; A153-A167 HydrophobicContact CB-CB 3.73Å
154	P	90.4	Very high	90.5	Very high	41 Å²	41	56.4 Å²	56.4	27%	0.266	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-57.4	-21	173.4	-29	36.7	0	0	0	115.8	L150 V164 T197 F201	L150-P154 WeakPolarHBondContact O-CD 3.3Å; P154-V164 HydrophobicContact CB-CG2 4.25Å; P154-V164 HydrophobicContact CG-CG2 3.79Å; P154-T197 HydrophobicContact CG-CG2 4.31Å; P154-F201 HydrophobicContact CB-CD2 3.86Å; P154-F201 HydrophobicContact CB-CE2 4.26Å; P154-F201 HydrophobicContact CG-CD2 4.28Å
155	R	88.9	Confident	90.3	Very high	194 Å²	194	51.1 Å²	51.1	73%	0.732	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-99	-13.7	-168.9	-53.3	-179.2	-173.3	-178.1	1.3	113.5	T151 R152 A153 K157	T151-R155 PolarHBondContact O-NE 3.41Å; R152-R155 WeakPolarHBondContact O-CA 3.46Å; R152-R155 WeakPolarHBondContact O-CB 3.35Å; R152-R155 PolarHBondContact O-N 3.07Å; A153-R155 PolarHBondContact O-N 3.37Å; A153-R155 VanDerWaalsContact O-N 3.08Å; R155-K157 PolarHBondContact O-N 2.77Å
156	L	83.2	Confident	90	Very high	54 Å²	54	49.8 Å²	49.8	28%	0.283	23%	0.225	S	C	.	.	S	Bend	trans	-61.4	-41.3	-174.5	-64.7	171.5	0	0	0	113.5	R152 A153 E163 F338	R152-L156 PolarHBondContact O-N 3.21Å; A153-L156 PolarHBondContact O-N 3.28Å; L156-E163 HydrophobicContact CD1-CB 3.87Å; L156-E163 HydrophobicContact CD1-CG 3.82Å; L156-F338 HydrophobicContact CD1-CB 3.87Å; L156-F338 HydrophobicContact CD1-CD1 3.78Å; L156-F338 HydrophobicContact CD1-CG 4.07Å; L156-F338 HydrophobicContact CD2-CB 4.03Å; L156-F338 HydrophobicContact CD2-CD1 4.09Å; L156-F338 HydrophobicContact CD2-CD2 4.48Å; L156-F338 HydrophobicContact CD2-CG 3.89Å; L156-F338 HydrophobicContact CG-CD1 4.31Å
157	K	84.7	Confident	90	Very high	111 Å²	111	49.7 Å²	49.7	48%	0.483	23%	0.225	S	C	.	.	S	Bend	trans	-150.4	154	-170.8	-61.7	179.1	-165.8	157.3	0	110.3	R155 N159 A160 E163	R155-K157 PolarHBondContact O-N 2.77Å; K157-N159 PolarHBondContact O-N 3.12Å; K157-A160 WeakPolarHBondContact O-CB 3.28Å; K157-A160 PolarHBondContact O-N 3.28Å; K157-E163 WeakPolarHBondContact CD-OE1 3.44Å; K157-E163 VanDerWaalsContact CE-OE1 3.27Å; K157-E163 WeakPolarHBondContact CE-OE1 3.17Å; K157-E163 IonicContact NZ-OE1 3.16Å; K157-E163 PolarHBondContact NZ-OE1 3.35Å
158	R	77.8	Confident	89.9	Confident	263 Å²	263	45.1 Å²	45.1	99%	0.992	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.7	179.4	-170.9	174.1	179.7	-176.3	1.2	114.8
159	N	84.4	Confident	89.9	Confident	110 Å²	110	45.5 Å²	45.5	59%	0.588	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.7	53.5	175.6	-172.9	39.9	0	0	0	110.7	K157 A161 P162	K157-N159 PolarHBondContact O-N 3.12Å; N159-A161 PolarHBondContact O-N 3.13Å; N159-P162 WeakPolarHBondContact O-CD 3.47Å
160	A	89.8	Confident	89.9	Confident	1 Å²	1	46 Å²	46	1%	0.008	21%	0.209	C	C	.	.			trans	-71.7	20.8	-174.4	0	0	0	0	0	115.5	A153 K157 P162 E163 V164 F201	A153-A160 WeakPolarHBondContact O-CB 3.39Å; K157-A160 WeakPolarHBondContact O-CB 3.28Å; K157-A160 PolarHBondContact O-N 3.28Å; A160-P162 VanDerWaalsContact C-CD 3.48Å; A160-E163 WeakPolarHBondContact CA-OE2 3.23Å; A160-E163 PolarHBondContact O-N 3.34Å; A160-V164 WeakPolarHBondContact O-CG2 3.48Å; A160-V164 PolarHBondContact O-N 3.45Å; A160-F201 HydrophobicContact CB-CZ 4.46Å
161	A	91.1	Very high	90	Very high	1 Å²	1	46 Å²	46	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-41.9	178.5	0	0	0	0	0	113.5	N159 E163 V164 I165 F201 F202 F207 L352	N159-A161 PolarHBondContact O-N 3.13Å; A161-E163 PolarHBondContact O-N 2.88Å; A161-V164 PolarHBondContact O-N 2.87Å; A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 2.63Å; A161-F201 HydrophobicContact CB-CE1 3.86Å; A161-F201 HydrophobicContact CB-CZ 4.31Å; A161-F202 HydrophobicContact CB-CE1 3.99Å; A161-F202 HydrophobicContact CB-CZ 4.45Å; A161-F207 HydrophobicContact CB-CD2 3.92Å; A161-F207 HydrophobicContact CB-CE2 3.62Å; A161-F207 HydrophobicContact CB-CZ 4.31Å; A161-L352 HydrophobicContact CB-CD2 3.74Å
162	P	90.3	Very high	90.1	Very high	28 Å²	28	44.7 Å²	44.7	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-42.7	174	-21.6	33.7	0	0	0	112.9	N159 A160 A166 V348 L352	N159-P162 WeakPolarHBondContact O-CD 3.47Å; A160-P162 VanDerWaalsContact C-CD 3.48Å; P162-A166 WeakPolarHBondContact O-CB 3.34Å; P162-A166 PolarHBondContact O-N 3.45Å; P162-V348 HydrophobicContact CB-CG1 4.06Å; P162-L352 HydrophobicContact CB-CD1 3.99Å; P162-L352 HydrophobicContact CG-CD1 3.74Å
163	E	90.7	Very high	90.4	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.028	20%	0.201	C	C	.	.	H	α-helix	trans	-71.4	-34.8	179.9	-65.7	88.9	161.8	0	0	113	L156 K157 A160 A161 A166 A167	L156-E163 HydrophobicContact CD1-CB 3.87Å; L156-E163 HydrophobicContact CD1-CG 3.82Å; K157-E163 WeakPolarHBondContact CD-OE1 3.44Å; K157-E163 VanDerWaalsContact CE-OE1 3.27Å; K157-E163 WeakPolarHBondContact CE-OE1 3.17Å; K157-E163 IonicContact NZ-OE1 3.16Å; K157-E163 PolarHBondContact NZ-OE1 3.35Å; A160-E163 WeakPolarHBondContact CA-OE2 3.23Å; A160-E163 PolarHBondContact O-N 3.34Å; A161-E163 PolarHBondContact O-N 2.88Å; E163-A166 PolarHBondContact O-N 3.46Å; E163-A167 WeakPolarHBondContact O-CB 3.48Å; E163-A167 PolarHBondContact O-N 3.19Å
164	V	92.3	Very high	90.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-40	174.9	172.1	0	0	0	0	111.3	A153 P154 A160 A161 A167 A168 F201 F202	A153-V164 HydrophobicContact CB-CG2 4.27Å; P154-V164 HydrophobicContact CB-CG2 4.25Å; P154-V164 HydrophobicContact CG-CG2 3.79Å; A160-V164 WeakPolarHBondContact O-CG2 3.48Å; A160-V164 PolarHBondContact O-N 3.45Å; A161-V164 PolarHBondContact O-N 2.87Å; V164-A167 PolarHBondContact O-N 2.79Å; V164-A168 VanDerWaalsContact O-CB 3.32Å; V164-A168 WeakPolarHBondContact O-CB 3.31Å; V164-A168 PolarHBondContact O-N 3.09Å; V164-F201 HydrophobicContact CB-CD1 4.12Å; V164-F201 HydrophobicContact CB-CE1 4.29Å; V164-F201 HydrophobicContact CB-CG 4.39Å; V164-F201 HydrophobicContact CG1-CB 4.18Å; V164-F201 HydrophobicContact CG1-CD1 3.93Å; V164-F201 HydrophobicContact CG1-CG 4.07Å; V164-F201 HydrophobicContact CG2-CD1 4.1Å; V164-F201 HydrophobicContact CG2-CD2 3.97Å; V164-F201 HydrophobicContact CG2-CE1 4.21Å; V164-F201 HydrophobicContact CG2-CE2 4.05Å; V164-F201 HydrophobicContact CG2-CG 3.98Å; V164-F201 HydrophobicContact CG2-CZ 4.17Å; V164-F202 HydrophobicContact CB-CZ 4.46Å; V164-F202 HydrophobicContact CG1-CE2 3.79Å; V164-F202 HydrophobicContact CG1-CZ 4.14Å
165	I	92.1	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-43.9	173.1	-65.7	172.1	0	0	0	110.3	A161 A167 A168 L169 F202 A210 L214 V348 L351 L352	A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 2.63Å; I165-A167 VanDerWaalsContact C-N 3.33Å; I165-A167 PolarHBondContact O-N 3.39Å; I165-A168 PolarHBondContact O-N 3.14Å; I165-L169 HydrophobicContact CG2-CD1 3.84Å; I165-L169 HydrophobicContact CG2-CG 4.2Å; I165-L169 WeakPolarHBondContact O-CB 3.36Å; I165-L169 VanDerWaalsContact O-CG 3.31Å; I165-L169 WeakPolarHBondContact O-CG 3.16Å; I165-L169 PolarHBondContact O-N 3.25Å; I165-F202 HydrophobicContact CD1-CZ 4.21Å; I165-F202 HydrophobicContact CG1-CE2 4.28Å; I165-F202 HydrophobicContact CG1-CZ 3.74Å; I165-A210 HydrophobicContact CD1-CB 4.14Å; I165-L214 HydrophobicContact CB-CD1 4.44Å; I165-L214 HydrophobicContact CG1-CD1 3.99Å; I165-L214 HydrophobicContact CG2-CD1 4.28Å; I165-V348 HydrophobicContact CB-CG1 4.18Å; I165-V348 HydrophobicContact CB-CG2 4.36Å; I165-V348 HydrophobicContact CG2-CB 4.25Å; I165-V348 HydrophobicContact CG2-CG1 4.2Å; I165-V348 HydrophobicContact CG2-CG2 3.78Å; I165-L351 HydrophobicContact CD1-CB 4.14Å; I165-L351 HydrophobicContact CG2-CB 4.38Å; I165-L351 HydrophobicContact CG2-CD1 3.66Å; I165-L352 HydrophobicContact CD1-CD2 3.55Å; I165-L352 HydrophobicContact CD1-CG 3.71Å
166	A	91.3	Very high	91.3	Very high	7 Å²	7	35 Å²	35	6%	0.058	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-39.7	177.2	0	0	0	0	0	112.6	P162 E163 L170 P339 V348	P162-A166 WeakPolarHBondContact O-CB 3.34Å; P162-A166 PolarHBondContact O-N 3.45Å; E163-A166 PolarHBondContact O-N 3.46Å; A166-L170 WeakPolarHBondContact O-CB 3.31Å; A166-L170 PolarHBondContact O-N 3.19Å; A166-L170 VanDerWaalsContact O-N 3.13Å; A166-P339 HydrophobicContact CB-CB 3.62Å; A166-V348 HydrophobicContact CB-CG2 4.16Å
167	A	93.8	Very high	91.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.5	-40.7	173.8	0	0	0	0	0	112.6	V149 L150 A153 E163 V164 I165 L170 G171	V149-A167 HydrophobicContact CG1-CB 3.98Å; L150-A167 HydrophobicContact CD2-CB 4.07Å; A153-A167 HydrophobicContact CB-CB 3.73Å; E163-A167 WeakPolarHBondContact O-CB 3.48Å; E163-A167 PolarHBondContact O-N 3.19Å; V164-A167 PolarHBondContact O-N 2.79Å; I165-A167 VanDerWaalsContact C-N 3.33Å; I165-A167 PolarHBondContact O-N 3.39Å; A167-L170 PolarHBondContact O-N 3.23Å; A167-G171 PolarHBondContact O-N 2.49Å
168	A	94.4	Very high	92.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-48.4	175.6	0	0	0	0	0	111.7	V164 I165 L170 G171 L172 V194 V198 L214	V164-A168 VanDerWaalsContact O-CB 3.32Å; V164-A168 WeakPolarHBondContact O-CB 3.31Å; V164-A168 PolarHBondContact O-N 3.09Å; I165-A168 PolarHBondContact O-N 3.14Å; A168-L170 VanDerWaalsContact C-N 3.31Å; A168-L170 PolarHBondContact O-N 3.44Å; A168-G171 CarbonylContact O-C 3.57Å; A168-G171 WeakPolarHBondContact O-CA 3.32Å; A168-G171 PolarHBondContact O-N 3.4Å; A168-G171 VanDerWaalsContact O-N 3.07Å; A168-L172 WeakPolarHBondContact O-CG 3.46Å; A168-L172 PolarHBondContact O-N 3.39Å; A168-V194 HydrophobicContact CB-CG1 3.86Å; A168-V198 HydrophobicContact CB-CG2 3.66Å; A168-L214 HydrophobicContact CB-CD1 4.09Å; A168-L214 HydrophobicContact CB-CD2 4.28Å
169	L	92.7	Very high	93.3	Very high	40 Å²	40	14.6 Å²	14.6	21%	0.209	8%	0.078	C	C	.	.	H	α-helix	trans	-59.6	-39	176.7	-70.6	171.2	0	0	0	112.3	I165 L172 K173 L214 V347 V348 L351	I165-L169 HydrophobicContact CG2-CD1 3.84Å; I165-L169 HydrophobicContact CG2-CG 4.2Å; I165-L169 WeakPolarHBondContact O-CB 3.36Å; I165-L169 VanDerWaalsContact O-CG 3.31Å; I165-L169 WeakPolarHBondContact O-CG 3.16Å; I165-L169 PolarHBondContact O-N 3.25Å; L169-L172 HydrophobicContact CD2-CD1 4.43Å; L169-L172 PolarHBondContact O-N 3.23Å; L169-K173 WeakPolarHBondContact O-CG 3.31Å; L169-K173 PolarHBondContact O-N 3.44Å; L169-K173 VanDerWaalsContact O-N 3.16Å; L169-L214 HydrophobicContact CD2-CD2 4Å; L169-L214 HydrophobicContact CG-CD2 4.37Å; L169-V347 HydrophobicContact CD1-CG1 3.96Å; L169-V348 HydrophobicContact CD1-CG2 3.85Å; L169-L351 HydrophobicContact CD1-CD1 4.33Å; L169-L351 HydrophobicContact CD2-CD1 4.37Å
170	L	93.6	Very high	93.7	Very high	14 Å²	14	11.1 Å²	11.1	7%	0.073	6%	0.058	C	C	.	.	H	α-helix	trans	-63.1	-44.8	172.4	177.2	56.1	0	0	0	111.6	P80 F83 N84 V149 A166 A167 A168 L172 K173 V174	P80-L170 HydrophobicContact CB-CD2 4Å; F83-L170 HydrophobicContact CD1-CD1 4.11Å; F83-L170 HydrophobicContact CE1-CD1 4.43Å; N84-L170 HydrophobicContact CB-CD1 3.77Å; V149-L170 HydrophobicContact CG1-CD2 4.49Å; A166-L170 WeakPolarHBondContact O-CB 3.31Å; A166-L170 PolarHBondContact O-N 3.19Å; A166-L170 VanDerWaalsContact O-N 3.13Å; A167-L170 PolarHBondContact O-N 3.23Å; A168-L170 VanDerWaalsContact C-N 3.31Å; A168-L170 PolarHBondContact O-N 3.44Å; L170-L172 VanDerWaalsContact C-N 3.33Å; L170-L172 PolarHBondContact O-N 3.21Å; L170-K173 WeakPolarHBondContact O-CB 3.29Å; L170-K173 PolarHBondContact O-N 3.02Å; L170-V174 WeakPolarHBondContact O-CG2 3.43Å; L170-V174 PolarHBondContact O-N 2.86Å
171	G	95.8	Very high	93.9	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.9	-36	175.9	0	0	0	0	0	113.7	L146 A167 A168 V174 S175	L146-G171 VanDerWaalsContact CD1-CA 3.44Å; A167-G171 PolarHBondContact O-N 2.49Å; A168-G171 CarbonylContact O-C 3.57Å; A168-G171 WeakPolarHBondContact O-CA 3.32Å; A168-G171 PolarHBondContact O-N 3.4Å; A168-G171 VanDerWaalsContact O-N 3.07Å; G171-V174 PolarHBondContact O-N 3.1Å; G171-S175 WeakPolarHBondContact O-CB 3.45Å; G171-S175 PolarHBondContact O-N 2.93Å; G171-S175 PolarHBondContact O-OG 3.02Å
172	L	95.6	Very high	94	Very high	17 Å²	17	11.1 Å²	11.1	9%	0.089	6%	0.058	C	C	.	.	H	α-helix	trans	-63.9	-41	173.6	-67	172.1	0	0	0	111.8	A168 L169 L170 S175 N176 V194 L214 D217 A218 I221	A168-L172 WeakPolarHBondContact O-CG 3.46Å; A168-L172 PolarHBondContact O-N 3.39Å; L169-L172 HydrophobicContact CD2-CD1 4.43Å; L169-L172 PolarHBondContact O-N 3.23Å; L170-L172 VanDerWaalsContact C-N 3.33Å; L170-L172 PolarHBondContact O-N 3.21Å; L172-S175 PolarHBondContact O-N 3.01Å; L172-N176 WeakPolarHBondContact O-CB 3.44Å; L172-N176 PolarHBondContact O-N 3.43Å; L172-V194 HydrophobicContact CD2-CG1 4.23Å; L172-V194 HydrophobicContact CG-CG1 4.28Å; L172-L214 HydrophobicContact CD1-CD2 3.84Å; L172-D217 HydrophobicContact CD1-CB 3.66Å; L172-D217 HydrophobicContact CD2-CB 3.89Å; L172-D217 HydrophobicContact CG-CB 4.42Å; L172-A218 HydrophobicContact CD2-CB 3.95Å; L172-A218 VanDerWaalsContact CD2-N 3.32Å; L172-I221 HydrophobicContact CB-CD1 4.39Å; L172-I221 HydrophobicContact CD2-CD1 3.94Å; L172-I221 WeakPolarHBondContact O-CD1 3.48Å
173	K	95	Very high	94.3	Very high	51 Å²	51	9.9 Å²	9.9	22%	0.222	5%	0.05	C	C	.	.	H	α-helix	trans	-61.7	-48.5	172.9	-67.5	176.4	-174.5	-172.1	0	112	F83 N84 Y87 E88 L169 L170 S175 N176 F177	F83-K173 HydrophobicContact CE1-CB 4.07Å; N84-K173 WeakPolarHBondContact OD1-CD 3.32Å; N84-K173 PolarHBondContact OD1-NZ 3.41Å; Y87-K173 HydrophobicContact CD1-CB 4.21Å; Y87-K173 HydrophobicContact CD1-CD 3.77Å; Y87-K173 HydrophobicContact CD1-CG 4.02Å; Y87-K173 HydrophobicContact CE1-CB 4.07Å; Y87-K173 HydrophobicContact CE1-CD 3.96Å; Y87-K173 HydrophobicContact CE1-CG 3.73Å; Y87-K173 HydrophobicContact CE2-CB 4.43Å; Y87-K173 HydrophobicContact CG-CB 4.44Å; Y87-K173 HydrophobicContact CG-CD 4.5Å; E88-K173 WeakPolarHBondContact OE1-CE 3.19Å; E88-K173 IonicContact OE1-NZ 3.55Å; E88-K173 PolarHBondContact OE1-NZ 3.29Å; L169-K173 WeakPolarHBondContact O-CG 3.31Å; L169-K173 PolarHBondContact O-N 3.44Å; L169-K173 VanDerWaalsContact O-N 3.16Å; L170-K173 WeakPolarHBondContact O-CB 3.29Å; L170-K173 PolarHBondContact O-N 3.02Å; K173-S175 VanDerWaalsContact C-N 3.32Å; K173-S175 PolarHBondContact O-N 3.23Å; K173-N176 PolarHBondContact O-N 3.29Å; K173-F177 VanDerWaalsContact O-CB 3.25Å; K173-F177 WeakPolarHBondContact O-CB 3.25Å; K173-F177 PolarHBondContact O-N 3.36Å
174	V	96.8	Very high	94.5	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.012	5%	0.052	C	C	.	.	H	α-helix	trans	-56.3	-48	175.9	170	0	0	0	0	110.6	F83 L142 L146 L170 G171 F177 L178 A190	F83-V174 HydrophobicContact CD1-CG2 3.52Å; F83-V174 HydrophobicContact CE1-CB 4.19Å; F83-V174 HydrophobicContact CE1-CG2 3.35Å; F83-V174 HydrophobicContact CE2-CG2 4.48Å; F83-V174 HydrophobicContact CG-CG2 4.2Å; F83-V174 HydrophobicContact CZ-CB 4.34Å; F83-V174 HydrophobicContact CZ-CG2 3.89Å; L142-V174 HydrophobicContact CD1-CG2 4.31Å; L142-V174 HydrophobicContact CD2-CG1 3.97Å; L142-V174 HydrophobicContact CG-CG1 3.9Å; L146-V174 HydrophobicContact CD2-CB 4Å; L146-V174 HydrophobicContact CD2-CG1 3.89Å; L146-V174 HydrophobicContact CD2-CG2 4.42Å; L170-V174 WeakPolarHBondContact O-CG2 3.43Å; L170-V174 PolarHBondContact O-N 2.86Å; G171-V174 PolarHBondContact O-N 3.1Å; V174-F177 PolarHBondContact O-N 3.48Å; V174-L178 HydrophobicContact CG1-CD1 3.73Å; V174-L178 HydrophobicContact CG1-CG 4.42Å; V174-L178 WeakPolarHBondContact O-CB 3.43Å; V174-L178 VanDerWaalsContact O-CG 3.29Å; V174-L178 WeakPolarHBondContact O-CG 3.34Å; V174-L178 PolarHBondContact O-N 2.64Å; V174-A190 HydrophobicContact CG1-CB 4.3Å
175	S	97.6	Very high	94.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-64.7	-43.3	-177.9	-50.3	0	0	0	0	111.9	G171 L172 K173 L178 C179 A187 A190 A191	G171-S175 WeakPolarHBondContact O-CB 3.45Å; G171-S175 PolarHBondContact O-N 2.93Å; G171-S175 PolarHBondContact O-OG 3.02Å; L172-S175 PolarHBondContact O-N 3.01Å; K173-S175 VanDerWaalsContact C-N 3.32Å; K173-S175 PolarHBondContact O-N 3.23Å; S175-L178 PolarHBondContact O-N 2.87Å; S175-C179 PolarHBondContact O-N 2.87Å; S175-C179 VanDerWaalsContact O-N 3.13Å; S175-A187 WeakPolarHBondContact O-CB 3.39Å; S175-A190 VanDerWaalsContact OG-C 3.3Å; S175-A190 WeakPolarHBondContact OG-CB 3.38Å; S175-A191 WeakPolarHBondContact OG-CA 3.42Å; S175-A191 PolarHBondContact OG-N 2.79Å; S175-A191 VanDerWaalsContact OG-N 3.07Å
176	N	94.9	Very high	94.9	Very high	28 Å²	28	11.9 Å²	11.9	15%	0.15	6%	0.06	C	C	.	.	H	α-helix	trans	-67.4	-39.8	176.4	179.8	68.1	0	0	0	112.2	Y87 R91 L172 K173 C179 E180 I221 R224	Y87-N176 PolarHBondContact OH-ND2 2.91Å; R91-N176 PolarHBondContact NH2-ND2 3.28Å; L172-N176 WeakPolarHBondContact O-CB 3.44Å; L172-N176 PolarHBondContact O-N 3.43Å; K173-N176 PolarHBondContact O-N 3.29Å; N176-C179 WeakPolarHBondContact O-CB 3.32Å; N176-C179 PolarHBondContact O-N 3.37Å; N176-E180 PolarHBondContact ND2-OE1 3.05Å; N176-E180 PolarHBondContact O-N 3.16Å; N176-I221 HydrophobicContact CB-CD1 4.13Å; N176-R224 PolarHBondContact OD1-NH1 3.24Å
177	F	95.4	Very high	95.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-62.2	-42.6	175.4	175.1	-94.2	0	0	0	112.4	F83 Y87 Q94 V95 Y98 K173 V174 C179 E180 C181	F83-F177 HydrophobicContact CE2-CB 3.9Å; F83-F177 AromaticContact CE2-CD1 3.56Å; F83-F177 HydrophobicContact CE2-CD1 3.56Å; F83-F177 HydrophobicContact CE2-CD2 4.2Å; F83-F177 HydrophobicContact CE2-CE1 4.11Å; F83-F177 AromaticContact CE2-CG 3.6Å; F83-F177 HydrophobicContact CE2-CG 3.6Å; F83-F177 HydrophobicContact CZ-CB 3.76Å; F83-F177 HydrophobicContact CZ-CD1 4.29Å; F83-F177 AromaticContact CZ-CG 3.98Å; F83-F177 HydrophobicContact CZ-CG 3.98Å; Y87-F177 HydrophobicContact CD2-CB 4.15Å; Y87-F177 HydrophobicContact CD2-CD2 4.21Å; Y87-F177 HydrophobicContact CE2-CB 3.98Å; Y87-F177 HydrophobicContact CE2-CD2 4.49Å; Q94-F177 HydrophobicContact CB-CE2 4Å; Q94-F177 HydrophobicContact CG-CD2 4.5Å; Q94-F177 HydrophobicContact CG-CE2 3.49Å; Q94-F177 VanDerWaalsContact CG-CE2 3.49Å; Q94-F177 HydrophobicContact CG-CZ 3.69Å; V95-F177 HydrophobicContact CG2-CD2 4.19Å; V95-F177 HydrophobicContact CG2-CE2 3.71Å; Y98-F177 HydrophobicContact CD1-CE1 4.05Å; Y98-F177 HydrophobicContact CD1-CZ 4.4Å; Y98-F177 AromaticContact CD2-CE1 3.56Å; Y98-F177 HydrophobicContact CD2-CE1 3.56Å; Y98-F177 AromaticContact CD2-CZ 3.83Å; Y98-F177 HydrophobicContact CD2-CZ 3.83Å; Y98-F177 HydrophobicContact CE1-CE1 4.25Å; Y98-F177 AromaticContact CE2-CE1 3.76Å; Y98-F177 HydrophobicContact CE2-CE1 3.76Å; Y98-F177 HydrophobicContact CE2-CZ 4.48Å; Y98-F177 AromaticContact CG-CE1 3.7Å; Y98-F177 HydrophobicContact CG-CE1 3.7Å; Y98-F177 AromaticContact CG-CZ 3.77Å; Y98-F177 HydrophobicContact CG-CZ 3.77Å; K173-F177 VanDerWaalsContact O-CB 3.25Å; K173-F177 WeakPolarHBondContact O-CB 3.25Å; K173-F177 PolarHBondContact O-N 3.36Å; V174-F177 PolarHBondContact O-N 3.48Å; F177-C179 VanDerWaalsContact C-N 3.32Å; F177-C179 PolarHBondContact O-N 2.89Å; F177-E180 CarbonylContact O-C 3.54Å; F177-E180 WeakPolarHBondContact O-CA 3.49Å; F177-E180 WeakPolarHBondContact O-CB 3.31Å; F177-E180 PolarHBondContact O-N 3.43Å; F177-C181 WeakPolarHBondContact CE1-SG 3.36Å; F177-C181 WeakPolarHBondContact CZ-SG 3.47Å; F177-C181 PolarHBondContact O-N 2.86Å; F177-C181 PolarHBondContact O-SG 3.35Å
178	L	97.1	Very high	95.4	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.7	-39.7	175.1	-71.5	166.5	0	0	0	111	Y98 V143 V174 S175 E180 C181 S182 E183 H186 A187 A190	Y98-L178 HydrophobicContact CE1-CD2 4.33Å; Y98-L178 WeakPolarHBondContact OH-CD2 3.22Å; V143-L178 HydrophobicContact CG2-CD1 3.94Å; V174-L178 HydrophobicContact CG1-CD1 3.73Å; V174-L178 HydrophobicContact CG1-CG 4.42Å; V174-L178 WeakPolarHBondContact O-CB 3.43Å; V174-L178 VanDerWaalsContact O-CG 3.29Å; V174-L178 WeakPolarHBondContact O-CG 3.34Å; V174-L178 PolarHBondContact O-N 2.64Å; S175-L178 PolarHBondContact O-N 2.87Å; L178-E180 VanDerWaalsContact C-N 3.29Å; L178-E180 PolarHBondContact O-N 3.07Å; L178-C181 CarbonylContact O-C 3.58Å; L178-C181 PolarHBondContact O-N 3.37Å; L178-C181 VanDerWaalsContact O-N 3.13Å; L178-S182 PolarHBondContact O-N 2.87Å; L178-E183 HydrophobicContact CB-CB 3.97Å; L178-E183 HydrophobicContact CD2-CB 3.69Å; L178-E183 HydrophobicContact CD2-CG 4.1Å; L178-E183 HydrophobicContact CG-CB 4.44Å; L178-E183 WeakPolarHBondContact O-CA 3.13Å; L178-E183 WeakPolarHBondContact O-CB 3.37Å; L178-E183 PolarHBondContact O-N 3.24Å; L178-H186 HydrophobicContact CD1-CB 4.01Å; L178-H186 HydrophobicContact CD2-CB 4.35Å; L178-A187 HydrophobicContact CB-CB 3.7Å; L178-A190 HydrophobicContact CD1-CB 4.35Å
179	C	94.9	Very high	95.5	Very high	1 Å²	1	17 Å²	17	1%	0.007	8%	0.081	C	C	.	.	H	α-helix	trans	-61.8	-30.9	169.4	-91.1	0	0	0	0	114.2	S175 N176 F177 Y184 A187	S175-C179 PolarHBondContact O-N 2.87Å; S175-C179 VanDerWaalsContact O-N 3.13Å; N176-C179 WeakPolarHBondContact O-CB 3.32Å; N176-C179 PolarHBondContact O-N 3.37Å; F177-C179 VanDerWaalsContact C-N 3.32Å; F177-C179 PolarHBondContact O-N 2.89Å; C179-Y184 WeakPolarHBondContact O-CE1 3.48Å; C179-A187 HydrophobicContact CB-CB 4.35Å; C179-A187 VanDerWaalsContact SG-CB 3.52Å
180	E	91.9	Very high	95.8	Very high	36 Å²	36	15.1 Å²	15.1	17%	0.168	7%	0.071	C	C	.	.	H	α-helix	trans	-75.2	-29.8	172.9	-77.4	164.1	-158.6	0	0	112.1	R91 V95 N176 F177 L178 S182	R91-E180 IonicContact CZ-OE1 3.6Å; R91-E180 IonicContact CZ-OE2 2.98Å; R91-E180 IonicContact NE-OE2 2.74Å; R91-E180 PolarHBondContact NE-OE2 2.91Å; R91-E180 IonicContact NH2-OE1 3.82Å; R91-E180 PolarHBondContact NH2-OE1 2.94Å; R91-E180 IonicContact NH2-OE2 3.66Å; R91-E180 PolarHBondContact NH2-OE2 3.05Å; V95-E180 HydrophobicContact CG2-CB 4.37Å; N176-E180 PolarHBondContact ND2-OE1 3.05Å; N176-E180 PolarHBondContact O-N 3.16Å; F177-E180 CarbonylContact O-C 3.54Å; F177-E180 WeakPolarHBondContact O-CA 3.49Å; F177-E180 WeakPolarHBondContact O-CB 3.31Å; F177-E180 PolarHBondContact O-N 3.43Å; L178-E180 VanDerWaalsContact C-N 3.29Å; L178-E180 PolarHBondContact O-N 3.07Å; E180-S182 VanDerWaalsContact C-N 3.31Å; E180-S182 PolarHBondContact O-N 3.28Å
181	C	94	Very high	96	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.007	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	5	175.4	-62.2	0	0	0	0	114.7	Y98 F177 L178 E183	Y98-C181 HydrophobicContact CD1-CB 4.12Å; Y98-C181 HydrophobicContact CE1-CB 4.41Å; F177-C181 WeakPolarHBondContact CE1-SG 3.36Å; F177-C181 WeakPolarHBondContact CZ-SG 3.47Å; F177-C181 PolarHBondContact O-N 2.86Å; F177-C181 PolarHBondContact O-SG 3.35Å; L178-C181 CarbonylContact O-C 3.58Å; L178-C181 PolarHBondContact O-N 3.37Å; L178-C181 VanDerWaalsContact O-N 3.13Å; C181-E183 HydrophobicContact CB-CB 4.48Å; C181-E183 HydrophobicContact CB-CG 3.81Å; C181-E183 PolarHBondContact O-N 2.8Å
182	S	94.8	Very high	96.1	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.014	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	17.4	-171.5	-174.2	0	0	0	0	115.2	L178 E180 Y184 I491 M492	L178-S182 PolarHBondContact O-N 2.87Å; E180-S182 VanDerWaalsContact C-N 3.31Å; E180-S182 PolarHBondContact O-N 3.28Å; S182-Y184 VanDerWaalsContact C-N 3.32Å; S182-Y184 PolarHBondContact O-N 3.05Å; S182-I491 WeakPolarHBondContact OG-CB 3.43Å; S182-I491 PolarHBondContact OG-N 3.32Å; S182-M492 PolarHBondContact OG-N 3.46Å
183	E	95.6	Very high	96.2	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.009	8%	0.081	C	C	.	.			trans	-91.1	53.9	-176.5	-64.2	-69.7	116	0	0	111.7	Y98 Q102 H103 H136 S139 L178 C181 V185 H186 A187	Y98-E183 HydrophobicContact CE1-CG 4.3Å; Q102-E183 PolarHBondContact NE2-OE1 2.89Å; Q102-E183 PolarHBondContact NE2-OE2 3.39Å; H103-E183 IonicContact CD2-OE1 2.67Å; H103-E183 IonicContact CE1-OE1 3.97Å; H103-E183 PolarHBondContact CE1-OE1 3.42Å; H103-E183 IonicContact NE2-OE1 2.87Å; H103-E183 PolarHBondContact NE2-OE1 3.09Å; H136-E183 IonicContact CE1-OE1 3.24Å; H136-E183 PolarHBondContact CE1-OE1 3.11Å; H136-E183 IonicContact CE1-OE2 2.71Å; H136-E183 IonicContact CG-OE2 3.07Å; H136-E183 VanDerWaalsContact ND1-CD 3.27Å; H136-E183 IonicContact ND1-OE1 2.71Å; H136-E183 PolarHBondContact ND1-OE1 3.4Å; H136-E183 VanDerWaalsContact ND1-OE1 3.11Å; H136-E183 IonicContact ND1-OE2 3.79Å; H136-E183 PolarHBondContact ND1-OE2 3.36Å; S139-E183 VanDerWaalsContact CB-OE2 3.3Å; S139-E183 WeakPolarHBondContact CB-OE2 3.41Å; S139-E183 PolarHBondContact OG-OE2 3.49Å; L178-E183 HydrophobicContact CB-CB 3.97Å; L178-E183 HydrophobicContact CD2-CB 3.69Å; L178-E183 HydrophobicContact CD2-CG 4.1Å; L178-E183 HydrophobicContact CG-CB 4.44Å; L178-E183 WeakPolarHBondContact O-CA 3.13Å; L178-E183 WeakPolarHBondContact O-CB 3.37Å; L178-E183 PolarHBondContact O-N 3.24Å; C181-E183 HydrophobicContact CB-CB 4.48Å; C181-E183 HydrophobicContact CB-CG 3.81Å; C181-E183 PolarHBondContact O-N 2.8Å; E183-V185 PolarHBondContact O-N 3.04Å; E183-H186 HydrophobicContact CB-CB 4.48Å; E183-H186 PolarHBondContact O-N 3.25Å; E183-A187 PolarHBondContact O-N 3.47Å
184	Y	95.6	Very high	96.3	Very high	18 Å²	18	15.2 Å²	15.2	7%	0.071	7%	0.071	C	C	.	.	H	α-helix	trans	-64.2	-40.1	-163.5	-57.2	-53.9	0	0	0	114.8	C179 S182 H186 A187 C188 A225 A228 H229 I491 M492	C179-Y184 WeakPolarHBondContact O-CE1 3.48Å; S182-Y184 VanDerWaalsContact C-N 3.32Å; S182-Y184 PolarHBondContact O-N 3.05Å; Y184-H186 VanDerWaalsContact C-N 3.26Å; Y184-H186 PolarHBondContact O-N 2.99Å; Y184-A187 WeakPolarHBondContact O-CB 3.28Å; Y184-A187 PolarHBondContact O-N 3.07Å; Y184-C188 WeakPolarHBondContact O-CB 3.24Å; Y184-C188 PolarHBondContact O-N 3.11Å; Y184-A225 WeakPolarHBondContact O-CB 3.42Å; Y184-A228 HydrophobicContact CD1-CB 3.79Å; Y184-A228 HydrophobicContact CD2-CB 3.83Å; Y184-A228 HydrophobicContact CE1-CB 3.64Å; Y184-A228 HydrophobicContact CE2-CB 3.67Å; Y184-A228 HydrophobicContact CG-CB 3.9Å; Y184-H229 HydrophobicContact CD2-CB 4.04Å; Y184-H229 HydrophobicContact CG-CB 4.29Å; Y184-I491 HydrophobicContact CD2-CD1 3.75Å; Y184-I491 HydrophobicContact CE2-CB 4.26Å; Y184-I491 HydrophobicContact CE2-CD1 4.24Å; Y184-I491 HydrophobicContact CE2-CG2 4.42Å; Y184-M492 VanDerWaalsContact OH-CG 3.31Å; Y184-M492 WeakPolarHBondContact OH-CG 3.25Å; Y184-M492 PolarHBondContact OH-SD 2.96Å
185	V	94.9	Very high	96.3	Very high	22 Å²	22	15.5 Å²	15.5	13%	0.133	7%	0.072	C	C	.	.	H	α-helix	trans	-60.3	-40.2	177.5	176.2	0	0	0	0	110.8	E183 C188 K189 H229 M231 Y533	E183-V185 PolarHBondContact O-N 3.04Å; V185-C188 PolarHBondContact O-N 3.11Å; V185-K189 HydrophobicContact CG1-CD 4.17Å; V185-K189 VanDerWaalsContact O-CG 3.31Å; V185-K189 WeakPolarHBondContact O-CG 3.47Å; V185-K189 PolarHBondContact O-N 3.12Å; V185-H229 WeakPolarHBondContact CG2-CD2 3.19Å; V185-M231 HydrophobicContact CG2-SD 4.37Å; V185-Y533 HydrophobicContact CG2-CE1 3.88Å
186	H	97.6	Very high	96.2	Very high	8 Å²	8	20.8 Å²	20.8	4%	0.037	10%	0.097	C	C	.	.	H	α-helix	trans	-73.8	-38.2	178.4	-60.4	71.7	0	0	0	112.1	H136 S139 N140 V143 L178 E183 Y184 C188 K189 A190	H136-H186 WeakPolarHBondContact CB-CE1 3.43Å; H136-H186 AromaticContact CG-CE1 3.6Å; S139-H186 WeakPolarHBondContact CB-CD2 3.17Å; N140-H186 PolarHBondContact OD1-CD2 2.91Å; N140-H186 PolarHBondContact OD1-NE2 2.92Å; V143-H186 HydrophobicContact CG2-CB 3.97Å; L178-H186 HydrophobicContact CD1-CB 4.01Å; L178-H186 HydrophobicContact CD2-CB 4.35Å; E183-H186 HydrophobicContact CB-CB 4.48Å; E183-H186 PolarHBondContact O-N 3.25Å; Y184-H186 VanDerWaalsContact C-N 3.26Å; Y184-H186 PolarHBondContact O-N 2.99Å; H186-C188 VanDerWaalsContact C-N 3.32Å; H186-C188 PolarHBondContact O-N 2.91Å; H186-K189 PolarHBondContact O-N 3.21Å; H186-A190 VanDerWaalsContact O-CB 3.31Å; H186-A190 WeakPolarHBondContact O-CB 3.49Å; H186-A190 PolarHBondContact O-N 3.43Å
187	A	98	Very high	96.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.7	-43.1	171	0	0	0	0	0	112	S175 L178 C179 E183 Y184 A191 A225	S175-A187 WeakPolarHBondContact O-CB 3.39Å; L178-A187 HydrophobicContact CB-CB 3.7Å; C179-A187 HydrophobicContact CB-CB 4.35Å; C179-A187 VanDerWaalsContact SG-CB 3.52Å; E183-A187 PolarHBondContact O-N 3.47Å; Y184-A187 WeakPolarHBondContact O-CB 3.28Å; Y184-A187 PolarHBondContact O-N 3.07Å; A187-A191 WeakPolarHBondContact O-CB 3.38Å; A187-A191 PolarHBondContact O-N 3.07Å; A187-A225 HydrophobicContact CB-CB 4.11Å
188	C	97.2	Very high	96.2	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.014	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-47.6	175.9	-171.5	0	0	0	0	111.5	Y184 V185 H186 A190 A191 R192 A225 M231	Y184-C188 WeakPolarHBondContact O-CB 3.24Å; Y184-C188 PolarHBondContact O-N 3.11Å; V185-C188 PolarHBondContact O-N 3.11Å; H186-C188 VanDerWaalsContact C-N 3.32Å; H186-C188 PolarHBondContact O-N 2.91Å; C188-A190 VanDerWaalsContact C-N 3.34Å; C188-A190 PolarHBondContact O-N 3.3Å; C188-A191 PolarHBondContact O-N 2.64Å; C188-R192 VanDerWaalsContact O-CB 3.29Å; C188-R192 WeakPolarHBondContact O-CB 3.36Å; C188-R192 PolarHBondContact O-N 2.97Å; C188-A225 HydrophobicContact CB-CB 4.06Å; C188-M231 HydrophobicContact CB-CE 4.35Å; C188-M231 HydrophobicContact CB-SD 4.26Å
189	K	97.3	Very high	96.1	Very high	113 Å²	113	26.2 Å²	26.2	49%	0.491	12%	0.118	S	C	.	.	H	α-helix	trans	-59	-41.6	176.3	-73.5	169	-179.7	175.2	0	112.8	V143 V185 H186 S193	V143-K189 HydrophobicContact CG1-CB 4.27Å; V185-K189 HydrophobicContact CG1-CD 4.17Å; V185-K189 VanDerWaalsContact O-CG 3.31Å; V185-K189 WeakPolarHBondContact O-CG 3.47Å; V185-K189 PolarHBondContact O-N 3.12Å; H186-K189 PolarHBondContact O-N 3.21Å; K189-S193 WeakPolarHBondContact O-CB 3.48Å; K189-S193 PolarHBondContact O-N 3.38Å; K189-S193 PolarHBondContact O-OG 3.23Å
190	A	98.2	Very high	95.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-47.1	175.6	0	0	0	0	0	111.8	V143 L146 V174 S175 L178 H186 C188 S193 V194	V143-A190 HydrophobicContact CG2-CB 4.33Å; L146-A190 HydrophobicContact CD2-CB 3.78Å; V174-A190 HydrophobicContact CG1-CB 4.3Å; S175-A190 VanDerWaalsContact OG-C 3.3Å; S175-A190 WeakPolarHBondContact OG-CB 3.38Å; L178-A190 HydrophobicContact CD1-CB 4.35Å; H186-A190 VanDerWaalsContact O-CB 3.31Å; H186-A190 WeakPolarHBondContact O-CB 3.49Å; H186-A190 PolarHBondContact O-N 3.43Å; C188-A190 VanDerWaalsContact C-N 3.34Å; C188-A190 PolarHBondContact O-N 3.3Å; A190-S193 WeakPolarHBondContact O-CB 3.45Å; A190-S193 PolarHBondContact O-N 3.3Å; A190-V194 PolarHBondContact O-N 2.76Å; A190-V194 VanDerWaalsContact O-N 3.09Å
191	A	97.9	Very high	96	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.7	-40.8	-179.4	0	0	0	0	0	112.4	S175 A187 C188 S193 V194 H195 A218 I221 M222	S175-A191 WeakPolarHBondContact OG-CA 3.42Å; S175-A191 PolarHBondContact OG-N 2.79Å; S175-A191 VanDerWaalsContact OG-N 3.07Å; A187-A191 WeakPolarHBondContact O-CB 3.38Å; A187-A191 PolarHBondContact O-N 3.07Å; C188-A191 PolarHBondContact O-N 2.64Å; A191-S193 VanDerWaalsContact C-N 3.34Å; A191-S193 PolarHBondContact O-N 3.45Å; A191-V194 WeakPolarHBondContact O-CB 3.45Å; A191-V194 PolarHBondContact O-N 2.88Å; A191-V194 VanDerWaalsContact O-N 3.11Å; A191-H195 PolarHBondContact O-N 3.48Å; A191-A218 WeakPolarHBondContact O-CB 3.33Å; A191-I221 HydrophobicContact CB-CB 4.12Å; A191-I221 HydrophobicContact CB-CG2 4.24Å; A191-M222 HydrophobicContact CB-CG 3.56Å
192	R	97.3	Very high	95.8	Very high	66 Å²	66	31.2 Å²	31.2	25%	0.249	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-42.1	173.6	-175.7	171.6	-93.9	150.9	-8.8	110.9	C188 V194 H195 E196 M222 D237	C188-R192 VanDerWaalsContact O-CB 3.29Å; C188-R192 WeakPolarHBondContact O-CB 3.36Å; C188-R192 PolarHBondContact O-N 2.97Å; R192-V194 VanDerWaalsContact C-N 3.32Å; R192-V194 PolarHBondContact O-N 3.48Å; R192-H195 PolarHBondContact O-N 2.91Å; R192-E196 VanDerWaalsContact CG-OE1 3.31Å; R192-E196 WeakPolarHBondContact CG-OE1 3.14Å; R192-E196 WeakPolarHBondContact O-CB 3.44Å; R192-E196 WeakPolarHBondContact O-CG 3.37Å; R192-E196 PolarHBondContact O-N 3.3Å; R192-M222 HydrophobicContact CB-CE 4.04Å; R192-M222 HydrophobicContact CB-SD 4.06Å; R192-M222 HydrophobicContact CG-CE 4.25Å; R192-D237 IonicContact CZ-OD1 3.68Å; R192-D237 VanDerWaalsContact CZ-OD1 3.31Å; R192-D237 IonicContact NH1-OD1 2.74Å; R192-D237 PolarHBondContact NH1-OD1 3.43Å; R192-D237 IonicContact NH2-OD1 2.72Å; R192-D237 PolarHBondContact NH2-OD1 3.08Å
193	S	97.9	Very high	95.2	Very high	18 Å²	18	35.4 Å²	35.4	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-59.2	-38.5	172.4	-59.8	0	0	0	0	113	K189 A190 A191 T197	K189-S193 WeakPolarHBondContact O-CB 3.48Å; K189-S193 PolarHBondContact O-N 3.38Å; K189-S193 PolarHBondContact O-OG 3.23Å; A190-S193 WeakPolarHBondContact O-CB 3.45Å; A190-S193 PolarHBondContact O-N 3.3Å; A191-S193 VanDerWaalsContact C-N 3.34Å; A191-S193 PolarHBondContact O-N 3.45Å; S193-T197 VanDerWaalsContact O-CB 3.32Å; S193-T197 WeakPolarHBondContact O-CB 3.48Å; S193-T197 PolarHBondContact O-N 3.09Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 3.4Å
194	V	97.4	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-49.8	173.8	173.9	0	0	0	0	110.8	L150 A168 L172 A190 A191 R192 E196 T197 V198 A218	L150-V194 HydrophobicContact CD1-CG2 3.98Å; L150-V194 HydrophobicContact CD2-CG2 4.27Å; A168-V194 HydrophobicContact CB-CG1 3.86Å; L172-V194 HydrophobicContact CD2-CG1 4.23Å; L172-V194 HydrophobicContact CG-CG1 4.28Å; A190-V194 PolarHBondContact O-N 2.76Å; A190-V194 VanDerWaalsContact O-N 3.09Å; A191-V194 WeakPolarHBondContact O-CB 3.45Å; A191-V194 PolarHBondContact O-N 2.88Å; A191-V194 VanDerWaalsContact O-N 3.11Å; R192-V194 VanDerWaalsContact C-N 3.32Å; R192-V194 PolarHBondContact O-N 3.48Å; V194-E196 PolarHBondContact O-N 2.88Å; V194-T197 PolarHBondContact O-N 3.24Å; V194-V198 HydrophobicContact CG1-CG2 4.06Å; V194-V198 WeakPolarHBondContact O-CB 3.34Å; V194-V198 VanDerWaalsContact O-CG2 3.25Å; V194-V198 WeakPolarHBondContact O-CG2 3.23Å; V194-V198 PolarHBondContact O-N 3.46Å; V194-A218 HydrophobicContact CB-CB 4.3Å; V194-A218 HydrophobicContact CG1-CB 4.18Å
195	H	96.5	Very high	93.2	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-49	-179.6	-174.6	96.1	0	0	0	111.2	A191 R192 T197 R199 E215 A218 M222	A191-H195 PolarHBondContact O-N 3.48Å; R192-H195 PolarHBondContact O-N 2.91Å; H195-T197 PolarHBondContact O-N 2.93Å; H195-R199 PolarHBondContact NE2-NH1 2.74Å; H195-R199 WeakPolarHBondContact O-CB 3.29Å; H195-R199 PolarHBondContact O-N 3.42Å; H195-E215 PolarHBondContact ND1-O 3.09Å; H195-E215 VanDerWaalsContact ND1-O 3.09Å; H195-A218 HydrophobicContact CB-CB 3.96Å; H195-M222 HydrophobicContact CB-SD 4.48Å
196	E	96	Very high	92.6	Very high	111 Å²	111	53.3 Å²	53.3	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-45.6	177.5	-72	170.5	-169.2	0	0	112.5	R192 V194 R199 S200	R192-E196 VanDerWaalsContact CG-OE1 3.31Å; R192-E196 WeakPolarHBondContact CG-OE1 3.14Å; R192-E196 WeakPolarHBondContact O-CB 3.44Å; R192-E196 WeakPolarHBondContact O-CG 3.37Å; R192-E196 PolarHBondContact O-N 3.3Å; V194-E196 PolarHBondContact O-N 2.88Å; E196-R199 PolarHBondContact O-N 3.46Å; E196-S200 WeakPolarHBondContact O-CB 3.42Å; E196-S200 PolarHBondContact O-N 2.92Å
197	T	95.3	Very high	92.1	Very high	23 Å²	23	55.7 Å²	55.7	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-46.5	-179.4	-58.3	0	0	0	0	111.7	L150 P154 S193 V194 H195 F201	L150-T197 HydrophobicContact CB-CG2 4.18Å; L150-T197 HydrophobicContact CD2-CG2 4.13Å; P154-T197 HydrophobicContact CG-CG2 4.31Å; S193-T197 VanDerWaalsContact O-CB 3.32Å; S193-T197 WeakPolarHBondContact O-CB 3.48Å; S193-T197 PolarHBondContact O-N 3.09Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 3.4Å; V194-T197 PolarHBondContact O-N 3.24Å; H195-T197 PolarHBondContact O-N 2.93Å; T197-F201 VanDerWaalsContact O-CB 3.29Å; T197-F201 WeakPolarHBondContact O-CB 3.31Å; T197-F201 PolarHBondContact O-N 3.1Å
198	V	95	Very high	91.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-51.1	177	168.6	0	0	0	0	109.9	A168 V194 F201 F202 Q211 L214 E215	A168-V198 HydrophobicContact CB-CG2 3.66Å; V194-V198 HydrophobicContact CG1-CG2 4.06Å; V194-V198 WeakPolarHBondContact O-CB 3.34Å; V194-V198 VanDerWaalsContact O-CG2 3.25Å; V194-V198 WeakPolarHBondContact O-CG2 3.23Å; V194-V198 PolarHBondContact O-N 3.46Å; V198-F201 PolarHBondContact O-N 3.15Å; V198-F202 HydrophobicContact CB-CD2 4.41Å; V198-F202 HydrophobicContact CG1-CD2 3.82Å; V198-F202 HydrophobicContact CG1-CE2 4.33Å; V198-F202 WeakPolarHBondContact O-CB 3.36Å; V198-F202 VanDerWaalsContact O-CD2 3.24Å; V198-F202 WeakPolarHBondContact O-CD2 3.46Å; V198-F202 PolarHBondContact O-N 3.05Å; V198-Q211 HydrophobicContact CG1-CG 4.16Å; V198-L214 HydrophobicContact CG1-CB 3.88Å; V198-L214 HydrophobicContact CG2-CB 4.01Å; V198-L214 HydrophobicContact CG2-CD1 4.21Å; V198-E215 HydrophobicContact CG1-CG 3.9Å
199	R	94	Very high	91.4	Very high	120 Å²	120	64.8 Å²	64.8	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-46.2	-178.4	-172.6	167.4	-179.2	165.1	-4.8	112.5	H195 E196 T203 E215	H195-R199 PolarHBondContact NE2-NH1 2.74Å; H195-R199 WeakPolarHBondContact O-CB 3.29Å; H195-R199 PolarHBondContact O-N 3.42Å; E196-R199 PolarHBondContact O-N 3.46Å; R199-T203 WeakPolarHBondContact O-CB 3.34Å; R199-T203 PolarHBondContact O-N 3.25Å; R199-T203 PolarHBondContact O-OG1 3.27Å; R199-E215 WeakPolarHBondContact CA-OE1 3.47Å; R199-E215 VanDerWaalsContact CB-OE1 3.28Å; R199-E215 WeakPolarHBondContact CB-OE1 3.31Å; R199-E215 WeakPolarHBondContact CG-OE1 3.39Å
200	S	92.7	Very high	91	Very high	97 Å²	97	59.4 Å²	59.4	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-60.5	-46.6	177.8	-174.9	0	0	0	0	111.7	E196	E196-S200 WeakPolarHBondContact O-CB 3.42Å; E196-S200 PolarHBondContact O-N 2.92Å
201	F	92.4	Very high	90.8	Very high	44 Å²	44	60.1 Å²	60.1	19%	0.193	29%	0.293	C	S	.	.	H	α-helix	trans	-71.6	-49.1	-178.2	-176.1	-97.7	0	0	0	112.9	P154 A160 A161 V164 T197 V198 T205	P154-F201 HydrophobicContact CB-CD2 3.86Å; P154-F201 HydrophobicContact CB-CE2 4.26Å; P154-F201 HydrophobicContact CG-CD2 4.28Å; A160-F201 HydrophobicContact CB-CZ 4.46Å; A161-F201 HydrophobicContact CB-CE1 3.86Å; A161-F201 HydrophobicContact CB-CZ 4.31Å; V164-F201 HydrophobicContact CB-CD1 4.12Å; V164-F201 HydrophobicContact CB-CE1 4.29Å; V164-F201 HydrophobicContact CB-CG 4.39Å; V164-F201 HydrophobicContact CG1-CB 4.18Å; V164-F201 HydrophobicContact CG1-CD1 3.93Å; V164-F201 HydrophobicContact CG1-CG 4.07Å; V164-F201 HydrophobicContact CG2-CD1 4.1Å; V164-F201 HydrophobicContact CG2-CD2 3.97Å; V164-F201 HydrophobicContact CG2-CE1 4.21Å; V164-F201 HydrophobicContact CG2-CE2 4.05Å; V164-F201 HydrophobicContact CG2-CG 3.98Å; V164-F201 HydrophobicContact CG2-CZ 4.17Å; T197-F201 VanDerWaalsContact O-CB 3.29Å; T197-F201 WeakPolarHBondContact O-CB 3.31Å; T197-F201 PolarHBondContact O-N 3.1Å; V198-F201 PolarHBondContact O-N 3.15Å; F201-T205 HydrophobicContact CE1-CG2 4.47Å; F201-T205 WeakPolarHBondContact O-CG2 3.41Å
202	F	90	Very high	90.6	Very high	1 Å²	1	60.2 Å²	60.2	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-81.9	-18.7	-168.2	-72.4	-67.5	0	0	0	115.1	A161 V164 I165 V198 L204 T205 F207 Q211	A161-F202 HydrophobicContact CB-CE1 3.99Å; A161-F202 HydrophobicContact CB-CZ 4.45Å; V164-F202 HydrophobicContact CB-CZ 4.46Å; V164-F202 HydrophobicContact CG1-CE2 3.79Å; V164-F202 HydrophobicContact CG1-CZ 4.14Å; I165-F202 HydrophobicContact CD1-CZ 4.21Å; I165-F202 HydrophobicContact CG1-CE2 4.28Å; I165-F202 HydrophobicContact CG1-CZ 3.74Å; V198-F202 HydrophobicContact CB-CD2 4.41Å; V198-F202 HydrophobicContact CG1-CD2 3.82Å; V198-F202 HydrophobicContact CG1-CE2 4.33Å; V198-F202 WeakPolarHBondContact O-CB 3.36Å; V198-F202 VanDerWaalsContact O-CD2 3.24Å; V198-F202 WeakPolarHBondContact O-CD2 3.46Å; V198-F202 PolarHBondContact O-N 3.05Å; F202-L204 PolarHBondContact O-N 3.1Å; F202-T205 WeakPolarHBondContact CA-OG1 3.36Å; F202-T205 HydrophobicContact CD1-CG2 4.32Å; F202-T205 WeakPolarHBondContact CD1-OG1 3.31Å; F202-T205 WeakPolarHBondContact O-CB 3.48Å; F202-T205 PolarHBondContact O-N 3.3Å; F202-T205 PolarHBondContact O-OG1 2.84Å; F202-F207 HydrophobicContact CD1-CB 3.77Å; F202-F207 HydrophobicContact CD1-CD2 4.2Å; F202-F207 HydrophobicContact CD1-CG 4.45Å; F202-F207 HydrophobicContact CE1-CB 3.88Å; F202-F207 AromaticContact CE1-CD2 3.97Å; F202-F207 HydrophobicContact CE1-CD2 3.97Å; F202-F207 HydrophobicContact CE1-CG 4.25Å; F202-Q211 HydrophobicContact CB-CB 3.65Å; F202-Q211 HydrophobicContact CB-CG 3.77Å; F202-Q211 HydrophobicContact CD2-CB 4.32Å; F202-Q211 HydrophobicContact CG-CB 4.1Å
203	T	81.5	Confident	90.3	Very high	91 Å²	91	57.8 Å²	57.8	56%	0.558	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-26	-178.9	-69.6	0	0	0	0	114.1	R199	R199-T203 WeakPolarHBondContact O-CB 3.34Å; R199-T203 PolarHBondContact O-N 3.25Å; R199-T203 PolarHBondContact O-OG1 3.27Å
204	L	76.1	Confident	90.1	Very high	165 Å²	165	57 Å²	57	86%	0.864	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	13.2	177.9	-61.8	177.7	0	0	0	114	F202	F202-L204 PolarHBondContact O-N 3.1Å
205	T	73.4	Confident	90	Very high	52 Å²	52	57.6 Å²	57.6	32%	0.319	28%	0.281	S	S	.	.	S	Bend	trans	-119.7	-179	-169.3	78.3	0	0	0	0	113.1	F201 F202 F207	F201-T205 HydrophobicContact CE1-CG2 4.47Å; F201-T205 WeakPolarHBondContact O-CG2 3.41Å; F202-T205 WeakPolarHBondContact CA-OG1 3.36Å; F202-T205 HydrophobicContact CD1-CG2 4.32Å; F202-T205 WeakPolarHBondContact CD1-OG1 3.31Å; F202-T205 WeakPolarHBondContact O-CB 3.48Å; F202-T205 PolarHBondContact O-N 3.3Å; F202-T205 PolarHBondContact O-OG1 2.84Å; T205-F207 PolarHBondContact OG1-N 3.18Å
206	K	82.5	Confident	90	Very high	201 Å²	201	57.2 Å²	57.2	87%	0.874	28%	0.279	S	S	*	.	S	Bend	trans	-92.5	-8.1	175.9	-61.5	-176.5	-179.8	-179	0	114	H208	K206-H208 VanDerWaalsContact C-N 3.25Å; K206-H208 PolarHBondContact O-N 2.9Å; K206-H208 VanDerWaalsContact O-N 3.07Å
207	F	88.5	Confident	89.9	Confident	57 Å²	57	53.6 Å²	53.6	25%	0.25	26%	0.263	C	S	.	.			trans	-88.3	41.4	-168.8	-56.3	-72.9	0	0	0	113.7	A161 F202 T205 R209 A210 Q211 L352	A161-F207 HydrophobicContact CB-CD2 3.92Å; A161-F207 HydrophobicContact CB-CE2 3.62Å; A161-F207 HydrophobicContact CB-CZ 4.31Å; F202-F207 HydrophobicContact CD1-CB 3.77Å; F202-F207 HydrophobicContact CD1-CD2 4.2Å; F202-F207 HydrophobicContact CD1-CG 4.45Å; F202-F207 HydrophobicContact CE1-CB 3.88Å; F202-F207 AromaticContact CE1-CD2 3.97Å; F202-F207 HydrophobicContact CE1-CD2 3.97Å; F202-F207 HydrophobicContact CE1-CG 4.25Å; T205-F207 PolarHBondContact OG1-N 3.18Å; F207-R209 PolarHBondContact O-N 3.27Å; F207-R209 VanDerWaalsContact O-N 3.12Å; F207-A210 HydrophobicContact CB-CB 4.31Å; F207-A210 PolarHBondContact O-N 3.27Å; F207-A210 VanDerWaalsContact O-N 3.11Å; F207-Q211 PolarHBondContact O-N 3.11Å; F207-Q211 VanDerWaalsContact O-N 3.07Å; F207-L352 HydrophobicContact CD1-CD2 3.98Å; F207-L352 WeakPolarHBondContact CD1-O 3.42Å; F207-L352 HydrophobicContact CE1-CB 4.22Å; F207-L352 HydrophobicContact CE1-CD2 3.77Å; F207-L352 WeakPolarHBondContact CE1-O 3.39Å; F207-L352 HydrophobicContact CE2-CD2 4.36Å; F207-L352 HydrophobicContact CG-CD2 4.36Å; F207-L352 HydrophobicContact CZ-CD2 3.98Å
208	H	88.8	Confident	90	Very high	87 Å²	87	52.5 Å²	52.5	40%	0.403	26%	0.257	S	S	.	.	H	α-helix	trans	-59	-30.3	-170.8	-172.6	52.7	0	0	0	114	K206 Q211 Q212	K206-H208 VanDerWaalsContact C-N 3.25Å; K206-H208 PolarHBondContact O-N 2.9Å; K206-H208 VanDerWaalsContact O-N 3.07Å; H208-Q211 PolarHBondContact ND1-OE1 2.83Å; H208-Q211 WeakPolarHBondContact O-CB 3.39Å; H208-Q212 VanDerWaalsContact NE2-CD 3.34Å; H208-Q212 PolarHBondContact NE2-NE2 3.49Å; H208-Q212 PolarHBondContact NE2-OE1 2.71Å; H208-Q212 WeakPolarHBondContact O-CB 3.41Å; H208-Q212 WeakPolarHBondContact O-CG 3.31Å; H208-Q212 PolarHBondContact O-N 3.24Å
209	R	90	Very high	90.2	Very high	106 Å²	106	52.5 Å²	52.5	40%	0.4	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-46.5	175.7	-65.7	-172.5	167.9	170.9	-3.2	112.7	F207 Q211 Q212 R213 L257 G354 C359	F207-R209 PolarHBondContact O-N 3.27Å; F207-R209 VanDerWaalsContact O-N 3.12Å; R209-Q211 VanDerWaalsContact C-N 3.31Å; R209-Q211 PolarHBondContact O-N 2.74Å; R209-Q212 PolarHBondContact O-N 3.13Å; R209-R213 WeakPolarHBondContact O-CB 3.48Å; R209-R213 PolarHBondContact O-N 3.49Å; R209-L257 HydrophobicContact CB-CD1 4.45Å; R209-L257 HydrophobicContact CB-CD2 4.41Å; R209-L257 HydrophobicContact CG-CD2 4.02Å; R209-G354 WeakPolarHBondContact CD-O 3.4Å; R209-G354 PolarHBondContact NH1-O 3.41Å; R209-C359 HydrophobicContact CB-CB 4.14Å
210	A	90.1	Very high	90.3	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-42.9	175.9	0	0	0	0	0	111.2	I165 F207 R213 L214 L351	I165-A210 HydrophobicContact CD1-CB 4.14Å; F207-A210 HydrophobicContact CB-CB 4.31Å; F207-A210 PolarHBondContact O-N 3.27Å; F207-A210 VanDerWaalsContact O-N 3.11Å; A210-R213 PolarHBondContact O-N 3.34Å; A210-L214 WeakPolarHBondContact O-CB 3.29Å; A210-L214 VanDerWaalsContact O-CG 3.31Å; A210-L214 WeakPolarHBondContact O-CG 3.48Å; A210-L214 PolarHBondContact O-N 3.39Å; A210-L351 HydrophobicContact CB-CB 4.29Å; A210-L351 WeakPolarHBondContact CB-O 3.31Å
211	Q	93.8	Very high	90.4	Very high	15 Å²	15	43.6 Å²	43.6	7%	0.07	21%	0.211	C	C	.	.	H	α-helix	trans	-54.2	-58.7	173.2	-179.9	-175.5	1.7	0	0	111.1	V198 F202 F207 H208 R209 R213 L214 E215	V198-Q211 HydrophobicContact CG1-CG 4.16Å; F202-Q211 HydrophobicContact CB-CB 3.65Å; F202-Q211 HydrophobicContact CB-CG 3.77Å; F202-Q211 HydrophobicContact CD2-CB 4.32Å; F202-Q211 HydrophobicContact CG-CB 4.1Å; F207-Q211 PolarHBondContact O-N 3.11Å; F207-Q211 VanDerWaalsContact O-N 3.07Å; H208-Q211 PolarHBondContact ND1-OE1 2.83Å; H208-Q211 WeakPolarHBondContact O-CB 3.39Å; R209-Q211 VanDerWaalsContact C-N 3.31Å; R209-Q211 PolarHBondContact O-N 2.74Å; Q211-R213 VanDerWaalsContact C-N 3.33Å; Q211-R213 PolarHBondContact O-N 3.02Å; Q211-L214 PolarHBondContact O-N 3.44Å; Q211-E215 HydrophobicContact CG-CG 4.21Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.27Å; Q211-E215 PolarHBondContact NE2-OE1 3.03Å; Q211-E215 VanDerWaalsContact O-CB 3.32Å; Q211-E215 WeakPolarHBondContact O-CB 3.43Å; Q211-E215 WeakPolarHBondContact O-CG 3.48Å; Q211-E215 PolarHBondContact O-N 2.88Å
212	Q	93.2	Very high	90.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-38.1	-176.4	-77.4	-177.5	-50.8	0	0	113.1	H208 R209 Y216 S251 M252 S255 L257	H208-Q212 VanDerWaalsContact NE2-CD 3.34Å; H208-Q212 PolarHBondContact NE2-NE2 3.49Å; H208-Q212 PolarHBondContact NE2-OE1 2.71Å; H208-Q212 WeakPolarHBondContact O-CB 3.41Å; H208-Q212 WeakPolarHBondContact O-CG 3.31Å; H208-Q212 PolarHBondContact O-N 3.24Å; R209-Q212 PolarHBondContact O-N 3.13Å; Q212-Y216 PolarHBondContact O-N 3.12Å; Q212-S251 VanDerWaalsContact NE2-C 3.25Å; Q212-S251 PolarHBondContact NE2-O 2.81Å; Q212-S251 PolarHBondContact NE2-OG 3.27Å; Q212-M252 HydrophobicContact CB-CG 4.03Å; Q212-M252 HydrophobicContact CG-CG 4.41Å; Q212-S255 PolarHBondContact NE2-OG 3.38Å; Q212-S255 VanDerWaalsContact NE2-OG 3.08Å; Q212-S255 PolarHBondContact OE1-OG 2.92Å; Q212-L257 HydrophobicContact CB-CD1 3.63Å; Q212-L257 HydrophobicContact CG-CD1 4.44Å; Q212-L257 VanDerWaalsContact OE1-CD1 3.28Å
213	R	91.8	Very high	91	Very high	16 Å²	16	41.5 Å²	41.5	6%	0.06	20%	0.202	C	C	.	.	H	α-helix	trans	-62.2	-52	175.1	176.3	67.3	-144.8	-140.3	7.5	111.4	R209 A210 Q211 Y216 D217 L351	R209-R213 WeakPolarHBondContact O-CB 3.48Å; R209-R213 PolarHBondContact O-N 3.49Å; A210-R213 PolarHBondContact O-N 3.34Å; Q211-R213 VanDerWaalsContact C-N 3.33Å; Q211-R213 PolarHBondContact O-N 3.02Å; R213-Y216 PolarHBondContact O-N 3.46Å; R213-D217 IonicContact CZ-OD1 3.49Å; R213-D217 IonicContact CZ-OD2 2.72Å; R213-D217 IonicContact NE-OD1 3.3Å; R213-D217 PolarHBondContact NE-OD1 3.4Å; R213-D217 IonicContact NE-OD2 3.19Å; R213-D217 PolarHBondContact NE-OD2 3.26Å; R213-D217 IonicContact NH2-OD1 2.73Å; R213-D217 PolarHBondContact NH2-OD1 3.34Å; R213-D217 IonicContact NH2-OD2 3.16Å; R213-D217 PolarHBondContact NH2-OD2 2.88Å; R213-D217 PolarHBondContact O-N 2.89Å; R213-L351 HydrophobicContact CB-CD2 4.45Å; R213-L351 HydrophobicContact CG-CD2 4.04Å
214	L	93.4	Very high	91.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-38.1	-178.2	-68.1	169.9	0	0	0	112.9	I165 A168 L169 L172 V198 A210 Q211 Y216 D217 A218 L351	I165-L214 HydrophobicContact CB-CD1 4.44Å; I165-L214 HydrophobicContact CG1-CD1 3.99Å; I165-L214 HydrophobicContact CG2-CD1 4.28Å; A168-L214 HydrophobicContact CB-CD1 4.09Å; A168-L214 HydrophobicContact CB-CD2 4.28Å; L169-L214 HydrophobicContact CD2-CD2 4Å; L169-L214 HydrophobicContact CG-CD2 4.37Å; L172-L214 HydrophobicContact CD1-CD2 3.84Å; V198-L214 HydrophobicContact CG1-CB 3.88Å; V198-L214 HydrophobicContact CG2-CB 4.01Å; V198-L214 HydrophobicContact CG2-CD1 4.21Å; A210-L214 WeakPolarHBondContact O-CB 3.29Å; A210-L214 VanDerWaalsContact O-CG 3.31Å; A210-L214 WeakPolarHBondContact O-CG 3.48Å; A210-L214 PolarHBondContact O-N 3.39Å; Q211-L214 PolarHBondContact O-N 3.44Å; L214-Y216 VanDerWaalsContact C-N 3.25Å; L214-Y216 PolarHBondContact O-N 3.16Å; L214-D217 PolarHBondContact O-N 3.33Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 2.89Å; L214-A218 VanDerWaalsContact O-N 3.07Å; L214-L351 HydrophobicContact CD2-CD1 4.49Å
215	E	96.2	Very high	92.7	Very high	13 Å²	13	31.5 Å²	31.5	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-58.4	-38.9	174.3	-82.4	-179.8	-173.3	0	0	111.3	H195 V198 R199 Q211 M219 L248	H195-E215 PolarHBondContact ND1-O 3.09Å; H195-E215 VanDerWaalsContact ND1-O 3.09Å; V198-E215 HydrophobicContact CG1-CG 3.9Å; R199-E215 WeakPolarHBondContact CA-OE1 3.47Å; R199-E215 VanDerWaalsContact CB-OE1 3.28Å; R199-E215 WeakPolarHBondContact CB-OE1 3.31Å; R199-E215 WeakPolarHBondContact CG-OE1 3.39Å; Q211-E215 HydrophobicContact CG-CG 4.21Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.27Å; Q211-E215 PolarHBondContact NE2-OE1 3.03Å; Q211-E215 VanDerWaalsContact O-CB 3.32Å; Q211-E215 WeakPolarHBondContact O-CB 3.43Å; Q211-E215 WeakPolarHBondContact O-CG 3.48Å; Q211-E215 PolarHBondContact O-N 2.88Å; E215-M219 WeakPolarHBondContact O-CB 3.25Å; E215-M219 PolarHBondContact O-N 2.93Å; E215-L248 HydrophobicContact CB-CD1 4.18Å; E215-L248 HydrophobicContact CB-CD2 4.17Å
216	Y	95.6	Very high	93.7	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-75.2	-45.4	177.4	179.3	-65.9	0	0	0	111.6	Q212 R213 L214 A218 M219 C220 L249 M252 L277 S363 M366	Q212-Y216 PolarHBondContact O-N 3.12Å; R213-Y216 PolarHBondContact O-N 3.46Å; L214-Y216 VanDerWaalsContact C-N 3.25Å; L214-Y216 PolarHBondContact O-N 3.16Å; Y216-A218 PolarHBondContact O-N 3.33Å; Y216-M219 CarbonylContact O-C 3.5Å; Y216-M219 WeakPolarHBondContact O-CA 3.5Å; Y216-M219 WeakPolarHBondContact O-CB 3.45Å; Y216-M219 PolarHBondContact O-N 3.07Å; Y216-C220 HydrophobicContact CD1-CB 4.37Å; Y216-C220 HydrophobicContact CE1-CB 3.98Å; Y216-C220 WeakPolarHBondContact CE1-SG 3.34Å; Y216-C220 PolarHBondContact O-N 3.42Å; Y216-L249 HydrophobicContact CD2-CD2 4.43Å; Y216-L249 HydrophobicContact CE2-CD2 3.82Å; Y216-M252 HydrophobicContact CD2-SD 3.76Å; Y216-M252 HydrophobicContact CG-SD 4.08Å; Y216-L277 HydrophobicContact CD1-CB 3.61Å; Y216-L277 HydrophobicContact CD1-CD1 3.15Å; Y216-L277 HydrophobicContact CD1-CD2 3.34Å; Y216-L277 HydrophobicContact CD1-CG 3.41Å; Y216-L277 VanDerWaalsContact CD1-CG 3.41Å; Y216-L277 HydrophobicContact CD2-CB 4.01Å; Y216-L277 HydrophobicContact CD2-CD1 4.11Å; Y216-L277 HydrophobicContact CE1-CB 3.25Å; Y216-L277 HydrophobicContact CE1-CD1 3.77Å; Y216-L277 HydrophobicContact CE1-CD2 3.17Å; Y216-L277 HydrophobicContact CE1-CG 3.44Å; Y216-L277 VanDerWaalsContact CE1-CG 3.44Å; Y216-L277 HydrophobicContact CE2-CB 3.63Å; Y216-L277 HydrophobicContact CG-CB 4.01Å; Y216-L277 HydrophobicContact CG-CD1 3.38Å; Y216-L277 HydrophobicContact CG-CD2 4.4Å; Y216-L277 HydrophobicContact CG-CG 4.02Å; Y216-S363 WeakPolarHBondContact CE2-OG 3.41Å; Y216-S363 WeakPolarHBondContact OH-CA 3.47Å; Y216-S363 VanDerWaalsContact OH-CB 3.31Å; Y216-S363 WeakPolarHBondContact OH-CB 3.27Å; Y216-S363 PolarHBondContact OH-OG 3.22Å; Y216-M366 HydrophobicContact CD1-CE 4.18Å; Y216-M366 HydrophobicContact CD2-CE 3.42Å; Y216-M366 VanDerWaalsContact CD2-CE 3.42Å; Y216-M366 HydrophobicContact CD2-SD 3.98Å; Y216-M366 HydrophobicContact CE1-CE 4.09Å; Y216-M366 HydrophobicContact CE2-CB 3.73Å; Y216-M366 HydrophobicContact CE2-CE 3.34Å; Y216-M366 HydrophobicContact CE2-CG 4.27Å; Y216-M366 HydrophobicContact CE2-SD 3.56Å; Y216-M366 VanDerWaalsContact CE2-SD 3.56Å; Y216-M366 HydrophobicContact CG-CE 3.86Å; Y216-M366 WeakPolarHBondContact OH-CB 3.47Å; Y216-M366 PolarHBondContact OH-N 3.32Å
217	D	94.4	Very high	94.3	Very high	34 Å²	34	20 Å²	20	18%	0.182	9%	0.088	C	C	.	.	H	α-helix	trans	-56.4	-38.3	179.7	-75.3	-40.1	0	0	0	110.5	L172 R213 L214 I221 L277	L172-D217 HydrophobicContact CD1-CB 3.66Å; L172-D217 HydrophobicContact CD2-CB 3.89Å; L172-D217 HydrophobicContact CG-CB 4.42Å; R213-D217 IonicContact CZ-OD1 3.49Å; R213-D217 IonicContact CZ-OD2 2.72Å; R213-D217 IonicContact NE-OD1 3.3Å; R213-D217 PolarHBondContact NE-OD1 3.4Å; R213-D217 IonicContact NE-OD2 3.19Å; R213-D217 PolarHBondContact NE-OD2 3.26Å; R213-D217 IonicContact NH2-OD1 2.73Å; R213-D217 PolarHBondContact NH2-OD1 3.34Å; R213-D217 IonicContact NH2-OD2 3.16Å; R213-D217 PolarHBondContact NH2-OD2 2.88Å; R213-D217 PolarHBondContact O-N 2.89Å; L214-D217 PolarHBondContact O-N 3.33Å; D217-I221 WeakPolarHBondContact O-CG1 3.47Å; D217-I221 PolarHBondContact O-N 3.02Å; D217-L277 WeakPolarHBondContact OD1-CD2 3.44Å
218	A	97.3	Very high	94.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.4	-52	170.3	0	0	0	0	0	112.1	L172 A191 V194 H195 L214 Y216 C220 I221 M222	L172-A218 HydrophobicContact CD2-CB 3.95Å; L172-A218 VanDerWaalsContact CD2-N 3.32Å; A191-A218 WeakPolarHBondContact O-CB 3.33Å; V194-A218 HydrophobicContact CB-CB 4.3Å; V194-A218 HydrophobicContact CG1-CB 4.18Å; H195-A218 HydrophobicContact CB-CB 3.96Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 2.89Å; L214-A218 VanDerWaalsContact O-N 3.07Å; Y216-A218 PolarHBondContact O-N 3.33Å; A218-C220 VanDerWaalsContact C-N 3.27Å; A218-C220 PolarHBondContact O-N 3.2Å; A218-I221 PolarHBondContact O-N 2.89Å; A218-M222 WeakPolarHBondContact O-CG 3.49Å; A218-M222 PolarHBondContact O-N 2.98Å
219	M	97.6	Very high	94.5	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-55.2	-39	179.9	-173.2	61.1	64.8	0	0	112.5	E215 Y216 M222 L223 V240 E244 A245 L248 M366	E215-M219 WeakPolarHBondContact O-CB 3.25Å; E215-M219 PolarHBondContact O-N 2.93Å; Y216-M219 CarbonylContact O-C 3.5Å; Y216-M219 WeakPolarHBondContact O-CA 3.5Å; Y216-M219 WeakPolarHBondContact O-CB 3.45Å; Y216-M219 PolarHBondContact O-N 3.07Å; M219-M222 WeakPolarHBondContact O-CB 3.37Å; M219-M222 PolarHBondContact O-N 2.82Å; M219-L223 HydrophobicContact CG-CD1 4.11Å; M219-L223 HydrophobicContact CG-CG 4.4Å; M219-L223 VanDerWaalsContact O-CG 3.22Å; M219-L223 WeakPolarHBondContact O-CG 3.48Å; M219-L223 PolarHBondContact O-N 3.04Å; M219-L223 HydrophobicContact SD-CG 4.43Å; M219-V240 HydrophobicContact CE-CG1 4.3Å; M219-V240 HydrophobicContact SD-CG1 3.43Å; M219-V240 WeakPolarHBondContact SD-CG1 3.42Å; M219-E244 HydrophobicContact CE-CB 3.71Å; M219-A245 HydrophobicContact CG-CB 3.92Å; M219-A245 HydrophobicContact SD-CB 4.07Å; M219-L248 HydrophobicContact CB-CD2 4.02Å; M219-L248 HydrophobicContact CG-CD2 4.32Å; M219-M366 HydrophobicContact CB-CE 3.74Å; M219-M366 HydrophobicContact CG-CE 3.41Å; M219-M366 VanDerWaalsContact CG-CE 3.41Å
220	C	96.6	Very high	94.4	Very high	9 Å²	9	12.3 Å²	12.3	6%	0.061	6%	0.064	C	C	.	.	H	α-helix	trans	-69.2	-32.7	177.1	-92.8	0	0	0	0	114.2	Y216 A218 R224 Y365 M366	Y216-C220 HydrophobicContact CD1-CB 4.37Å; Y216-C220 HydrophobicContact CE1-CB 3.98Å; Y216-C220 WeakPolarHBondContact CE1-SG 3.34Å; Y216-C220 PolarHBondContact O-N 3.42Å; A218-C220 VanDerWaalsContact C-N 3.27Å; A218-C220 PolarHBondContact O-N 3.2Å; C220-R224 VanDerWaalsContact O-CB 3.3Å; C220-R224 WeakPolarHBondContact O-CB 3.47Å; C220-R224 PolarHBondContact O-N 3.4Å; C220-Y365 HydrophobicContact CB-CD1 3.88Å; C220-Y365 HydrophobicContact CB-CE1 4.06Å; C220-Y365 VanDerWaalsContact SG-CD1 3.56Å; C220-M366 VanDerWaalsContact SG-CE 3.56Å
221	I	96.1	Very high	94	Very high	20 Å²	20	13.8 Å²	13.8	10%	0.103	7%	0.072	C	C	.	.	H	α-helix	trans	-73.1	-37.3	173.5	-58.6	167.1	0	0	0	110.2	L172 N176 A191 D217 A218 R224 A225	L172-I221 HydrophobicContact CB-CD1 4.39Å; L172-I221 HydrophobicContact CD2-CD1 3.94Å; L172-I221 WeakPolarHBondContact O-CD1 3.48Å; N176-I221 HydrophobicContact CB-CD1 4.13Å; A191-I221 HydrophobicContact CB-CB 4.12Å; A191-I221 HydrophobicContact CB-CG2 4.24Å; D217-I221 WeakPolarHBondContact O-CG1 3.47Å; D217-I221 PolarHBondContact O-N 3.02Å; A218-I221 PolarHBondContact O-N 2.89Å; I221-R224 PolarHBondContact O-N 3.49Å; I221-A225 VanDerWaalsContact O-CB 3.3Å; I221-A225 WeakPolarHBondContact O-CB 3.48Å; I221-A225 PolarHBondContact O-N 2.95Å
222	M	97.6	Very high	93.3	Very high	2 Å²	2	13.1 Å²	13.1	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-57.2	-57.7	170.6	-65.9	168.4	59.9	0	0	110.8	A191 R192 H195 A218 M219 R224 A225 M226 V240	A191-M222 HydrophobicContact CB-CG 3.56Å; R192-M222 HydrophobicContact CB-CE 4.04Å; R192-M222 HydrophobicContact CB-SD 4.06Å; R192-M222 HydrophobicContact CG-CE 4.25Å; H195-M222 HydrophobicContact CB-SD 4.48Å; A218-M222 WeakPolarHBondContact O-CG 3.49Å; A218-M222 PolarHBondContact O-N 2.98Å; M219-M222 WeakPolarHBondContact O-CB 3.37Å; M219-M222 PolarHBondContact O-N 2.82Å; M222-R224 VanDerWaalsContact C-N 3.32Å; M222-R224 PolarHBondContact O-N 3.26Å; M222-A225 PolarHBondContact O-N 3.22Å; M222-A225 VanDerWaalsContact O-N 3.08Å; M222-M226 HydrophobicContact CB-SD 4.14Å; M222-M226 WeakPolarHBondContact O-CB 3.45Å; M222-M226 WeakPolarHBondContact O-CG 3.29Å; M222-M226 PolarHBondContact O-N 3.38Å; M222-V240 HydrophobicContact CE-CG1 4.12Å; M222-V240 HydrophobicContact CE-CG2 4.42Å
223	L	97.4	Very high	92.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57.9	-40.9	-179.2	-64.2	167.5	0	0	0	112.3	M219 N227 V240 F241 A245 M366 Q369	M219-L223 HydrophobicContact CG-CD1 4.11Å; M219-L223 HydrophobicContact CG-CG 4.4Å; M219-L223 VanDerWaalsContact O-CG 3.22Å; M219-L223 WeakPolarHBondContact O-CG 3.48Å; M219-L223 PolarHBondContact O-N 3.04Å; M219-L223 HydrophobicContact SD-CG 4.43Å; L223-N227 WeakPolarHBondContact O-CB 3.36Å; L223-N227 VanDerWaalsContact O-CG 3.23Å; L223-N227 PolarHBondContact O-N 3.34Å; L223-N227 PolarHBondContact O-ND2 3.27Å; L223-V240 HydrophobicContact CD2-CG1 4.13Å; L223-F241 HydrophobicContact CB-CE1 4.37Å; L223-F241 HydrophobicContact CD2-CD1 3.31Å; L223-F241 HydrophobicContact CD2-CE1 3.4Å; L223-F241 HydrophobicContact CD2-CG 3.98Å; L223-F241 HydrophobicContact CD2-CZ 4.13Å; L223-F241 HydrophobicContact CG-CE1 4.48Å; L223-A245 HydrophobicContact CD1-CB 3.9Å; L223-A245 HydrophobicContact CD2-CB 4.31Å; L223-M366 HydrophobicContact CD1-CE 3.87Å; L223-M366 HydrophobicContact CD1-CG 3.65Å; L223-M366 HydrophobicContact CD1-SD 4.16Å; L223-Q369 HydrophobicContact CB-CB 3.91Å; L223-Q369 HydrophobicContact CB-CG 4.44Å; L223-Q369 HydrophobicContact CD1-CB 4.49Å
224	R	96.1	Very high	92.1	Very high	45 Å²	45	20.5 Å²	20.5	17%	0.17	11%	0.106	C	C	.	.	H	α-helix	trans	-59.9	-48.7	174.1	-179.3	-165.9	179.5	-177.9	-5.2	111.6	N176 C220 I221 M222 A228 Y365	N176-R224 PolarHBondContact OD1-NH1 3.24Å; C220-R224 VanDerWaalsContact O-CB 3.3Å; C220-R224 WeakPolarHBondContact O-CB 3.47Å; C220-R224 PolarHBondContact O-N 3.4Å; I221-R224 PolarHBondContact O-N 3.49Å; M222-R224 VanDerWaalsContact C-N 3.32Å; M222-R224 PolarHBondContact O-N 3.26Å; R224-A228 WeakPolarHBondContact O-CB 3.48Å; R224-A228 PolarHBondContact O-N 3.37Å; R224-Y365 VanDerWaalsContact CD-OH 3.29Å; R224-Y365 WeakPolarHBondContact CD-OH 3.31Å; R224-Y365 WeakPolarHBondContact CG-OH 3.42Å
225	A	96.3	Very high	91.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-47.5	-178.7	0	0	0	0	0	111.7	Y184 A187 C188 I221 M222 N227 A228 H229	Y184-A225 WeakPolarHBondContact O-CB 3.42Å; A187-A225 HydrophobicContact CB-CB 4.11Å; C188-A225 HydrophobicContact CB-CB 4.06Å; I221-A225 VanDerWaalsContact O-CB 3.3Å; I221-A225 WeakPolarHBondContact O-CB 3.48Å; I221-A225 PolarHBondContact O-N 2.95Å; M222-A225 PolarHBondContact O-N 3.22Å; M222-A225 VanDerWaalsContact O-N 3.08Å; A225-N227 VanDerWaalsContact C-N 3.35Å; A225-N227 PolarHBondContact O-N 3.07Å; A225-A228 PolarHBondContact O-N 2.89Å; A225-H229 PolarHBondContact O-N 3.38Å
226	M	95.4	Very high	90.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-40.6	178.9	-64.3	165.5	86.6	0	0	111.3	M222 N230 M231 D237 V240 F241	M222-M226 HydrophobicContact CB-SD 4.14Å; M222-M226 WeakPolarHBondContact O-CB 3.45Å; M222-M226 WeakPolarHBondContact O-CG 3.29Å; M222-M226 PolarHBondContact O-N 3.38Å; M226-N230 CarbonylContact O-C 3.54Å; M226-N230 VanDerWaalsContact O-CA 3.31Å; M226-N230 WeakPolarHBondContact O-CA 3.4Å; M226-N230 PolarHBondContact O-N 2.79Å; M226-M231 HydrophobicContact CB-CB 4.01Å; M226-M231 HydrophobicContact CB-SD 4.48Å; M226-M231 HydrophobicContact CG-CB 4.11Å; M226-M231 HydrophobicContact CG-SD 4.01Å; M226-M231 PolarHBondContact O-N 3.01Å; M226-D237 HydrophobicContact CE-CB 3.46Å; M226-D237 VanDerWaalsContact CE-CB 3.46Å; M226-D237 VanDerWaalsContact CE-O 3.28Å; M226-D237 WeakPolarHBondContact CE-O 3.16Å; M226-V240 HydrophobicContact CE-CB 4Å; M226-V240 HydrophobicContact CE-CG1 4.45Å; M226-V240 HydrophobicContact CE-CG2 3.8Å; M226-V240 HydrophobicContact SD-CB 4.38Å; M226-V240 HydrophobicContact SD-CG1 4.19Å; M226-V240 HydrophobicContact SD-CG2 4.4Å; M226-F241 HydrophobicContact CB-CE2 3.98Å; M226-F241 HydrophobicContact CB-CZ 3.62Å; M226-F241 HydrophobicContact CE-CD2 4.47Å; M226-F241 HydrophobicContact CE-CE2 3.81Å; M226-F241 HydrophobicContact SD-CE2 4.28Å; M226-F241 HydrophobicContact SD-CZ 4.45Å
227	N	94.4	Very high	90.4	Very high	11 Å²	11	30.8 Å²	30.8	6%	0.059	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-41.9	173	-80.6	-23.7	0	0	0	113	L223 A225 Y232 F241 Q369 T372 Y373	L223-N227 WeakPolarHBondContact O-CB 3.36Å; L223-N227 VanDerWaalsContact O-CG 3.23Å; L223-N227 PolarHBondContact O-N 3.34Å; L223-N227 PolarHBondContact O-ND2 3.27Å; A225-N227 VanDerWaalsContact C-N 3.35Å; A225-N227 PolarHBondContact O-N 3.07Å; N227-Y232 WeakPolarHBondContact CA-OH 3.33Å; N227-Y232 PolarHBondContact O-OH 3.04Å; N227-Y232 PolarHBondContact OD1-OH 2.78Å; N227-F241 WeakPolarHBondContact OD1-CE1 3.32Å; N227-Q369 PolarHBondContact ND2-O 3.49Å; N227-Q369 PolarHBondContact ND2-OE1 2.88Å; N227-T372 HydrophobicContact CB-CG2 4.16Å; N227-Y373 PolarHBondContact OD1-N 3.26Å
228	A	92.4	Very high	90.1	Very high	31 Å²	31	31.1 Å²	31.1	26%	0.256	16%	0.161	S	C	.	.	H	α-helix	trans	-70.1	-34	-177.9	0	0	0	0	0	112.8	Y184 R224 A225 Q538	Y184-A228 HydrophobicContact CD1-CB 3.79Å; Y184-A228 HydrophobicContact CD2-CB 3.83Å; Y184-A228 HydrophobicContact CE1-CB 3.64Å; Y184-A228 HydrophobicContact CE2-CB 3.67Å; Y184-A228 HydrophobicContact CG-CB 3.9Å; R224-A228 WeakPolarHBondContact O-CB 3.48Å; R224-A228 PolarHBondContact O-N 3.37Å; A225-A228 PolarHBondContact O-N 2.89Å; A228-Q538 PolarHBondContact O-NE2 3.38Å
229	H	89.5	Confident	89.8	Confident	18 Å²	18	35.5 Å²	35.5	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-98	2.4	176.8	-169.1	48	0	0	0	114.4	Y184 V185 A225 M231 I491 Y533 Q538	Y184-H229 HydrophobicContact CD2-CB 4.04Å; Y184-H229 HydrophobicContact CG-CB 4.29Å; V185-H229 WeakPolarHBondContact CG2-CD2 3.19Å; A225-H229 PolarHBondContact O-N 3.38Å; H229-M231 VanDerWaalsContact C-N 3.32Å; H229-M231 HydrophobicContact CB-CG 3.98Å; H229-M231 HydrophobicContact CB-SD 4.45Å; H229-M231 PolarHBondContact O-N 3.41Å; H229-I491 WeakPolarHBondContact ND1-CD1 3.48Å; H229-Y533 AromaticContact CE1-CD1 3.45Å; H229-Y533 VanDerWaalsContact CE1-CD1 3.45Å; H229-Y533 WeakPolarHBondContact CE1-CD1 3.44Å; H229-Y533 AromaticContact CE1-CD2 3.98Å; H229-Y533 AromaticContact CE1-CE1 3.77Å; H229-Y533 AromaticContact CE1-CG 3.59Å; H229-Y533 AromaticContact NE2-CD1 3.47Å; H229-Y533 WeakPolarHBondContact NE2-CD1 3.27Å; H229-Y533 AromaticContact NE2-CE1 3.5Å; H229-Y533 WeakPolarHBondContact NE2-CE1 3.48Å; H229-Q538 VanDerWaalsContact CA-NE2 3.32Å; H229-Q538 PolarHBondContact O-NE2 3.04Å; H229-Q538 PolarHBondContact O-OE1 3.28Å
230	N	87.3	Confident	89.6	Confident	40 Å²	40	35.5 Å²	35.5	21%	0.214	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	46.6	-176	-61.7	-52.1	0	0	0	113	M226 Y232 M537 Q538	M226-N230 CarbonylContact O-C 3.54Å; M226-N230 VanDerWaalsContact O-CA 3.31Å; M226-N230 WeakPolarHBondContact O-CA 3.4Å; M226-N230 PolarHBondContact O-N 2.79Å; N230-Y232 VanDerWaalsContact CA-CE2 3.49Å; N230-Y232 HydrophobicContact CB-CD2 3.97Å; N230-Y232 HydrophobicContact CB-CE2 3.61Å; N230-Y232 PolarHBondContact O-N 2.84Å; N230-Y232 VanDerWaalsContact OD1-CE2 3.22Å; N230-Y232 WeakPolarHBondContact OD1-CE2 3.41Å; N230-Y232 PolarHBondContact OD1-OH 3.36Å; N230-M537 HydrophobicContact CB-CB 4.04Å; N230-Q538 PolarHBondContact ND2-NE2 3.45Å; N230-Q538 VanDerWaalsContact ND2-NE2 3.14Å
231	M	81.7	Confident	89.4	Confident	33 Å²	33	35.1 Å²	35.1	16%	0.163	18%	0.179	C	C	.	.			trans	-74.8	67.6	178.4	-60.1	177	65.7	0	0	110.5	V185 C188 M226 H229	V185-M231 HydrophobicContact CG2-SD 4.37Å; C188-M231 HydrophobicContact CB-CE 4.35Å; C188-M231 HydrophobicContact CB-SD 4.26Å; M226-M231 HydrophobicContact CB-CB 4.01Å; M226-M231 HydrophobicContact CB-SD 4.48Å; M226-M231 HydrophobicContact CG-CB 4.11Å; M226-M231 HydrophobicContact CG-SD 4.01Å; M226-M231 PolarHBondContact O-N 3.01Å; H229-M231 VanDerWaalsContact C-N 3.32Å; H229-M231 HydrophobicContact CB-CG 3.98Å; H229-M231 HydrophobicContact CB-SD 4.45Å; H229-M231 PolarHBondContact O-N 3.41Å
232	Y	79.5	Confident	89.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.			trans	-125.4	5.2	-178.9	-26.8	-62	0	0	0	113.1	N227 N230 Q238 F241 Y373 S376 M377 Y585	N227-Y232 WeakPolarHBondContact CA-OH 3.33Å; N227-Y232 PolarHBondContact O-OH 3.04Å; N227-Y232 PolarHBondContact OD1-OH 2.78Å; N230-Y232 VanDerWaalsContact CA-CE2 3.49Å; N230-Y232 HydrophobicContact CB-CD2 3.97Å; N230-Y232 HydrophobicContact CB-CE2 3.61Å; N230-Y232 PolarHBondContact O-N 2.84Å; N230-Y232 VanDerWaalsContact OD1-CE2 3.22Å; N230-Y232 WeakPolarHBondContact OD1-CE2 3.41Å; N230-Y232 PolarHBondContact OD1-OH 3.36Å; Y232-Q238 PolarHBondContact O-NE2 2.78Å; Y232-F241 AromaticContact CD1-CE2 3.98Å; Y232-F241 HydrophobicContact CD1-CE2 3.98Å; Y232-F241 HydrophobicContact CD1-CZ 4.29Å; Y232-F241 HydrophobicContact CE1-CE2 4.1Å; Y232-F241 AromaticContact CE1-CZ 3.92Å; Y232-F241 HydrophobicContact CE1-CZ 3.92Å; Y232-Y373 AromaticContact CD1-CD2 3.71Å; Y232-Y373 HydrophobicContact CD1-CD2 3.71Å; Y232-Y373 AromaticContact CD1-CE2 3.69Å; Y232-Y373 HydrophobicContact CD1-CE2 3.69Å; Y232-Y373 AromaticContact CE1-CD2 3.59Å; Y232-Y373 HydrophobicContact CE1-CD2 3.59Å; Y232-Y373 HydrophobicContact CE1-CE2 4.08Å; Y232-Y373 HydrophobicContact CG-CD2 4.47Å; Y232-Y373 HydrophobicContact CG-CE2 4.19Å; Y232-S376 PolarHBondContact OH-OG 3.09Å; Y232-M377 HydrophobicContact CD2-SD 4.04Å; Y232-M377 HydrophobicContact CG-SD 4.16Å; Y232-Y585 HydrophobicContact CD2-CE1 4.44Å
233	L	78.6	Confident	88.8	Confident	66 Å²	66	42.6 Å²	42.6	35%	0.346	21%	0.213	S	C	.	.	S	Bend	trans	-64.4	-43.1	-178.7	-175.5	66.4	0	0	0	111.7	L580 R583 T584	L233-L580 HydrophobicContact CD1-CD1 3.95Å; L233-L580 HydrophobicContact CD2-CD1 4.46Å; L233-R583 HydrophobicContact CD1-CB 3.87Å; L233-T584 WeakPolarHBondContact CD1-OG1 3.33Å
234	E	80.3	Confident	88.7	Confident	107 Å²	107	45.5 Å²	45.5	50%	0.5	23%	0.227	S	C	.	.	S	Bend	trans	-92.7	134.2	-178.9	-53.9	-51.2	141.8	0	0	111.6	E236 D237 Q238	E234-E236 PolarHBondContact O-N 3.35Å; E234-D237 PolarHBondContact O-N 3.23Å; E234-D237 VanDerWaalsContact O-N 3.16Å; E234-Q238 PolarHBondContact O-N 2.83Å
235	P	78.9	Confident	88.6	Confident	73 Å²	73	43.4 Å²	43.4	47%	0.474	22%	0.219	S	C	.	.	H	α-helix	trans	-55.7	-32.6	177.6	-26.8	35.5	0	0	0	114.1	D237 Q238 Q239	P235-D237 VanDerWaalsContact C-N 3.33Å; P235-D237 PolarHBondContact O-N 3.34Å; P235-Q238 WeakPolarHBondContact O-CB 3.28Å; P235-Q238 PolarHBondContact O-N 3.42Å; P235-Q238 VanDerWaalsContact O-N 3.15Å; P235-Q239 WeakPolarHBondContact O-CG 3.38Å; P235-Q239 PolarHBondContact O-N 3.27Å
236	E	84.7	Confident	88.4	Confident	131 Å²	131	45.4 Å²	45.4	61%	0.612	23%	0.232	S	C	*	.	H	α-helix	trans	-61.2	-38.1	179.2	-72.5	67.4	-155.5	0	0	112.4	E234 Q239	E234-E236 PolarHBondContact O-N 3.35Å; E236-Q239 WeakPolarHBondContact O-CB 3.43Å; E236-Q239 PolarHBondContact O-N 2.99Å
237	D	87	Confident	88.3	Confident	25 Å²	25	49 Å²	49	13%	0.134	26%	0.257	C	S	.	.	H	α-helix	trans	-79.7	-26.5	175.9	-88.4	-17	0	0	0	111.4	R192 M226 E234 P235 Q239 V240 F241	R192-D237 IonicContact CZ-OD1 3.68Å; R192-D237 VanDerWaalsContact CZ-OD1 3.31Å; R192-D237 IonicContact NH1-OD1 2.74Å; R192-D237 PolarHBondContact NH1-OD1 3.43Å; R192-D237 IonicContact NH2-OD1 2.72Å; R192-D237 PolarHBondContact NH2-OD1 3.08Å; M226-D237 HydrophobicContact CE-CB 3.46Å; M226-D237 VanDerWaalsContact CE-CB 3.46Å; M226-D237 VanDerWaalsContact CE-O 3.28Å; M226-D237 WeakPolarHBondContact CE-O 3.16Å; E234-D237 PolarHBondContact O-N 3.23Å; E234-D237 VanDerWaalsContact O-N 3.16Å; P235-D237 VanDerWaalsContact C-N 3.33Å; P235-D237 PolarHBondContact O-N 3.34Å; D237-Q239 VanDerWaalsContact C-N 3.31Å; D237-Q239 PolarHBondContact O-N 2.83Å; D237-V240 WeakPolarHBondContact O-CB 3.21Å; D237-V240 PolarHBondContact O-N 3.03Å; D237-F241 WeakPolarHBondContact O-CD2 3.27Å
238	Q	87.7	Confident	88.3	Confident	42 Å²	42	49 Å²	49	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-32.3	168.1	-58.3	-175.2	9.8	0	0	112.3	Y232 E234 P235 V240 F241 H242	Y232-Q238 PolarHBondContact O-NE2 2.78Å; E234-Q238 PolarHBondContact O-N 2.83Å; P235-Q238 WeakPolarHBondContact O-CB 3.28Å; P235-Q238 PolarHBondContact O-N 3.42Å; P235-Q238 VanDerWaalsContact O-N 3.15Å; Q238-V240 PolarHBondContact O-N 3.36Å; Q238-F241 PolarHBondContact O-N 3.47Å; Q238-F241 VanDerWaalsContact O-N 3.17Å; Q238-H242 PolarHBondContact O-CD2 2.98Å; Q238-H242 PolarHBondContact O-N 3.4Å; Q238-H242 VanDerWaalsContact O-N 3.08Å
239	Q	91.1	Very high	88.2	Confident	92 Å²	92	47.7 Å²	47.7	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-30.3	176.3	-67.5	-65.5	-66.8	0	0	113.1	P235 E236 D237 F241 H242 H243 E244	P235-Q239 WeakPolarHBondContact O-CG 3.38Å; P235-Q239 PolarHBondContact O-N 3.27Å; E236-Q239 WeakPolarHBondContact O-CB 3.43Å; E236-Q239 PolarHBondContact O-N 2.99Å; D237-Q239 VanDerWaalsContact C-N 3.31Å; D237-Q239 PolarHBondContact O-N 2.83Å; Q239-F241 VanDerWaalsContact C-N 3.35Å; Q239-F241 PolarHBondContact O-N 2.94Å; Q239-H242 PolarHBondContact O-N 2.79Å; Q239-H243 PolarHBondContact O-N 2.76Å; Q239-H243 PolarHBondContact OE1-CD2 2.71Å; Q239-E244 PolarHBondContact O-N 2.8Å
240	V	94.2	Very high	88.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-60.3	-46.2	178	-175.1	0	0	0	0	110.9	M219 M222 L223 M226 D237 Q238 E244 A245	M219-V240 HydrophobicContact CE-CG1 4.3Å; M219-V240 HydrophobicContact SD-CG1 3.43Å; M219-V240 WeakPolarHBondContact SD-CG1 3.42Å; M222-V240 HydrophobicContact CE-CG1 4.12Å; M222-V240 HydrophobicContact CE-CG2 4.42Å; L223-V240 HydrophobicContact CD2-CG1 4.13Å; M226-V240 HydrophobicContact CE-CB 4Å; M226-V240 HydrophobicContact CE-CG1 4.45Å; M226-V240 HydrophobicContact CE-CG2 3.8Å; M226-V240 HydrophobicContact SD-CB 4.38Å; M226-V240 HydrophobicContact SD-CG1 4.19Å; M226-V240 HydrophobicContact SD-CG2 4.4Å; D237-V240 WeakPolarHBondContact O-CB 3.21Å; D237-V240 PolarHBondContact O-N 3.03Å; Q238-V240 PolarHBondContact O-N 3.36Å; V240-E244 PolarHBondContact O-N 3.01Å; V240-A245 WeakPolarHBondContact O-CB 3.41Å; V240-A245 PolarHBondContact O-N 3.22Å
241	F	92.4	Very high	88.3	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	27%	0.265	C	S	.	.	I	π-helix	trans	-73.5	-41.7	179	-62.2	-87	0	0	0	112.3	L223 M226 N227 Y232 D237 Q238 Q239 P246 L370 Y373	L223-F241 HydrophobicContact CB-CE1 4.37Å; L223-F241 HydrophobicContact CD2-CD1 3.31Å; L223-F241 HydrophobicContact CD2-CE1 3.4Å; L223-F241 HydrophobicContact CD2-CG 3.98Å; L223-F241 HydrophobicContact CD2-CZ 4.13Å; L223-F241 HydrophobicContact CG-CE1 4.48Å; M226-F241 HydrophobicContact CB-CE2 3.98Å; M226-F241 HydrophobicContact CB-CZ 3.62Å; M226-F241 HydrophobicContact CE-CD2 4.47Å; M226-F241 HydrophobicContact CE-CE2 3.81Å; M226-F241 HydrophobicContact SD-CE2 4.28Å; M226-F241 HydrophobicContact SD-CZ 4.45Å; N227-F241 WeakPolarHBondContact OD1-CE1 3.32Å; Y232-F241 AromaticContact CD1-CE2 3.98Å; Y232-F241 HydrophobicContact CD1-CE2 3.98Å; Y232-F241 HydrophobicContact CD1-CZ 4.29Å; Y232-F241 HydrophobicContact CE1-CE2 4.1Å; Y232-F241 AromaticContact CE1-CZ 3.92Å; Y232-F241 HydrophobicContact CE1-CZ 3.92Å; D237-F241 WeakPolarHBondContact O-CD2 3.27Å; Q238-F241 PolarHBondContact O-N 3.47Å; Q238-F241 VanDerWaalsContact O-N 3.17Å; Q239-F241 VanDerWaalsContact C-N 3.35Å; Q239-F241 PolarHBondContact O-N 2.94Å; F241-P246 VanDerWaalsContact O-CD 3.25Å; F241-P246 WeakPolarHBondContact O-CD 3.41Å; F241-P246 VanDerWaalsContact O-CG 3.31Å; F241-P246 WeakPolarHBondContact O-CG 3.22Å; F241-L370 HydrophobicContact CB-CD2 4.36Å; F241-L370 HydrophobicContact CD1-CD2 4.3Å; F241-L370 WeakPolarHBondContact O-CD2 3.05Å; F241-Y373 HydrophobicContact CB-CD1 3.5Å; F241-Y373 HydrophobicContact CB-CD2 4.31Å; F241-Y373 HydrophobicContact CB-CE1 3.5Å; F241-Y373 VanDerWaalsContact CB-CE1 3.5Å; F241-Y373 HydrophobicContact CB-CE2 4.32Å; F241-Y373 HydrophobicContact CB-CG 3.92Å; F241-Y373 AromaticContact CD1-CD1 3.84Å; F241-Y373 HydrophobicContact CD1-CD1 3.84Å; F241-Y373 AromaticContact CD1-CD2 3.78Å; F241-Y373 HydrophobicContact CD1-CD2 3.78Å; F241-Y373 AromaticContact CD1-CG 3.38Å; F241-Y373 HydrophobicContact CD1-CG 3.38Å; F241-Y373 AromaticContact CD2-CD2 3.79Å; F241-Y373 HydrophobicContact CD2-CD2 3.79Å; F241-Y373 AromaticContact CD2-CE2 3.8Å; F241-Y373 HydrophobicContact CD2-CE2 3.8Å; F241-Y373 HydrophobicContact CD2-CG 4.15Å; F241-Y373 AromaticContact CE1-CD2 3.94Å; F241-Y373 HydrophobicContact CE1-CD2 3.94Å; F241-Y373 AromaticContact CE1-CG 3.84Å; F241-Y373 HydrophobicContact CE1-CG 3.84Å; F241-Y373 AromaticContact CE2-CD2 3.93Å; F241-Y373 HydrophobicContact CE2-CD2 3.93Å; F241-Y373 HydrophobicContact CE2-CE2 4.17Å; F241-Y373 AromaticContact CG-CD1 3.73Å; F241-Y373 HydrophobicContact CG-CD1 3.73Å; F241-Y373 AromaticContact CG-CD2 3.7Å; F241-Y373 HydrophobicContact CG-CD2 3.7Å; F241-Y373 AromaticContact CG-CE1 3.98Å; F241-Y373 HydrophobicContact CG-CE1 3.98Å; F241-Y373 AromaticContact CG-CE2 3.98Å; F241-Y373 HydrophobicContact CG-CE2 3.98Å; F241-Y373 AromaticContact CG-CG 3.56Å; F241-Y373 HydrophobicContact CG-CG 3.56Å; F241-Y373 AromaticContact CZ-CD2 4Å; F241-Y373 HydrophobicContact CZ-CD2 4Å; F241-Y373 HydrophobicContact CZ-CG 4.37Å
242	H	89.3	Confident	88.8	Confident	71 Å²	71	49.9 Å²	49.9	33%	0.329	26%	0.257	S	S	.	.	I	π-helix	trans	-79.1	-32	-174.5	-72.1	-62.8	0	0	0	114.2	Q238 Q239 Y373	Q238-H242 PolarHBondContact O-CD2 2.98Å; Q238-H242 PolarHBondContact O-N 3.4Å; Q238-H242 VanDerWaalsContact O-N 3.08Å; Q239-H242 PolarHBondContact O-N 2.79Å; H242-Y373 PolarHBondContact CD2-OH 2.87Å; H242-Y373 AromaticContact CE1-CE1 3.74Å; H242-Y373 AromaticContact NE2-CE1 3.61Å; H242-Y373 AromaticContact NE2-CZ 3.64Å; H242-Y373 PolarHBondContact NE2-OH 3.22Å
243	H	90.9	Very high	89.2	Confident	108 Å²	108	53.8 Å²	53.8	50%	0.5	27%	0.272	S	S	.	.	I	π-helix	trans	-129.4	-49.4	-170	-60.4	-72.8	0	0	0	113.8	Q239 S247	Q239-H243 PolarHBondContact O-N 2.76Å; Q239-H243 PolarHBondContact OE1-CD2 2.71Å; H243-S247 WeakPolarHBondContact O-CB 3.25Å; H243-S247 PolarHBondContact O-N 3.17Å
244	E	94.7	Very high	89.6	Confident	62 Å²	62	57.7 Å²	57.7	29%	0.29	29%	0.286	S	S	.	.	I	π-helix	trans	-67.4	-55.7	-172.8	-61.3	-165.7	-120.3	0	0	112.7	M219 Q239 V240 S247 L248	M219-E244 HydrophobicContact CE-CB 3.71Å; Q239-E244 PolarHBondContact O-N 2.8Å; V240-E244 PolarHBondContact O-N 3.01Å; E244-S247 PolarHBondContact O-N 3.48Å; E244-L248 WeakPolarHBondContact O-CB 3.31Å; E244-L248 PolarHBondContact O-N 3.12Å
245	A	95.3	Very high	90	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-47.6	179.8	0	0	0	0	0	112.7	M219 L223 V240 S247 L248 L249 M366 L370	M219-A245 HydrophobicContact CG-CB 3.92Å; M219-A245 HydrophobicContact SD-CB 4.07Å; L223-A245 HydrophobicContact CD1-CB 3.9Å; L223-A245 HydrophobicContact CD2-CB 4.31Å; V240-A245 WeakPolarHBondContact O-CB 3.41Å; V240-A245 PolarHBondContact O-N 3.22Å; A245-S247 VanDerWaalsContact C-N 3.33Å; A245-S247 PolarHBondContact O-N 3.29Å; A245-L248 PolarHBondContact O-N 3.49Å; A245-L249 WeakPolarHBondContact O-CD1 3.5Å; A245-L249 VanDerWaalsContact O-CG 3.31Å; A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.02Å; A245-M366 HydrophobicContact CB-CE 4.4Å; A245-M366 HydrophobicContact CB-SD 3.77Å; A245-L370 HydrophobicContact CB-CD2 4.35Å
246	P	91.6	Very high	90.5	Very high	42 Å²	42	60.3 Å²	60.3	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-35.6	173.9	-25.8	36.7	0	0	0	114	F241 K250	F241-P246 VanDerWaalsContact O-CD 3.25Å; F241-P246 WeakPolarHBondContact O-CD 3.41Å; F241-P246 VanDerWaalsContact O-CG 3.31Å; F241-P246 WeakPolarHBondContact O-CG 3.22Å; P246-K250 WeakPolarHBondContact O-CB 3.47Å; P246-K250 PolarHBondContact O-N 3.2Å
247	S	92.9	Very high	90.6	Very high	77 Å²	77	54 Å²	54	54%	0.538	26%	0.258	S	S	.	.	H	α-helix	trans	-68.3	-42.4	176.4	-173.5	0	0	0	0	111.8	H243 E244 A245 K250 S251	H243-S247 WeakPolarHBondContact O-CB 3.25Å; H243-S247 PolarHBondContact O-N 3.17Å; E244-S247 PolarHBondContact O-N 3.48Å; A245-S247 VanDerWaalsContact C-N 3.33Å; A245-S247 PolarHBondContact O-N 3.29Å; S247-K250 PolarHBondContact O-N 3.41Å; S247-S251 WeakPolarHBondContact O-CB 3.35Å; S247-S251 PolarHBondContact O-N 3.18Å
248	L	94.1	Very high	90.6	Very high	11 Å²	11	53.1 Å²	53.1	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-45.5	175.8	-179.7	55.1	0	0	0	111.6	E215 M219 E244 A245 K250 S251 M252	E215-L248 HydrophobicContact CB-CD1 4.18Å; E215-L248 HydrophobicContact CB-CD2 4.17Å; M219-L248 HydrophobicContact CB-CD2 4.02Å; M219-L248 HydrophobicContact CG-CD2 4.32Å; E244-L248 WeakPolarHBondContact O-CB 3.31Å; E244-L248 PolarHBondContact O-N 3.12Å; A245-L248 PolarHBondContact O-N 3.49Å; L248-K250 PolarHBondContact O-N 3.28Å; L248-S251 WeakPolarHBondContact O-CA 3.44Å; L248-S251 VanDerWaalsContact O-CB 3.31Å; L248-S251 WeakPolarHBondContact O-CB 3.46Å; L248-S251 PolarHBondContact O-N 2.84Å; L248-S251 VanDerWaalsContact O-N 3.11Å; L248-M252 HydrophobicContact CD1-CG 4.16Å; L248-M252 HydrophobicContact CD1-SD 4.35Å; L248-M252 HydrophobicContact CG-SD 4.39Å; L248-M252 WeakPolarHBondContact O-CG 3.41Å; L248-M252 PolarHBondContact O-N 3.47Å
249	L	90.8	Very high	90.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-56.2	-48.2	172.2	-72.4	161.2	0	0	0	111.8	Y216 A245 S251 M252 W253 L258 P274 V275 M366 L370	Y216-L249 HydrophobicContact CD2-CD2 4.43Å; Y216-L249 HydrophobicContact CE2-CD2 3.82Å; A245-L249 WeakPolarHBondContact O-CD1 3.5Å; A245-L249 VanDerWaalsContact O-CG 3.31Å; A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.02Å; L249-S251 VanDerWaalsContact C-N 3.26Å; L249-S251 PolarHBondContact O-N 3.36Å; L249-M252 PolarHBondContact O-N 3.21Å; L249-W253 WeakPolarHBondContact O-CB 3.35Å; L249-W253 PolarHBondContact O-N 2.84Å; L249-L258 WeakPolarHBondContact O-CD1 3.21Å; L249-P274 HydrophobicContact CB-CB 3.83Å; L249-P274 HydrophobicContact CD1-CB 3.64Å; L249-P274 HydrophobicContact CD1-CG 3.74Å; L249-P274 HydrophobicContact CD2-CB 4.17Å; L249-P274 HydrophobicContact CG-CB 4.1Å; L249-V275 VanDerWaalsContact CD2-O 3.26Å; L249-V275 WeakPolarHBondContact CD2-O 3.38Å; L249-M366 HydrophobicContact CD1-CG 3.91Å; L249-M366 HydrophobicContact CD1-SD 3.45Å; L249-M366 WeakPolarHBondContact CD1-SD 3.44Å; L249-M366 HydrophobicContact CD2-SD 3.89Å; L249-M366 HydrophobicContact CG-SD 3.55Å; L249-M366 VanDerWaalsContact CG-SD 3.55Å; L249-L370 HydrophobicContact CD1-CD1 3.96Å
250	K	87	Confident	89.8	Confident	95 Å²	95	49.9 Å²	49.9	41%	0.413	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-32.4	176.4	-174	174	-177.6	169.9	0	112.7	P246 S247 L248 K254 L272	P246-K250 WeakPolarHBondContact O-CB 3.47Å; P246-K250 PolarHBondContact O-N 3.2Å; S247-K250 PolarHBondContact O-N 3.41Å; L248-K250 PolarHBondContact O-N 3.28Å; K250-K254 WeakPolarHBondContact O-CG 3.45Å; K250-K254 PolarHBondContact O-N 3.42Å; K250-L272 HydrophobicContact CD-CD2 3.9Å; K250-L272 HydrophobicContact CG-CD2 4.17Å
251	S	91.7	Very high	88.3	Confident	43 Å²	43	54 Å²	54	30%	0.301	26%	0.26	S	S	.	.	H	α-helix	trans	-70.9	-51.4	176.1	-168.9	0	0	0	0	111.5	Q212 S247 L248 L249 W253 K254 S255	Q212-S251 VanDerWaalsContact NE2-C 3.25Å; Q212-S251 PolarHBondContact NE2-O 2.81Å; Q212-S251 PolarHBondContact NE2-OG 3.27Å; S247-S251 WeakPolarHBondContact O-CB 3.35Å; S247-S251 PolarHBondContact O-N 3.18Å; L248-S251 WeakPolarHBondContact O-CA 3.44Å; L248-S251 VanDerWaalsContact O-CB 3.31Å; L248-S251 WeakPolarHBondContact O-CB 3.46Å; L248-S251 PolarHBondContact O-N 2.84Å; L248-S251 VanDerWaalsContact O-N 3.11Å; L249-S251 VanDerWaalsContact C-N 3.26Å; L249-S251 PolarHBondContact O-N 3.36Å; S251-W253 VanDerWaalsContact C-N 3.33Å; S251-W253 PolarHBondContact O-N 2.98Å; S251-K254 PolarHBondContact O-N 3.26Å; S251-S255 PolarHBondContact O-N 3.13Å; S251-S255 VanDerWaalsContact O-N 3.12Å; S251-S255 PolarHBondContact O-OG 2.75Å
252	M	91.7	Very high	86.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-37.2	178.3	-69.5	-173.4	76.9	0	0	112.7	Q212 Y216 L248 L249 K254 S255 R256 L257 L258 L277	Q212-M252 HydrophobicContact CB-CG 4.03Å; Q212-M252 HydrophobicContact CG-CG 4.41Å; Y216-M252 HydrophobicContact CD2-SD 3.76Å; Y216-M252 HydrophobicContact CG-SD 4.08Å; L248-M252 HydrophobicContact CD1-CG 4.16Å; L248-M252 HydrophobicContact CD1-SD 4.35Å; L248-M252 HydrophobicContact CG-SD 4.39Å; L248-M252 WeakPolarHBondContact O-CG 3.41Å; L248-M252 PolarHBondContact O-N 3.47Å; L249-M252 PolarHBondContact O-N 3.21Å; M252-K254 PolarHBondContact O-N 3.26Å; M252-S255 CarbonylContact O-C 3.54Å; M252-S255 PolarHBondContact O-N 3.32Å; M252-R256 PolarHBondContact O-N 2.78Å; M252-L257 HydrophobicContact CB-CB 4.26Å; M252-L257 HydrophobicContact CE-CB 3.95Å; M252-L257 HydrophobicContact CE-CD1 4.19Å; M252-L257 PolarHBondContact O-N 2.97Å; M252-L258 HydrophobicContact CB-CD1 4.31Å; M252-L258 HydrophobicContact CB-CD2 3.5Å; M252-L258 HydrophobicContact CB-CG 3.83Å; M252-L258 HydrophobicContact CE-CD2 4.1Å; M252-L258 HydrophobicContact CG-CD2 4.42Å; M252-L258 HydrophobicContact SD-CD2 4.16Å; M252-L277 HydrophobicContact CE-CD1 3.85Å
253	W	87.5	Confident	84	Confident	82 Å²	82	62.7 Å²	62.7	31%	0.311	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-47.4	175.4	-178.9	74.8	0	0	0	111.4	L249 S251 S255 R256 L258 F268	L249-W253 WeakPolarHBondContact O-CB 3.35Å; L249-W253 PolarHBondContact O-N 2.84Å; S251-W253 VanDerWaalsContact C-N 3.33Å; S251-W253 PolarHBondContact O-N 2.98Å; W253-S255 VanDerWaalsContact C-N 3.32Å; W253-S255 PolarHBondContact O-N 2.84Å; W253-R256 WeakPolarHBondContact O-CA 3.4Å; W253-R256 PolarHBondContact O-N 3.21Å; W253-L258 HydrophobicContact CB-CD1 3.62Å; W253-L258 HydrophobicContact CB-CG 4.36Å; W253-L258 HydrophobicContact CG-CD1 4.45Å; W253-F268 HydrophobicContact CD2-CE1 4.04Å; W253-F268 HydrophobicContact CD2-CZ 4.28Å; W253-F268 AromaticContact CE2-CE1 3.51Å; W253-F268 AromaticContact CE2-CZ 3.4Å; W253-F268 VanDerWaalsContact CE2-CZ 3.4Å; W253-F268 HydrophobicContact CE3-CE1 4.22Å; W253-F268 AromaticContact CH2-CD1 3.31Å; W253-F268 HydrophobicContact CH2-CD1 3.31Å; W253-F268 HydrophobicContact CH2-CD2 4.24Å; W253-F268 AromaticContact CH2-CE1 3.46Å; W253-F268 HydrophobicContact CH2-CE1 3.46Å; W253-F268 VanDerWaalsContact CH2-CE1 3.46Å; W253-F268 HydrophobicContact CH2-CE2 4.35Å; W253-F268 AromaticContact CH2-CG 3.76Å; W253-F268 HydrophobicContact CH2-CG 3.76Å; W253-F268 HydrophobicContact CH2-CZ 4Å; W253-F268 AromaticContact CZ2-CD1 3.49Å; W253-F268 HydrophobicContact CZ2-CD1 3.49Å; W253-F268 VanDerWaalsContact CZ2-CD1 3.49Å; W253-F268 AromaticContact CZ2-CD2 3.81Å; W253-F268 HydrophobicContact CZ2-CD2 3.81Å; W253-F268 AromaticContact CZ2-CE1 3.22Å; W253-F268 HydrophobicContact CZ2-CE1 3.22Å; W253-F268 AromaticContact CZ2-CE2 3.55Å; W253-F268 HydrophobicContact CZ2-CE2 3.55Å; W253-F268 AromaticContact CZ2-CG 3.79Å; W253-F268 HydrophobicContact CZ2-CG 3.79Å; W253-F268 AromaticContact CZ2-CZ 3.26Å; W253-F268 HydrophobicContact CZ2-CZ 3.26Å; W253-F268 AromaticContact CZ3-CD1 3.94Å; W253-F268 HydrophobicContact CZ3-CD1 3.94Å; W253-F268 AromaticContact CZ3-CE1 3.95Å; W253-F268 HydrophobicContact CZ3-CE1 3.95Å; W253-F268 AromaticContact NE1-CZ 3.58Å
254	K	88.6	Confident	81.1	Confident	147 Å²	147	64.9 Å²	64.9	64%	0.639	33%	0.332	S	S	*	.	H	α-helix	trans	-61.1	-39.6	176.6	-72.7	176.6	176.2	-172	0	112.3	K250 S251 M252 R256	K250-K254 WeakPolarHBondContact O-CG 3.45Å; K250-K254 PolarHBondContact O-N 3.42Å; S251-K254 PolarHBondContact O-N 3.26Å; M252-K254 PolarHBondContact O-N 3.26Å; K254-R256 PolarHBondContact O-N 3.46Å
255	S	88.5	Confident	78.1	Confident	35 Å²	35	70.4 Å²	70.4	25%	0.245	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-4.5	174.5	-65	0	0	0	0	114.3	Q212 S251 M252 W253 L257	Q212-S255 PolarHBondContact NE2-OG 3.38Å; Q212-S255 VanDerWaalsContact NE2-OG 3.08Å; Q212-S255 PolarHBondContact OE1-OG 2.92Å; S251-S255 PolarHBondContact O-N 3.13Å; S251-S255 VanDerWaalsContact O-N 3.12Å; S251-S255 PolarHBondContact O-OG 2.75Å; M252-S255 CarbonylContact O-C 3.54Å; M252-S255 PolarHBondContact O-N 3.32Å; W253-S255 VanDerWaalsContact C-N 3.32Å; W253-S255 PolarHBondContact O-N 2.84Å; S255-L257 PolarHBondContact O-N 3.08Å
256	R	88.3	Confident	74.8	Confident	200 Å²	200	77.2 Å²	77.2	76%	0.755	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	33	-171	-51.4	-174.5	-166.7	157.1	8	113.4	M252 W253 K254 L258	M252-R256 PolarHBondContact O-N 2.78Å; W253-R256 WeakPolarHBondContact O-CA 3.4Å; W253-R256 PolarHBondContact O-N 3.21Å; K254-R256 PolarHBondContact O-N 3.46Å; R256-L258 VanDerWaalsContact C-N 3.32Å
257	L	87.9	Confident	71.8	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	42%	0.418	C	S	.	.			trans	-81.5	-14	170.9	-64.9	-174	0	0	0	111.7	R209 Q212 M252 S255 L356 C359 L360 S361	R209-L257 HydrophobicContact CB-CD1 4.45Å; R209-L257 HydrophobicContact CB-CD2 4.41Å; R209-L257 HydrophobicContact CG-CD2 4.02Å; Q212-L257 HydrophobicContact CB-CD1 3.63Å; Q212-L257 HydrophobicContact CG-CD1 4.44Å; Q212-L257 VanDerWaalsContact OE1-CD1 3.28Å; M252-L257 HydrophobicContact CB-CB 4.26Å; M252-L257 HydrophobicContact CE-CB 3.95Å; M252-L257 HydrophobicContact CE-CD1 4.19Å; M252-L257 PolarHBondContact O-N 2.97Å; S255-L257 PolarHBondContact O-N 3.08Å; L257-L356 HydrophobicContact CD2-CD1 4.26Å; L257-C359 HydrophobicContact CD2-CB 3.74Å; L257-L360 CarbonylContact O-C 3.51Å; L257-L360 VanDerWaalsContact O-CA 3.24Å; L257-L360 WeakPolarHBondContact O-CA 3.38Å; L257-L360 WeakPolarHBondContact O-CD1 3.34Å; L257-S361 WeakPolarHBondContact O-CB 3.4Å; L257-S361 PolarHBondContact O-N 3.48Å
258	L	86.9	Confident	68.8	Low	5 Å²	5	83.2 Å²	83.2	3%	0.026	41%	0.411	C	S	.	.	S	Bend	trans	-95.1	136.4	-179.7	-49.1	-179.5	0	0	0	112.2	L249 M252 W253 R256 T260 V275 S276	L249-L258 WeakPolarHBondContact O-CD1 3.21Å; M252-L258 HydrophobicContact CB-CD1 4.31Å; M252-L258 HydrophobicContact CB-CD2 3.5Å; M252-L258 HydrophobicContact CB-CG 3.83Å; M252-L258 HydrophobicContact CE-CD2 4.1Å; M252-L258 HydrophobicContact CG-CD2 4.42Å; M252-L258 HydrophobicContact SD-CD2 4.16Å; W253-L258 HydrophobicContact CB-CD1 3.62Å; W253-L258 HydrophobicContact CB-CG 4.36Å; W253-L258 HydrophobicContact CG-CD1 4.45Å; R256-L258 VanDerWaalsContact C-N 3.32Å; L258-T260 PolarHBondContact O-N 2.96Å; L258-V275 HydrophobicContact CB-CB 4.33Å; L258-V275 HydrophobicContact CB-CG1 3.88Å; L258-V275 HydrophobicContact CD1-CB 3.95Å; L258-V275 HydrophobicContact CD1-CG1 4.42Å; L258-S276 VanDerWaalsContact CA-O 3.24Å; L258-S276 WeakPolarHBondContact CA-O 3.38Å; L258-S276 WeakPolarHBondContact CB-O 3.45Å; L258-S276 WeakPolarHBondContact CD2-O 3.22Å
259	M	81.4	Confident	65.5	Low	7 Å²	7	91.3 Å²	91.3	3%	0.034	45%	0.449	C	S	.	.			trans	-61.7	91.6	173	-73.9	167.8	174.3	0	0	111.9	S276 E278 L360 S361 Q393 I396 C397 T402	M259-S276 VanDerWaalsContact CA-OG 3.29Å; M259-S276 WeakPolarHBondContact CA-OG 3.47Å; M259-S276 WeakPolarHBondContact CB-OG 3.3Å; M259-S276 PolarHBondContact N-OG 3.5Å; M259-S276 PolarHBondContact O-OG 3.03Å; M259-E278 HydrophobicContact CE-CG 3.84Å; M259-E278 VanDerWaalsContact CE-OE1 3.31Å; M259-E278 WeakPolarHBondContact CE-OE1 3.28Å; M259-L360 HydrophobicContact CB-CD1 4.42Å; M259-L360 HydrophobicContact CE-CD2 4.35Å; M259-L360 HydrophobicContact CE-CG 4.19Å; M259-L360 HydrophobicContact CG-CD1 3.76Å; M259-L360 HydrophobicContact CG-CD2 4.17Å; M259-L360 HydrophobicContact CG-CG 3.76Å; M259-S361 WeakPolarHBondContact CB-O 3.41Å; M259-S361 WeakPolarHBondContact CG-O 3.46Å; M259-S361 PolarHBondContact N-O 2.87Å; M259-S361 VanDerWaalsContact SD-O 3.38Å; M259-Q393 PolarHBondContact O-OE1 3.27Å; M259-I396 HydrophobicContact CB-CG2 4.07Å; M259-I396 WeakPolarHBondContact O-CG2 3.08Å; M259-C397 HydrophobicContact SD-CB 4.42Å; M259-C397 PolarHBondContact SD-SG 2.89Å; M259-T402 HydrophobicContact CE-CG2 4.49Å
260	T	79	Confident	62.5	Low	59 Å²	59	101.4 Å²	101.4	36%	0.362	49%	0.489	S	S	.	.			trans	-83	152.4	169.4	55	0	0	0	0	111.6	L258 V275 Q400	L258-T260 PolarHBondContact O-N 2.96Å; T260-V275 HydrophobicContact CG2-CG1 4.25Å; T260-Q400 PolarHBondContact O-NE2 3.03Å; T260-Q400 VanDerWaalsContact O-NE2 3.11Å
261	K	64.1	Low	59.5	Low	87 Å²	87	100.8 Å²	100.8	38%	0.378	50%	0.496	S	S	.	.			trans	-52.1	147.9	157.6	-69.4	174.7	179.4	163	0	109.5	M263 E392 I396	K261-M263 WeakPolarHBondContact O-CG 3.16Å; K261-M263 PolarHBondContact O-N 2.88Å; K261-E392 IonicContact NZ-OE2 3.62Å; K261-I396 HydrophobicContact CD-CD1 4.38Å; K261-I396 HydrophobicContact CD-CG1 4.34Å; K261-I396 HydrophobicContact CG-CD1 3.75Å; K261-I396 HydrophobicContact CG-CG1 3.63Å
262	S	46.4	Very low	56.4	Low	132 Å²	132	104.4 Å²	104.4	92%	0.923	51%	0.511	S	S	*	.	S	Bend	trans	-60.2	105	172.2	-174.2	0	0	0	0	109
263	M	44.2	Very low	53.3	Low	123 Å²	123	108 Å²	108	61%	0.606	53%	0.531	S	S	*	.			trans	-104.7	131.5	-159.8	-98.9	-66	-171.4	0	0	113.5	K261	K261-M263 WeakPolarHBondContact O-CG 3.16Å; K261-M263 PolarHBondContact O-N 2.88Å
264	N	30.9	Very low	50.5	Low	153 Å²	153	105.1 Å²	105.1	82%	0.818	52%	0.522	S	S	*	.			trans	-76.3	130.1	159.1	-135.4	-13.3	0	0	0	107.9	N266	N264-N266 PolarHBondContact O-N 3.29Å; N264-N266 VanDerWaalsContact O-N 3.15Å
265	K	30.7	Very low	47.6	Very low	179 Å²	179	99.2 Å²	99.2	78%	0.778	50%	0.498	S	S	*	.	S	Bend	trans	-76.1	-5.4	-149.5	-72.6	-179.6	177.8	172.2	0	118.1
266	N	27.4	Very low	44.8	Very low	142 Å²	142	97.6 Å²	97.6	76%	0.759	49%	0.487	S	S	*	.	S	Bend	trans	-98.3	-4.7	-146.7	-69.2	13.2	0	0	0	118	N264	N264-N266 PolarHBondContact O-N 3.29Å; N264-N266 VanDerWaalsContact O-N 3.15Å
267	N	27.1	Very low	41.9	Very low	155 Å²	155	88.6 Å²	88.6	83%	0.829	45%	0.454	S	S	*	.			trans	-111.9	27.1	-166.8	-69.4	26.3	0	0	0	115.4
268	F	30.7	Very low	39	Very low	90 Å²	90	89.6 Å²	89.6	40%	0.395	46%	0.458	S	S	.	.			trans	-93.9	0.3	-160.5	-130.6	-84.4	0	0	0	118.5	W253	W253-F268 HydrophobicContact CD2-CE1 4.04Å; W253-F268 HydrophobicContact CD2-CZ 4.28Å; W253-F268 AromaticContact CE2-CE1 3.51Å; W253-F268 AromaticContact CE2-CZ 3.4Å; W253-F268 VanDerWaalsContact CE2-CZ 3.4Å; W253-F268 HydrophobicContact CE3-CE1 4.22Å; W253-F268 AromaticContact CH2-CD1 3.31Å; W253-F268 HydrophobicContact CH2-CD1 3.31Å; W253-F268 HydrophobicContact CH2-CD2 4.24Å; W253-F268 AromaticContact CH2-CE1 3.46Å; W253-F268 HydrophobicContact CH2-CE1 3.46Å; W253-F268 VanDerWaalsContact CH2-CE1 3.46Å; W253-F268 HydrophobicContact CH2-CE2 4.35Å; W253-F268 AromaticContact CH2-CG 3.76Å; W253-F268 HydrophobicContact CH2-CG 3.76Å; W253-F268 HydrophobicContact CH2-CZ 4Å; W253-F268 AromaticContact CZ2-CD1 3.49Å; W253-F268 HydrophobicContact CZ2-CD1 3.49Å; W253-F268 VanDerWaalsContact CZ2-CD1 3.49Å; W253-F268 AromaticContact CZ2-CD2 3.81Å; W253-F268 HydrophobicContact CZ2-CD2 3.81Å; W253-F268 AromaticContact CZ2-CE1 3.22Å; W253-F268 HydrophobicContact CZ2-CE1 3.22Å; W253-F268 AromaticContact CZ2-CE2 3.55Å; W253-F268 HydrophobicContact CZ2-CE2 3.55Å; W253-F268 AromaticContact CZ2-CG 3.79Å; W253-F268 HydrophobicContact CZ2-CG 3.79Å; W253-F268 AromaticContact CZ2-CZ 3.26Å; W253-F268 HydrophobicContact CZ2-CZ 3.26Å; W253-F268 AromaticContact CZ3-CD1 3.94Å; W253-F268 HydrophobicContact CZ3-CD1 3.94Å; W253-F268 AromaticContact CZ3-CE1 3.95Å; W253-F268 HydrophobicContact CZ3-CE1 3.95Å; W253-F268 AromaticContact NE1-CZ 3.58Å
269	E	25.4	Very low	36.2	Very low	182 Å²	182	91.8 Å²	91.8	85%	0.85	47%	0.47	S	S	*	.	S	Bend	trans	-85.2	-15.4	-173.6	-67.5	-164.5	135.8	0	0	115.8
270	Y	27.1	Very low	33.4	Very low	214 Å²	214	96.9 Å²	96.9	84%	0.839	50%	0.502	S	S	*	.	S	Bend	trans	-114.3	13.8	-171.4	-76.8	-86.3	0	0	0	115.8
271	S	24.9	Very low	30.8	Very low	82 Å²	82	99.7 Å²	99.7	57%	0.573	52%	0.524	S	S	*	.			trans	-145	81.2	178	-66.3	0	0	0	0	113.5	L273	S271-L273 PolarHBondContact O-N 3.33Å; S271-L273 VanDerWaalsContact O-N 3.09Å
272	L	25.8	Very low	29	Very low	118 Å²	118	103 Å²	103	62%	0.618	54%	0.54	S	S	*	.			trans	-82.9	57.4	173.8	-84.3	172.4	0	0	0	112.5	K250	K250-L272 HydrophobicContact CD-CD2 3.9Å; K250-L272 HydrophobicContact CG-CD2 4.17Å
273	L	25.9	Very low	27.9	Very low	77 Å²	77	103.4 Å²	103.4	40%	0.403	53%	0.533	S	S	.	.			trans	-126.5	126.3	-178.4	-81.3	160.3	0	0	0	110.6	S271 H385 F386 L389	S271-L273 PolarHBondContact O-N 3.33Å; S271-L273 VanDerWaalsContact O-N 3.09Å; L273-H385 WeakPolarHBondContact CB-NE2 3.11Å; L273-H385 WeakPolarHBondContact CD1-NE2 3.26Å; L273-F386 HydrophobicContact CD2-CZ 4.45Å; L273-L389 HydrophobicContact CB-CD1 4.03Å; L273-L389 HydrophobicContact CB-CD2 4.3Å; L273-L389 HydrophobicContact CD2-CD1 4.4Å
274	P	30.3	Very low	26.9	Very low	20 Å²	20	101.6 Å²	101.6	13%	0.13	54%	0.537	C	S	.	.			trans	-88	168.2	-145.3	32.4	-40.9	0	0	0	119.9	L249 F386 L389	L249-P274 HydrophobicContact CB-CB 3.83Å; L249-P274 HydrophobicContact CD1-CB 3.64Å; L249-P274 HydrophobicContact CD1-CG 3.74Å; L249-P274 HydrophobicContact CD2-CB 4.17Å; L249-P274 HydrophobicContact CG-CB 4.1Å; P274-F386 HydrophobicContact CG-CD1 4.23Å; P274-F386 HydrophobicContact CG-CE1 3.66Å; P274-L389 VanDerWaalsContact CD-CD1 3.42Å; P274-L389 HydrophobicContact CG-CD1 4.07Å
275	V	27.1	Very low	26.7	Very low	24 Å²	24	104.1 Å²	104.1	15%	0.145	54%	0.541	C	S	.	.			trans	-126.5	-160.2	-167.9	179.2	0	0	0	0	108	L249 L258 T260 S363	L249-V275 VanDerWaalsContact CD2-O 3.26Å; L249-V275 WeakPolarHBondContact CD2-O 3.38Å; L258-V275 HydrophobicContact CB-CB 4.33Å; L258-V275 HydrophobicContact CB-CG1 3.88Å; L258-V275 HydrophobicContact CD1-CB 3.95Å; L258-V275 HydrophobicContact CD1-CG1 4.42Å; T260-V275 HydrophobicContact CG2-CG1 4.25Å; V275-S363 WeakPolarHBondContact O-CB 3.35Å; V275-S363 PolarHBondContact O-OG 3.07Å
276	S	29.5	Very low	26.2	Very low	0 Å²	0	101.3 Å²	101.3	0%	0	54%	0.539	C	S	.	.			trans	-112.3	132.3	-130.7	35.2	0	0	0	0	122.1	L258 M259 S361 T362 S363 Q393	L258-S276 VanDerWaalsContact CA-O 3.24Å; L258-S276 WeakPolarHBondContact CA-O 3.38Å; L258-S276 WeakPolarHBondContact CB-O 3.45Å; L258-S276 WeakPolarHBondContact CD2-O 3.22Å; M259-S276 VanDerWaalsContact CA-OG 3.29Å; M259-S276 WeakPolarHBondContact CA-OG 3.47Å; M259-S276 WeakPolarHBondContact CB-OG 3.3Å; M259-S276 PolarHBondContact N-OG 3.5Å; M259-S276 PolarHBondContact O-OG 3.03Å; S276-S361 CarbonylContact C-O 3.35Å; S276-S361 WeakPolarHBondContact CB-O 3.4Å; S276-S361 CarbonylContact O-C 3.53Å; S276-S361 VanDerWaalsContact O-CA 3.22Å; S276-S361 WeakPolarHBondContact O-CA 3.31Å; S276-S361 WeakPolarHBondContact O-CB 3.4Å; S276-S361 PolarHBondContact OG-O 2.86Å; S276-T362 WeakPolarHBondContact CA-O 3.29Å; S276-T362 WeakPolarHBondContact CB-O 3.41Å; S276-T362 PolarHBondContact O-N 3.43Å; S276-S363 WeakPolarHBondContact CA-OG 3.34Å; S276-Q393 VanDerWaalsContact CB-OE1 3.23Å; S276-Q393 PolarHBondContact OG-OE1 3.5Å; S276-Q393 VanDerWaalsContact OG-OE1 3.07Å
277	L	26.7	Very low	25.9	Very low	11 Å²	11	100.1 Å²	100.1	6%	0.058	54%	0.541	C	S	.	.			trans	-115.8	134	159.4	-169.7	137.3	0	0	0	125.3	Y216 D217 M252 S361 T362 S363	Y216-L277 HydrophobicContact CD1-CB 3.61Å; Y216-L277 HydrophobicContact CD1-CD1 3.15Å; Y216-L277 HydrophobicContact CD1-CD2 3.34Å; Y216-L277 HydrophobicContact CD1-CG 3.41Å; Y216-L277 VanDerWaalsContact CD1-CG 3.41Å; Y216-L277 HydrophobicContact CD2-CB 4.01Å; Y216-L277 HydrophobicContact CD2-CD1 4.11Å; Y216-L277 HydrophobicContact CE1-CB 3.25Å; Y216-L277 HydrophobicContact CE1-CD1 3.77Å; Y216-L277 HydrophobicContact CE1-CD2 3.17Å; Y216-L277 HydrophobicContact CE1-CG 3.44Å; Y216-L277 VanDerWaalsContact CE1-CG 3.44Å; Y216-L277 HydrophobicContact CE2-CB 3.63Å; Y216-L277 HydrophobicContact CG-CB 4.01Å; Y216-L277 HydrophobicContact CG-CD1 3.38Å; Y216-L277 HydrophobicContact CG-CD2 4.4Å; Y216-L277 HydrophobicContact CG-CG 4.02Å; D217-L277 WeakPolarHBondContact OD1-CD2 3.44Å; M252-L277 HydrophobicContact CE-CD1 3.85Å; L277-S361 VanDerWaalsContact CA-OG 3.31Å; L277-S361 WeakPolarHBondContact CA-OG 3.34Å; L277-S361 WeakPolarHBondContact CB-OG 3.48Å; L277-S361 WeakPolarHBondContact CD1-OG 3.33Å; L277-S361 WeakPolarHBondContact CG-OG 3.14Å; L277-T362 VanDerWaalsContact C-CA 3.41Å; L277-T362 VanDerWaalsContact N-CA 3.33Å; L277-T362 CarbonylContact O-C 3.54Å; L277-T362 VanDerWaalsContact O-C 3.3Å; L277-T362 VanDerWaalsContact O-CA 3.29Å; L277-T362 WeakPolarHBondContact O-CA 3.38Å; L277-T362 WeakPolarHBondContact O-CG2 3.27Å; L277-T362 PolarHBondContact O-N 2.83Å; L277-S363 VanDerWaalsContact C-N 3.34Å; L277-S363 VanDerWaalsContact CA-N 3.31Å; L277-S363 PolarHBondContact N-OG 3.43Å; L277-S363 PolarHBondContact O-N 2.99Å
278	E	28.4	Very low	25.7	Very low	21 Å²	21	99.4 Å²	99.4	10%	0.098	54%	0.536	C	S	.	.			trans	-88.1	173.2	-138.1	-123.7	-178.8	-144.5	0	0	122.9	M259 L360 S361 T362	M259-E278 HydrophobicContact CE-CG 3.84Å; M259-E278 VanDerWaalsContact CE-OE1 3.31Å; M259-E278 WeakPolarHBondContact CE-OE1 3.28Å; E278-L360 VanDerWaalsContact CB-O 3.27Å; E278-L360 WeakPolarHBondContact CB-O 2.97Å; E278-L360 WeakPolarHBondContact CG-O 3.42Å; E278-L360 WeakPolarHBondContact OE1-CB 3.44Å; E278-L360 VanDerWaalsContact OE1-O 3.13Å; E278-S361 VanDerWaalsContact CG-CA 3.48Å; E278-S361 PolarHBondContact N-OG 2.86Å; E278-S361 PolarHBondContact OE1-N 3.21Å; E278-T362 VanDerWaalsContact CA-N 3.34Å
279	N	26.7	Very low	25.2	Very low	52 Å²	52	98.1 Å²	98.1	28%	0.278	55%	0.548	S	S	.	.			trans	-11.4	142.6	142.2	-62.4	-26.6	0	0	0	117.9
280	T	23.9	Very low	25.1	Very low	114 Å²	114	95.6 Å²	95.6	70%	0.699	54%	0.54	S	S	*	.			trans	-151.2	135.7	144.5	16.1	0	0	0	0	108.9
281	S	24.1	Very low	24.8	Very low	118 Å²	118	91.2 Å²	91.2	83%	0.825	54%	0.54	S	S	*	.			trans	30	115.4	165.4	57.2	0	0	0	0	120
282	Q	25.7	Very low	24.8	Very low	155 Å²	155	91.9 Å²	91.9	72%	0.724	55%	0.551	S	S	*	*			trans	-75.4	168	168.5	-60.2	176.8	-23.5	0	0	113.5
283	N	24.7	Very low	24.5	Very low	142 Å²	142	92.1 Å²	92.1	76%	0.759	56%	0.562	S	S	*	*			trans	66.5	85	151.4	-57.7	-25.4	0	0	0	119.6
284	A	22.8	Very low	24.3	Very low	84 Å²	84	100.3 Å²	100.3	69%	0.694	59%	0.588	S	S	*	*				-174.6	134.6	120.7	0	0	0	0	0	111.1
285	F	25.4	Very low	23.9	Very low	206 Å²	206	105 Å²	105	90%	0.904	62%	0.621	S	S	*	*				-177.2	155.1	98.3	-109.5	-82.9	0	0	0	112.2
286	V	21.9	Very low	23.6	Very low	121 Å²	121	108.5 Å²	108.5	73%	0.733	65%	0.646	S	S	*	*			trans	-84.5	139.6	-177.8	172.7	0	0	0	0	110.9	I288	V286-I288 PolarHBondContact O-N 3.03Å
287	S	20.8	Very low	23.4	Very low	116 Å²	116	115.1 Å²	115.1	81%	0.811	68%	0.682	S	S	*	*			trans	-68.9	119.2	171.9	42.7	0	0	0	0	111.5
288	I	21.3	Very low	23.2	Very low	141 Å²	141	122.3 Å²	122.3	72%	0.723	72%	0.715	S	S	*	*			trans	-102.8	109.4	169.8	-62.6	-179.7	0	0	0	108.4	V286 L290	V286-I288 PolarHBondContact O-N 3.03Å; I288-L290 PolarHBondContact O-N 2.78Å
289	G	20.7	Very low	22.9	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	74%	0.744	S	S	*	*			trans	-71.5	125	174.6	0	0	0	0	0	111.2
290	L	23.7	Very low	22.8	Very low	129 Å²	129	130.6 Å²	130.6	68%	0.675	77%	0.767	S	S	*	*			trans	-119	103.6	162	-74.1	174.4	0	0	0	108.6	I288 R447	I288-L290 PolarHBondContact O-N 2.78Å; L290-R447 PolarHBondContact O-NH1 3.39Å; L290-R447 VanDerWaalsContact O-NH1 3.11Å; L290-R447 PolarHBondContact O-NH2 3.11Å
291	S	20.2	Very low	22.7	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	78%	0.776	S	S	*	*			trans	-91.7	130.8	161.8	42.6	0	0	0	0	108.4
292	A	24.3	Very low	22.7	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	78%	0.775	S	S	*	*			trans	-138.9	113.9	175.3	0	0	0	0	0	108.1
293	S	21.3	Very low	22.6	Very low	123 Å²	123	132.5 Å²	132.5	86%	0.86	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-69.4	129.2	-178.4	44.8	0	0	0	0	111.1
294	R	20.7	Very low	22.5	Very low	250 Å²	250	131.1 Å²	131.1	94%	0.943	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.4	117.1	167.2	-70	-178.8	173.8	-179.7	-3.1	109.1
295	S	21.3	Very low	22.9	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-86.4	155.3	159.4	53.1	0	0	0	0	110
296	S	22.7	Very low	23.1	Very low	98 Å²	98	128.2 Å²	128.2	69%	0.685	78%	0.779	S	S	*	*			trans	-80.6	-171.1	179.2	50.8	0	0	0	0	113.1
297	D	24.5	Very low	23.1	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	78%	0.782	S	S	*	*			trans	112.2	140.2	155	-52.3	-1.3	0	0	0	114.4
298	E	22.4	Very low	23.1	Very low	162 Å²	162	130 Å²	130	76%	0.757	78%	0.782	S	S	*	*			cis	-165.3	155.6	-46.8	-125.7	-168.8	175.3	0	0	109.4
299	I	23	Very low	23.1	Very low	135 Å²	135	128.6 Å²	128.6	69%	0.692	79%	0.785	S	S	*	*			trans	76.1	144.1	148.7	-69.2	166.3	0	0	0	122.2
300	S	23.1	Very low	23.1	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	79%	0.793	S	S	*	*			trans	87	98.7	156.7	57.6	0	0	0	0	121.7
301	E	22.3	Very low	23	Very low	190 Å²	190	133.5 Å²	133.5	89%	0.888	80%	0.8	S	S	*	*			trans	-46.1	161	157.7	-54.7	167.7	145.4	0	0	116.8
302	G	24.5	Very low	23.2	Very low	78 Å²	78	130.5 Å²	130.5	80%	0.804	79%	0.788	S	S	*	*			trans	-165.2	122.3	161.5	0	0	0	0	0	111.3
303	I	23.4	Very low	23.3	Very low	160 Å²	160	132.3 Å²	132.3	82%	0.821	79%	0.792	S	S	*	*			trans	-114.9	129.1	-167.6	-59.4	169.2	0	0	0	111.9
304	S	22.9	Very low	23.5	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	79%	0.793	S	S	*	*			trans	-175.8	126.1	140.6	55.7	0	0	0	0	113.6
305	S	30.3	Very low	23.5	Very low	115 Å²	115	122.6 Å²	122.6	80%	0.804	78%	0.779	S	S	*	*			trans	-76.1	165.2	163.3	-43.8	0	0	0	0	111.2
306	P	30.2	Very low	23.6	Very low	114 Å²	114	125 Å²	125	74%	0.74	78%	0.783	S	S	*	*				-153.3	166	93.8	39.9	-22.5	0	0	0	117.8
307	S	21.9	Very low	23.7	Very low	113 Å²	113	130 Å²	130	79%	0.79	80%	0.795	S	S	*	*			trans	54.8	109.8	150.8	56.3	0	0	0	0	120.2
308	I	21	Very low	23.6	Very low	161 Å²	161	128.4 Å²	128.4	83%	0.826	80%	0.795	S	S	*	*			trans	-89.2	141.4	169.7	-62.9	162.8	0	0	0	110.1	I310	I308-I310 HydrophobicContact CG2-CG1 4Å
309	S	19.9	Very low	23.9	Very low	111 Å²	111	126 Å²	126	78%	0.776	79%	0.794	S	S	*	*			trans	-117.1	108.8	165.5	58.8	0	0	0	0	110.5
310	I	21.2	Very low	24	Very low	157 Å²	157	125.7 Å²	125.7	81%	0.805	80%	0.802	S	S	*	*			trans	-78.7	124.7	-178.2	-56.2	174.2	0	0	0	109.9	I308	I308-I310 HydrophobicContact CG2-CG1 4Å
311	V	22.9	Very low	23.9	Very low	137 Å²	137	125.9 Å²	125.9	83%	0.83	80%	0.798	S	S	*	*			trans	-115.9	138.9	163.6	-179.4	0	0	0	0	107.6
312	G	23.7	Very low	24.3	Very low	59 Å²	59	125.1 Å²	125.1	61%	0.608	80%	0.799	S	S	*	*			trans	-71.3	166.3	-166.3	0	0	0	0	0	115.3
313	P	26.4	Very low	24.3	Very low	134 Å²	134	129.1 Å²	129.1	87%	0.87	80%	0.797	S	S	*	*			trans	-68.9	137.4	-177.2	29.5	-35.3	0	0	0	111.9	G315	P313-G315 PolarHBondContact O-N 3.45Å
314	A	24.9	Very low	24.2	Very low	107 Å²	107	126.9 Å²	126.9	88%	0.884	79%	0.791	S	S	*	*			trans	-76.9	110.6	163.3	0	0	0	0	0	108.7
315	G	21.5	Very low	24.5	Very low	63 Å²	63	127.3 Å²	127.3	65%	0.649	79%	0.791	S	S	*	*			trans	-89.2	-173.7	168.2	0	0	0	0	0	112.3	P313	P313-G315 PolarHBondContact O-N 3.45Å
316	D	23	Very low	24.4	Very low	167 Å²	167	128.1 Å²	128.1	89%	0.893	79%	0.792	S	S	*	*			trans	66.1	61.2	172.5	-58.3	-10.8	0	0	0	116.3	S318	D316-S318 VanDerWaalsContact C-N 3.34Å; D316-S318 PolarHBondContact O-N 2.7Å
317	E	24.9	Very low	24.2	Very low	202 Å²	202	129.7 Å²	129.7	94%	0.944	80%	0.799	S	S	*	*			trans	-63.1	94.2	151.6	-72	-169.7	159.2	0	0	110
318	S	22.4	Very low	24.8	Very low	107 Å²	107	132 Å²	132	75%	0.748	79%	0.79	S	S	*	*			trans	-73.1	134.3	165.6	-165.1	0	0	0	0	109.3	D316	D316-S318 VanDerWaalsContact C-N 3.34Å; D316-S318 PolarHBondContact O-N 2.7Å
319	P	27.5	Very low	25.4	Very low	112 Å²	112	128.9 Å²	128.9	73%	0.727	78%	0.781	S	S	*	*			trans	-64.8	136.8	-162.7	23.9	-34.8	0	0	0	113.5	V321	P319-V321 PolarHBondContact O-N 3.13Å
320	C	25.3	Very low	26.1	Very low	128 Å²	128	128 Å²	128	87%	0.865	78%	0.781	S	S	*	*			trans	-52.6	106.4	-173.7	-65.7	0	0	0	0	114.1
321	V	22.2	Very low	27	Very low	116 Å²	116	123.1 Å²	123.1	70%	0.703	76%	0.76	S	S	*	*			trans	-68.8	136	162.8	-179.5	0	0	0	0	108.8	P319 E323	P319-V321 PolarHBondContact O-N 3.13Å; V321-E323 HydrophobicContact CG1-CG 4.44Å; V321-E323 PolarHBondContact O-N 3.06Å
322	L	30.5	Very low	28.3	Very low	173 Å²	173	124 Å²	124	91%	0.906	76%	0.759	S	S	*	*			trans	-74.2	89.4	-179.4	-81	83.5	0	0	0	112
323	E	23.4	Very low	29.4	Very low	162 Å²	162	121.8 Å²	121.8	76%	0.757	73%	0.734	S	S	*	*			trans	-135.7	134.7	170.7	-76.4	-171.1	-164.2	0	0	109.6	V321	V321-E323 HydrophobicContact CG1-CG 4.44Å; V321-E323 PolarHBondContact O-N 3.06Å
324	T	22.1	Very low	30.5	Very low	114 Å²	114	118.1 Å²	118.1	70%	0.699	71%	0.711	S	S	*	*			cis	-137.7	158	-13.9	35.5	0	0	0	0	108.4	T326	T324-T326 PolarHBondContact O-N 3.41Å; T324-T326 VanDerWaalsContact O-N 3.14Å
325	P	29.3	Very low	31.6	Very low	122 Å²	122	118.1 Å²	118.1	79%	0.792	70%	0.696	S	S	*	*			trans	-69.3	113.9	-176.2	27.5	-34.5	0	0	0	111.8	T327	P325-T327 PolarHBondContact O-N 2.83Å
326	T	29.3	Very low	32.9	Very low	132 Å²	132	119.7 Å²	119.7	81%	0.81	70%	0.697	S	S	*	*			trans	-55.2	137.6	165.4	45.4	0	0	0	0	109.7	T324 R328	T324-T326 PolarHBondContact O-N 3.41Å; T324-T326 VanDerWaalsContact O-N 3.14Å; T326-R328 PolarHBondContact O-N 2.67Å
327	T	26	Very low	34.2	Very low	146 Å²	146	115.3 Å²	115.3	90%	0.896	67%	0.669	S	S	*	*			trans	-66.3	93.8	-170.4	43.3	0	0	0	0	111.7	P325	P325-T327 PolarHBondContact O-N 2.83Å
328	R	34.4	Very low	35.4	Very low	161 Å²	161	105.8 Å²	105.8	61%	0.608	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-56.5	126.6	-176.2	-162.3	-170.4	-175.8	-161.3	-2.4	110.8	E148 T326	E148-R328 IonicContact OE2-CZ 3.99Å; E148-R328 IonicContact OE2-NH1 3.4Å; E148-R328 PolarHBondContact OE2-NH1 2.72Å; E148-R328 VanDerWaalsContact OE2-NH1 3.16Å; E148-R328 IonicContact OE2-NH2 2.82Å; E148-R328 PolarHBondContact OE2-NH2 3.19Å; T326-R328 PolarHBondContact O-N 2.67Å
329	P	32.8	Very low	36.7	Very low	97 Å²	97	101 Å²	101	63%	0.63	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-60.3	143.1	164.4	26.9	-33.1	0	0	0	109.2
330	A	33.9	Very low	37.9	Very low	93 Å²	93	98.1 Å²	98.1	77%	0.769	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-53.7	145.4	-174	0	0	0	0	0	112	L332	A330-L332 PolarHBondContact O-N 3.36Å
331	S	40	Very low	39.2	Very low	54 Å²	54	97.4 Å²	97.4	38%	0.378	56%	0.562	S	S	.	*			trans	-53.3	109.9	-168.3	62.1	0	0	0	0	112.3	R152 I333	R152-S331 VanDerWaalsContact NH2-CB 3.29Å; R152-S331 PolarHBondContact NH2-OG 3.46Å; S331-I333 PolarHBondContact O-N 3.16Å
332	L	50	Low	41	Very low	155 Å²	155	96.4 Å²	96.4	81%	0.812	55%	0.546	S	S	*	.			trans	-65.5	-17.8	-177.2	-76.4	130.8	0	0	0	113.6	A330 S334	A330-L332 PolarHBondContact O-N 3.36Å; L332-S334 PolarHBondContact O-N 3.02Å; L332-S334 VanDerWaalsContact O-N 3.16Å
333	I	47.4	Very low	42.4	Very low	13 Å²	13	88.6 Å²	88.6	7%	0.067	51%	0.506	C	S	.	.			trans	-78.6	98.9	177.4	-47.2	178.2	0	0	0	109.6	V149 R152 S331 F338	V149-I333 HydrophobicContact CG2-CD1 4.19Å; R152-I333 PolarHBondContact NH1-O 3.15Å; R152-I333 VanDerWaalsContact NH1-O 3.13Å; S331-I333 PolarHBondContact O-N 3.16Å; I333-F338 HydrophobicContact CG2-CD2 4.07Å; I333-F338 HydrophobicContact CG2-CE2 3.5Å; I333-F338 HydrophobicContact CG2-CZ 4.3Å
334	S	50.8	Low	44.5	Very low	57 Å²	57	85.6 Å²	85.6	40%	0.399	50%	0.499	S	S	.	.			trans	-61.8	143.3	168.8	177.6	0	0	0	0	111.1	L332 S336 Y337	L332-S334 PolarHBondContact O-N 3.02Å; L332-S334 VanDerWaalsContact O-N 3.16Å; S334-S336 PolarHBondContact O-N 3.47Å; S334-S336 PolarHBondContact OG-N 3.17Å; S334-S336 PolarHBondContact OG-OG 2.97Å; S334-Y337 WeakPolarHBondContact O-CB 3.43Å; S334-Y337 PolarHBondContact O-N 3.34Å
335	D	47.7	Very low	47.3	Very low	106 Å²	106	82.1 Å²	82.1	57%	0.567	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-63	-23	173.1	-63.5	-33.6	0	0	0	112.1	R152 Y337 F338	R152-D335 IonicContact CZ-OD1 3.27Å; R152-D335 IonicContact NH1-OD1 3.65Å; R152-D335 PolarHBondContact NH1-OD1 3.43Å; D335-Y337 PolarHBondContact O-N 3.41Å; D335-F338 PolarHBondContact O-N 3.45Å
336	S	48.2	Very low	49.9	Very low	96 Å²	96	83.2 Å²	83.2	67%	0.671	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-69.4	-11.3	172.1	74.2	0	0	0	0	114.2	S334	S334-S336 PolarHBondContact O-N 3.47Å; S334-S336 PolarHBondContact OG-N 3.17Å; S334-S336 PolarHBondContact OG-OG 2.97Å
337	Y	49.7	Very low	52.4	Low	75 Å²	75	80.8 Å²	80.8	29%	0.294	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-99.4	-10.3	-179.4	-105.2	-98.8	0	0	0	113.1	H27 L30 H81 S334 D335	H27-Y337 WeakPolarHBondContact CA-OH 3.39Å; H27-Y337 VanDerWaalsContact CB-OH 3.29Å; H27-Y337 WeakPolarHBondContact CB-OH 3.43Å; H27-Y337 PolarHBondContact CD2-OH 3.2Å; L30-Y337 HydrophobicContact CD1-CE1 4.34Å; H81-Y337 AromaticContact CD2-CD1 3.72Å; H81-Y337 PolarHBondContact CE1-O 3.28Å; H81-Y337 AromaticContact CG-CD1 3.94Å; H81-Y337 AromaticContact NE2-CD1 3.81Å; S334-Y337 WeakPolarHBondContact O-CB 3.43Å; S334-Y337 PolarHBondContact O-N 3.34Å; D335-Y337 PolarHBondContact O-N 3.41Å
338	F	51.8	Low	55.2	Low	3 Å²	3	73.8 Å²	73.8	1%	0.013	42%	0.416	C	S	.	.	S	Bend	trans	-59.2	158.8	-177.8	-101.1	-96.7	0	0	0	112.8	V149 R152 L156 I333 D335 T340	V149-F338 HydrophobicContact CB-CE1 4.33Å; V149-F338 HydrophobicContact CB-CZ 4.44Å; V149-F338 HydrophobicContact CG1-CE1 4.06Å; V149-F338 HydrophobicContact CG2-CE1 4.49Å; V149-F338 HydrophobicContact CG2-CZ 4.24Å; V149-F338 WeakPolarHBondContact O-CE1 3.48Å; R152-F338 HydrophobicContact CB-CD1 4.43Å; R152-F338 HydrophobicContact CB-CE1 3.52Å; R152-F338 HydrophobicContact CB-CE2 4.15Å; R152-F338 HydrophobicContact CB-CZ 3.38Å; R152-F338 VanDerWaalsContact CD-CE2 3.45Å; R152-F338 VanDerWaalsContact CD-CZ 3.4Å; R152-F338 HydrophobicContact CG-CE2 4.46Å; R152-F338 HydrophobicContact CG-CZ 3.97Å; L156-F338 HydrophobicContact CD1-CB 3.87Å; L156-F338 HydrophobicContact CD1-CD1 3.78Å; L156-F338 HydrophobicContact CD1-CG 4.07Å; L156-F338 HydrophobicContact CD2-CB 4.03Å; L156-F338 HydrophobicContact CD2-CD1 4.09Å; L156-F338 HydrophobicContact CD2-CD2 4.48Å; L156-F338 HydrophobicContact CD2-CG 3.89Å; L156-F338 HydrophobicContact CG-CD1 4.31Å; I333-F338 HydrophobicContact CG2-CD2 4.07Å; I333-F338 HydrophobicContact CG2-CE2 3.5Å; I333-F338 HydrophobicContact CG2-CZ 4.3Å; D335-F338 PolarHBondContact O-N 3.45Å; F338-T340 PolarHBondContact O-N 2.86Å; F338-T340 PolarHBondContact O-OG1 3.2Å
339	P	49.5	Very low	57.6	Low	5 Å²	5	70.1 Å²	70.1	3%	0.032	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-61	15.3	-164.1	-26.6	36.7	0	0	0	118.6	V149 A166 V341 Y342 S343	V149-P339 HydrophobicContact CG1-CG 4.27Å; A166-P339 HydrophobicContact CB-CB 3.62Å; P339-V341 PolarHBondContact O-N 2.85Å; P339-Y342 CarbonylContact O-C 3.44Å; P339-Y342 WeakPolarHBondContact O-CA 3.43Å; P339-Y342 PolarHBondContact O-N 3.27Å; P339-S343 PolarHBondContact O-N 2.91Å
340	T	51.5	Low	60.2	Low	52 Å²	52	67.4 Å²	67.4	32%	0.319	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-40.3	-32.6	168	57.9	0	0	0	0	115.8	F338 S343	F338-T340 PolarHBondContact O-N 2.86Å; F338-T340 PolarHBondContact O-OG1 3.2Å; T340-S343 VanDerWaalsContact CA-OG 3.29Å; T340-S343 WeakPolarHBondContact CA-OG 3.31Å; T340-S343 PolarHBondContact O-OG 3.44Å; T340-S343 VanDerWaalsContact O-OG 3.08Å
341	V	53.8	Low	62.6	Low	113 Å²	113	63.3 Å²	63.3	69%	0.685	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-75.5	-33.4	174.5	-178.4	0	0	0	0	112.2	P339 T344	P339-V341 PolarHBondContact O-N 2.85Å; V341-T344 PolarHBondContact O-OG1 3.11Å
342	Y	60	Low	64.9	Low	95 Å²	95	62 Å²	62	37%	0.373	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-20.7	178	-61.2	-63.5	0	0	0	112.9	N84 P339 T344 S345 V348	N84-Y342 PolarHBondContact ND2-OH 3.25Å; P339-Y342 CarbonylContact O-C 3.44Å; P339-Y342 WeakPolarHBondContact O-CA 3.43Å; P339-Y342 PolarHBondContact O-N 3.27Å; Y342-T344 PolarHBondContact O-N 3.31Å; Y342-S345 WeakPolarHBondContact O-CB 3.5Å; Y342-S345 PolarHBondContact O-N 3.39Å; Y342-S345 PolarHBondContact O-OG 2.98Å; Y342-V348 WeakPolarHBondContact O-CG2 3.34Å
343	S	58.6	Low	66.7	Low	9 Å²	9	60.8 Å²	60.8	6%	0.063	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.5	179	70.7	0	0	0	0	113.2	P339 T340	P339-S343 PolarHBondContact O-N 2.91Å; T340-S343 VanDerWaalsContact CA-OG 3.29Å; T340-S343 WeakPolarHBondContact CA-OG 3.31Å; T340-S343 PolarHBondContact O-OG 3.44Å; T340-S343 VanDerWaalsContact O-OG 3.08Å
344	T	67.3	Low	68.3	Low	100 Å²	100	60.6 Å²	60.6	61%	0.613	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	10.2	168.6	56.7	0	0	0	0	112.6	V341 Y342	V341-T344 PolarHBondContact O-OG1 3.11Å; Y342-T344 PolarHBondContact O-N 3.31Å
345	S	80.5	Confident	69.6	Low	40 Å²	40	60.9 Å²	60.9	28%	0.28	34%	0.335	S	S	.	.	S	Bend	trans	-72.9	149.1	175.2	68.6	0	0	0	0	111.4	Y342 V347 V348 L349	Y342-S345 WeakPolarHBondContact O-CB 3.5Å; Y342-S345 PolarHBondContact O-N 3.39Å; Y342-S345 PolarHBondContact O-OG 2.98Å; S345-V347 VanDerWaalsContact C-N 3.25Å; S345-V347 PolarHBondContact O-N 2.72Å; S345-V348 PolarHBondContact O-N 3.24Å; S345-L349 PolarHBondContact O-N 3.4Å; S345-L349 VanDerWaalsContact O-N 3.1Å
346	E	83.9	Confident	70.9	Confident	146 Å²	146	59 Å²	59	68%	0.682	32%	0.324	S	S	*	.	H	α-helix	trans	-54.8	-40.8	-176.8	-160.9	-169.7	139.4	0	0	112.3	V348 L349 N350	E346-V348 VanDerWaalsContact C-N 3.35Å; E346-V348 PolarHBondContact O-N 3.45Å; E346-L349 PolarHBondContact O-N 3.12Å; E346-N350 VanDerWaalsContact O-CB 3.23Å; E346-N350 WeakPolarHBondContact O-CB 3.48Å; E346-N350 PolarHBondContact O-N 3.34Å; E346-N350 PolarHBondContact O-ND2 2.85Å
347	V	83.1	Confident	72	Confident	80 Å²	80	59.9 Å²	59.9	49%	0.485	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-39.8	177.5	-176.1	0	0	0	0	112.1	L169 S345 L351	L169-V347 HydrophobicContact CD1-CG1 3.96Å; S345-V347 VanDerWaalsContact C-N 3.25Å; S345-V347 PolarHBondContact O-N 2.72Å; V347-L351 HydrophobicContact CG1-CD1 4.26Å; V347-L351 VanDerWaalsContact O-CG 3.32Å; V347-L351 WeakPolarHBondContact O-CG 3.01Å; V347-L351 PolarHBondContact O-N 3.07Å; V347-L351 VanDerWaalsContact O-N 3.16Å
348	V	84.1	Confident	73	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-68.7	-44.2	176.9	169.6	0	0	0	0	111.1	P162 I165 A166 L169 Y342 S345 E346 L351 L352	P162-V348 HydrophobicContact CB-CG1 4.06Å; I165-V348 HydrophobicContact CB-CG1 4.18Å; I165-V348 HydrophobicContact CB-CG2 4.36Å; I165-V348 HydrophobicContact CG2-CB 4.25Å; I165-V348 HydrophobicContact CG2-CG1 4.2Å; I165-V348 HydrophobicContact CG2-CG2 3.78Å; A166-V348 HydrophobicContact CB-CG2 4.16Å; L169-V348 HydrophobicContact CD1-CG2 3.85Å; Y342-V348 WeakPolarHBondContact O-CG2 3.34Å; S345-V348 PolarHBondContact O-N 3.24Å; E346-V348 VanDerWaalsContact C-N 3.35Å; E346-V348 PolarHBondContact O-N 3.45Å; V348-L351 PolarHBondContact O-N 2.97Å; V348-L352 HydrophobicContact CG1-CD1 3.89Å; V348-L352 HydrophobicContact CG1-CG 4.49Å; V348-L352 VanDerWaalsContact O-CG 3.29Å; V348-L352 WeakPolarHBondContact O-CG 3.45Å; V348-L352 PolarHBondContact O-N 3.08Å
349	L	86.2	Confident	74	Confident	83 Å²	83	58.4 Å²	58.4	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-47.9	178.1	-62.5	174.5	0	0	0	111.1	S345 E346 L351 L352 D353	S345-L349 PolarHBondContact O-N 3.4Å; S345-L349 VanDerWaalsContact O-N 3.1Å; E346-L349 PolarHBondContact O-N 3.12Å; L349-L351 VanDerWaalsContact C-N 3.29Å; L349-L351 PolarHBondContact O-N 3.49Å; L349-L352 WeakPolarHBondContact O-CB 3.46Å; L349-L352 PolarHBondContact O-N 3.41Å; L349-D353 PolarHBondContact O-N 3.26Å
350	N	86	Confident	75.4	Confident	40 Å²	40	59.7 Å²	59.7	21%	0.214	33%	0.325	C	S	.	.	H	α-helix	trans	-57.9	-36.6	177.3	-79.2	-21.9	0	0	0	113.7	E346 G354 N355 I358	E346-N350 VanDerWaalsContact O-CB 3.23Å; E346-N350 WeakPolarHBondContact O-CB 3.48Å; E346-N350 PolarHBondContact O-N 3.34Å; E346-N350 PolarHBondContact O-ND2 2.85Å; N350-G354 PolarHBondContact O-N 3.32Å; N350-N355 PolarHBondContact O-N 2.93Å; N350-I358 HydrophobicContact CB-CD1 3.51Å; N350-I358 HydrophobicContact CB-CG2 4.35Å; N350-I358 VanDerWaalsContact CG-CD1 3.49Å; N350-I358 WeakPolarHBondContact ND2-CD1 3.17Å
351	L	85.7	Confident	76.8	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-71.4	-40.5	173.9	-74.7	168.2	0	0	0	111.8	I165 L169 A210 R213 L214 V347 V348 L349 G354 I358	I165-L351 HydrophobicContact CD1-CB 4.14Å; I165-L351 HydrophobicContact CG2-CB 4.38Å; I165-L351 HydrophobicContact CG2-CD1 3.66Å; L169-L351 HydrophobicContact CD1-CD1 4.33Å; L169-L351 HydrophobicContact CD2-CD1 4.37Å; A210-L351 HydrophobicContact CB-CB 4.29Å; A210-L351 WeakPolarHBondContact CB-O 3.31Å; R213-L351 HydrophobicContact CB-CD2 4.45Å; R213-L351 HydrophobicContact CG-CD2 4.04Å; L214-L351 HydrophobicContact CD2-CD1 4.49Å; V347-L351 HydrophobicContact CG1-CD1 4.26Å; V347-L351 VanDerWaalsContact O-CG 3.32Å; V347-L351 WeakPolarHBondContact O-CG 3.01Å; V347-L351 PolarHBondContact O-N 3.07Å; V347-L351 VanDerWaalsContact O-N 3.16Å; V348-L351 PolarHBondContact O-N 2.97Å; L349-L351 VanDerWaalsContact C-N 3.29Å; L349-L351 PolarHBondContact O-N 3.49Å; L351-G354 WeakPolarHBondContact O-CA 3.18Å; L351-G354 PolarHBondContact O-N 3.39Å; L351-I358 HydrophobicContact CD2-CG2 4.3Å
352	L	87.8	Confident	78.4	Confident	27 Å²	27	51.9 Å²	51.9	14%	0.141	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-40.3	176.7	-70.1	163.9	0	0	0	112.6	A161 P162 I165 F207 V348 L349 G354	A161-L352 HydrophobicContact CB-CD2 3.74Å; P162-L352 HydrophobicContact CB-CD1 3.99Å; P162-L352 HydrophobicContact CG-CD1 3.74Å; I165-L352 HydrophobicContact CD1-CD2 3.55Å; I165-L352 HydrophobicContact CD1-CG 3.71Å; F207-L352 HydrophobicContact CD1-CD2 3.98Å; F207-L352 WeakPolarHBondContact CD1-O 3.42Å; F207-L352 HydrophobicContact CE1-CB 4.22Å; F207-L352 HydrophobicContact CE1-CD2 3.77Å; F207-L352 WeakPolarHBondContact CE1-O 3.39Å; F207-L352 HydrophobicContact CE2-CD2 4.36Å; F207-L352 HydrophobicContact CG-CD2 4.36Å; F207-L352 HydrophobicContact CZ-CD2 3.98Å; V348-L352 HydrophobicContact CG1-CD1 3.89Å; V348-L352 HydrophobicContact CG1-CG 4.49Å; V348-L352 VanDerWaalsContact O-CG 3.29Å; V348-L352 WeakPolarHBondContact O-CG 3.45Å; V348-L352 PolarHBondContact O-N 3.08Å; L349-L352 WeakPolarHBondContact O-CB 3.46Å; L349-L352 PolarHBondContact O-N 3.41Å; L352-G354 PolarHBondContact O-N 3.21Å
353	D	87.1	Confident	79.8	Confident	130 Å²	130	47.3 Å²	47.3	70%	0.695	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-15	173.2	-70.2	-23.6	0	0	0	112	L349 N355	L349-D353 PolarHBondContact O-N 3.26Å; D353-N355 VanDerWaalsContact C-N 3.26Å; D353-N355 PolarHBondContact O-N 2.97Å
354	G	81.3	Confident	81.4	Confident	9 Å²	9	46.9 Å²	46.9	9%	0.093	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	32.9	177.3	0	0	0	0	0	112.4	R209 N350 L351 L352 L356	R209-G354 WeakPolarHBondContact CD-O 3.4Å; R209-G354 PolarHBondContact NH1-O 3.41Å; N350-G354 PolarHBondContact O-N 3.32Å; L351-G354 WeakPolarHBondContact O-CA 3.18Å; L351-G354 PolarHBondContact O-N 3.39Å; L352-G354 PolarHBondContact O-N 3.21Å; G354-L356 PolarHBondContact O-N 3.43Å
355	N	78	Confident	82.6	Confident	63 Å²	63	43 Å²	43	34%	0.337	23%	0.23	S	C	.	.			trans	-54.7	134.4	-178.5	-174.3	9.2	0	0	0	110.1	N350 D353 D357 I358 C359	N350-N355 PolarHBondContact O-N 2.93Å; D353-N355 VanDerWaalsContact C-N 3.26Å; D353-N355 PolarHBondContact O-N 2.97Å; N355-D357 PolarHBondContact OD1-N 2.87Å; N355-I358 HydrophobicContact CB-CB 4.47Å; N355-I358 HydrophobicContact CB-CD1 4.36Å; N355-I358 PolarHBondContact O-N 2.59Å; N355-C359 WeakPolarHBondContact O-CB 3.43Å; N355-C359 PolarHBondContact O-N 2.96Å; N355-C359 PolarHBondContact O-SG 2.94Å
356	L	74.4	Confident	83.4	Confident	65 Å²	65	41.1 Å²	41.1	34%	0.34	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-42.4	-178.5	-172.8	60.1	0	0	0	110.3	L257 G354 I358 C359 L360	L257-L356 HydrophobicContact CD2-CD1 4.26Å; G354-L356 PolarHBondContact O-N 3.43Å; L356-I358 PolarHBondContact O-N 3.12Å; L356-C359 PolarHBondContact O-N 3.43Å; L356-C359 VanDerWaalsContact O-N 3.13Å; L356-L360 HydrophobicContact CD1-CB 4.13Å; L356-L360 HydrophobicContact CG-CB 4.22Å; L356-L360 WeakPolarHBondContact O-CA 3.41Å; L356-L360 WeakPolarHBondContact O-CB 3.5Å; L356-L360 PolarHBondContact O-N 3.29Å
357	D	71.1	Confident	83.9	Confident	116 Å²	116	34.1 Å²	34.1	62%	0.62	19%	0.185	S	C	*	.	H	α-helix	trans	-68.9	5.9	-175.8	-49.5	-31	0	0	0	114.8	N355	N355-D357 PolarHBondContact OD1-N 2.87Å
358	I	70.9	Confident	84.6	Confident	46 Å²	46	30.3 Å²	30.3	24%	0.236	16%	0.162	C	C	.	.	H	α-helix	trans	-133.1	-21.2	-176.7	-59.3	177.6	0	0	0	110.9	N350 L351 N355 L356	N350-I358 HydrophobicContact CB-CD1 3.51Å; N350-I358 HydrophobicContact CB-CG2 4.35Å; N350-I358 VanDerWaalsContact CG-CD1 3.49Å; N350-I358 WeakPolarHBondContact ND2-CD1 3.17Å; L351-I358 HydrophobicContact CD2-CG2 4.3Å; N355-I358 HydrophobicContact CB-CB 4.47Å; N355-I358 HydrophobicContact CB-CD1 4.36Å; N355-I358 PolarHBondContact O-N 2.59Å; L356-I358 PolarHBondContact O-N 3.12Å
359	C	72.5	Confident	85.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-102.6	-14.5	171.6	-55.6	0	0	0	0	113.2	R209 L257 N355 L356	R209-C359 HydrophobicContact CB-CB 4.14Å; L257-C359 HydrophobicContact CD2-CB 3.74Å; N355-C359 WeakPolarHBondContact O-CB 3.43Å; N355-C359 PolarHBondContact O-N 2.96Å; N355-C359 PolarHBondContact O-SG 2.94Å; L356-C359 PolarHBondContact O-N 3.43Å; L356-C359 VanDerWaalsContact O-N 3.13Å
360	L	79.3	Confident	85.7	Confident	32 Å²	32	26.6 Å²	26.6	17%	0.168	14%	0.142	C	C	.	.			trans	-68.3	167	168.8	-176.2	58.9	0	0	0	109.9	L257 M259 E278 L356	L257-L360 CarbonylContact O-C 3.51Å; L257-L360 VanDerWaalsContact O-CA 3.24Å; L257-L360 WeakPolarHBondContact O-CA 3.38Å; L257-L360 WeakPolarHBondContact O-CD1 3.34Å; M259-L360 HydrophobicContact CB-CD1 4.42Å; M259-L360 HydrophobicContact CE-CD2 4.35Å; M259-L360 HydrophobicContact CE-CG 4.19Å; M259-L360 HydrophobicContact CG-CD1 3.76Å; M259-L360 HydrophobicContact CG-CD2 4.17Å; M259-L360 HydrophobicContact CG-CG 3.76Å; E278-L360 VanDerWaalsContact CB-O 3.27Å; E278-L360 WeakPolarHBondContact CB-O 2.97Å; E278-L360 WeakPolarHBondContact CG-O 3.42Å; E278-L360 WeakPolarHBondContact OE1-CB 3.44Å; E278-L360 VanDerWaalsContact OE1-O 3.13Å; L356-L360 HydrophobicContact CD1-CB 4.13Å; L356-L360 HydrophobicContact CG-CB 4.22Å; L356-L360 WeakPolarHBondContact O-CA 3.41Å; L356-L360 WeakPolarHBondContact O-CB 3.5Å; L356-L360 PolarHBondContact O-N 3.29Å
361	S	80.9	Confident	86.2	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.			trans	-165.1	138.3	-144.9	-97.1	0	0	0	0	116.7	L257 M259 S276 L277 E278	L257-S361 WeakPolarHBondContact O-CB 3.4Å; L257-S361 PolarHBondContact O-N 3.48Å; M259-S361 WeakPolarHBondContact CB-O 3.41Å; M259-S361 WeakPolarHBondContact CG-O 3.46Å; M259-S361 PolarHBondContact N-O 2.87Å; M259-S361 VanDerWaalsContact SD-O 3.38Å; S276-S361 CarbonylContact C-O 3.35Å; S276-S361 WeakPolarHBondContact CB-O 3.4Å; S276-S361 CarbonylContact O-C 3.53Å; S276-S361 VanDerWaalsContact O-CA 3.22Å; S276-S361 WeakPolarHBondContact O-CA 3.31Å; S276-S361 WeakPolarHBondContact O-CB 3.4Å; S276-S361 PolarHBondContact OG-O 2.86Å; L277-S361 VanDerWaalsContact CA-OG 3.31Å; L277-S361 WeakPolarHBondContact CA-OG 3.34Å; L277-S361 WeakPolarHBondContact CB-OG 3.48Å; L277-S361 WeakPolarHBondContact CD1-OG 3.33Å; L277-S361 WeakPolarHBondContact CG-OG 3.14Å; E278-S361 VanDerWaalsContact CG-CA 3.48Å; E278-S361 PolarHBondContact N-OG 2.86Å; E278-S361 PolarHBondContact OE1-N 3.21Å
362	T	87	Confident	86.7	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.135	C	C	.	.			trans	-92.9	-46.8	174.1	-166.5	0	0	0	0	125.5	S276 L277 E278 A364 Q393 C397	S276-T362 WeakPolarHBondContact CA-O 3.29Å; S276-T362 WeakPolarHBondContact CB-O 3.41Å; S276-T362 PolarHBondContact O-N 3.43Å; L277-T362 VanDerWaalsContact C-CA 3.41Å; L277-T362 VanDerWaalsContact N-CA 3.33Å; L277-T362 CarbonylContact O-C 3.54Å; L277-T362 VanDerWaalsContact O-C 3.3Å; L277-T362 VanDerWaalsContact O-CA 3.29Å; L277-T362 WeakPolarHBondContact O-CA 3.38Å; L277-T362 WeakPolarHBondContact O-CG2 3.27Å; L277-T362 PolarHBondContact O-N 2.83Å; E278-T362 VanDerWaalsContact CA-N 3.34Å; T362-A364 PolarHBondContact O-N 3.06Å; T362-Q393 WeakPolarHBondContact O-CB 3.3Å; T362-Q393 WeakPolarHBondContact O-CG 3.32Å; T362-C397 WeakPolarHBondContact CB-SG 3.42Å; T362-C397 PolarHBondContact OG1-SG 3.43Å
363	S	90.9	Very high	87	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.			trans	47.6	14.7	170.8	-42.4	0	0	0	0	119.1	Y216 V275 S276 L277 Y365 S367	Y216-S363 WeakPolarHBondContact CE2-OG 3.41Å; Y216-S363 WeakPolarHBondContact OH-CA 3.47Å; Y216-S363 VanDerWaalsContact OH-CB 3.31Å; Y216-S363 WeakPolarHBondContact OH-CB 3.27Å; Y216-S363 PolarHBondContact OH-OG 3.22Å; V275-S363 WeakPolarHBondContact O-CB 3.35Å; V275-S363 PolarHBondContact O-OG 3.07Å; S276-S363 WeakPolarHBondContact CA-OG 3.34Å; L277-S363 VanDerWaalsContact C-N 3.34Å; L277-S363 VanDerWaalsContact CA-N 3.31Å; L277-S363 PolarHBondContact N-OG 3.43Å; L277-S363 PolarHBondContact O-N 2.99Å; S363-Y365 PolarHBondContact O-N 3.41Å; S363-Y365 VanDerWaalsContact O-N 3.08Å; S363-S367 WeakPolarHBondContact O-CB 3.27Å; S363-S367 PolarHBondContact O-N 3.33Å; S363-S367 VanDerWaalsContact O-N 3.16Å; S363-S367 PolarHBondContact O-OG 3.44Å
364	A	92	Very high	87.2	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-44.2	-31.5	143.1	0	0	0	0	0	110.7	T362 A368 A390 Q393 L394 V408 V412	T362-A364 PolarHBondContact O-N 3.06Å; A364-A368 WeakPolarHBondContact O-CB 3.29Å; A364-A368 PolarHBondContact O-N 2.98Å; A364-A368 VanDerWaalsContact O-N 3.08Å; A364-A390 WeakPolarHBondContact CB-O 3.22Å; A364-A390 WeakPolarHBondContact O-CB 3.31Å; A364-Q393 HydrophobicContact CB-CB 4.36Å; A364-L394 HydrophobicContact CB-CD1 4.46Å; A364-L394 HydrophobicContact CB-CD2 3.37Å; A364-L394 HydrophobicContact CB-CG 3.57Å; A364-V408 HydrophobicContact CB-CG1 3.37Å; A364-V412 HydrophobicContact CB-CG2 3.8Å; A364-V412 WeakPolarHBondContact O-CG2 3.21Å
365	Y	93	Very high	87.7	Confident	18 Å²	18	19 Å²	19	7%	0.071	10%	0.098	C	C	.	.	H	α-helix	trans	-70.5	-63.6	174.7	-154.4	-90.9	0	0	0	115.9	C220 R224 S363 S367 A368 Q369 H407 V408 E411	C220-Y365 HydrophobicContact CB-CD1 3.88Å; C220-Y365 HydrophobicContact CB-CE1 4.06Å; C220-Y365 VanDerWaalsContact SG-CD1 3.56Å; R224-Y365 VanDerWaalsContact CD-OH 3.29Å; R224-Y365 WeakPolarHBondContact CD-OH 3.31Å; R224-Y365 WeakPolarHBondContact CG-OH 3.42Å; S363-Y365 PolarHBondContact O-N 3.41Å; S363-Y365 VanDerWaalsContact O-N 3.08Å; Y365-S367 VanDerWaalsContact C-N 3.28Å; Y365-S367 PolarHBondContact O-N 2.91Å; Y365-A368 PolarHBondContact O-N 3.39Å; Y365-Q369 HydrophobicContact CD1-CG 3.87Å; Y365-Q369 HydrophobicContact CE1-CG 3.57Å; Y365-Q369 WeakPolarHBondContact O-CG 3.41Å; Y365-Q369 PolarHBondContact O-N 3.49Å; Y365-H407 AromaticContact CE2-CE1 3.41Å; Y365-H407 VanDerWaalsContact CE2-CE1 3.41Å; Y365-H407 WeakPolarHBondContact CE2-CE1 3.42Å; Y365-H407 AromaticContact CE2-ND1 3.75Å; Y365-H407 AromaticContact CZ-CE1 3.92Å; Y365-V408 HydrophobicContact CD2-CB 4.38Å; Y365-V408 HydrophobicContact CD2-CG1 4.32Å; Y365-V408 HydrophobicContact CD2-CG2 3.92Å; Y365-V408 HydrophobicContact CG-CG2 4.47Å; Y365-E411 HydrophobicContact CD2-CG 4.29Å; Y365-E411 HydrophobicContact CE2-CB 4.39Å; Y365-E411 HydrophobicContact CE2-CG 3.71Å
366	M	96	Very high	88.2	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.1	-35.6	-175.6	-175.4	169	-71.1	0	0	111.8	Y216 M219 C220 L223 A245 L249 Q369 L370	Y216-M366 HydrophobicContact CD1-CE 4.18Å; Y216-M366 HydrophobicContact CD2-CE 3.42Å; Y216-M366 VanDerWaalsContact CD2-CE 3.42Å; Y216-M366 HydrophobicContact CD2-SD 3.98Å; Y216-M366 HydrophobicContact CE1-CE 4.09Å; Y216-M366 HydrophobicContact CE2-CB 3.73Å; Y216-M366 HydrophobicContact CE2-CE 3.34Å; Y216-M366 HydrophobicContact CE2-CG 4.27Å; Y216-M366 HydrophobicContact CE2-SD 3.56Å; Y216-M366 VanDerWaalsContact CE2-SD 3.56Å; Y216-M366 HydrophobicContact CG-CE 3.86Å; Y216-M366 WeakPolarHBondContact OH-CB 3.47Å; Y216-M366 PolarHBondContact OH-N 3.32Å; M219-M366 HydrophobicContact CB-CE 3.74Å; M219-M366 HydrophobicContact CG-CE 3.41Å; M219-M366 VanDerWaalsContact CG-CE 3.41Å; C220-M366 VanDerWaalsContact SG-CE 3.56Å; L223-M366 HydrophobicContact CD1-CE 3.87Å; L223-M366 HydrophobicContact CD1-CG 3.65Å; L223-M366 HydrophobicContact CD1-SD 4.16Å; A245-M366 HydrophobicContact CB-CE 4.4Å; A245-M366 HydrophobicContact CB-SD 3.77Å; L249-M366 HydrophobicContact CD1-CG 3.91Å; L249-M366 HydrophobicContact CD1-SD 3.45Å; L249-M366 WeakPolarHBondContact CD1-SD 3.44Å; L249-M366 HydrophobicContact CD2-SD 3.89Å; L249-M366 HydrophobicContact CG-SD 3.55Å; L249-M366 VanDerWaalsContact CG-SD 3.55Å; M366-Q369 PolarHBondContact O-N 3.45Å; M366-L370 HydrophobicContact CG-CD1 4.06Å; M366-L370 HydrophobicContact CG-CG 4.33Å; M366-L370 WeakPolarHBondContact O-CB 3.47Å; M366-L370 WeakPolarHBondContact O-CG 3.31Å; M366-L370 PolarHBondContact O-N 3.3Å
367	S	95.8	Very high	88.8	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.2	-36.9	172.4	-62.9	0	0	0	0	111.9	S363 Y365 A371 F386	S363-S367 WeakPolarHBondContact O-CB 3.27Å; S363-S367 PolarHBondContact O-N 3.33Å; S363-S367 VanDerWaalsContact O-N 3.16Å; S363-S367 PolarHBondContact O-OG 3.44Å; Y365-S367 VanDerWaalsContact C-N 3.28Å; Y365-S367 PolarHBondContact O-N 2.91Å; S367-A371 WeakPolarHBondContact O-CB 3.49Å; S367-A371 PolarHBondContact O-N 2.71Å; S367-F386 WeakPolarHBondContact O-CB 3.09Å
368	A	96.4	Very high	89.5	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.8	-34.1	171.5	0	0	0	0	0	113.5	A364 Y365 T372 E411 V412 I415	A364-A368 WeakPolarHBondContact O-CB 3.29Å; A364-A368 PolarHBondContact O-N 2.98Å; A364-A368 VanDerWaalsContact O-N 3.08Å; Y365-A368 PolarHBondContact O-N 3.39Å; A368-T372 WeakPolarHBondContact O-CB 3.31Å; A368-T372 PolarHBondContact O-N 3.13Å; A368-T372 PolarHBondContact O-OG1 3.2Å; A368-E411 HydrophobicContact CB-CB 4.42Å; A368-V412 HydrophobicContact CB-CG2 4.19Å; A368-I415 HydrophobicContact CB-CG2 4.08Å
369	Q	97.1	Very high	90.2	Very high	5 Å²	5	11.4 Å²	11.4	2%	0.023	6%	0.058	C	C	.	.	H	α-helix	trans	-73.2	-40.3	175.7	-62.4	-54.2	-38.1	0	0	112	L223 N227 Y365 M366 A371 T372 Y373 E411	L223-Q369 HydrophobicContact CB-CB 3.91Å; L223-Q369 HydrophobicContact CB-CG 4.44Å; L223-Q369 HydrophobicContact CD1-CB 4.49Å; N227-Q369 PolarHBondContact ND2-O 3.49Å; N227-Q369 PolarHBondContact ND2-OE1 2.88Å; Y365-Q369 HydrophobicContact CD1-CG 3.87Å; Y365-Q369 HydrophobicContact CE1-CG 3.57Å; Y365-Q369 WeakPolarHBondContact O-CG 3.41Å; Y365-Q369 PolarHBondContact O-N 3.49Å; M366-Q369 PolarHBondContact O-N 3.45Å; Q369-A371 VanDerWaalsContact C-N 3.35Å; Q369-T372 PolarHBondContact O-N 2.94Å; Q369-Y373 PolarHBondContact O-N 3.45Å; Q369-E411 PolarHBondContact NE2-OE2 3.18Å; Q369-E411 VanDerWaalsContact NE2-OE2 3.09Å
370	L	96.9	Very high	90.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64	-39.9	170.9	-69.8	169.9	0	0	0	111.3	F241 A245 L249 M366 T372 Y373 H374 F386	F241-L370 HydrophobicContact CB-CD2 4.36Å; F241-L370 HydrophobicContact CD1-CD2 4.3Å; F241-L370 WeakPolarHBondContact O-CD2 3.05Å; A245-L370 HydrophobicContact CB-CD2 4.35Å; L249-L370 HydrophobicContact CD1-CD1 3.96Å; M366-L370 HydrophobicContact CG-CD1 4.06Å; M366-L370 HydrophobicContact CG-CG 4.33Å; M366-L370 WeakPolarHBondContact O-CB 3.47Å; M366-L370 WeakPolarHBondContact O-CG 3.31Å; M366-L370 PolarHBondContact O-N 3.3Å; L370-T372 VanDerWaalsContact C-N 3.32Å; L370-T372 PolarHBondContact O-N 3.42Å; L370-Y373 PolarHBondContact O-N 3.03Å; L370-H374 PolarHBondContact O-CD2 3.46Å; L370-H374 PolarHBondContact O-N 2.89Å; L370-F386 HydrophobicContact CB-CD1 3.9Å; L370-F386 HydrophobicContact CB-CD2 4.16Å; L370-F386 HydrophobicContact CB-CE1 3.98Å; L370-F386 HydrophobicContact CB-CE2 4.24Å; L370-F386 HydrophobicContact CB-CG 4Å; L370-F386 HydrophobicContact CB-CZ 4.17Å; L370-F386 HydrophobicContact CD1-CD1 4.13Å; L370-F386 HydrophobicContact CD1-CE1 3.58Å; L370-F386 HydrophobicContact CD1-CZ 4.01Å; L370-F386 HydrophobicContact CG-CE1 4.41Å
371	A	95.9	Very high	91	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.9	-40.7	172.1	0	0	0	0	0	112.2	S367 Q369 H374 Y375 A383 F386 I415	S367-A371 WeakPolarHBondContact O-CB 3.49Å; S367-A371 PolarHBondContact O-N 2.71Å; Q369-A371 VanDerWaalsContact C-N 3.35Å; A371-H374 PolarHBondContact O-N 3.46Å; A371-Y375 VanDerWaalsContact O-CB 3.27Å; A371-Y375 WeakPolarHBondContact O-CB 3.01Å; A371-Y375 PolarHBondContact O-N 2.98Å; A371-A383 WeakPolarHBondContact CB-O 3.4Å; A371-A383 WeakPolarHBondContact O-CB 3.44Å; A371-F386 HydrophobicContact CB-CB 3.63Å; A371-I415 HydrophobicContact CB-CD1 4.48Å; A371-I415 HydrophobicContact CB-CG1 3.65Å; A371-I415 HydrophobicContact CB-CG2 4.44Å
372	T	95.7	Very high	91.4	Very high	17 Å²	17	15.6 Å²	15.6	10%	0.104	8%	0.078	C	C	.	.	H	α-helix	trans	-66.3	-41	177.3	-61.9	0	0	0	0	111.8	N227 A368 Q369 L370 Y375 S376	N227-T372 HydrophobicContact CB-CG2 4.16Å; A368-T372 WeakPolarHBondContact O-CB 3.31Å; A368-T372 PolarHBondContact O-N 3.13Å; A368-T372 PolarHBondContact O-OG1 3.2Å; Q369-T372 PolarHBondContact O-N 2.94Å; L370-T372 VanDerWaalsContact C-N 3.32Å; L370-T372 PolarHBondContact O-N 3.42Å; T372-Y375 PolarHBondContact O-N 2.95Å; T372-S376 PolarHBondContact O-N 2.9Å; T372-S376 PolarHBondContact O-OG 2.85Å
373	Y	94.5	Very high	91.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.5	-55.1	171.8	171	-112.5	0	0	0	111.7	N227 Y232 F241 H242 Q369 L370 Y375 S376 M377	N227-Y373 PolarHBondContact OD1-N 3.26Å; Y232-Y373 AromaticContact CD1-CD2 3.71Å; Y232-Y373 HydrophobicContact CD1-CD2 3.71Å; Y232-Y373 AromaticContact CD1-CE2 3.69Å; Y232-Y373 HydrophobicContact CD1-CE2 3.69Å; Y232-Y373 AromaticContact CE1-CD2 3.59Å; Y232-Y373 HydrophobicContact CE1-CD2 3.59Å; Y232-Y373 HydrophobicContact CE1-CE2 4.08Å; Y232-Y373 HydrophobicContact CG-CD2 4.47Å; Y232-Y373 HydrophobicContact CG-CE2 4.19Å; F241-Y373 HydrophobicContact CB-CD1 3.5Å; F241-Y373 HydrophobicContact CB-CD2 4.31Å; F241-Y373 HydrophobicContact CB-CE1 3.5Å; F241-Y373 VanDerWaalsContact CB-CE1 3.5Å; F241-Y373 HydrophobicContact CB-CE2 4.32Å; F241-Y373 HydrophobicContact CB-CG 3.92Å; F241-Y373 AromaticContact CD1-CD1 3.84Å; F241-Y373 HydrophobicContact CD1-CD1 3.84Å; F241-Y373 AromaticContact CD1-CD2 3.78Å; F241-Y373 HydrophobicContact CD1-CD2 3.78Å; F241-Y373 AromaticContact CD1-CG 3.38Å; F241-Y373 HydrophobicContact CD1-CG 3.38Å; F241-Y373 AromaticContact CD2-CD2 3.79Å; F241-Y373 HydrophobicContact CD2-CD2 3.79Å; F241-Y373 AromaticContact CD2-CE2 3.8Å; F241-Y373 HydrophobicContact CD2-CE2 3.8Å; F241-Y373 HydrophobicContact CD2-CG 4.15Å; F241-Y373 AromaticContact CE1-CD2 3.94Å; F241-Y373 HydrophobicContact CE1-CD2 3.94Å; F241-Y373 AromaticContact CE1-CG 3.84Å; F241-Y373 HydrophobicContact CE1-CG 3.84Å; F241-Y373 AromaticContact CE2-CD2 3.93Å; F241-Y373 HydrophobicContact CE2-CD2 3.93Å; F241-Y373 HydrophobicContact CE2-CE2 4.17Å; F241-Y373 AromaticContact CG-CD1 3.73Å; F241-Y373 HydrophobicContact CG-CD1 3.73Å; F241-Y373 AromaticContact CG-CD2 3.7Å; F241-Y373 HydrophobicContact CG-CD2 3.7Å; F241-Y373 AromaticContact CG-CE1 3.98Å; F241-Y373 HydrophobicContact CG-CE1 3.98Å; F241-Y373 AromaticContact CG-CE2 3.98Å; F241-Y373 HydrophobicContact CG-CE2 3.98Å; F241-Y373 AromaticContact CG-CG 3.56Å; F241-Y373 HydrophobicContact CG-CG 3.56Å; F241-Y373 AromaticContact CZ-CD2 4Å; F241-Y373 HydrophobicContact CZ-CD2 4Å; F241-Y373 HydrophobicContact CZ-CG 4.37Å; H242-Y373 PolarHBondContact CD2-OH 2.87Å; H242-Y373 AromaticContact CE1-CE1 3.74Å; H242-Y373 AromaticContact NE2-CE1 3.61Å; H242-Y373 AromaticContact NE2-CZ 3.64Å; H242-Y373 PolarHBondContact NE2-OH 3.22Å; Q369-Y373 PolarHBondContact O-N 3.45Å; L370-Y373 PolarHBondContact O-N 3.03Å; Y373-Y375 PolarHBondContact O-N 3.14Å; Y373-S376 WeakPolarHBondContact O-CB 3.11Å; Y373-S376 PolarHBondContact O-N 2.85Å; Y373-M377 HydrophobicContact CD2-CG 3.89Å; Y373-M377 HydrophobicContact CE1-CG 4.26Å; Y373-M377 HydrophobicContact CE2-CG 3.46Å; Y373-M377 VanDerWaalsContact CE2-CG 3.46Å; Y373-M377 HydrophobicContact CE2-SD 3.98Å; Y373-M377 HydrophobicContact CG-CG 4.46Å; Y373-M377 WeakPolarHBondContact O-CG 3.08Å; Y373-M377 PolarHBondContact O-N 3.26Å
374	H	91.3	Very high	91.4	Very high	14 Å²	14	16.9 Å²	16.9	7%	0.065	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-29.2	-179.9	-78	-70.8	0	0	0	112.5	L370 A371 C378 H379 I382 A383 F386	L370-H374 PolarHBondContact O-CD2 3.46Å; L370-H374 PolarHBondContact O-N 2.89Å; A371-H374 PolarHBondContact O-N 3.46Å; H374-C378 PolarHBondContact O-N 2.97Å; H374-H379 HydrophobicContact CB-CB 4.06Å; H374-H379 AromaticContact ND1-ND1 3.86Å; H374-H379 CarbonylContact O-C 3.55Å; H374-H379 WeakPolarHBondContact O-CA 3.24Å; H374-H379 WeakPolarHBondContact O-CB 3.31Å; H374-H379 PolarHBondContact O-N 2.94Å; H374-I382 HydrophobicContact CB-CB 4.25Å; H374-I382 HydrophobicContact CB-CG2 4.23Å; H374-A383 HydrophobicContact CB-CB 3.93Å; H374-F386 AromaticContact CD2-CD2 3.74Å; H374-F386 AromaticContact CD2-CE2 3.56Å; H374-F386 AromaticContact NE2-CE2 3.68Å
375	Y	91.5	Very high	91.3	Very high	22 Å²	22	19.9 Å²	19.9	9%	0.086	10%	0.097	C	C	.	.	H	α-helix	trans	-66.5	-48.7	171.4	177.6	-87.5	0	0	0	111.6	A371 T372 Y373 M377 C378 Y380 I415 K418 V419 I422	A371-Y375 VanDerWaalsContact O-CB 3.27Å; A371-Y375 WeakPolarHBondContact O-CB 3.01Å; A371-Y375 PolarHBondContact O-N 2.98Å; T372-Y375 PolarHBondContact O-N 2.95Å; Y373-Y375 PolarHBondContact O-N 3.14Å; Y375-M377 VanDerWaalsContact C-N 3.31Å; Y375-M377 PolarHBondContact O-N 2.74Å; Y375-C378 PolarHBondContact O-N 3.45Å; Y375-Y380 HydrophobicContact CD2-CD1 4.05Å; Y375-Y380 HydrophobicContact CD2-CE1 4.16Å; Y375-Y380 HydrophobicContact CE2-CD1 4.48Å; Y375-Y380 HydrophobicContact CE2-CE1 4.33Å; Y375-Y380 WeakPolarHBondContact O-CE1 3.1Å; Y375-I415 HydrophobicContact CD2-CD1 4.43Å; Y375-I415 HydrophobicContact CG-CD1 4.14Å; Y375-K418 HydrophobicContact CD1-CD 4.23Å; Y375-K418 HydrophobicContact CD2-CB 4.08Å; Y375-K418 HydrophobicContact CE1-CB 4.13Å; Y375-K418 HydrophobicContact CE1-CD 4.07Å; Y375-K418 HydrophobicContact CE1-CG 4.27Å; Y375-K418 HydrophobicContact CE2-CB 3.66Å; Y375-K418 VanDerWaalsContact CE2-O 3.29Å; Y375-K418 WeakPolarHBondContact CE2-O 3.42Å; Y375-K418 HydrophobicContact CG-CB 4.48Å; Y375-K418 PolarHBondContact OH-O 2.91Å; Y375-V419 HydrophobicContact CD2-CG2 4.42Å; Y375-I422 HydrophobicContact CD2-CG1 4.38Å; Y375-I422 HydrophobicContact CE2-CB 3.95Å; Y375-I422 HydrophobicContact CE2-CD1 3.56Å; Y375-I422 HydrophobicContact CE2-CG1 3.65Å; Y375-I422 WeakPolarHBondContact OH-CD1 2.9Å
376	S	89.6	Confident	91.2	Very high	25 Å²	25	19.7 Å²	19.7	18%	0.175	10%	0.097	C	C	.	.	H	α-helix	trans	-59.6	-41	177.7	-58.2	0	0	0	0	112.1	Y232 T372 Y373 C378	Y232-S376 PolarHBondContact OH-OG 3.09Å; T372-S376 PolarHBondContact O-N 2.9Å; T372-S376 PolarHBondContact O-OG 2.85Å; Y373-S376 WeakPolarHBondContact O-CB 3.11Å; Y373-S376 PolarHBondContact O-N 2.85Å; S376-C378 PolarHBondContact O-N 3.31Å
377	M	87	Confident	91.1	Very high	11 Å²	11	19.7 Å²	19.7	5%	0.054	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	6.3	176.5	-58.6	-59.3	-77.2	0	0	113.8	Y232 Y373 Y375 H379 Y585 N589	Y232-M377 HydrophobicContact CD2-SD 4.04Å; Y232-M377 HydrophobicContact CG-SD 4.16Å; Y373-M377 HydrophobicContact CD2-CG 3.89Å; Y373-M377 HydrophobicContact CE1-CG 4.26Å; Y373-M377 HydrophobicContact CE2-CG 3.46Å; Y373-M377 VanDerWaalsContact CE2-CG 3.46Å; Y373-M377 HydrophobicContact CE2-SD 3.98Å; Y373-M377 HydrophobicContact CG-CG 4.46Å; Y373-M377 WeakPolarHBondContact O-CG 3.08Å; Y373-M377 PolarHBondContact O-N 3.26Å; Y375-M377 VanDerWaalsContact C-N 3.31Å; Y375-M377 PolarHBondContact O-N 2.74Å; M377-H379 VanDerWaalsContact C-N 3.25Å; M377-H379 WeakPolarHBondContact CB-ND1 3.22Å; M377-H379 PolarHBondContact O-N 3.21Å; M377-Y585 HydrophobicContact CE-CD1 4Å; M377-Y585 HydrophobicContact SD-CD1 3.63Å; M377-Y585 HydrophobicContact SD-CE1 3.64Å; M377-N589 PolarHBondContact O-ND2 3.32Å; M377-N589 VanDerWaalsContact O-ND2 3.17Å
378	C	85.7	Confident	90.9	Very high	12 Å²	12	20.4 Å²	20.4	8%	0.081	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	11.5	-177.3	-60.1	0	0	0	0	117	H374 Y375 S376 Y380 N589 I590 Q591	H374-C378 PolarHBondContact O-N 2.97Å; Y375-C378 PolarHBondContact O-N 3.45Å; S376-C378 PolarHBondContact O-N 3.31Å; C378-Y380 HydrophobicContact CB-CE1 4.33Å; C378-Y380 HydrophobicContact CB-CE2 4.01Å; C378-Y380 VanDerWaalsContact O-CD2 3.27Å; C378-Y380 WeakPolarHBondContact O-CD2 3.39Å; C378-Y380 WeakPolarHBondContact O-CE2 3.38Å; C378-Y380 PolarHBondContact O-N 3.48Å; C378-Y380 PolarHBondContact SG-OH 3.46Å; C378-N589 PolarHBondContact SG-OD1 3.27Å; C378-N589 VanDerWaalsContact SG-OD1 3.35Å; C378-I590 HydrophobicContact CB-CB 4.5Å; C378-I590 HydrophobicContact CB-CD1 3.9Å; C378-I590 HydrophobicContact CB-CG1 4.34Å; C378-Q591 PolarHBondContact SG-NE2 2.87Å; C378-Q591 VanDerWaalsContact SG-NE2 3.43Å
379	H	85.5	Confident	90.5	Very high	83 Å²	83	21.4 Å²	21.4	38%	0.384	11%	0.107	S	C	.	.			trans	-79.5	57.2	176.8	-61.8	124	0	0	0	112.2	H374 M377 Q381 I382 A383	H374-H379 HydrophobicContact CB-CB 4.06Å; H374-H379 AromaticContact ND1-ND1 3.86Å; H374-H379 CarbonylContact O-C 3.55Å; H374-H379 WeakPolarHBondContact O-CA 3.24Å; H374-H379 WeakPolarHBondContact O-CB 3.31Å; H374-H379 PolarHBondContact O-N 2.94Å; M377-H379 VanDerWaalsContact C-N 3.25Å; M377-H379 WeakPolarHBondContact CB-ND1 3.22Å; M377-H379 PolarHBondContact O-N 3.21Å; H379-Q381 PolarHBondContact O-N 2.67Å; H379-I382 HydrophobicContact CB-CB 4.36Å; H379-I382 HydrophobicContact CB-CD1 4.12Å; H379-I382 WeakPolarHBondContact O-CB 3.42Å; H379-I382 PolarHBondContact O-N 3.25Å; H379-A383 PolarHBondContact O-N 3.3Å
380	Y	85.4	Confident	90.3	Very high	5 Å²	5	21.2 Å²	21.2	2%	0.02	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-30.1	-163.3	-52.1	-57.7	0	0	0	116.2	Y375 C378 I382 A383 F384 I422 I590 A794	Y375-Y380 HydrophobicContact CD2-CD1 4.05Å; Y375-Y380 HydrophobicContact CD2-CE1 4.16Å; Y375-Y380 HydrophobicContact CE2-CD1 4.48Å; Y375-Y380 HydrophobicContact CE2-CE1 4.33Å; Y375-Y380 WeakPolarHBondContact O-CE1 3.1Å; C378-Y380 HydrophobicContact CB-CE1 4.33Å; C378-Y380 HydrophobicContact CB-CE2 4.01Å; C378-Y380 VanDerWaalsContact O-CD2 3.27Å; C378-Y380 WeakPolarHBondContact O-CD2 3.39Å; C378-Y380 WeakPolarHBondContact O-CE2 3.38Å; C378-Y380 PolarHBondContact O-N 3.48Å; C378-Y380 PolarHBondContact SG-OH 3.46Å; Y380-I382 VanDerWaalsContact C-N 3.33Å; Y380-A383 PolarHBondContact O-N 3.49Å; Y380-F384 WeakPolarHBondContact O-CB 3.45Å; Y380-F384 PolarHBondContact O-N 3.19Å; Y380-I422 HydrophobicContact CD1-CD1 4.32Å; Y380-I422 HydrophobicContact CD1-CG1 3.55Å; Y380-I422 HydrophobicContact CD1-CG2 4.36Å; Y380-I422 HydrophobicContact CD2-CG1 4.27Å; Y380-I422 HydrophobicContact CE1-CD1 3.63Å; Y380-I422 HydrophobicContact CE1-CG1 3.35Å; Y380-I422 HydrophobicContact CE2-CG1 4.11Å; Y380-I422 HydrophobicContact CG-CG1 3.99Å; Y380-I422 HydrophobicContact CG-CG2 4.3Å; Y380-I590 HydrophobicContact CD2-CD1 4.44Å; Y380-I590 HydrophobicContact CE2-CD1 3.53Å; Y380-A794 HydrophobicContact CD2-CB 3.94Å; Y380-A794 HydrophobicContact CE2-CB 3.22Å
381	Q	83.1	Confident	90	Very high	43 Å²	43	21.2 Å²	21.2	20%	0.201	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-39.6	173.4	-70.1	-170.6	12	0	0	111.4	H379 H385 F759 Y766	H379-Q381 PolarHBondContact O-N 2.67Å; Q381-H385 PolarHBondContact O-N 3.1Å; Q381-F759 HydrophobicContact CB-CE1 4.38Å; Q381-F759 HydrophobicContact CG-CD1 3.95Å; Q381-F759 HydrophobicContact CG-CE1 3.7Å; Q381-Y766 PolarHBondContact OE1-OH 2.81Å
382	I	88.3	Confident	89.7	Confident	71 Å²	71	23.3 Å²	23.3	36%	0.364	12%	0.115	S	C	.	.	H	α-helix	trans	-72.1	-41.7	178	-55	171.3	0	0	0	109.8	H374 H379 Y380 F384 H385 F386	H374-I382 HydrophobicContact CB-CB 4.25Å; H374-I382 HydrophobicContact CB-CG2 4.23Å; H379-I382 HydrophobicContact CB-CB 4.36Å; H379-I382 HydrophobicContact CB-CD1 4.12Å; H379-I382 WeakPolarHBondContact O-CB 3.42Å; H379-I382 PolarHBondContact O-N 3.25Å; Y380-I382 VanDerWaalsContact C-N 3.33Å; I382-F384 PolarHBondContact O-N 3.31Å; I382-H385 PolarHBondContact O-N 3.34Å; I382-F386 HydrophobicContact CG2-CD2 3.68Å; I382-F386 HydrophobicContact CG2-CE2 3.56Å; I382-F386 WeakPolarHBondContact O-CD2 2.92Å; I382-F386 PolarHBondContact O-N 3.46Å
383	A	89.1	Confident	89.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.4	-45.4	173.7	0	0	0	0	0	112.6	A371 H374 H379 Y380 T387	A371-A383 WeakPolarHBondContact CB-O 3.4Å; A371-A383 WeakPolarHBondContact O-CB 3.44Å; H374-A383 HydrophobicContact CB-CB 3.93Å; H379-A383 PolarHBondContact O-N 3.3Å; Y380-A383 PolarHBondContact O-N 3.49Å; A383-T387 WeakPolarHBondContact O-CB 3.33Å; A383-T387 PolarHBondContact O-N 3.39Å; A383-T387 PolarHBondContact O-OG1 2.89Å
384	F	90.2	Very high	89.1	Confident	28 Å²	28	22.8 Å²	22.8	12%	0.123	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-46.8	173.2	164.9	-102.7	0	0	0	111.7	Y380 I382 T387 V388 V419 F755 F759	Y380-F384 WeakPolarHBondContact O-CB 3.45Å; Y380-F384 PolarHBondContact O-N 3.19Å; I382-F384 PolarHBondContact O-N 3.31Å; F384-T387 WeakPolarHBondContact O-CB 3.39Å; F384-T387 PolarHBondContact O-N 3.41Å; F384-T387 VanDerWaalsContact O-N 3.17Å; F384-V388 HydrophobicContact CD2-CG2 4.32Å; F384-V388 HydrophobicContact CE1-CG2 4.28Å; F384-V388 HydrophobicContact CE2-CG2 3.84Å; F384-V388 HydrophobicContact CZ-CG2 3.83Å; F384-V388 PolarHBondContact O-N 3.35Å; F384-V419 HydrophobicContact CB-CG1 4.46Å; F384-V419 HydrophobicContact CD2-CG1 4.34Å; F384-F755 AromaticContact CD2-CD1 3.88Å; F384-F755 HydrophobicContact CD2-CD1 3.88Å; F384-F755 AromaticContact CD2-CE1 3.37Å; F384-F755 HydrophobicContact CD2-CE1 3.37Å; F384-F755 AromaticContact CD2-CZ 3.93Å; F384-F755 HydrophobicContact CD2-CZ 3.93Å; F384-F755 AromaticContact CE2-CD1 3.54Å; F384-F755 HydrophobicContact CE2-CD1 3.54Å; F384-F755 AromaticContact CE2-CE1 3.56Å; F384-F755 HydrophobicContact CE2-CE1 3.56Å; F384-F755 HydrophobicContact CE2-CG 4.39Å; F384-F755 HydrophobicContact CE2-CZ 4.41Å; F384-F755 VanDerWaalsContact CE2-O 3.24Å; F384-F755 WeakPolarHBondContact CE2-O 3.45Å; F384-F759 HydrophobicContact CB-CD2 3.94Å; F384-F759 HydrophobicContact CB-CE2 3.47Å; F384-F759 VanDerWaalsContact CB-CE2 3.47Å; F384-F759 HydrophobicContact CB-CZ 3.78Å; F384-F759 HydrophobicContact CD1-CB 4.07Å; F384-F759 HydrophobicContact CD1-CD1 4.42Å; F384-F759 AromaticContact CD1-CD2 3.58Å; F384-F759 HydrophobicContact CD1-CD2 3.58Å; F384-F759 HydrophobicContact CD1-CE2 4.05Å; F384-F759 AromaticContact CD1-CG 3.79Å; F384-F759 HydrophobicContact CD1-CG 3.79Å; F384-F759 AromaticContact CD2-CD2 3.38Å; F384-F759 HydrophobicContact CD2-CD2 3.38Å; F384-F759 AromaticContact CD2-CE2 3.53Å; F384-F759 HydrophobicContact CD2-CE2 3.53Å; F384-F759 HydrophobicContact CD2-CG 4.38Å; F384-F759 HydrophobicContact CE1-CB 3.71Å; F384-F759 AromaticContact CE1-CD2 3.84Å; F384-F759 HydrophobicContact CE1-CD2 3.84Å; F384-F759 AromaticContact CE1-CG 3.94Å; F384-F759 HydrophobicContact CE1-CG 3.94Å; F384-F759 AromaticContact CE2-CD2 3.66Å; F384-F759 HydrophobicContact CE2-CD2 3.66Å; F384-F759 HydrophobicContact CE2-CE2 4.26Å; F384-F759 AromaticContact CG-CD2 3.32Å; F384-F759 HydrophobicContact CG-CD2 3.32Å; F384-F759 AromaticContact CG-CE2 3.4Å; F384-F759 HydrophobicContact CG-CE2 3.4Å; F384-F759 HydrophobicContact CG-CG 4.01Å; F384-F759 HydrophobicContact CG-CZ 4.12Å; F384-F759 HydrophobicContact CZ-CB 4.01Å; F384-F759 AromaticContact CZ-CD2 3.86Å; F384-F759 HydrophobicContact CZ-CD2 3.86Å; F384-F759 HydrophobicContact CZ-CG 4.29Å
385	H	89.3	Confident	88.9	Confident	64 Å²	64	23.1 Å²	23.1	30%	0.296	11%	0.113	S	C	.	.	H	α-helix	trans	-59.1	-51	178.3	-171.9	95.8	0	0	0	111.7	L273 Q381 I382 T387 V388 L389	L273-H385 WeakPolarHBondContact CB-NE2 3.11Å; L273-H385 WeakPolarHBondContact CD1-NE2 3.26Å; Q381-H385 PolarHBondContact O-N 3.1Å; I382-H385 PolarHBondContact O-N 3.34Å; H385-T387 PolarHBondContact O-N 3.36Å; H385-V388 WeakPolarHBondContact O-CB 3.42Å; H385-V388 PolarHBondContact O-N 3.06Å; H385-V388 VanDerWaalsContact O-N 3.07Å; H385-L389 PolarHBondContact O-N 3.37Å
386	F	92	Very high	88.7	Confident	14 Å²	14	22.5 Å²	22.5	6%	0.061	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-32.5	177.1	-81.3	-69.5	0	0	0	112.7	L273 P274 S367 L370 A371 H374 I382 L389 A390	L273-F386 HydrophobicContact CD2-CZ 4.45Å; P274-F386 HydrophobicContact CG-CD1 4.23Å; P274-F386 HydrophobicContact CG-CE1 3.66Å; S367-F386 WeakPolarHBondContact O-CB 3.09Å; L370-F386 HydrophobicContact CB-CD1 3.9Å; L370-F386 HydrophobicContact CB-CD2 4.16Å; L370-F386 HydrophobicContact CB-CE1 3.98Å; L370-F386 HydrophobicContact CB-CE2 4.24Å; L370-F386 HydrophobicContact CB-CG 4Å; L370-F386 HydrophobicContact CB-CZ 4.17Å; L370-F386 HydrophobicContact CD1-CD1 4.13Å; L370-F386 HydrophobicContact CD1-CE1 3.58Å; L370-F386 HydrophobicContact CD1-CZ 4.01Å; L370-F386 HydrophobicContact CG-CE1 4.41Å; A371-F386 HydrophobicContact CB-CB 3.63Å; H374-F386 AromaticContact CD2-CD2 3.74Å; H374-F386 AromaticContact CD2-CE2 3.56Å; H374-F386 AromaticContact NE2-CE2 3.68Å; I382-F386 HydrophobicContact CG2-CD2 3.68Å; I382-F386 HydrophobicContact CG2-CE2 3.56Å; I382-F386 WeakPolarHBondContact O-CD2 2.92Å; I382-F386 PolarHBondContact O-N 3.46Å; F386-L389 HydrophobicContact CD1-CD1 3.89Å; F386-L389 HydrophobicContact CE1-CD1 4.37Å; F386-L389 PolarHBondContact O-N 3.34Å; F386-A390 WeakPolarHBondContact O-CB 3.24Å; F386-A390 PolarHBondContact O-N 2.76Å
387	T	93.4	Very high	88.4	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.5	-44.4	171.9	-55.2	0	0	0	0	111.5	A383 F384 H385 L389 A390 I391 I415 M416 F755	A383-T387 WeakPolarHBondContact O-CB 3.33Å; A383-T387 PolarHBondContact O-N 3.39Å; A383-T387 PolarHBondContact O-OG1 2.89Å; F384-T387 WeakPolarHBondContact O-CB 3.39Å; F384-T387 PolarHBondContact O-N 3.41Å; F384-T387 VanDerWaalsContact O-N 3.17Å; H385-T387 PolarHBondContact O-N 3.36Å; T387-L389 PolarHBondContact O-N 3.5Å; T387-A390 WeakPolarHBondContact O-CB 3.4Å; T387-A390 PolarHBondContact O-N 2.81Å; T387-I391 HydrophobicContact CG2-CD1 4.2Å; T387-I391 VanDerWaalsContact O-CG1 3.3Å; T387-I391 WeakPolarHBondContact O-CG1 3.38Å; T387-I391 PolarHBondContact O-N 2.99Å; T387-I415 HydrophobicContact CG2-CG2 4Å; T387-M416 HydrophobicContact CG2-CB 4.41Å; T387-M416 HydrophobicContact CG2-CG 3.48Å; T387-M416 VanDerWaalsContact CG2-CG 3.48Å; T387-F755 HydrophobicContact CG2-CE1 3.59Å; T387-F755 HydrophobicContact CG2-CZ 3.51Å
388	V	90.5	Very high	88.2	Confident	14 Å²	14	23.5 Å²	23.5	9%	0.085	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-44.8	175.5	169	0	0	0	0	111.4	F384 H385 A390 I391 E392 F755 K756	F384-V388 HydrophobicContact CD2-CG2 4.32Å; F384-V388 HydrophobicContact CE1-CG2 4.28Å; F384-V388 HydrophobicContact CE2-CG2 3.84Å; F384-V388 HydrophobicContact CZ-CG2 3.83Å; F384-V388 PolarHBondContact O-N 3.35Å; H385-V388 WeakPolarHBondContact O-CB 3.42Å; H385-V388 PolarHBondContact O-N 3.06Å; H385-V388 VanDerWaalsContact O-N 3.07Å; V388-A390 VanDerWaalsContact C-N 3.3Å; V388-A390 PolarHBondContact O-N 2.95Å; V388-I391 PolarHBondContact O-N 3.38Å; V388-E392 WeakPolarHBondContact O-CG 3.25Å; V388-E392 PolarHBondContact O-N 2.8Å; V388-F755 HydrophobicContact CG2-CD1 4.06Å; V388-F755 HydrophobicContact CG2-CE1 4.15Å; V388-K756 VanDerWaalsContact CG1-CE 3.46Å; V388-K756 HydrophobicContact CG2-CG 4.37Å
389	L	89.4	Confident	88.1	Confident	22 Å²	22	28.1 Å²	28.1	12%	0.115	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-44.4	174.4	-66	173	0	0	0	112	L273 P274 H385 F386 T387 E392 Q393	L273-L389 HydrophobicContact CB-CD1 4.03Å; L273-L389 HydrophobicContact CB-CD2 4.3Å; L273-L389 HydrophobicContact CD2-CD1 4.4Å; P274-L389 VanDerWaalsContact CD-CD1 3.42Å; P274-L389 HydrophobicContact CG-CD1 4.07Å; H385-L389 PolarHBondContact O-N 3.37Å; F386-L389 HydrophobicContact CD1-CD1 3.89Å; F386-L389 HydrophobicContact CE1-CD1 4.37Å; F386-L389 PolarHBondContact O-N 3.34Å; T387-L389 PolarHBondContact O-N 3.5Å; L389-E392 PolarHBondContact O-N 2.83Å; L389-E392 VanDerWaalsContact O-N 3.16Å; L389-Q393 WeakPolarHBondContact O-CG 3.31Å; L389-Q393 PolarHBondContact O-N 3.38Å
390	A	91.9	Very high	88	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-44.1	-178.3	0	0	0	0	0	111.7	A364 F386 T387 V388 E392 Q393 L394 V412	A364-A390 WeakPolarHBondContact CB-O 3.22Å; A364-A390 WeakPolarHBondContact O-CB 3.31Å; F386-A390 WeakPolarHBondContact O-CB 3.24Å; F386-A390 PolarHBondContact O-N 2.76Å; T387-A390 WeakPolarHBondContact O-CB 3.4Å; T387-A390 PolarHBondContact O-N 2.81Å; V388-A390 VanDerWaalsContact C-N 3.3Å; V388-A390 PolarHBondContact O-N 2.95Å; A390-E392 VanDerWaalsContact C-N 3.34Å; A390-E392 PolarHBondContact O-N 3.5Å; A390-Q393 PolarHBondContact O-N 3.48Å; A390-L394 PolarHBondContact O-N 3.06Å; A390-V412 HydrophobicContact CB-CG1 4.3Å; A390-V412 HydrophobicContact CB-CG2 3.76Å
391	I	91.7	Very high	87.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-45.3	172.1	-62.9	163.5	0	0	0	110.9	T387 V388 Q393 L394 E395 V412 M416 L748 K752 F755	T387-I391 HydrophobicContact CG2-CD1 4.2Å; T387-I391 VanDerWaalsContact O-CG1 3.3Å; T387-I391 WeakPolarHBondContact O-CG1 3.38Å; T387-I391 PolarHBondContact O-N 2.99Å; V388-I391 PolarHBondContact O-N 3.38Å; I391-Q393 PolarHBondContact O-N 2.99Å; I391-L394 PolarHBondContact O-N 3.44Å; I391-E395 PolarHBondContact O-N 3.18Å; I391-E395 VanDerWaalsContact O-N 3.09Å; I391-V412 HydrophobicContact CG1-CG1 3.65Å; I391-M416 HydrophobicContact CD1-CE 3.71Å; I391-M416 HydrophobicContact CD1-CG 3.96Å; I391-M416 HydrophobicContact CD1-SD 3.58Å; I391-M416 VanDerWaalsContact CD1-SD 3.58Å; I391-M416 HydrophobicContact CG1-CE 4.42Å; I391-M416 HydrophobicContact CG1-CG 4.41Å; I391-M416 HydrophobicContact CG1-SD 3.76Å; I391-L748 HydrophobicContact CG1-CD1 4.36Å; I391-L748 HydrophobicContact CG2-CD1 4.17Å; I391-L748 HydrophobicContact CG2-CD2 4.08Å; I391-L748 HydrophobicContact CG2-CG 3.9Å; I391-K752 HydrophobicContact CG2-CB 3.94Å; I391-K752 HydrophobicContact CG2-CD 3.84Å; I391-K752 HydrophobicContact CG2-CG 3.87Å; I391-F755 HydrophobicContact CD1-CD1 4.23Å
392	E	89.3	Confident	87.1	Confident	44 Å²	44	31.1 Å²	31.1	21%	0.206	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-20.6	-179.8	-68.3	-155.2	179.8	0	0	113.7	K261 V388 L389 A390 I396 K752 K756	K261-E392 IonicContact NZ-OE2 3.62Å; V388-E392 WeakPolarHBondContact O-CG 3.25Å; V388-E392 PolarHBondContact O-N 2.8Å; L389-E392 PolarHBondContact O-N 2.83Å; L389-E392 VanDerWaalsContact O-N 3.16Å; A390-E392 VanDerWaalsContact C-N 3.34Å; A390-E392 PolarHBondContact O-N 3.5Å; E392-I396 VanDerWaalsContact O-CD1 3.3Å; E392-I396 WeakPolarHBondContact O-CD1 3.47Å; E392-I396 WeakPolarHBondContact O-CG1 3.39Å; E392-I396 PolarHBondContact O-N 3.11Å; E392-K752 VanDerWaalsContact CG-CE 3.45Å; E392-K752 WeakPolarHBondContact OE1-CE 3.36Å; E392-K752 IonicContact OE1-NZ 3.16Å; E392-K752 PolarHBondContact OE1-NZ 3.17Å; E392-K756 IonicContact OE1-NZ 3.9Å; E392-K756 PolarHBondContact OE1-NZ 3.08Å
393	Q	89.2	Confident	86.5	Confident	7 Å²	7	30.9 Å²	30.9	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-80.3	-39.2	169.8	-56.6	-43.6	-51	0	0	113.8	M259 S276 T362 A364 L389 A390 I391 E395 I396 C397	M259-Q393 PolarHBondContact O-OE1 3.27Å; S276-Q393 VanDerWaalsContact CB-OE1 3.23Å; S276-Q393 PolarHBondContact OG-OE1 3.5Å; S276-Q393 VanDerWaalsContact OG-OE1 3.07Å; T362-Q393 WeakPolarHBondContact O-CB 3.3Å; T362-Q393 WeakPolarHBondContact O-CG 3.32Å; A364-Q393 HydrophobicContact CB-CB 4.36Å; L389-Q393 WeakPolarHBondContact O-CG 3.31Å; L389-Q393 PolarHBondContact O-N 3.38Å; A390-Q393 PolarHBondContact O-N 3.48Å; I391-Q393 PolarHBondContact O-N 2.99Å; Q393-E395 PolarHBondContact O-N 2.99Å; Q393-I396 PolarHBondContact O-N 3.03Å; Q393-C397 PolarHBondContact O-N 3Å; Q393-C397 PolarHBondContact O-SG 2.98Å
394	L	88.1	Confident	86.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.2	-41.7	172.2	-63.6	177.2	0	0	0	110.6	A364 A390 I391 F398 P404 V408 T409 V412 M745 L748	A364-L394 HydrophobicContact CB-CD1 4.46Å; A364-L394 HydrophobicContact CB-CD2 3.37Å; A364-L394 HydrophobicContact CB-CG 3.57Å; A390-L394 PolarHBondContact O-N 3.06Å; I391-L394 PolarHBondContact O-N 3.44Å; L394-F398 WeakPolarHBondContact O-CB 3.42Å; L394-F398 PolarHBondContact O-N 2.94Å; L394-P404 HydrophobicContact CB-CG 4.49Å; L394-P404 HydrophobicContact CD2-CB 3.46Å; L394-P404 VanDerWaalsContact CD2-CB 3.46Å; L394-P404 HydrophobicContact CD2-CG 4.01Å; L394-V408 HydrophobicContact CD2-CG1 4.44Å; L394-T409 HydrophobicContact CD1-CG2 4.33Å; L394-V412 HydrophobicContact CD1-CB 3.83Å; L394-V412 HydrophobicContact CD1-CG1 3.91Å; L394-V412 HydrophobicContact CD1-CG2 3.84Å; L394-V412 HydrophobicContact CG-CG2 4.36Å; L394-M745 VanDerWaalsContact C-CE 3.48Å; L394-M745 HydrophobicContact CB-CE 3.98Å; L394-M745 HydrophobicContact CB-SD 4.22Å; L394-M745 VanDerWaalsContact O-CE 3.32Å; L394-M745 WeakPolarHBondContact O-CE 3.31Å; L394-L748 HydrophobicContact CB-CD2 3.79Å; L394-L748 HydrophobicContact CD1-CD2 3.66Å; L394-L748 HydrophobicContact CG-CD2 4.38Å
395	E	87.8	Confident	85.8	Confident	21 Å²	21	31.3 Å²	31.3	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-58.7	-45	171.8	-72	-179.2	158	0	0	112.6	I391 Q393 N399 K752	I391-E395 PolarHBondContact O-N 3.18Å; I391-E395 VanDerWaalsContact O-N 3.09Å; Q393-E395 PolarHBondContact O-N 2.99Å; E395-N399 VanDerWaalsContact O-CB 3.3Å; E395-N399 WeakPolarHBondContact O-CB 3.32Å; E395-N399 PolarHBondContact O-N 3.35Å; E395-N399 PolarHBondContact O-ND2 3.21Å; E395-K752 WeakPolarHBondContact OE1-CD 3.48Å; E395-K752 IonicContact OE1-NZ 3.83Å; E395-K752 PolarHBondContact OE1-NZ 2.93Å; E395-K752 IonicContact OE2-NZ 2.71Å; E395-K752 PolarHBondContact OE2-NZ 2.86Å
396	I	86.5	Confident	85.6	Confident	9 Å²	9	29.9 Å²	29.9	5%	0.046	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-45.4	-176.7	-72	161.5	0	0	0	111.1	M259 K261 E392 Q393 N399 Q400	M259-I396 HydrophobicContact CB-CG2 4.07Å; M259-I396 WeakPolarHBondContact O-CG2 3.08Å; K261-I396 HydrophobicContact CD-CD1 4.38Å; K261-I396 HydrophobicContact CD-CG1 4.34Å; K261-I396 HydrophobicContact CG-CD1 3.75Å; K261-I396 HydrophobicContact CG-CG1 3.63Å; E392-I396 VanDerWaalsContact O-CD1 3.3Å; E392-I396 WeakPolarHBondContact O-CD1 3.47Å; E392-I396 WeakPolarHBondContact O-CG1 3.39Å; E392-I396 PolarHBondContact O-N 3.11Å; Q393-I396 PolarHBondContact O-N 3.03Å; I396-N399 PolarHBondContact O-N 3.44Å; I396-Q400 HydrophobicContact CG2-CG 4.44Å; I396-Q400 WeakPolarHBondContact O-CB 3.4Å; I396-Q400 VanDerWaalsContact O-CG 3.31Å; I396-Q400 WeakPolarHBondContact O-CG 3.48Å; I396-Q400 PolarHBondContact O-N 3.25Å
397	C	82.6	Confident	85.5	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-52	178.2	-58.1	0	0	0	0	111.2	M259 T362 Q393 N399 Q400 G401 T402 P404	M259-C397 HydrophobicContact SD-CB 4.42Å; M259-C397 PolarHBondContact SD-SG 2.89Å; T362-C397 WeakPolarHBondContact CB-SG 3.42Å; T362-C397 PolarHBondContact OG1-SG 3.43Å; Q393-C397 PolarHBondContact O-N 3Å; Q393-C397 PolarHBondContact O-SG 2.98Å; C397-N399 VanDerWaalsContact C-N 3.31Å; C397-N399 PolarHBondContact O-N 3.03Å; C397-Q400 CarbonylContact O-C 3.59Å; C397-Q400 WeakPolarHBondContact O-CA 3.45Å; C397-Q400 PolarHBondContact O-N 3.08Å; C397-G401 PolarHBondContact O-N 3.22Å; C397-T402 CarbonylContact C-O 3.58Å; C397-T402 VanDerWaalsContact CB-O 3.25Å; C397-T402 WeakPolarHBondContact CB-O 3.39Å; C397-T402 PolarHBondContact O-N 3.28Å; C397-T402 PolarHBondContact O-OG1 3.44Å; C397-T402 VanDerWaalsContact O-OG1 3.13Å; C397-P404 HydrophobicContact CB-CB 4.47Å
398	F	82.8	Confident	85.4	Confident	56 Å²	56	31.5 Å²	31.5	25%	0.246	19%	0.185	C	C	.	.	H	α-helix	trans	-57.1	-43.9	178.5	-177.4	-92.5	0	0	0	112.1	L394 Q400 G401 T402 Q742 M745	L394-F398 WeakPolarHBondContact O-CB 3.42Å; L394-F398 PolarHBondContact O-N 2.94Å; F398-Q400 VanDerWaalsContact C-N 3.25Å; F398-Q400 PolarHBondContact O-N 2.9Å; F398-G401 PolarHBondContact O-N 3.2Å; F398-G401 VanDerWaalsContact O-N 3.1Å; F398-T402 PolarHBondContact N-O 3.33Å; F398-Q742 HydrophobicContact CE2-CG 4.07Å; F398-Q742 HydrophobicContact CZ-CG 4.11Å; F398-M745 HydrophobicContact CB-CE 3.86Å; F398-M745 HydrophobicContact CB-CG 4.37Å; F398-M745 HydrophobicContact CD1-CB 4.37Å; F398-M745 HydrophobicContact CD2-CB 3.8Å; F398-M745 HydrophobicContact CD2-CG 3.6Å; F398-M745 HydrophobicContact CE1-CB 4.41Å; F398-M745 HydrophobicContact CE2-CB 3.82Å; F398-M745 HydrophobicContact CE2-CG 4.03Å; F398-M745 HydrophobicContact CG-CB 4.07Å; F398-M745 HydrophobicContact CG-CE 4.26Å; F398-M745 HydrophobicContact CG-CG 4.02Å; F398-M745 HydrophobicContact CZ-CB 4.13Å
399	N	84.5	Confident	85.4	Confident	109 Å²	109	31 Å²	31	58%	0.583	18%	0.181	S	C	*	.	H	α-helix	trans	-70.1	-17.8	176.7	-68.8	-43.9	0	0	0	113.7	E395 I396 C397	E395-N399 VanDerWaalsContact O-CB 3.3Å; E395-N399 WeakPolarHBondContact O-CB 3.32Å; E395-N399 PolarHBondContact O-N 3.35Å; E395-N399 PolarHBondContact O-ND2 3.21Å; I396-N399 PolarHBondContact O-N 3.44Å; C397-N399 VanDerWaalsContact C-N 3.31Å; C397-N399 PolarHBondContact O-N 3.03Å
400	Q	82.8	Confident	85.5	Confident	91 Å²	91	29.9 Å²	29.9	43%	0.425	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.5	172	-72	176.6	-2.9	0	0	112.8	T260 I396 C397 F398 T402	T260-Q400 PolarHBondContact O-NE2 3.03Å; T260-Q400 VanDerWaalsContact O-NE2 3.11Å; I396-Q400 HydrophobicContact CG2-CG 4.44Å; I396-Q400 WeakPolarHBondContact O-CB 3.4Å; I396-Q400 VanDerWaalsContact O-CG 3.31Å; I396-Q400 WeakPolarHBondContact O-CG 3.48Å; I396-Q400 PolarHBondContact O-N 3.25Å; C397-Q400 CarbonylContact O-C 3.59Å; C397-Q400 WeakPolarHBondContact O-CA 3.45Å; C397-Q400 PolarHBondContact O-N 3.08Å; F398-Q400 VanDerWaalsContact C-N 3.25Å; F398-Q400 PolarHBondContact O-N 2.9Å; Q400-T402 VanDerWaalsContact C-N 3.27Å; Q400-T402 PolarHBondContact O-N 3.39Å
401	G	77.3	Confident	85.6	Confident	64 Å²	64	30.8 Å²	30.8	66%	0.66	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	4.8	-178.4	0	0	0	0	0	114.6	C397 F398 P403	C397-G401 PolarHBondContact O-N 3.22Å; F398-G401 PolarHBondContact O-N 3.2Å; F398-G401 VanDerWaalsContact O-N 3.1Å; G401-P403 WeakPolarHBondContact O-CD 3.2Å
402	T	73.2	Confident	85.7	Confident	39 Å²	39	30.8 Å²	30.8	24%	0.239	18%	0.18	C	C	.	.			trans	-96.9	103.9	173.3	46.9	0	0	0	0	109	M259 C397 F398 Q400	M259-T402 HydrophobicContact CE-CG2 4.49Å; C397-T402 CarbonylContact C-O 3.58Å; C397-T402 VanDerWaalsContact CB-O 3.25Å; C397-T402 WeakPolarHBondContact CB-O 3.39Å; C397-T402 PolarHBondContact O-N 3.28Å; C397-T402 PolarHBondContact O-OG1 3.44Å; C397-T402 VanDerWaalsContact O-OG1 3.13Å; F398-T402 PolarHBondContact N-O 3.33Å; Q400-T402 VanDerWaalsContact C-N 3.27Å; Q400-T402 PolarHBondContact O-N 3.39Å
403	P	75.1	Confident	86	Confident	66 Å²	66	28.8 Å²	28.8	43%	0.429	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-62.1	129.6	178.8	25.9	-33.3	0	0	0	109.2	G401	G401-P403 WeakPolarHBondContact O-CD 3.2Å
404	P	80.6	Confident	86.3	Confident	8 Å²	8	30.3 Å²	30.3	5%	0.052	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-63.9	145.2	-176.4	25.1	-33.5	0	0	0	111.4	L394 C397 M745	L394-P404 HydrophobicContact CB-CG 4.49Å; L394-P404 HydrophobicContact CD2-CB 3.46Å; L394-P404 VanDerWaalsContact CD2-CB 3.46Å; L394-P404 HydrophobicContact CD2-CG 4.01Å; C397-P404 HydrophobicContact CB-CB 4.47Å; P404-M745 HydrophobicContact CG-SD 4Å
405	S	83.2	Confident	86.6	Confident	29 Å²	29	30.3 Å²	30.3	20%	0.203	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-54.3	125	179	171.9	0	0	0	0	111	H407 V408 T409	S405-H407 VanDerWaalsContact C-N 3.31Å; S405-H407 PolarHBondContact O-N 2.95Å; S405-V408 WeakPolarHBondContact O-CA 3.11Å; S405-V408 WeakPolarHBondContact O-CB 3.38Å; S405-V408 PolarHBondContact O-N 3.49Å; S405-T409 PolarHBondContact O-N 3.16Å; S405-T409 PolarHBondContact O-OG1 3.26Å
406	P	86.6	Confident	86.9	Confident	34 Å²	34	29.3 Å²	29.3	22%	0.221	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-37.7	-173.2	-28	34.7	0	0	0	114.4	V408 T409 V410 Y439 V443 Y444	P406-V408 VanDerWaalsContact C-N 3.29Å; P406-V408 PolarHBondContact O-N 3Å; P406-T409 WeakPolarHBondContact O-CB 3.47Å; P406-T409 PolarHBondContact O-N 3.38Å; P406-V410 WeakPolarHBondContact O-CG2 3.44Å; P406-V410 PolarHBondContact O-N 2.89Å; P406-Y439 HydrophobicContact CB-CE1 3.76Å; P406-Y439 WeakPolarHBondContact CB-OH 3.3Å; P406-V443 HydrophobicContact CB-CB 4.36Å; P406-V443 HydrophobicContact CB-CG1 3.7Å; P406-V443 HydrophobicContact CB-CG2 4.09Å; P406-V443 HydrophobicContact CG-CG1 3.86Å; P406-V443 HydrophobicContact CG-CG2 4.28Å; P406-Y444 HydrophobicContact CB-CE2 4.03Å
407	H	88.8	Confident	87.3	Confident	39 Å²	39	28.9 Å²	28.9	18%	0.181	17%	0.169	C	C	.	.	H	α-helix	trans	-58.9	-42.3	173.5	173.3	-125.7	0	0	0	111.5	Y365 S405 V410 E411 Y444	Y365-H407 AromaticContact CE2-CE1 3.41Å; Y365-H407 VanDerWaalsContact CE2-CE1 3.41Å; Y365-H407 WeakPolarHBondContact CE2-CE1 3.42Å; Y365-H407 AromaticContact CE2-ND1 3.75Å; Y365-H407 AromaticContact CZ-CE1 3.92Å; S405-H407 VanDerWaalsContact C-N 3.31Å; S405-H407 PolarHBondContact O-N 2.95Å; H407-V410 PolarHBondContact O-N 3.43Å; H407-E411 WeakPolarHBondContact O-CG 3.28Å; H407-E411 PolarHBondContact O-N 3.39Å; H407-Y444 WeakPolarHBondContact CB-OH 3.4Å; H407-Y444 PolarHBondContact N-OH 2.93Å
408	V	91	Very high	87.8	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.055	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-43.2	178.7	-176.2	0	0	0	0	110.7	A364 Y365 L394 S405 P406 V410 E411 V412	A364-V408 HydrophobicContact CB-CG1 3.37Å; Y365-V408 HydrophobicContact CD2-CB 4.38Å; Y365-V408 HydrophobicContact CD2-CG1 4.32Å; Y365-V408 HydrophobicContact CD2-CG2 3.92Å; Y365-V408 HydrophobicContact CG-CG2 4.47Å; L394-V408 HydrophobicContact CD2-CG1 4.44Å; S405-V408 WeakPolarHBondContact O-CA 3.11Å; S405-V408 WeakPolarHBondContact O-CB 3.38Å; S405-V408 PolarHBondContact O-N 3.49Å; P406-V408 VanDerWaalsContact C-N 3.29Å; P406-V408 PolarHBondContact O-N 3Å; V408-V410 VanDerWaalsContact C-N 3.33Å; V408-V410 PolarHBondContact O-N 2.98Å; V408-E411 PolarHBondContact O-N 3.07Å; V408-V412 WeakPolarHBondContact O-CG2 3.43Å; V408-V412 PolarHBondContact O-N 3.5Å; V408-V412 VanDerWaalsContact O-N 3.16Å
409	T	91.1	Very high	88.1	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-57.6	-45	173.4	-54.8	0	0	0	0	111.3	L394 S405 P406 V412 L413 Y439 L744	L394-T409 HydrophobicContact CD1-CG2 4.33Å; S405-T409 PolarHBondContact O-N 3.16Å; S405-T409 PolarHBondContact O-OG1 3.26Å; P406-T409 WeakPolarHBondContact O-CB 3.47Å; P406-T409 PolarHBondContact O-N 3.38Å; T409-V412 PolarHBondContact O-N 3.09Å; T409-L413 HydrophobicContact CG2-CD1 4.2Å; T409-L413 WeakPolarHBondContact O-CG 3.49Å; T409-L413 PolarHBondContact O-N 3.48Å; T409-Y439 HydrophobicContact CG2-CE1 4.19Å; T409-L744 HydrophobicContact CG2-CD2 3.71Å; T409-L744 HydrophobicContact CG2-CG 4.46Å
410	V	92	Very high	88.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-44.3	177.6	167.8	0	0	0	0	112.2	P406 H407 V408 V412 L413 R414 Y439 T440 I450 L454	P406-V410 WeakPolarHBondContact O-CG2 3.44Å; P406-V410 PolarHBondContact O-N 2.89Å; H407-V410 PolarHBondContact O-N 3.43Å; V408-V410 VanDerWaalsContact C-N 3.33Å; V408-V410 PolarHBondContact O-N 2.98Å; V410-V412 VanDerWaalsContact C-N 3.31Å; V410-V412 PolarHBondContact O-N 3.35Å; V410-L413 PolarHBondContact O-N 2.6Å; V410-R414 HydrophobicContact CG1-CG 4.36Å; V410-R414 WeakPolarHBondContact O-CG 3.34Å; V410-R414 PolarHBondContact O-N 3.47Å; V410-Y439 HydrophobicContact CG2-CD1 4.18Å; V410-T440 VanDerWaalsContact CG2-OG1 3.28Å; V410-T440 WeakPolarHBondContact CG2-OG1 3.36Å; V410-I450 HydrophobicContact CG1-CG2 3.77Å; V410-L454 HydrophobicContact CG1-CD1 3.86Å; V410-L454 HydrophobicContact CG1-CD2 4.25Å; V410-L454 HydrophobicContact CG1-CG 4.15Å
411	E	93.7	Very high	88.7	Confident	19 Å²	19	18.3 Å²	18.3	9%	0.089	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-36.7	177.4	-70.7	-61.8	96.5	0	0	112.5	Y365 A368 Q369 H407 V408 R414 I415	Y365-E411 HydrophobicContact CD2-CG 4.29Å; Y365-E411 HydrophobicContact CE2-CB 4.39Å; Y365-E411 HydrophobicContact CE2-CG 3.71Å; A368-E411 HydrophobicContact CB-CB 4.42Å; Q369-E411 PolarHBondContact NE2-OE2 3.18Å; Q369-E411 VanDerWaalsContact NE2-OE2 3.09Å; H407-E411 WeakPolarHBondContact O-CG 3.28Å; H407-E411 PolarHBondContact O-N 3.39Å; V408-E411 PolarHBondContact O-N 3.07Å; E411-R414 PolarHBondContact O-N 3.18Å; E411-R414 VanDerWaalsContact OE1-CD 3.3Å; E411-R414 WeakPolarHBondContact OE1-CD 3.34Å; E411-R414 IonicContact OE1-CZ 3.11Å; E411-R414 IonicContact OE1-NE 2.78Å; E411-R414 IonicContact OE1-NH1 2.84Å; E411-R414 PolarHBondContact OE1-NH1 3.47Å; E411-R414 IonicContact OE2-NH1 3.31Å; E411-R414 PolarHBondContact OE2-NH1 3.49Å; E411-I415 PolarHBondContact O-N 3.39Å; E411-I415 VanDerWaalsContact O-N 3.15Å
412	V	94.5	Very high	88.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.9	-46.6	172.9	178.1	0	0	0	0	111.2	A364 A368 A390 I391 L394 V408 T409 V410 R414 I415 M416	A364-V412 HydrophobicContact CB-CG2 3.8Å; A364-V412 WeakPolarHBondContact O-CG2 3.21Å; A368-V412 HydrophobicContact CB-CG2 4.19Å; A390-V412 HydrophobicContact CB-CG1 4.3Å; A390-V412 HydrophobicContact CB-CG2 3.76Å; I391-V412 HydrophobicContact CG1-CG1 3.65Å; L394-V412 HydrophobicContact CD1-CB 3.83Å; L394-V412 HydrophobicContact CD1-CG1 3.91Å; L394-V412 HydrophobicContact CD1-CG2 3.84Å; L394-V412 HydrophobicContact CG-CG2 4.36Å; V408-V412 WeakPolarHBondContact O-CG2 3.43Å; V408-V412 PolarHBondContact O-N 3.5Å; V408-V412 VanDerWaalsContact O-N 3.16Å; T409-V412 PolarHBondContact O-N 3.09Å; V410-V412 VanDerWaalsContact C-N 3.31Å; V410-V412 PolarHBondContact O-N 3.35Å; V412-R414 VanDerWaalsContact C-N 3.28Å; V412-R414 PolarHBondContact O-N 3.03Å; V412-I415 VanDerWaalsContact O-CG2 3.32Å; V412-I415 WeakPolarHBondContact O-CG2 3.39Å; V412-I415 PolarHBondContact O-N 3.04Å; V412-M416 HydrophobicContact CG1-CG 4.36Å; V412-M416 HydrophobicContact CG1-SD 4Å; V412-M416 VanDerWaalsContact O-CG 3.27Å; V412-M416 WeakPolarHBondContact O-CG 3.42Å; V412-M416 PolarHBondContact O-N 3.05Å
413	L	94.4	Very high	89.3	Confident	1 Å²	1	13.7 Å²	13.7	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-62	-36.1	177.9	-63.2	168.1	0	0	0	111.7	T409 V410 M416 C417 I432 A436 L744 L748	T409-L413 HydrophobicContact CG2-CD1 4.2Å; T409-L413 WeakPolarHBondContact O-CG 3.49Å; T409-L413 PolarHBondContact O-N 3.48Å; V410-L413 PolarHBondContact O-N 2.6Å; L413-M416 HydrophobicContact CD2-SD 4.25Å; L413-M416 PolarHBondContact O-N 2.91Å; L413-C417 PolarHBondContact O-N 3.43Å; L413-C417 PolarHBondContact O-SG 2.92Å; L413-I432 HydrophobicContact CB-CG2 4.08Å; L413-I432 HydrophobicContact CD2-CG2 3.88Å; L413-A436 HydrophobicContact CB-CB 4.05Å; L413-A436 HydrophobicContact CD1-CB 3.85Å; L413-L744 HydrophobicContact CD1-CD1 4.09Å; L413-L744 HydrophobicContact CD1-CD2 4.2Å; L413-L748 HydrophobicContact CD2-CD1 4.12Å
414	R	95	Very high	89.6	Confident	39 Å²	39	12.3 Å²	12.3	15%	0.147	6%	0.062	C	C	.	.	H	α-helix	trans	-62.9	-47	175.3	-74.1	178.7	67.3	-148.1	-1.4	112.7	V410 E411 V412 C417 K418 L454 E457	V410-R414 HydrophobicContact CG1-CG 4.36Å; V410-R414 WeakPolarHBondContact O-CG 3.34Å; V410-R414 PolarHBondContact O-N 3.47Å; E411-R414 PolarHBondContact O-N 3.18Å; E411-R414 VanDerWaalsContact OE1-CD 3.3Å; E411-R414 WeakPolarHBondContact OE1-CD 3.34Å; E411-R414 IonicContact OE1-CZ 3.11Å; E411-R414 IonicContact OE1-NE 2.78Å; E411-R414 IonicContact OE1-NH1 2.84Å; E411-R414 PolarHBondContact OE1-NH1 3.47Å; E411-R414 IonicContact OE2-NH1 3.31Å; E411-R414 PolarHBondContact OE2-NH1 3.49Å; V412-R414 VanDerWaalsContact C-N 3.28Å; V412-R414 PolarHBondContact O-N 3.03Å; R414-C417 WeakPolarHBondContact O-CB 3.5Å; R414-C417 PolarHBondContact O-N 2.89Å; R414-K418 PolarHBondContact O-N 2.88Å; R414-L454 HydrophobicContact CG-CD2 3.53Å; R414-L454 HydrophobicContact CG-CG 4.42Å; R414-E457 HydrophobicContact CG-CG 4.44Å; R414-E457 IonicContact CZ-OE1 3.34Å; R414-E457 IonicContact NE-OE1 3.49Å; R414-E457 PolarHBondContact NE-OE1 3.35Å; R414-E457 IonicContact NH2-OE1 2.74Å; R414-E457 PolarHBondContact NH2-OE1 3.06Å
415	I	95.2	Very high	89.9	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-72.6	-31.2	178.6	-168.2	56	0	0	0	112	A368 A371 Y375 T387 E411 V412 K418 V419	A368-I415 HydrophobicContact CB-CG2 4.08Å; A371-I415 HydrophobicContact CB-CD1 4.48Å; A371-I415 HydrophobicContact CB-CG1 3.65Å; A371-I415 HydrophobicContact CB-CG2 4.44Å; Y375-I415 HydrophobicContact CD2-CD1 4.43Å; Y375-I415 HydrophobicContact CG-CD1 4.14Å; T387-I415 HydrophobicContact CG2-CG2 4Å; E411-I415 PolarHBondContact O-N 3.39Å; E411-I415 VanDerWaalsContact O-N 3.15Å; V412-I415 VanDerWaalsContact O-CG2 3.32Å; V412-I415 WeakPolarHBondContact O-CG2 3.39Å; V412-I415 PolarHBondContact O-N 3.04Å; I415-K418 HydrophobicContact CD1-CB 4.04Å; I415-K418 HydrophobicContact CD1-CD 4.11Å; I415-K418 PolarHBondContact O-N 3.18Å; I415-V419 WeakPolarHBondContact O-CG2 3.5Å; I415-V419 PolarHBondContact O-N 3.3Å
416	M	94.7	Very high	90	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.5	-47.8	166.8	-70	173.1	75.3	0	0	111.6	T387 I391 V412 L413 K418 V419 C420 I432 L748 F755	T387-M416 HydrophobicContact CG2-CB 4.41Å; T387-M416 HydrophobicContact CG2-CG 3.48Å; T387-M416 VanDerWaalsContact CG2-CG 3.48Å; I391-M416 HydrophobicContact CD1-CE 3.71Å; I391-M416 HydrophobicContact CD1-CG 3.96Å; I391-M416 HydrophobicContact CD1-SD 3.58Å; I391-M416 VanDerWaalsContact CD1-SD 3.58Å; I391-M416 HydrophobicContact CG1-CE 4.42Å; I391-M416 HydrophobicContact CG1-CG 4.41Å; I391-M416 HydrophobicContact CG1-SD 3.76Å; V412-M416 HydrophobicContact CG1-CG 4.36Å; V412-M416 HydrophobicContact CG1-SD 4Å; V412-M416 VanDerWaalsContact O-CG 3.27Å; V412-M416 WeakPolarHBondContact O-CG 3.42Å; V412-M416 PolarHBondContact O-N 3.05Å; L413-M416 HydrophobicContact CD2-SD 4.25Å; L413-M416 PolarHBondContact O-N 2.91Å; M416-K418 PolarHBondContact O-N 3.39Å; M416-V419 PolarHBondContact O-N 2.95Å; M416-C420 PolarHBondContact O-N 2.88Å; M416-C420 PolarHBondContact O-SG 3.3Å; M416-I432 HydrophobicContact CB-CD1 4.22Å; M416-I432 HydrophobicContact CB-CG2 4.49Å; M416-I432 HydrophobicContact CE-CD1 4.04Å; M416-L748 HydrophobicContact CE-CD1 4.22Å; M416-L748 HydrophobicContact SD-CD1 3.86Å; M416-F755 HydrophobicContact CB-CE2 4.08Å; M416-F755 HydrophobicContact CE-CD2 4.42Å; M416-F755 HydrophobicContact CE-CG 4.5Å; M416-F755 HydrophobicContact CG-CE2 4.2Å; M416-F755 HydrophobicContact CG-CZ 4.3Å
417	C	94.2	Very high	90.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.5	-48.3	174.9	-73.5	0	0	0	0	111.6	L413 R414 V419 C420 I421 I432 L461	L413-C417 PolarHBondContact O-N 3.43Å; L413-C417 PolarHBondContact O-SG 2.92Å; R414-C417 WeakPolarHBondContact O-CB 3.5Å; R414-C417 PolarHBondContact O-N 2.89Å; C417-V419 PolarHBondContact O-N 3.22Å; C417-C420 CarbonylContact O-C 3.15Å; C417-C420 WeakPolarHBondContact O-CA 3.49Å; C417-C420 WeakPolarHBondContact O-CB 3.34Å; C417-C420 PolarHBondContact O-N 3.28Å; C417-I421 WeakPolarHBondContact O-CG1 3.42Å; C417-I421 PolarHBondContact O-N 2.96Å; C417-I432 WeakPolarHBondContact SG-CG2 3.3Å; C417-L461 HydrophobicContact CB-CD1 4.26Å
418	K	92.6	Very high	90.1	Very high	32 Å²	32	17.4 Å²	17.4	14%	0.139	9%	0.086	C	C	.	.	H	α-helix	trans	-56	-45.4	177.5	-77.2	178.8	-175.7	174.3	0	113	Y375 R414 I415 M416 I421 I422 E457	Y375-K418 HydrophobicContact CD1-CD 4.23Å; Y375-K418 HydrophobicContact CD2-CB 4.08Å; Y375-K418 HydrophobicContact CE1-CB 4.13Å; Y375-K418 HydrophobicContact CE1-CD 4.07Å; Y375-K418 HydrophobicContact CE1-CG 4.27Å; Y375-K418 HydrophobicContact CE2-CB 3.66Å; Y375-K418 VanDerWaalsContact CE2-O 3.29Å; Y375-K418 WeakPolarHBondContact CE2-O 3.42Å; Y375-K418 HydrophobicContact CG-CB 4.48Å; Y375-K418 PolarHBondContact OH-O 2.91Å; R414-K418 PolarHBondContact O-N 2.88Å; I415-K418 HydrophobicContact CD1-CB 4.04Å; I415-K418 HydrophobicContact CD1-CD 4.11Å; I415-K418 PolarHBondContact O-N 3.18Å; M416-K418 PolarHBondContact O-N 3.39Å; K418-I421 PolarHBondContact O-N 2.86Å; K418-I422 PolarHBondContact O-N 2.98Å; K418-E457 WeakPolarHBondContact CE-OE1 3.37Å; K418-E457 WeakPolarHBondContact CE-OE2 3.48Å; K418-E457 IonicContact NZ-OE1 3.65Å; K418-E457 PolarHBondContact NZ-OE1 2.93Å; K418-E457 IonicContact NZ-OE2 2.78Å
419	V	90.8	Very high	90.2	Very high	1 Å²	1	17 Å²	17	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-67.8	-34.4	175.3	175.3	0	0	0	0	111.7	Y375 F384 I415 M416 C417 I422 K423 F755 F759	Y375-V419 HydrophobicContact CD2-CG2 4.42Å; F384-V419 HydrophobicContact CB-CG1 4.46Å; F384-V419 HydrophobicContact CD2-CG1 4.34Å; I415-V419 WeakPolarHBondContact O-CG2 3.5Å; I415-V419 PolarHBondContact O-N 3.3Å; M416-V419 PolarHBondContact O-N 2.95Å; C417-V419 PolarHBondContact O-N 3.22Å; V419-I422 WeakPolarHBondContact O-CG2 3.39Å; V419-I422 PolarHBondContact O-N 3.48Å; V419-K423 PolarHBondContact O-N 2.86Å; V419-F755 HydrophobicContact CB-CE2 3.83Å; V419-F755 HydrophobicContact CB-CZ 3.72Å; V419-F755 HydrophobicContact CG1-CE2 3.77Å; V419-F755 HydrophobicContact CG1-CZ 3.59Å; V419-F755 HydrophobicContact CG2-CZ 4.24Å; V419-F759 HydrophobicContact CG1-CE2 4.12Å
420	C	90.6	Very high	90.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.5	-36.8	171.2	-68.1	0	0	0	0	112.7	M416 C417 R424 K425	M416-C420 PolarHBondContact O-N 2.88Å; M416-C420 PolarHBondContact O-SG 3.3Å; C417-C420 CarbonylContact O-C 3.15Å; C417-C420 WeakPolarHBondContact O-CA 3.49Å; C417-C420 WeakPolarHBondContact O-CB 3.34Å; C417-C420 PolarHBondContact O-N 3.28Å; C420-R424 CarbonylContact O-C 3.58Å; C420-R424 PolarHBondContact O-N 2.85Å; C420-K425 HydrophobicContact CB-CB 4.43Å; C420-K425 PolarHBondContact O-N 3.11Å
421	I	87.6	Confident	90.1	Very high	2 Å²	2	23 Å²	23	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-48.9	172.9	-53.1	163.9	0	0	0	109.5	C417 K418 K423 R424 Y426 C460 L461 N464 S795	C417-I421 WeakPolarHBondContact O-CG1 3.42Å; C417-I421 PolarHBondContact O-N 2.96Å; K418-I421 PolarHBondContact O-N 2.86Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.35Å; I421-R424 PolarHBondContact O-N 3.45Å; I421-Y426 HydrophobicContact CG2-CE1 4.15Å; I421-C460 HydrophobicContact CD1-CB 4.38Å; I421-L461 HydrophobicContact CD1-CD2 4.39Å; I421-L461 HydrophobicContact CD1-CG 4.02Å; I421-L461 HydrophobicContact CG1-CD2 3.59Å; I421-L461 HydrophobicContact CG1-CG 3.78Å; I421-N464 HydrophobicContact CG2-CB 4.16Å; I421-S795 WeakPolarHBondContact CG2-OG 3.46Å; I421-S795 WeakPolarHBondContact O-CB 3.28Å
422	I	81.3	Confident	90.1	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-51.9	-48.1	-178.8	-125.1	49.7	0	0	0	111.1	Y375 Y380 K418 V419 R424 E793 A794 S795	Y375-I422 HydrophobicContact CD2-CG1 4.38Å; Y375-I422 HydrophobicContact CE2-CB 3.95Å; Y375-I422 HydrophobicContact CE2-CD1 3.56Å; Y375-I422 HydrophobicContact CE2-CG1 3.65Å; Y375-I422 WeakPolarHBondContact OH-CD1 2.9Å; Y380-I422 HydrophobicContact CD1-CD1 4.32Å; Y380-I422 HydrophobicContact CD1-CG1 3.55Å; Y380-I422 HydrophobicContact CD1-CG2 4.36Å; Y380-I422 HydrophobicContact CD2-CG1 4.27Å; Y380-I422 HydrophobicContact CE1-CD1 3.63Å; Y380-I422 HydrophobicContact CE1-CG1 3.35Å; Y380-I422 HydrophobicContact CE2-CG1 4.11Å; Y380-I422 HydrophobicContact CG-CG1 3.99Å; Y380-I422 HydrophobicContact CG-CG2 4.3Å; K418-I422 PolarHBondContact O-N 2.98Å; V419-I422 WeakPolarHBondContact O-CG2 3.39Å; V419-I422 PolarHBondContact O-N 3.48Å; I422-R424 VanDerWaalsContact C-N 3.33Å; I422-R424 PolarHBondContact O-N 3.41Å; I422-E793 CarbonylContact C-O 3.54Å; I422-E793 CarbonylContact O-C 3.53Å; I422-A794 HydrophobicContact CG1-CB 4.31Å; I422-A794 WeakPolarHBondContact O-CA 3.37Å; I422-A794 PolarHBondContact O-N 2.79Å; I422-S795 WeakPolarHBondContact CA-OG 3.45Å; I422-S795 WeakPolarHBondContact CD1-OG 3.45Å; I422-S795 PolarHBondContact N-OG 3.18Å; I422-S795 PolarHBondContact O-N 3.02Å
423	K	82	Confident	90	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.017	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	18.5	-179.8	-67.6	-83.2	166.2	-126.9	0	114.2	V419 I421 K425 I758 F759 T791 M792 E793	V419-K423 PolarHBondContact O-N 2.86Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.35Å; K423-K425 HydrophobicContact CB-CG 4.09Å; K423-K425 WeakPolarHBondContact O-CD 3.19Å; K423-K425 VanDerWaalsContact O-CE 3.27Å; K423-K425 WeakPolarHBondContact O-CE 3.32Å; K423-K425 VanDerWaalsContact O-CG 3.25Å; K423-K425 WeakPolarHBondContact O-CG 3.47Å; K423-K425 PolarHBondContact O-N 2.84Å; K423-K425 PolarHBondContact O-NZ 3.24Å; K423-I758 HydrophobicContact CB-CG2 3.48Å; K423-I758 VanDerWaalsContact CB-CG2 3.48Å; K423-I758 HydrophobicContact CD-CG2 3.85Å; K423-I758 HydrophobicContact CG-CG2 3.39Å; K423-F759 HydrophobicContact CD-CE2 4.27Å; K423-F759 HydrophobicContact CD-CZ 4.14Å; K423-F759 VanDerWaalsContact CE-CE1 3.44Å; K423-F759 HydrophobicContact CG-CE2 4.04Å; K423-F759 HydrophobicContact CG-CZ 4.17Å; K423-T791 PolarHBondContact NZ-O 3.3Å; K423-M792 VanDerWaalsContact NZ-CA 3.34Å; K423-M792 PolarHBondContact NZ-O 3.45Å; K423-E793 VanDerWaalsContact C-OE2 3.26Å; K423-E793 WeakPolarHBondContact CA-OE2 3.34Å; K423-E793 HydrophobicContact CD-CB 4.26Å; K423-E793 PolarHBondContact NZ-O 2.65Å
424	R	81.7	Confident	89.8	Confident	37 Å²	37	25.2 Å²	25.2	14%	0.14	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	23.5	178.8	-60.9	-178.2	162.8	-140.7	-2.8	115.3	C420 I421 I422 Y426 F632 F670 Y674	C420-R424 CarbonylContact O-C 3.58Å; C420-R424 PolarHBondContact O-N 2.85Å; I421-R424 PolarHBondContact O-N 3.45Å; I422-R424 VanDerWaalsContact C-N 3.33Å; I422-R424 PolarHBondContact O-N 3.41Å; R424-Y426 HydrophobicContact CB-CE1 4.29Å; R424-Y426 HydrophobicContact CB-CE2 4.21Å; R424-Y426 HydrophobicContact CG-CE1 4.41Å; R424-Y426 HydrophobicContact CG-CE2 4.49Å; R424-Y426 PolarHBondContact O-N 3.31Å; R424-F632 HydrophobicContact CG-CE1 4.19Å; R424-F632 VanDerWaalsContact NE-CE1 3.25Å; R424-F670 VanDerWaalsContact CD-CZ 3.46Å; R424-F670 VanDerWaalsContact CZ-CZ 3.45Å; R424-Y674 PolarHBondContact NH1-OH 3.44Å; R424-Y674 PolarHBondContact NH2-OH 3.2Å; R424-Y674 VanDerWaalsContact NH2-OH 3.11Å
425	K	86.3	Confident	89.5	Confident	71 Å²	71	26.2 Å²	26.2	31%	0.309	13%	0.125	S	C	.	.			trans	-83.7	52.9	178.7	-51.9	-49.6	177.4	-117.7	0	110.3	C420 K423 S427 L428 G429 I758 E793	C420-K425 HydrophobicContact CB-CB 4.43Å; C420-K425 PolarHBondContact O-N 3.11Å; K423-K425 HydrophobicContact CB-CG 4.09Å; K423-K425 WeakPolarHBondContact O-CD 3.19Å; K423-K425 VanDerWaalsContact O-CE 3.27Å; K423-K425 WeakPolarHBondContact O-CE 3.32Å; K423-K425 VanDerWaalsContact O-CG 3.25Å; K423-K425 WeakPolarHBondContact O-CG 3.47Å; K423-K425 PolarHBondContact O-N 2.84Å; K423-K425 PolarHBondContact O-NZ 3.24Å; K425-S427 VanDerWaalsContact C-N 3.29Å; K425-S427 PolarHBondContact O-N 3.38Å; K425-L428 HydrophobicContact CB-CB 4.42Å; K425-L428 WeakPolarHBondContact O-CB 3.46Å; K425-L428 PolarHBondContact O-N 2.78Å; K425-G429 PolarHBondContact O-N 2.53Å; K425-I758 HydrophobicContact CG-CD1 4.05Å; K425-I758 HydrophobicContact CG-CG1 4.07Å; K425-I758 HydrophobicContact CG-CG2 4.41Å; K425-E793 IonicContact NZ-OE1 3.2Å; K425-E793 IonicContact NZ-OE2 2.79Å; K425-E793 PolarHBondContact NZ-OE2 3.2Å; K425-E793 VanDerWaalsContact NZ-OE2 3.16Å
426	Y	87.2	Confident	89.3	Confident	44 Å²	44	26.2 Å²	26.2	17%	0.173	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-34	-169.4	-51.6	-45.9	0	0	0	113.1	I421 R424 L428 G429 L430 L461 N464 T465	I421-Y426 HydrophobicContact CG2-CE1 4.15Å; R424-Y426 HydrophobicContact CB-CE1 4.29Å; R424-Y426 HydrophobicContact CB-CE2 4.21Å; R424-Y426 HydrophobicContact CG-CE1 4.41Å; R424-Y426 HydrophobicContact CG-CE2 4.49Å; R424-Y426 PolarHBondContact O-N 3.31Å; Y426-L428 VanDerWaalsContact C-N 3.27Å; Y426-L428 PolarHBondContact O-N 2.96Å; Y426-G429 PolarHBondContact O-N 2.79Å; Y426-L430 VanDerWaalsContact O-CB 3.25Å; Y426-L430 WeakPolarHBondContact O-CB 3.44Å; Y426-L430 VanDerWaalsContact O-CG 3.24Å; Y426-L430 WeakPolarHBondContact O-CG 3.49Å; Y426-L430 PolarHBondContact O-N 3.31Å; Y426-L461 HydrophobicContact CD1-CD2 4.35Å; Y426-N464 HydrophobicContact CD1-CB 4.43Å; Y426-N464 HydrophobicContact CE1-CB 3.72Å; Y426-N464 WeakPolarHBondContact CE2-O 3.44Å; Y426-N464 VanDerWaalsContact CZ-O 3.26Å; Y426-N464 PolarHBondContact OH-O 3.39Å; Y426-T465 HydrophobicContact CD2-CG2 3.69Å; Y426-T465 HydrophobicContact CE2-CG2 4.46Å; Y426-T465 HydrophobicContact CG-CG2 3.68Å
427	S	87.1	Confident	89.2	Confident	93 Å²	93	26.2 Å²	26.2	65%	0.65	12%	0.124	S	C	*	.	H	α-helix	trans	-65.8	-24.3	175.6	56.5	0	0	0	0	114.3	K425 R431	K425-S427 VanDerWaalsContact C-N 3.29Å; K425-S427 PolarHBondContact O-N 3.38Å; S427-R431 WeakPolarHBondContact O-CG 3.27Å; S427-R431 PolarHBondContact O-NE 3.33Å
428	L	90.3	Very high	88.9	Confident	8 Å²	8	30.4 Å²	30.4	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-83	-49.1	169.7	178.3	58.4	0	0	0	110	K425 Y426 L430 R431 I432 Y751 Q754 I758	K425-L428 HydrophobicContact CB-CB 4.42Å; K425-L428 WeakPolarHBondContact O-CB 3.46Å; K425-L428 PolarHBondContact O-N 2.78Å; Y426-L428 VanDerWaalsContact C-N 3.27Å; Y426-L428 PolarHBondContact O-N 2.96Å; L428-L430 VanDerWaalsContact C-N 3.31Å; L428-L430 PolarHBondContact O-N 2.71Å; L428-R431 PolarHBondContact O-N 3.38Å; L428-R431 VanDerWaalsContact O-N 3.12Å; L428-I432 HydrophobicContact CD1-CD1 3.89Å; L428-I432 HydrophobicContact CD1-CG1 4.17Å; L428-I432 HydrophobicContact CG-CD1 3.74Å; L428-I432 HydrophobicContact CG-CG1 4.45Å; L428-I432 WeakPolarHBondContact O-CG1 3.43Å; L428-I432 PolarHBondContact O-N 3.16Å; L428-Y751 HydrophobicContact CD1-CD1 3.56Å; L428-Y751 HydrophobicContact CD1-CE1 4.13Å; L428-Y751 HydrophobicContact CD1-CG 4.18Å; L428-Q754 HydrophobicContact CD1-CB 4.36Å; L428-Q754 HydrophobicContact CD2-CB 4.06Å; L428-I758 HydrophobicContact CD2-CD1 4.19Å
429	G	92.2	Very high	88.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.4	-40.1	178.3	0	0	0	0	0	113.9	K425 Y426 I432 I433 L461	K425-G429 PolarHBondContact O-N 2.53Å; Y426-G429 PolarHBondContact O-N 2.79Å; G429-I432 PolarHBondContact O-N 3.13Å; G429-I433 WeakPolarHBondContact O-CB 3.48Å; G429-I433 WeakPolarHBondContact O-CG2 3.25Å; G429-I433 PolarHBondContact O-N 3.02Å; G429-L461 WeakPolarHBondContact O-CD1 3.25Å
430	L	91	Very high	88.7	Confident	39 Å²	39	29.3 Å²	29.3	20%	0.204	14%	0.14	C	C	.	.	H	α-helix	trans	-68.9	-33.9	177.5	-74.4	173.4	0	0	0	113.2	Y426 L428 K434 Y458 L461 M462 T465	Y426-L430 VanDerWaalsContact O-CB 3.25Å; Y426-L430 WeakPolarHBondContact O-CB 3.44Å; Y426-L430 VanDerWaalsContact O-CG 3.24Å; Y426-L430 WeakPolarHBondContact O-CG 3.49Å; Y426-L430 PolarHBondContact O-N 3.31Å; L428-L430 VanDerWaalsContact C-N 3.31Å; L428-L430 PolarHBondContact O-N 2.71Å; L430-K434 WeakPolarHBondContact O-CB 2.89Å; L430-K434 WeakPolarHBondContact O-CG 3.41Å; L430-K434 PolarHBondContact O-N 2.96Å; L430-Y458 HydrophobicContact CD2-CD2 4.4Å; L430-Y458 HydrophobicContact CD2-CE2 4.04Å; L430-L461 HydrophobicContact CD2-CB 3.9Å; L430-M462 HydrophobicContact CD1-CE 4.49Å; L430-M462 HydrophobicContact CD2-CE 3.6Å; L430-T465 HydrophobicContact CD1-CG2 4.2Å
431	R	90.1	Very high	88.6	Confident	89 Å²	89	31.6 Å²	31.6	34%	0.336	15%	0.149	S	C	.	.	H	α-helix	trans	-72.4	-43.5	173.3	-72.4	-173.3	-64	135.6	3	111.2	S427 L428 I433 H435 E750 Y751	S427-R431 WeakPolarHBondContact O-CG 3.27Å; S427-R431 PolarHBondContact O-NE 3.33Å; L428-R431 PolarHBondContact O-N 3.38Å; L428-R431 VanDerWaalsContact O-N 3.12Å; R431-I433 PolarHBondContact O-N 3.45Å; R431-H435 PolarHBondContact O-N 3.2Å; R431-E750 IonicContact CZ-OE1 3.65Å; R431-E750 IonicContact NH1-OE1 3.92Å; R431-E750 PolarHBondContact NH1-OE1 2.94Å; R431-E750 IonicContact NH1-OE2 3.87Å; R431-E750 IonicContact NH2-OE1 3.73Å; R431-Y751 HydrophobicContact CB-CE1 4.3Å; R431-Y751 PolarHBondContact O-OH 3.09Å
432	I	92.4	Very high	88.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-57.6	-50	175.1	-64.7	165.9	0	0	0	110.5	L413 M416 C417 L428 G429 H435 A436 Y751	L413-I432 HydrophobicContact CB-CG2 4.08Å; L413-I432 HydrophobicContact CD2-CG2 3.88Å; M416-I432 HydrophobicContact CB-CD1 4.22Å; M416-I432 HydrophobicContact CB-CG2 4.49Å; M416-I432 HydrophobicContact CE-CD1 4.04Å; C417-I432 WeakPolarHBondContact SG-CG2 3.3Å; L428-I432 HydrophobicContact CD1-CD1 3.89Å; L428-I432 HydrophobicContact CD1-CG1 4.17Å; L428-I432 HydrophobicContact CG-CD1 3.74Å; L428-I432 HydrophobicContact CG-CG1 4.45Å; L428-I432 WeakPolarHBondContact O-CG1 3.43Å; L428-I432 PolarHBondContact O-N 3.16Å; G429-I432 PolarHBondContact O-N 3.13Å; I432-H435 PolarHBondContact O-N 3Å; I432-A436 WeakPolarHBondContact O-CB 3.3Å; I432-A436 PolarHBondContact O-N 3.37Å; I432-Y751 HydrophobicContact CB-CE2 4.38Å; I432-Y751 HydrophobicContact CD1-CD2 4.48Å; I432-Y751 HydrophobicContact CD1-CG 4.42Å; I432-Y751 HydrophobicContact CG1-CD1 4.25Å; I432-Y751 HydrophobicContact CG1-CD2 3.6Å; I432-Y751 HydrophobicContact CG1-CE1 4.38Å; I432-Y751 HydrophobicContact CG1-CE2 3.72Å; I432-Y751 HydrophobicContact CG1-CG 3.87Å
433	I	93.2	Very high	88.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.1	-37.4	-175.5	-158.8	69.5	0	0	0	112.7	G429 R431 H435 A436 L437 L454 E457 Y458 L461	G429-I433 WeakPolarHBondContact O-CB 3.48Å; G429-I433 WeakPolarHBondContact O-CG2 3.25Å; G429-I433 PolarHBondContact O-N 3.02Å; R431-I433 PolarHBondContact O-N 3.45Å; I433-H435 PolarHBondContact O-N 3.39Å; I433-A436 PolarHBondContact O-N 3.4Å; I433-L437 HydrophobicContact CG1-CD1 4.42Å; I433-L437 WeakPolarHBondContact O-CB 3.5Å; I433-L437 WeakPolarHBondContact O-CG 3.47Å; I433-L437 PolarHBondContact O-N 2.89Å; I433-L454 HydrophobicContact CD1-CD2 3.6Å; I433-E457 HydrophobicContact CD1-CB 4.04Å; I433-Y458 HydrophobicContact CG1-CD2 4.34Å; I433-Y458 HydrophobicContact CG1-CG 4.34Å; I433-Y458 HydrophobicContact CG2-CD2 3.48Å; I433-Y458 VanDerWaalsContact CG2-CD2 3.48Å; I433-Y458 HydrophobicContact CG2-CE2 4.01Å; I433-Y458 HydrophobicContact CG2-CG 4.24Å; I433-L461 HydrophobicContact CB-CD1 3.86Å; I433-L461 HydrophobicContact CG1-CD1 4.37Å; I433-L461 HydrophobicContact CG2-CD1 3.71Å
434	K	90.9	Very high	89.1	Confident	67 Å²	67	38.3 Å²	38.3	29%	0.291	18%	0.184	S	C	.	.	H	α-helix	trans	-61.4	-44.6	175.1	-78.9	-162.5	172.8	-157.3	0	110.7	L430 L437 M438 Y458 D724	L430-K434 WeakPolarHBondContact O-CB 2.89Å; L430-K434 WeakPolarHBondContact O-CG 3.41Å; L430-K434 PolarHBondContact O-N 2.96Å; K434-L437 PolarHBondContact O-N 3.2Å; K434-M438 WeakPolarHBondContact O-CG 3.4Å; K434-M438 PolarHBondContact O-N 3.37Å; K434-Y458 VanDerWaalsContact CE-OH 3.32Å; K434-Y458 WeakPolarHBondContact CE-OH 3.46Å; K434-D724 IonicContact NZ-OD2 2.68Å; K434-D724 PolarHBondContact NZ-OD2 3.14Å
435	H	88.3	Confident	89.4	Confident	60 Å²	60	37.8 Å²	37.8	28%	0.278	19%	0.191	S	C	.	.	H	α-helix	trans	-70.5	-35.2	175.5	-66.4	151.2	0	0	0	113.7	R431 I432 I433 L437 M438 Y439 L747 Y751	R431-H435 PolarHBondContact O-N 3.2Å; I432-H435 PolarHBondContact O-N 3Å; I433-H435 PolarHBondContact O-N 3.39Å; H435-L437 VanDerWaalsContact C-N 3.33Å; H435-L437 PolarHBondContact O-N 3.08Å; H435-M438 PolarHBondContact O-N 3.44Å; H435-Y439 WeakPolarHBondContact O-CB 3.4Å; H435-Y439 PolarHBondContact O-N 3.08Å; H435-L747 WeakPolarHBondContact ND1-CD1 3.39Å; H435-Y751 PolarHBondContact CE1-OH 3.03Å; H435-Y751 AromaticContact ND1-CZ 3.9Å; H435-Y751 PolarHBondContact ND1-OH 3.2Å
436	A	92	Very high	89.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-40.3	173.2	0	0	0	0	0	111.9	L413 I432 I433 T440 L454	L413-A436 HydrophobicContact CB-CB 4.05Å; L413-A436 HydrophobicContact CD1-CB 3.85Å; I432-A436 WeakPolarHBondContact O-CB 3.3Å; I432-A436 PolarHBondContact O-N 3.37Å; I433-A436 PolarHBondContact O-N 3.4Å; A436-T440 VanDerWaalsContact O-CB 3.27Å; A436-T440 WeakPolarHBondContact O-CB 3.34Å; A436-T440 PolarHBondContact O-N 3.05Å; A436-T440 PolarHBondContact O-OG1 2.78Å; A436-L454 HydrophobicContact CB-CD1 4.29Å; A436-L454 HydrophobicContact CB-CD2 3.93Å
437	L	92	Very high	89.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-46	173.7	-75.6	165.8	0	0	0	111.8	I433 K434 H435 T440 R441 Y451 L454 L455 Y458 F728	I433-L437 HydrophobicContact CG1-CD1 4.42Å; I433-L437 WeakPolarHBondContact O-CB 3.5Å; I433-L437 WeakPolarHBondContact O-CG 3.47Å; I433-L437 PolarHBondContact O-N 2.89Å; K434-L437 PolarHBondContact O-N 3.2Å; H435-L437 VanDerWaalsContact C-N 3.33Å; H435-L437 PolarHBondContact O-N 3.08Å; L437-T440 PolarHBondContact O-N 2.94Å; L437-R441 WeakPolarHBondContact O-CB 3.49Å; L437-R441 PolarHBondContact O-N 3.27Å; L437-Y451 HydrophobicContact CB-CE2 4.13Å; L437-Y451 HydrophobicContact CD2-CD2 3.96Å; L437-Y451 HydrophobicContact CD2-CE2 3.6Å; L437-Y451 HydrophobicContact CG-CE2 4.5Å; L437-Y451 WeakPolarHBondContact O-CE2 3.46Å; L437-L454 HydrophobicContact CD2-CB 3.57Å; L437-L454 HydrophobicContact CD2-CD1 4.48Å; L437-L454 HydrophobicContact CG-CB 4.23Å; L437-L455 HydrophobicContact CD1-CD2 4.25Å; L437-L455 HydrophobicContact CD2-CD2 3.72Å; L437-L455 HydrophobicContact CD2-CG 4.15Å; L437-Y458 HydrophobicContact CD1-CD1 3.65Å; L437-Y458 HydrophobicContact CD1-CE1 4.21Å; L437-Y458 HydrophobicContact CD1-CG 3.93Å; L437-F728 HydrophobicContact CB-CE2 4.37Å; L437-F728 HydrophobicContact CB-CZ 4.2Å
438	M	87.7	Confident	89.3	Confident	89 Å²	89	38.8 Å²	38.8	44%	0.438	18%	0.182	S	C	.	.	H	α-helix	trans	-59.6	-48.9	177.1	-70.5	170.5	69.4	0	0	112	K434 H435 T440 R441 S442 F728	K434-M438 WeakPolarHBondContact O-CG 3.4Å; K434-M438 PolarHBondContact O-N 3.37Å; H435-M438 PolarHBondContact O-N 3.44Å; M438-T440 VanDerWaalsContact C-N 3.34Å; M438-T440 PolarHBondContact O-N 2.67Å; M438-R441 PolarHBondContact O-N 2.9Å; M438-S442 PolarHBondContact O-N 3.03Å; M438-S442 VanDerWaalsContact O-N 3.12Å; M438-S442 PolarHBondContact O-OG 3.33Å; M438-F728 HydrophobicContact CG-CD1 3.69Å; M438-F728 HydrophobicContact CG-CE1 3.45Å; M438-F728 VanDerWaalsContact CG-CE1 3.45Å; M438-F728 HydrophobicContact CG-CE2 4.33Å; M438-F728 HydrophobicContact CG-CG 4.23Å; M438-F728 HydrophobicContact CG-CZ 3.81Å; M438-F728 HydrophobicContact SD-CD1 3.98Å; M438-F728 HydrophobicContact SD-CE1 3.82Å
439	Y	88.3	Confident	89.3	Confident	10 Å²	10	39.4 Å²	39.4	4%	0.039	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-36.1	177.7	-178.3	-110.9	0	0	0	112.8	P406 T409 V410 H435 S442 V443 L744	P406-Y439 HydrophobicContact CB-CE1 3.76Å; P406-Y439 WeakPolarHBondContact CB-OH 3.3Å; T409-Y439 HydrophobicContact CG2-CE1 4.19Å; V410-Y439 HydrophobicContact CG2-CD1 4.18Å; H435-Y439 WeakPolarHBondContact O-CB 3.4Å; H435-Y439 PolarHBondContact O-N 3.08Å; Y439-S442 PolarHBondContact O-OG 3.08Å; Y439-V443 HydrophobicContact CD2-CG2 4.23Å; Y439-V443 HydrophobicContact CE1-CG2 4.31Å; Y439-V443 HydrophobicContact CE2-CG2 3.96Å; Y439-V443 WeakPolarHBondContact O-CB 3.48Å; Y439-V443 VanDerWaalsContact O-CG2 3.29Å; Y439-V443 WeakPolarHBondContact O-CG2 3.43Å; Y439-V443 PolarHBondContact O-N 3.44Å; Y439-V443 VanDerWaalsContact O-N 3.09Å; Y439-L744 HydrophobicContact CD1-CD2 3.5Å; Y439-L744 VanDerWaalsContact CD1-CD2 3.5Å; Y439-L744 HydrophobicContact CD2-CD2 3.62Å; Y439-L744 HydrophobicContact CE1-CD2 3.74Å; Y439-L744 HydrophobicContact CE2-CD2 3.87Å; Y439-L744 HydrophobicContact CG-CD2 3.42Å; Y439-L744 VanDerWaalsContact CG-CD2 3.42Å
440	T	90.1	Very high	89.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.3	-38.6	175.8	-56.5	0	0	0	0	111.3	V410 A436 L437 M438 S442 Y444 I450 Y451 L454	V410-T440 VanDerWaalsContact CG2-OG1 3.28Å; V410-T440 WeakPolarHBondContact CG2-OG1 3.36Å; A436-T440 VanDerWaalsContact O-CB 3.27Å; A436-T440 WeakPolarHBondContact O-CB 3.34Å; A436-T440 PolarHBondContact O-N 3.05Å; A436-T440 PolarHBondContact O-OG1 2.78Å; L437-T440 PolarHBondContact O-N 2.94Å; M438-T440 VanDerWaalsContact C-N 3.34Å; M438-T440 PolarHBondContact O-N 2.67Å; T440-S442 VanDerWaalsContact C-N 3.3Å; T440-S442 PolarHBondContact O-N 3.08Å; T440-Y444 HydrophobicContact CG2-CD2 3.99Å; T440-Y444 WeakPolarHBondContact O-CB 3.26Å; T440-Y444 PolarHBondContact O-N 3.16Å; T440-I450 HydrophobicContact CG2-CB 4.24Å; T440-I450 HydrophobicContact CG2-CG2 3.83Å; T440-Y451 HydrophobicContact CG2-CD2 4.11Å; T440-L454 HydrophobicContact CG2-CD1 4.01Å; T440-L454 WeakPolarHBondContact OG1-CD1 3.09Å
441	R	89.7	Confident	89.4	Confident	48 Å²	48	39.3 Å²	39.3	18%	0.181	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-36.7	175.4	179	176.7	176	-165.8	0.7	111.8	L437 M438 G445 Y451 F728 E731	L437-R441 WeakPolarHBondContact O-CB 3.49Å; L437-R441 PolarHBondContact O-N 3.27Å; M438-R441 PolarHBondContact O-N 2.9Å; R441-G445 WeakPolarHBondContact O-CA 3.36Å; R441-G445 PolarHBondContact O-N 3.3Å; R441-G445 VanDerWaalsContact O-N 3.08Å; R441-Y451 HydrophobicContact CB-CD2 4.38Å; R441-Y451 HydrophobicContact CB-CE2 3.99Å; R441-F728 PolarHBondContact NH1-O 2.89Å; R441-E731 IonicContact CZ-OE1 2.79Å; R441-E731 IonicContact NH2-OE1 2.7Å; R441-E731 PolarHBondContact NH2-OE1 3.07Å
442	S	86.6	Confident	89.6	Confident	37 Å²	37	35.1 Å²	35.1	26%	0.259	17%	0.168	S	C	.	.	H	α-helix	trans	-81.2	-35.4	-179.6	60.2	0	0	0	0	114.1	M438 Y439 T440 Q740	M438-S442 PolarHBondContact O-N 3.03Å; M438-S442 VanDerWaalsContact O-N 3.12Å; M438-S442 PolarHBondContact O-OG 3.33Å; Y439-S442 PolarHBondContact O-OG 3.08Å; T440-S442 VanDerWaalsContact C-N 3.3Å; T440-S442 PolarHBondContact O-N 3.08Å; S442-Q740 PolarHBondContact OG-OE1 2.79Å
443	V	87.2	Confident	89.6	Confident	43 Å²	43	37.1 Å²	37.1	26%	0.261	18%	0.179	S	C	.	.	H	α-helix	trans	-79.8	-41.7	178.5	177.3	0	0	0	0	112.4	P406 Y439 L737	P406-V443 HydrophobicContact CB-CB 4.36Å; P406-V443 HydrophobicContact CB-CG1 3.7Å; P406-V443 HydrophobicContact CB-CG2 4.09Å; P406-V443 HydrophobicContact CG-CG1 3.86Å; P406-V443 HydrophobicContact CG-CG2 4.28Å; Y439-V443 HydrophobicContact CD2-CG2 4.23Å; Y439-V443 HydrophobicContact CE1-CG2 4.31Å; Y439-V443 HydrophobicContact CE2-CG2 3.96Å; Y439-V443 WeakPolarHBondContact O-CB 3.48Å; Y439-V443 VanDerWaalsContact O-CG2 3.29Å; Y439-V443 WeakPolarHBondContact O-CG2 3.43Å; Y439-V443 PolarHBondContact O-N 3.44Å; Y439-V443 VanDerWaalsContact O-N 3.09Å; V443-L737 HydrophobicContact CB-CD2 4.44Å; V443-L737 HydrophobicContact CG2-CD2 3.72Å
444	Y	86.3	Confident	89.7	Confident	68 Å²	68	37.1 Å²	37.1	27%	0.267	18%	0.179	S	C	.	.	H	α-helix	trans	-119	-4.7	-168.6	-62.7	-70.8	0	0	0	114.4	P406 H407 T440 I450	P406-Y444 HydrophobicContact CB-CE2 4.03Å; H407-Y444 WeakPolarHBondContact CB-OH 3.4Å; H407-Y444 PolarHBondContact N-OH 2.93Å; T440-Y444 HydrophobicContact CG2-CD2 3.99Å; T440-Y444 WeakPolarHBondContact O-CB 3.26Å; T440-Y444 PolarHBondContact O-N 3.16Å; Y444-I450 HydrophobicContact CD1-CD1 4.31Å; Y444-I450 HydrophobicContact CD2-CD1 4.22Å; Y444-I450 HydrophobicContact CE1-CD1 4.13Å; Y444-I450 HydrophobicContact CE2-CD1 4.03Å; Y444-I450 HydrophobicContact CG-CD1 4.35Å
445	G	87.9	Confident	90	Very high	27 Å²	27	34 Å²	34	28%	0.278	17%	0.165	S	C	.	.			trans	75.7	165.3	-166.6	0	0	0	0	0	112.9	R441 R447	R441-G445 WeakPolarHBondContact O-CA 3.36Å; R441-G445 PolarHBondContact O-N 3.3Å; R441-G445 VanDerWaalsContact O-N 3.08Å; G445-R447 VanDerWaalsContact C-N 3.32Å
446	Y	85.7	Confident	90.3	Very high	93 Å²	93	32.5 Å²	32.5	37%	0.365	16%	0.159	S	C	.	.	S	Bend	trans	-77	-20.3	172.5	66.7	-91.4	0	0	0	112.6	N448 Y451	Y446-N448 PolarHBondContact O-N 2.86Å; Y446-Y451 WeakPolarHBondContact O-CD1 3.39Å
447	R	85.5	Confident	90.4	Very high	97 Å²	97	33 Å²	33	37%	0.366	16%	0.161	S	C	.	.	S	Bend	trans	-87.7	80.6	172	-55.4	-172.8	-171.6	-157.2	-1.4	108.2	L290 G445 Y485	L290-R447 PolarHBondContact O-NH1 3.39Å; L290-R447 VanDerWaalsContact O-NH1 3.11Å; L290-R447 PolarHBondContact O-NH2 3.11Å; G445-R447 VanDerWaalsContact C-N 3.32Å; R447-Y485 PolarHBondContact O-OH 2.99Å
448	N	87.6	Confident	90.6	Very high	38 Å²	38	33.3 Å²	33.3	20%	0.203	16%	0.162	C	C	.	.	S	Bend	trans	-159.6	145.6	177.5	-163.4	-76.1	0	0	0	111.5	Y446 I450 Y451 A452	Y446-N448 PolarHBondContact O-N 2.86Å; N448-I450 VanDerWaalsContact C-N 3.28Å; N448-I450 PolarHBondContact O-N 2.9Å; N448-I450 WeakPolarHBondContact OD1-CB 3Å; N448-I450 WeakPolarHBondContact OD1-CG1 3.37Å; N448-I450 PolarHBondContact OD1-N 3.13Å; N448-Y451 PolarHBondContact O-N 2.93Å; N448-A452 PolarHBondContact O-N 3.23Å
449	L	91	Very high	90.9	Very high	21 Å²	21	29 Å²	29	11%	0.11	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-30.8	175.6	-74.2	169.1	0	0	0	113.4	A452 N453 I482 Y485 L486 M492	L449-A452 PolarHBondContact O-N 3.07Å; L449-N453 WeakPolarHBondContact O-CB 2.82Å; L449-N453 PolarHBondContact O-N 2.96Å; L449-N453 PolarHBondContact O-ND2 2.91Å; L449-N453 VanDerWaalsContact O-ND2 3.07Å; L449-I482 HydrophobicContact CD2-CB 4.43Å; L449-I482 HydrophobicContact CD2-CG1 4.27Å; L449-I482 HydrophobicContact CD2-CG2 4.31Å; L449-Y485 HydrophobicContact CD1-CG 4.33Å; L449-Y485 HydrophobicContact CD2-CG 4.43Å; L449-Y485 HydrophobicContact CG-CD2 4.25Å; L449-Y485 HydrophobicContact CG-CG 3.97Å; L449-L486 HydrophobicContact CD1-CD1 4.34Å; L449-L486 HydrophobicContact CD1-CG 4.29Å; L449-L486 HydrophobicContact CD2-CD1 4.15Å; L449-L486 HydrophobicContact CD2-CG 4.29Å; L449-M492 HydrophobicContact CB-CE 4.49Å; L449-M492 HydrophobicContact CD2-CE 3.73Å; L449-M492 HydrophobicContact CD2-SD 4.38Å
450	I	91.7	Very high	91.2	Very high	31 Å²	31	28.8 Å²	28.8	16%	0.159	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-43.8	174.6	-58.3	170.1	0	0	0	110.2	V410 T440 Y444 N448 N453 L454	V410-I450 HydrophobicContact CG1-CG2 3.77Å; T440-I450 HydrophobicContact CG2-CB 4.24Å; T440-I450 HydrophobicContact CG2-CG2 3.83Å; Y444-I450 HydrophobicContact CD1-CD1 4.31Å; Y444-I450 HydrophobicContact CD2-CD1 4.22Å; Y444-I450 HydrophobicContact CE1-CD1 4.13Å; Y444-I450 HydrophobicContact CE2-CD1 4.03Å; Y444-I450 HydrophobicContact CG-CD1 4.35Å; N448-I450 VanDerWaalsContact C-N 3.28Å; N448-I450 PolarHBondContact O-N 2.9Å; N448-I450 WeakPolarHBondContact OD1-CB 3Å; N448-I450 WeakPolarHBondContact OD1-CG1 3.37Å; N448-I450 PolarHBondContact OD1-N 3.13Å; I450-N453 PolarHBondContact O-N 3.22Å; I450-L454 PolarHBondContact O-N 3.41Å; I450-L454 VanDerWaalsContact O-N 3.09Å
451	Y	93.4	Very high	91.3	Very high	7 Å²	7	28.8 Å²	28.8	3%	0.027	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-43.7	176.6	-171.9	-97.4	0	0	0	111.3	L437 T440 R441 Y446 N448 N453 L454 L455 L481	L437-Y451 HydrophobicContact CB-CE2 4.13Å; L437-Y451 HydrophobicContact CD2-CD2 3.96Å; L437-Y451 HydrophobicContact CD2-CE2 3.6Å; L437-Y451 HydrophobicContact CG-CE2 4.5Å; L437-Y451 WeakPolarHBondContact O-CE2 3.46Å; T440-Y451 HydrophobicContact CG2-CD2 4.11Å; R441-Y451 HydrophobicContact CB-CD2 4.38Å; R441-Y451 HydrophobicContact CB-CE2 3.99Å; Y446-Y451 WeakPolarHBondContact O-CD1 3.39Å; N448-Y451 PolarHBondContact O-N 2.93Å; Y451-N453 VanDerWaalsContact C-N 3.34Å; Y451-N453 PolarHBondContact O-N 3.36Å; Y451-L454 WeakPolarHBondContact O-CB 3.12Å; Y451-L454 PolarHBondContact O-N 2.98Å; Y451-L455 HydrophobicContact CD1-CD1 4.11Å; Y451-L455 HydrophobicContact CD1-CG 4.3Å; Y451-L455 HydrophobicContact CE1-CD1 3.87Å; Y451-L455 HydrophobicContact CE1-CD2 4.21Å; Y451-L455 HydrophobicContact CE1-CG 4.08Å; Y451-L455 PolarHBondContact O-N 3.38Å; Y451-L481 HydrophobicContact CD1-CD1 3.97Å; Y451-L481 HydrophobicContact CE1-CD1 4.36Å
452	A	94.3	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-40.1	175.8	0	0	0	0	0	112.6	N448 L449 L454 L455 I456 L481 I482	N448-A452 PolarHBondContact O-N 3.23Å; L449-A452 PolarHBondContact O-N 3.07Å; A452-L454 PolarHBondContact O-N 2.99Å; A452-L455 WeakPolarHBondContact O-CB 3.31Å; A452-L455 PolarHBondContact O-N 3.46Å; A452-I456 PolarHBondContact O-N 3.49Å; A452-L481 HydrophobicContact CB-CB 3.79Å; A452-L481 HydrophobicContact CB-CD1 4.42Å; A452-I482 HydrophobicContact CB-CG1 3.84Å
453	N	93.3	Very high	91.4	Very high	44 Å²	44	25.3 Å²	25.3	24%	0.235	12%	0.123	C	C	.	.	H	α-helix	trans	-62.5	-39.7	173.6	-82.1	-44.2	0	0	0	112.6	L449 I450 Y451 L455 I456 E457 M492	L449-N453 WeakPolarHBondContact O-CB 2.82Å; L449-N453 PolarHBondContact O-N 2.96Å; L449-N453 PolarHBondContact O-ND2 2.91Å; L449-N453 VanDerWaalsContact O-ND2 3.07Å; I450-N453 PolarHBondContact O-N 3.22Å; Y451-N453 VanDerWaalsContact C-N 3.34Å; Y451-N453 PolarHBondContact O-N 3.36Å; N453-L455 VanDerWaalsContact C-N 3.31Å; N453-L455 PolarHBondContact O-N 3.23Å; N453-I456 WeakPolarHBondContact O-CB 3.49Å; N453-I456 PolarHBondContact O-N 2.85Å; N453-E457 PolarHBondContact O-N 2.83Å; N453-M492 WeakPolarHBondContact ND2-CE 3.35Å; N453-M492 WeakPolarHBondContact OD1-CE 3.49Å
454	L	95.1	Very high	91.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-33.9	173.4	-78.8	168	0	0	0	112.7	V410 R414 I433 A436 L437 T440 I450 Y451 A452 I456 E457 Y458	V410-L454 HydrophobicContact CG1-CD1 3.86Å; V410-L454 HydrophobicContact CG1-CD2 4.25Å; V410-L454 HydrophobicContact CG1-CG 4.15Å; R414-L454 HydrophobicContact CG-CD2 3.53Å; R414-L454 HydrophobicContact CG-CG 4.42Å; I433-L454 HydrophobicContact CD1-CD2 3.6Å; A436-L454 HydrophobicContact CB-CD1 4.29Å; A436-L454 HydrophobicContact CB-CD2 3.93Å; L437-L454 HydrophobicContact CD2-CB 3.57Å; L437-L454 HydrophobicContact CD2-CD1 4.48Å; L437-L454 HydrophobicContact CG-CB 4.23Å; T440-L454 HydrophobicContact CG2-CD1 4.01Å; T440-L454 WeakPolarHBondContact OG1-CD1 3.09Å; I450-L454 PolarHBondContact O-N 3.41Å; I450-L454 VanDerWaalsContact O-N 3.09Å; Y451-L454 WeakPolarHBondContact O-CB 3.12Å; Y451-L454 PolarHBondContact O-N 2.98Å; A452-L454 PolarHBondContact O-N 2.99Å; L454-I456 VanDerWaalsContact C-N 3.32Å; L454-I456 PolarHBondContact O-N 3.07Å; L454-E457 PolarHBondContact O-N 2.81Å; L454-Y458 WeakPolarHBondContact O-CB 3.4Å; L454-Y458 PolarHBondContact O-N 2.93Å
455	L	96.2	Very high	91.2	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-36	172.6	-66.8	178.7	0	0	0	112	L437 Y451 A452 N453 Y458 G459 I474 I477 A478 L481 L726	L437-L455 HydrophobicContact CD1-CD2 4.25Å; L437-L455 HydrophobicContact CD2-CD2 3.72Å; L437-L455 HydrophobicContact CD2-CG 4.15Å; Y451-L455 HydrophobicContact CD1-CD1 4.11Å; Y451-L455 HydrophobicContact CD1-CG 4.3Å; Y451-L455 HydrophobicContact CE1-CD1 3.87Å; Y451-L455 HydrophobicContact CE1-CD2 4.21Å; Y451-L455 HydrophobicContact CE1-CG 4.08Å; Y451-L455 PolarHBondContact O-N 3.38Å; A452-L455 WeakPolarHBondContact O-CB 3.31Å; A452-L455 PolarHBondContact O-N 3.46Å; N453-L455 VanDerWaalsContact C-N 3.31Å; N453-L455 PolarHBondContact O-N 3.23Å; L455-Y458 HydrophobicContact CD2-CD1 4.4Å; L455-Y458 PolarHBondContact O-N 2.84Å; L455-G459 PolarHBondContact O-N 3.21Å; L455-I474 HydrophobicContact CB-CG2 3.88Å; L455-I474 HydrophobicContact CD2-CG2 4.17Å; L455-I474 WeakPolarHBondContact O-CG2 3.45Å; L455-I477 HydrophobicContact CD1-CG2 3.96Å; L455-A478 HydrophobicContact CB-CB 3.76Å; L455-A478 HydrophobicContact CD1-CB 4.39Å; L455-L481 HydrophobicContact CD1-CD1 3.84Å; L455-L726 HydrophobicContact CD2-CD2 3.86Å
456	I	95.2	Very high	90.8	Very high	28 Å²	28	23.9 Å²	23.9	14%	0.144	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-46	172.6	-57	-61.1	0	0	0	111	A452 N453 L454 Y458 G459 C460 Y475 A478 A496	A452-I456 PolarHBondContact O-N 3.49Å; N453-I456 WeakPolarHBondContact O-CB 3.49Å; N453-I456 PolarHBondContact O-N 2.85Å; L454-I456 VanDerWaalsContact C-N 3.32Å; L454-I456 PolarHBondContact O-N 3.07Å; I456-Y458 VanDerWaalsContact C-N 3.29Å; I456-Y458 PolarHBondContact O-N 3.41Å; I456-G459 PolarHBondContact O-N 2.8Å; I456-C460 WeakPolarHBondContact O-CB 3.49Å; I456-C460 PolarHBondContact O-N 2.87Å; I456-Y475 HydrophobicContact CD1-CD1 3.96Å; I456-Y475 HydrophobicContact CG2-CE1 4.19Å; I456-Y475 WeakPolarHBondContact O-CE1 3.47Å; I456-A478 HydrophobicContact CD1-CB 3.46Å; I456-A478 VanDerWaalsContact CD1-CB 3.46Å; I456-A478 HydrophobicContact CG1-CB 4.09Å; I456-A496 HydrophobicContact CD1-CB 3.99Å
457	E	94.1	Very high	90.8	Very high	10 Å²	10	21.5 Å²	21.5	5%	0.047	11%	0.105	C	C	.	.	H	α-helix	trans	-65.9	-32.6	177	-48	-71.8	-175.9	0	0	111.5	R414 K418 I433 N453 L454 C460 L461	R414-E457 HydrophobicContact CG-CG 4.44Å; R414-E457 IonicContact CZ-OE1 3.34Å; R414-E457 IonicContact NE-OE1 3.49Å; R414-E457 PolarHBondContact NE-OE1 3.35Å; R414-E457 IonicContact NH2-OE1 2.74Å; R414-E457 PolarHBondContact NH2-OE1 3.06Å; K418-E457 WeakPolarHBondContact CE-OE1 3.37Å; K418-E457 WeakPolarHBondContact CE-OE2 3.48Å; K418-E457 IonicContact NZ-OE1 3.65Å; K418-E457 PolarHBondContact NZ-OE1 2.93Å; K418-E457 IonicContact NZ-OE2 2.78Å; I433-E457 HydrophobicContact CD1-CB 4.04Å; N453-E457 PolarHBondContact O-N 2.83Å; L454-E457 PolarHBondContact O-N 2.81Å; E457-C460 WeakPolarHBondContact O-CB 3.24Å; E457-C460 PolarHBondContact O-N 2.76Å; E457-L461 PolarHBondContact O-N 3.48Å
458	Y	95.5	Very high	90.8	Very high	7 Å²	7	18.3 Å²	18.3	3%	0.027	10%	0.096	C	C	.	.	H	α-helix	trans	-70.2	-43.5	176.1	-175.3	-145.9	0	0	0	112.9	L430 I433 K434 L437 L454 L455 I456 C460 L461 M462 I474 L726	L430-Y458 HydrophobicContact CD2-CD2 4.4Å; L430-Y458 HydrophobicContact CD2-CE2 4.04Å; I433-Y458 HydrophobicContact CG1-CD2 4.34Å; I433-Y458 HydrophobicContact CG1-CG 4.34Å; I433-Y458 HydrophobicContact CG2-CD2 3.48Å; I433-Y458 VanDerWaalsContact CG2-CD2 3.48Å; I433-Y458 HydrophobicContact CG2-CE2 4.01Å; I433-Y458 HydrophobicContact CG2-CG 4.24Å; K434-Y458 VanDerWaalsContact CE-OH 3.32Å; K434-Y458 WeakPolarHBondContact CE-OH 3.46Å; L437-Y458 HydrophobicContact CD1-CD1 3.65Å; L437-Y458 HydrophobicContact CD1-CE1 4.21Å; L437-Y458 HydrophobicContact CD1-CG 3.93Å; L454-Y458 WeakPolarHBondContact O-CB 3.4Å; L454-Y458 PolarHBondContact O-N 2.93Å; L455-Y458 HydrophobicContact CD2-CD1 4.4Å; L455-Y458 PolarHBondContact O-N 2.84Å; I456-Y458 VanDerWaalsContact C-N 3.29Å; I456-Y458 PolarHBondContact O-N 3.41Å; Y458-C460 PolarHBondContact O-N 3.4Å; Y458-L461 WeakPolarHBondContact O-CB 3.45Å; Y458-L461 PolarHBondContact O-N 2.88Å; Y458-M462 HydrophobicContact CD2-CG 4.35Å; Y458-M462 HydrophobicContact CE2-CE 3.85Å; Y458-M462 HydrophobicContact CE2-CG 4.14Å; Y458-M462 WeakPolarHBondContact O-CG 3.19Å; Y458-M462 PolarHBondContact O-N 3.47Å; Y458-I474 HydrophobicContact CD1-CD1 3.55Å; Y458-I474 HydrophobicContact CD1-CG1 4.17Å; Y458-I474 HydrophobicContact CD1-CG2 4.15Å; Y458-I474 HydrophobicContact CE1-CD1 3.51Å; Y458-I474 HydrophobicContact CE1-CG1 4.26Å; Y458-I474 HydrophobicContact CG-CD1 4.19Å; Y458-L726 HydrophobicContact CD1-CD2 4.39Å; Y458-L726 HydrophobicContact CE1-CD2 4.04Å
459	G	94.2	Very high	90.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60	-36.4	171.2	0	0	0	0	0	111.7	L455 I456 M462 L463 A471 Y475	L455-G459 PolarHBondContact O-N 3.21Å; I456-G459 PolarHBondContact O-N 2.8Å; G459-M462 PolarHBondContact O-N 3.09Å; G459-L463 WeakPolarHBondContact O-CB 3.03Å; G459-L463 PolarHBondContact O-N 3.39Å; G459-A471 VanDerWaalsContact O-CB 3.31Å; G459-A471 WeakPolarHBondContact O-CB 3.34Å; G459-Y475 VanDerWaalsContact C-CZ 3.41Å; G459-Y475 VanDerWaalsContact C-OH 3.27Å
460	C	93.8	Very high	90.7	Very high	5 Å²	5	23 Å²	23	3%	0.034	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-42.3	174.8	-166.6	0	0	0	0	111.7	I421 I456 E457 Y458 N464 Y475	I421-C460 HydrophobicContact CD1-CB 4.38Å; I456-C460 WeakPolarHBondContact O-CB 3.49Å; I456-C460 PolarHBondContact O-N 2.87Å; E457-C460 WeakPolarHBondContact O-CB 3.24Å; E457-C460 PolarHBondContact O-N 2.76Å; Y458-C460 PolarHBondContact O-N 3.4Å; C460-N464 PolarHBondContact O-N 3.21Å; C460-N464 PolarHBondContact O-ND2 2.98Å; C460-Y475 VanDerWaalsContact CA-OH 3.23Å; C460-Y475 WeakPolarHBondContact CA-OH 3.46Å; C460-Y475 PolarHBondContact N-OH 2.73Å; C460-Y475 VanDerWaalsContact N-OH 3.09Å
461	L	92	Very high	90.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.1	-47.2	172.9	-89.7	161	0	0	0	112.2	C417 I421 Y426 G429 L430 I433 E457 Y458 L463 N464 T465	C417-L461 HydrophobicContact CB-CD1 4.26Å; I421-L461 HydrophobicContact CD1-CD2 4.39Å; I421-L461 HydrophobicContact CD1-CG 4.02Å; I421-L461 HydrophobicContact CG1-CD2 3.59Å; I421-L461 HydrophobicContact CG1-CG 3.78Å; Y426-L461 HydrophobicContact CD1-CD2 4.35Å; G429-L461 WeakPolarHBondContact O-CD1 3.25Å; L430-L461 HydrophobicContact CD2-CB 3.9Å; I433-L461 HydrophobicContact CB-CD1 3.86Å; I433-L461 HydrophobicContact CG1-CD1 4.37Å; I433-L461 HydrophobicContact CG2-CD1 3.71Å; E457-L461 PolarHBondContact O-N 3.48Å; Y458-L461 WeakPolarHBondContact O-CB 3.45Å; Y458-L461 PolarHBondContact O-N 2.88Å; L461-L463 VanDerWaalsContact C-N 3.34Å; L461-L463 PolarHBondContact O-N 3.09Å; L461-N464 PolarHBondContact O-N 3.36Å; L461-T465 PolarHBondContact O-N 3.12Å; L461-T465 PolarHBondContact O-OG1 3.26Å
462	M	90.5	Very high	90.6	Very high	5 Å²	5	21.2 Å²	21.2	3%	0.025	11%	0.107	C	C	.	.	H	α-helix	trans	-56.4	-45.8	177.4	-77.7	-79.4	121.6	0	0	112.3	L430 Y458 G459 N464 T465 K467 K470 A471 I474	L430-M462 HydrophobicContact CD1-CE 4.49Å; L430-M462 HydrophobicContact CD2-CE 3.6Å; Y458-M462 HydrophobicContact CD2-CG 4.35Å; Y458-M462 HydrophobicContact CE2-CE 3.85Å; Y458-M462 HydrophobicContact CE2-CG 4.14Å; Y458-M462 WeakPolarHBondContact O-CG 3.19Å; Y458-M462 PolarHBondContact O-N 3.47Å; G459-M462 PolarHBondContact O-N 3.09Å; M462-N464 VanDerWaalsContact C-N 3.33Å; M462-N464 PolarHBondContact O-N 3.4Å; M462-T465 CarbonylContact O-C 2.96Å; M462-T465 PolarHBondContact O-N 3.12Å; M462-T465 VanDerWaalsContact O-N 3.07Å; M462-T465 PolarHBondContact O-OG1 3.28Å; M462-K467 HydrophobicContact CB-CB 4.26Å; M462-K467 HydrophobicContact CE-CD 4.09Å; M462-K467 WeakPolarHBondContact O-CA 3.29Å; M462-K467 WeakPolarHBondContact O-CB 3.48Å; M462-K467 PolarHBondContact O-N 2.87Å; M462-K467 HydrophobicContact SD-CB 3.75Å; M462-K467 HydrophobicContact SD-CD 3.73Å; M462-K467 HydrophobicContact SD-CG 4.32Å; M462-K470 HydrophobicContact CG-CG 4.41Å; M462-K470 HydrophobicContact SD-CB 3.98Å; M462-K470 HydrophobicContact SD-CG 3.75Å; M462-A471 HydrophobicContact CB-CB 3.87Å; M462-I474 HydrophobicContact CG-CD1 3.75Å
463	L	88.7	Confident	90.6	Very high	7 Å²	7	24.3 Å²	24.3	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-64.3	-35.7	179.2	-171.1	63.3	0	0	0	112.5	G459 L461 T465 D466 T468 A471 Y502 V506	G459-L463 WeakPolarHBondContact O-CB 3.03Å; G459-L463 PolarHBondContact O-N 3.39Å; L461-L463 VanDerWaalsContact C-N 3.34Å; L461-L463 PolarHBondContact O-N 3.09Å; L463-T465 PolarHBondContact O-N 2.57Å; L463-D466 PolarHBondContact O-N 3.13Å; L463-T468 HydrophobicContact CD1-CG2 3.94Å; L463-A471 HydrophobicContact CB-CB 3.96Å; L463-Y502 HydrophobicContact CD2-CD1 3.67Å; L463-Y502 HydrophobicContact CD2-CE1 3.67Å; L463-V506 HydrophobicContact CD1-CB 4.3Å; L463-V506 HydrophobicContact CD1-CG2 4.39Å
464	N	85.8	Confident	90.6	Very high	19 Å²	19	22.2 Å²	22.2	10%	0.102	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-5.4	176	-76.9	-101.5	0	0	0	113.2	I421 Y426 C460 L461 M462	I421-N464 HydrophobicContact CG2-CB 4.16Å; Y426-N464 HydrophobicContact CD1-CB 4.43Å; Y426-N464 HydrophobicContact CE1-CB 3.72Å; Y426-N464 WeakPolarHBondContact CE2-O 3.44Å; Y426-N464 VanDerWaalsContact CZ-O 3.26Å; Y426-N464 PolarHBondContact OH-O 3.39Å; C460-N464 PolarHBondContact O-N 3.21Å; C460-N464 PolarHBondContact O-ND2 2.98Å; L461-N464 PolarHBondContact O-N 3.36Å; M462-N464 VanDerWaalsContact C-N 3.33Å; M462-N464 PolarHBondContact O-N 3.4Å
465	T	84.6	Confident	90.7	Very high	36 Å²	36	22.7 Å²	22.7	22%	0.221	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	27.1	172.1	55.6	0	0	0	0	112.9	Y426 L430 L461 M462 L463 K467	Y426-T465 HydrophobicContact CD2-CG2 3.69Å; Y426-T465 HydrophobicContact CE2-CG2 4.46Å; Y426-T465 HydrophobicContact CG-CG2 3.68Å; L430-T465 HydrophobicContact CD1-CG2 4.2Å; L461-T465 PolarHBondContact O-N 3.12Å; L461-T465 PolarHBondContact O-OG1 3.26Å; M462-T465 CarbonylContact O-C 2.96Å; M462-T465 PolarHBondContact O-N 3.12Å; M462-T465 VanDerWaalsContact O-N 3.07Å; M462-T465 PolarHBondContact O-OG1 3.28Å; L463-T465 PolarHBondContact O-N 2.57Å; T465-K467 PolarHBondContact O-N 2.86Å
466	D	79.1	Confident	90.7	Very high	53 Å²	53	27.4 Å²	27.4	28%	0.283	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	14.3	-178.6	-56.2	-9.7	0	0	0	115	L463 T468 S675 R711 Y800	L463-D466 PolarHBondContact O-N 3.13Å; D466-T468 VanDerWaalsContact C-N 3.28Å; D466-T468 PolarHBondContact O-N 3.33Å; D466-S675 PolarHBondContact OD2-OG 2.71Å; D466-R711 IonicContact OD2-CZ 3.24Å; D466-R711 IonicContact OD2-NH1 2.96Å; D466-R711 IonicContact OD2-NH2 2.69Å; D466-R711 PolarHBondContact OD2-NH2 3.22Å; D466-Y800 PolarHBondContact OD2-OH 3.36Å
467	K	84.4	Confident	90.7	Very high	43 Å²	43	29 Å²	29	19%	0.187	14%	0.138	C	C	.	.			trans	-91	52.7	178.1	-67.2	-172.2	172.5	-177.7	0	111.9	M462 T465 H469 K470 A471 E718 E721	M462-K467 HydrophobicContact CB-CB 4.26Å; M462-K467 HydrophobicContact CE-CD 4.09Å; M462-K467 WeakPolarHBondContact O-CA 3.29Å; M462-K467 WeakPolarHBondContact O-CB 3.48Å; M462-K467 PolarHBondContact O-N 2.87Å; M462-K467 HydrophobicContact SD-CB 3.75Å; M462-K467 HydrophobicContact SD-CD 3.73Å; M462-K467 HydrophobicContact SD-CG 4.32Å; T465-K467 PolarHBondContact O-N 2.86Å; K467-H469 PolarHBondContact O-N 3.46Å; K467-K470 HydrophobicContact CB-CB 4.29Å; K467-K470 PolarHBondContact O-N 2.89Å; K467-K470 VanDerWaalsContact O-N 3.14Å; K467-A471 PolarHBondContact O-N 2.9Å; K467-E718 WeakPolarHBondContact CE-OE1 3.37Å; K467-E718 IonicContact NZ-OE1 2.71Å; K467-E718 PolarHBondContact NZ-OE1 3.12Å; K467-E721 IonicContact NZ-OE1 2.71Å; K467-E721 PolarHBondContact NZ-OE1 3.27Å
468	T	85.8	Confident	90.7	Very high	29 Å²	29	28.5 Å²	28.5	18%	0.178	14%	0.136	C	C	.	.	H	α-helix	trans	-48.6	-52	-177	53.8	0	0	0	0	112.9	L463 D466 K470 A471 A472 V506	L463-T468 HydrophobicContact CD1-CG2 3.94Å; D466-T468 VanDerWaalsContact C-N 3.28Å; D466-T468 PolarHBondContact O-N 3.33Å; T468-K470 VanDerWaalsContact C-N 3.29Å; T468-K470 PolarHBondContact O-N 3.22Å; T468-A471 WeakPolarHBondContact O-CB 3.34Å; T468-A471 PolarHBondContact O-N 2.84Å; T468-A472 PolarHBondContact O-N 3.26Å; T468-V506 HydrophobicContact CG2-CB 4.08Å; T468-V506 HydrophobicContact CG2-CG1 3.61Å
469	H	87.8	Confident	90.8	Very high	127 Å²	127	29.2 Å²	29.2	59%	0.588	14%	0.14	S	C	*	.	H	α-helix	trans	-65.3	-30.6	-175.7	-155.1	-49.8	0	0	0	113	K467 E473 L507	K467-H469 PolarHBondContact O-N 3.46Å; H469-E473 PolarHBondContact O-N 3.03Å; H469-L507 HydrophobicContact CB-CD1 3.97Å
470	K	88.4	Confident	90.8	Very high	32 Å²	32	31.6 Å²	31.6	14%	0.139	16%	0.16	C	C	.	.	H	α-helix	trans	-78.9	-39.3	175.1	-165.1	67.7	179.2	172.6	0	111.3	M462 K467 T468 A472 E473 I474 D724	M462-K470 HydrophobicContact CG-CG 4.41Å; M462-K470 HydrophobicContact SD-CB 3.98Å; M462-K470 HydrophobicContact SD-CG 3.75Å; K467-K470 HydrophobicContact CB-CB 4.29Å; K467-K470 PolarHBondContact O-N 2.89Å; K467-K470 VanDerWaalsContact O-N 3.14Å; T468-K470 VanDerWaalsContact C-N 3.29Å; T468-K470 PolarHBondContact O-N 3.22Å; K470-A472 VanDerWaalsContact C-N 3.34Å; K470-A472 PolarHBondContact O-N 3.19Å; K470-E473 VanDerWaalsContact CD-OE2 3.27Å; K470-E473 WeakPolarHBondContact CD-OE2 3.35Å; K470-E473 WeakPolarHBondContact CE-OE2 3.41Å; K470-E473 IonicContact NZ-OE2 3.61Å; K470-E473 PolarHBondContact NZ-OE2 3.17Å; K470-E473 WeakPolarHBondContact O-CB 3.5Å; K470-E473 PolarHBondContact O-N 3.48Å; K470-I474 HydrophobicContact CG-CD1 3.97Å; K470-I474 WeakPolarHBondContact O-CD1 3.42Å; K470-I474 VanDerWaalsContact O-CG1 3.28Å; K470-I474 WeakPolarHBondContact O-CG1 3.42Å; K470-I474 PolarHBondContact O-N 2.71Å; K470-D724 PolarHBondContact NZ-O 3.47Å
471	A	91.6	Very high	90.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-47.4	171.4	0	0	0	0	0	111.4	G459 M462 L463 K467 T468 E473 I474 Y475	G459-A471 VanDerWaalsContact O-CB 3.31Å; G459-A471 WeakPolarHBondContact O-CB 3.34Å; M462-A471 HydrophobicContact CB-CB 3.87Å; L463-A471 HydrophobicContact CB-CB 3.96Å; K467-A471 PolarHBondContact O-N 2.9Å; T468-A471 WeakPolarHBondContact O-CB 3.34Å; T468-A471 PolarHBondContact O-N 2.84Å; A471-E473 VanDerWaalsContact C-N 3.33Å; A471-E473 PolarHBondContact O-N 3.19Å; A471-I474 PolarHBondContact O-N 3.33Å; A471-Y475 HydrophobicContact CB-CD2 4.33Å; A471-Y475 HydrophobicContact CB-CE2 4.01Å; A471-Y475 WeakPolarHBondContact O-CD2 3.46Å; A471-Y475 PolarHBondContact O-N 2.95Å
472	A	92.1	Very high	90.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-35.6	176.8	0	0	0	0	0	113.4	T468 K470 R476 A503 L507	T468-A472 PolarHBondContact O-N 3.26Å; K470-A472 VanDerWaalsContact C-N 3.34Å; K470-A472 PolarHBondContact O-N 3.19Å; A472-R476 WeakPolarHBondContact O-CG 3.1Å; A472-R476 PolarHBondContact O-N 3.02Å; A472-R476 PolarHBondContact O-NE 2.93Å; A472-A503 HydrophobicContact CB-CB 4.18Å; A472-L507 HydrophobicContact CB-CD2 4.45Å
473	E	93.9	Very high	90.9	Very high	65 Å²	65	35.2 Å²	35.2	30%	0.304	18%	0.178	S	C	.	.	H	α-helix	trans	-63.7	-53.6	170.7	-171.8	-162.9	-176.8	0	0	111.3	H469 K470 A471 Y475 R476 I477	H469-E473 PolarHBondContact O-N 3.03Å; K470-E473 VanDerWaalsContact CD-OE2 3.27Å; K470-E473 WeakPolarHBondContact CD-OE2 3.35Å; K470-E473 WeakPolarHBondContact CE-OE2 3.41Å; K470-E473 IonicContact NZ-OE2 3.61Å; K470-E473 PolarHBondContact NZ-OE2 3.17Å; K470-E473 WeakPolarHBondContact O-CB 3.5Å; K470-E473 PolarHBondContact O-N 3.48Å; A471-E473 VanDerWaalsContact C-N 3.33Å; A471-E473 PolarHBondContact O-N 3.19Å; E473-Y475 PolarHBondContact O-N 3.49Å; E473-R476 PolarHBondContact O-N 2.81Å; E473-I477 HydrophobicContact CG-CD1 4.03Å; E473-I477 PolarHBondContact O-N 2.63Å; E473-I477 VanDerWaalsContact O-N 3.12Å
474	I	94.5	Very high	91	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-44.2	-176.4	-68.9	159.2	0	0	0	111.4	L455 Y458 M462 K470 A471 R476 I477 A478 L726	L455-I474 HydrophobicContact CB-CG2 3.88Å; L455-I474 HydrophobicContact CD2-CG2 4.17Å; L455-I474 WeakPolarHBondContact O-CG2 3.45Å; Y458-I474 HydrophobicContact CD1-CD1 3.55Å; Y458-I474 HydrophobicContact CD1-CG1 4.17Å; Y458-I474 HydrophobicContact CD1-CG2 4.15Å; Y458-I474 HydrophobicContact CE1-CD1 3.51Å; Y458-I474 HydrophobicContact CE1-CG1 4.26Å; Y458-I474 HydrophobicContact CG-CD1 4.19Å; M462-I474 HydrophobicContact CG-CD1 3.75Å; K470-I474 HydrophobicContact CG-CD1 3.97Å; K470-I474 WeakPolarHBondContact O-CD1 3.42Å; K470-I474 VanDerWaalsContact O-CG1 3.28Å; K470-I474 WeakPolarHBondContact O-CG1 3.42Å; K470-I474 PolarHBondContact O-N 2.71Å; A471-I474 PolarHBondContact O-N 3.33Å; I474-R476 PolarHBondContact O-N 3.49Å; I474-I477 PolarHBondContact O-N 2.92Å; I474-A478 WeakPolarHBondContact O-CB 3.43Å; I474-A478 PolarHBondContact O-N 3.27Å; I474-L726 HydrophobicContact CG1-CD1 4.28Å
475	Y	96.3	Very high	91.2	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-37.3	179	-66.8	-51.4	0	0	0	112.8	I456 G459 C460 A471 E473 I477 A478 L479 A499 A503	I456-Y475 HydrophobicContact CD1-CD1 3.96Å; I456-Y475 HydrophobicContact CG2-CE1 4.19Å; I456-Y475 WeakPolarHBondContact O-CE1 3.47Å; G459-Y475 VanDerWaalsContact C-CZ 3.41Å; G459-Y475 VanDerWaalsContact C-OH 3.27Å; C460-Y475 VanDerWaalsContact CA-OH 3.23Å; C460-Y475 WeakPolarHBondContact CA-OH 3.46Å; C460-Y475 PolarHBondContact N-OH 2.73Å; C460-Y475 VanDerWaalsContact N-OH 3.09Å; A471-Y475 HydrophobicContact CB-CD2 4.33Å; A471-Y475 HydrophobicContact CB-CE2 4.01Å; A471-Y475 WeakPolarHBondContact O-CD2 3.46Å; A471-Y475 PolarHBondContact O-N 2.95Å; E473-Y475 PolarHBondContact O-N 3.49Å; Y475-I477 VanDerWaalsContact C-N 3.34Å; Y475-A478 PolarHBondContact O-N 2.94Å; Y475-L479 WeakPolarHBondContact O-CB 3.5Å; Y475-L479 PolarHBondContact O-N 2.87Å; Y475-A499 HydrophobicContact CD1-CB 3.75Å; Y475-A499 HydrophobicContact CD2-CB 4.29Å; Y475-A499 WeakPolarHBondContact CD2-O 3.47Å; Y475-A499 HydrophobicContact CE1-CB 3.63Å; Y475-A499 HydrophobicContact CE2-CB 4.2Å; Y475-A499 HydrophobicContact CG-CB 4.07Å; Y475-A503 HydrophobicContact CD2-CB 3.7Å; Y475-A503 HydrophobicContact CE2-CB 3.79Å
476	R	96	Very high	91.5	Very high	100 Å²	100	40.4 Å²	40.4	38%	0.377	20%	0.2	S	C	.	.	H	α-helix	trans	-64.9	-37.9	174.6	-77.4	176.6	-71.7	144.7	-6.3	112	A472 E473 I474 A480 I500	A472-R476 WeakPolarHBondContact O-CG 3.1Å; A472-R476 PolarHBondContact O-N 3.02Å; A472-R476 PolarHBondContact O-NE 2.93Å; E473-R476 PolarHBondContact O-N 2.81Å; I474-R476 PolarHBondContact O-N 3.49Å; R476-A480 WeakPolarHBondContact O-CB 3.28Å; R476-A480 PolarHBondContact O-N 3.25Å; R476-I500 HydrophobicContact CG-CD1 3.97Å; R476-I500 HydrophobicContact CG-CG1 4.29Å
477	I	95	Very high	91.9	Very high	62 Å²	62	38.2 Å²	38.2	32%	0.318	19%	0.189	S	C	.	.	H	α-helix	trans	-69.7	-40.7	175.5	-66.9	168.3	0	0	0	110.9	L455 E473 I474 Y475 A480 L481 L726	L455-I477 HydrophobicContact CD1-CG2 3.96Å; E473-I477 HydrophobicContact CG-CD1 4.03Å; E473-I477 PolarHBondContact O-N 2.63Å; E473-I477 VanDerWaalsContact O-N 3.12Å; I474-I477 PolarHBondContact O-N 2.92Å; Y475-I477 VanDerWaalsContact C-N 3.34Å; I477-A480 PolarHBondContact O-N 3.01Å; I477-L481 HydrophobicContact CG2-CD1 4.38Å; I477-L481 WeakPolarHBondContact O-CG 3.02Å; I477-L481 PolarHBondContact O-N 3.44Å; I477-L726 HydrophobicContact CD1-CD1 3.48Å; I477-L726 VanDerWaalsContact CD1-CD1 3.48Å; I477-L726 HydrophobicContact CG2-CD1 4.36Å
478	A	95.8	Very high	91.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-48.1	173.5	0	0	0	0	0	111.9	L455 I456 I474 Y475 A480 L481 I482	L455-A478 HydrophobicContact CB-CB 3.76Å; L455-A478 HydrophobicContact CD1-CB 4.39Å; I456-A478 HydrophobicContact CD1-CB 3.46Å; I456-A478 VanDerWaalsContact CD1-CB 3.46Å; I456-A478 HydrophobicContact CG1-CB 4.09Å; I474-A478 WeakPolarHBondContact O-CB 3.43Å; I474-A478 PolarHBondContact O-N 3.27Å; Y475-A478 PolarHBondContact O-N 2.94Å; A478-A480 PolarHBondContact O-N 3.03Å; A478-L481 PolarHBondContact O-N 3.4Å; A478-I482 VanDerWaalsContact O-CG1 3.28Å; A478-I482 WeakPolarHBondContact O-CG1 3.27Å; A478-I482 PolarHBondContact O-N 3.26Å
479	L	95.7	Very high	91.9	Very high	22 Å²	22	35.2 Å²	35.2	12%	0.115	18%	0.176	C	C	.	.	H	α-helix	trans	-56.8	-46.8	174.9	172.7	61.8	0	0	0	111.8	Y475 L481 I482 L483 V493 A496 L497 I500	Y475-L479 WeakPolarHBondContact O-CB 3.5Å; Y475-L479 PolarHBondContact O-N 2.87Å; L479-L481 VanDerWaalsContact C-N 3.32Å; L479-L481 PolarHBondContact O-N 3.29Å; L479-I482 PolarHBondContact O-N 3.49Å; L479-L483 HydrophobicContact CD1-CD1 3.79Å; L479-L483 HydrophobicContact CD1-CG 4.01Å; L479-L483 HydrophobicContact CG-CD1 3.93Å; L479-L483 WeakPolarHBondContact O-CG 3.29Å; L479-L483 PolarHBondContact O-N 2.88Å; L479-V493 HydrophobicContact CD1-CG1 3.82Å; L479-A496 HydrophobicContact CB-CB 4.1Å; L479-A496 HydrophobicContact CD1-CB 4.11Å; L479-L497 HydrophobicContact CD1-CG 4.33Å; L479-L497 HydrophobicContact CD2-CD2 3.77Å; L479-L497 HydrophobicContact CD2-CG 4.26Å; L479-I500 HydrophobicContact CB-CD1 3.9Å; L479-I500 HydrophobicContact CD2-CD1 3.45Å; L479-I500 VanDerWaalsContact CD2-CD1 3.45Å; L479-I500 HydrophobicContact CG-CD1 4.29Å
480	A	94.3	Very high	92.1	Very high	50 Å²	50	29.2 Å²	29.2	41%	0.413	15%	0.148	S	C	.	.	H	α-helix	trans	-62	-38.8	178.1	0	0	0	0	0	112.4	R476 I477 A478 N484	R476-A480 WeakPolarHBondContact O-CB 3.28Å; R476-A480 PolarHBondContact O-N 3.25Å; I477-A480 PolarHBondContact O-N 3.01Å; A478-A480 PolarHBondContact O-N 3.03Å; A480-N484 VanDerWaalsContact O-CG 3.25Å; A480-N484 PolarHBondContact O-N 2.99Å; A480-N484 PolarHBondContact O-ND2 3.27Å
481	L	93.1	Very high	92.3	Very high	20 Å²	20	27.8 Å²	27.8	11%	0.105	14%	0.142	C	C	.	.	H	α-helix	trans	-68.2	-39.2	173.9	-71.5	174	0	0	0	112.5	Y451 A452 L455 I477 A478 L479 N484 Y485	Y451-L481 HydrophobicContact CD1-CD1 3.97Å; Y451-L481 HydrophobicContact CE1-CD1 4.36Å; A452-L481 HydrophobicContact CB-CB 3.79Å; A452-L481 HydrophobicContact CB-CD1 4.42Å; L455-L481 HydrophobicContact CD1-CD1 3.84Å; I477-L481 HydrophobicContact CG2-CD1 4.38Å; I477-L481 WeakPolarHBondContact O-CG 3.02Å; I477-L481 PolarHBondContact O-N 3.44Å; A478-L481 PolarHBondContact O-N 3.4Å; L479-L481 VanDerWaalsContact C-N 3.32Å; L479-L481 PolarHBondContact O-N 3.29Å; L481-N484 PolarHBondContact O-N 2.96Å; L481-Y485 WeakPolarHBondContact O-CD2 3.31Å
482	I	94.1	Very high	92.4	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-48.1	176.5	-66.1	164.5	0	0	0	110.2	L449 A452 A478 L479 N484 Y485 L486 M492 V493 A496	L449-I482 HydrophobicContact CD2-CB 4.43Å; L449-I482 HydrophobicContact CD2-CG1 4.27Å; L449-I482 HydrophobicContact CD2-CG2 4.31Å; A452-I482 HydrophobicContact CB-CG1 3.84Å; A478-I482 VanDerWaalsContact O-CG1 3.28Å; A478-I482 WeakPolarHBondContact O-CG1 3.27Å; A478-I482 PolarHBondContact O-N 3.26Å; L479-I482 PolarHBondContact O-N 3.49Å; I482-N484 PolarHBondContact O-N 3.3Å; I482-Y485 PolarHBondContact O-N 3.21Å; I482-L486 HydrophobicContact CG2-CB 4.35Å; I482-L486 HydrophobicContact CG2-CD1 4.31Å; I482-L486 PolarHBondContact O-N 3.17Å; I482-M492 HydrophobicContact CD1-CE 4.3Å; I482-M492 HydrophobicContact CG1-CE 4.15Å; I482-M492 HydrophobicContact CG2-CB 3.87Å; I482-M492 HydrophobicContact CG2-CE 4.49Å; I482-V493 HydrophobicContact CG2-CG2 3.59Å; I482-A496 HydrophobicContact CD1-CB 3.97Å
483	L	92.3	Very high	92.5	Very high	64 Å²	64	28.5 Å²	28.5	34%	0.335	15%	0.145	S	C	.	.	H	α-helix	trans	-62	-25	-179.9	-74.8	168.6	0	0	0	114	L479 Y485 V493	L479-L483 HydrophobicContact CD1-CD1 3.79Å; L479-L483 HydrophobicContact CD1-CG 4.01Å; L479-L483 HydrophobicContact CG-CD1 3.93Å; L479-L483 WeakPolarHBondContact O-CG 3.29Å; L479-L483 PolarHBondContact O-N 2.88Å; L483-Y485 VanDerWaalsContact C-N 3.25Å; L483-Y485 PolarHBondContact O-N 3.45Å; L483-V493 HydrophobicContact CD2-CG1 4.01Å; L483-V493 HydrophobicContact CD2-CG2 3.71Å; L483-V493 HydrophobicContact CG-CG2 4.17Å
484	N	90.3	Very high	92.5	Very high	109 Å²	109	25.5 Å²	25.5	58%	0.583	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-18.3	173.5	-71.5	-34.8	0	0	0	113.5	F96 A480 L481 I482	F96-N484 WeakPolarHBondContact CD2-O 3.47Å; A480-N484 VanDerWaalsContact O-CG 3.25Å; A480-N484 PolarHBondContact O-N 2.99Å; A480-N484 PolarHBondContact O-ND2 3.27Å; L481-N484 PolarHBondContact O-N 2.96Å; I482-N484 PolarHBondContact O-N 3.3Å
485	Y	89.3	Confident	92.5	Very high	61 Å²	61	28.5 Å²	28.5	24%	0.239	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-35.7	177.2	-76	-84.1	0	0	0	112.8	F96 R447 L449 L481 I482 L483 P487	F96-Y485 WeakPolarHBondContact CA-O 3.48Å; R447-Y485 PolarHBondContact O-OH 2.99Å; L449-Y485 HydrophobicContact CD1-CG 4.33Å; L449-Y485 HydrophobicContact CD2-CG 4.43Å; L449-Y485 HydrophobicContact CG-CD2 4.25Å; L449-Y485 HydrophobicContact CG-CG 3.97Å; L481-Y485 WeakPolarHBondContact O-CD2 3.31Å; I482-Y485 PolarHBondContact O-N 3.21Å; L483-Y485 VanDerWaalsContact C-N 3.25Å; L483-Y485 PolarHBondContact O-N 3.45Å; Y485-P487 VanDerWaalsContact O-CD 3.28Å; Y485-P487 WeakPolarHBondContact O-CD 3.43Å
486	L	91.4	Very high	92.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-120.2	69.3	-177.7	-58.9	178.8	0	0	0	110.2	V95 S99 L449 I482 M492	V95-L486 HydrophobicContact CG1-CD2 3.64Å; S99-L486 WeakPolarHBondContact OG-CA 3.3Å; L449-L486 HydrophobicContact CD1-CD1 4.34Å; L449-L486 HydrophobicContact CD1-CG 4.29Å; L449-L486 HydrophobicContact CD2-CD1 4.15Å; L449-L486 HydrophobicContact CD2-CG 4.29Å; I482-L486 HydrophobicContact CG2-CB 4.35Å; I482-L486 HydrophobicContact CG2-CD1 4.31Å; I482-L486 PolarHBondContact O-N 3.17Å; L486-M492 HydrophobicContact CD1-CB 4.09Å; L486-M492 HydrophobicContact CD1-CG 4.26Å; L486-M492 HydrophobicContact CD1-SD 3.72Å
487	P	87.6	Confident	92.6	Very high	8 Å²	8	23.9 Å²	23.9	5%	0.052	13%	0.131	C	C	.	.			trans	-63.3	145.6	170.8	30.1	-38.8	0	0	0	110.8	F96 S99 W100 S104 Y485	F96-P487 HydrophobicContact CD2-CG 3.76Å; F96-P487 HydrophobicContact CE2-CB 4.17Å; F96-P487 HydrophobicContact CE2-CG 3.66Å; F96-P487 HydrophobicContact CG-CG 4.29Å; F96-P487 HydrophobicContact CZ-CG 4.1Å; S99-P487 PolarHBondContact OG-O 2.96Å; W100-P487 HydrophobicContact CB-CG 3.92Å; W100-P487 HydrophobicContact CD2-CB 4.47Å; W100-P487 HydrophobicContact CD2-CG 4.47Å; W100-P487 HydrophobicContact CE3-CB 3.57Å; W100-P487 HydrophobicContact CE3-CG 3.77Å; W100-P487 HydrophobicContact CZ3-CB 4.03Å; S104-P487 PolarHBondContact OG-O 3.13Å; Y485-P487 VanDerWaalsContact O-CD 3.28Å; Y485-P487 WeakPolarHBondContact O-CD 3.43Å
488	G	83.6	Confident	92.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	96.1	-154.3	-178	0	0	0	0	0	112.9	H103 S104 M527	H103-G488 WeakPolarHBondContact O-CA 3.27Å; S104-G488 WeakPolarHBondContact OG-CA 3.34Å; S104-G488 PolarHBondContact OG-N 3.45Å; G488-M527 WeakPolarHBondContact O-CE 3.37Å
489	A	86.9	Confident	92.7	Very high	9 Å²	9	22.7 Å²	22.7	7%	0.074	13%	0.127	C	C	.	.	S	Bend	trans	-79.9	136.6	170	0	0	0	0	0	111.4	H103 M527 L531	H103-A489 VanDerWaalsContact CB-O 3.31Å; H103-A489 WeakPolarHBondContact CB-O 3.43Å; H103-A489 PolarHBondContact CD2-O 2.92Å; H103-A489 VanDerWaalsContact CD2-O 3.25Å; H103-A489 VanDerWaalsContact CG-O 3.27Å; H103-A489 PolarHBondContact O-N 2.97Å; A489-M527 HydrophobicContact CB-CB 4.32Å; A489-M527 HydrophobicContact CB-CG 4.08Å; A489-M527 HydrophobicContact CB-SD 4.46Å; A489-L531 HydrophobicContact CB-CD1 4.28Å; A489-L531 HydrophobicContact CB-CD2 4.06Å; A489-L531 HydrophobicContact CB-CG 4.08Å
490	S	91.3	Very high	92.7	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.007	12%	0.121	C	C	.	.			trans	-155.5	159	165.4	65.2	0	0	0	0	110.6	M492 V493 A494	S490-M492 VanDerWaalsContact C-N 3.25Å; S490-M492 PolarHBondContact O-N 2.99Å; S490-V493 PolarHBondContact O-N 3.4Å; S490-V493 VanDerWaalsContact OG-CG2 3.22Å; S490-V493 WeakPolarHBondContact OG-CG2 3.45Å; S490-V493 PolarHBondContact OG-N 2.91Å; S490-A494 PolarHBondContact O-N 3.18Å
491	I	93.2	Very high	92.9	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-62.9	-37.1	177.3	-60	160.9	0	0	0	110	S182 Y184 H229 V493 A494 L495 L528 L531 Y533 Q538	S182-I491 WeakPolarHBondContact OG-CB 3.43Å; S182-I491 PolarHBondContact OG-N 3.32Å; Y184-I491 HydrophobicContact CD2-CD1 3.75Å; Y184-I491 HydrophobicContact CE2-CB 4.26Å; Y184-I491 HydrophobicContact CE2-CD1 4.24Å; Y184-I491 HydrophobicContact CE2-CG2 4.42Å; H229-I491 WeakPolarHBondContact ND1-CD1 3.48Å; I491-V493 PolarHBondContact O-N 3.38Å; I491-A494 PolarHBondContact O-N 3.42Å; I491-L495 HydrophobicContact CG2-CD1 3.91Å; I491-L495 HydrophobicContact CG2-CG 4.25Å; I491-L495 WeakPolarHBondContact O-CB 3.38Å; I491-L495 WeakPolarHBondContact O-CG 3.26Å; I491-L495 PolarHBondContact O-N 3.21Å; I491-L528 HydrophobicContact CG1-CD2 4.31Å; I491-L531 HydrophobicContact CG1-CD1 4.26Å; I491-Y533 HydrophobicContact CD1-CD2 3.98Å; I491-Y533 HydrophobicContact CD1-CE2 3.81Å; I491-Y533 HydrophobicContact CG1-CD2 4.08Å; I491-Y533 HydrophobicContact CG1-CE2 4.26Å; I491-Q538 HydrophobicContact CG2-CG 4.29Å
492	M	94.1	Very high	93	Very high	12 Å²	12	20 Å²	20	6%	0.059	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-41.6	174.9	-70.5	-170.6	60.1	0	0	113.1	S182 Y184 L449 N453 I482 L486 S490 A496	S182-M492 PolarHBondContact OG-N 3.46Å; Y184-M492 VanDerWaalsContact OH-CG 3.31Å; Y184-M492 WeakPolarHBondContact OH-CG 3.25Å; Y184-M492 PolarHBondContact OH-SD 2.96Å; L449-M492 HydrophobicContact CB-CE 4.49Å; L449-M492 HydrophobicContact CD2-CE 3.73Å; L449-M492 HydrophobicContact CD2-SD 4.38Å; N453-M492 WeakPolarHBondContact ND2-CE 3.35Å; N453-M492 WeakPolarHBondContact OD1-CE 3.49Å; I482-M492 HydrophobicContact CD1-CE 4.3Å; I482-M492 HydrophobicContact CG1-CE 4.15Å; I482-M492 HydrophobicContact CG2-CB 3.87Å; I482-M492 HydrophobicContact CG2-CE 4.49Å; L486-M492 HydrophobicContact CD1-CB 4.09Å; L486-M492 HydrophobicContact CD1-CG 4.26Å; L486-M492 HydrophobicContact CD1-SD 3.72Å; S490-M492 VanDerWaalsContact C-N 3.25Å; S490-M492 PolarHBondContact O-N 2.99Å; M492-A496 WeakPolarHBondContact O-CB 3.25Å; M492-A496 PolarHBondContact O-N 3.24Å; M492-A496 VanDerWaalsContact O-N 3.13Å
493	V	94.1	Very high	93	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.012	10%	0.103	C	C	.	.	H	α-helix	trans	-68.3	-42.4	175.6	173.6	0	0	0	0	110.9	L479 I482 L483 S490 I491 A496 L497 M527	L479-V493 HydrophobicContact CD1-CG1 3.82Å; I482-V493 HydrophobicContact CG2-CG2 3.59Å; L483-V493 HydrophobicContact CD2-CG1 4.01Å; L483-V493 HydrophobicContact CD2-CG2 3.71Å; L483-V493 HydrophobicContact CG-CG2 4.17Å; S490-V493 PolarHBondContact O-N 3.4Å; S490-V493 VanDerWaalsContact OG-CG2 3.22Å; S490-V493 WeakPolarHBondContact OG-CG2 3.45Å; S490-V493 PolarHBondContact OG-N 2.91Å; I491-V493 PolarHBondContact O-N 3.38Å; V493-A496 PolarHBondContact O-N 3.19Å; V493-L497 HydrophobicContact CG1-CD1 3.91Å; V493-L497 HydrophobicContact CG1-CG 4.49Å; V493-L497 WeakPolarHBondContact O-CG 3.49Å; V493-L497 PolarHBondContact O-N 3.44Å; V493-M527 HydrophobicContact CB-SD 4.02Å; V493-M527 HydrophobicContact CG1-CE 3.81Å; V493-M527 HydrophobicContact CG1-SD 3.42Å; V493-M527 WeakPolarHBondContact CG1-SD 3.34Å
494	A	94.2	Very high	93.2	Very high	2 Å²	2	17.7 Å²	17.7	2%	0.017	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-43.8	177.6	0	0	0	0	0	112.6	S490 I491 A496 L497 E498 A524 M527 L528	S490-A494 PolarHBondContact O-N 3.18Å; I491-A494 PolarHBondContact O-N 3.42Å; A494-A496 PolarHBondContact O-N 3.15Å; A494-L497 PolarHBondContact O-N 3.04Å; A494-E498 PolarHBondContact O-N 3.18Å; A494-A524 HydrophobicContact CB-CB 4.42Å; A494-A524 WeakPolarHBondContact O-CB 3.45Å; A494-M527 HydrophobicContact CB-CB 4.19Å; A494-L528 HydrophobicContact CB-CD1 4.35Å; A494-L528 HydrophobicContact CB-CD2 4Å; A494-L528 HydrophobicContact CB-CG 3.82Å
495	L	94.5	Very high	93.3	Very high	63 Å²	63	12.7 Å²	12.7	33%	0.33	6%	0.063	S	C	.	.	H	α-helix	trans	-65	-36.5	175.9	-73.9	171.9	0	0	0	112.7	I491 A499 Q538	I491-L495 HydrophobicContact CG2-CD1 3.91Å; I491-L495 HydrophobicContact CG2-CG 4.25Å; I491-L495 WeakPolarHBondContact O-CB 3.38Å; I491-L495 WeakPolarHBondContact O-CG 3.26Å; I491-L495 PolarHBondContact O-N 3.21Å; L495-A499 WeakPolarHBondContact O-CB 3.3Å; L495-A499 PolarHBondContact O-N 2.97Å; L495-Q538 HydrophobicContact CD2-CB 4.32Å; L495-Q538 HydrophobicContact CD2-CG 3.85Å; L495-Q538 HydrophobicContact CG-CG 4.38Å
496	A	96.2	Very high	93.4	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.008	6%	0.056	C	C	.	.	H	α-helix	trans	-67.8	-38.4	174.1	0	0	0	0	0	111.8	I456 L479 I482 M492 V493 A494 A499 I500	I456-A496 HydrophobicContact CD1-CB 3.99Å; L479-A496 HydrophobicContact CB-CB 4.1Å; L479-A496 HydrophobicContact CD1-CB 4.11Å; I482-A496 HydrophobicContact CD1-CB 3.97Å; M492-A496 WeakPolarHBondContact O-CB 3.25Å; M492-A496 PolarHBondContact O-N 3.24Å; M492-A496 VanDerWaalsContact O-N 3.13Å; V493-A496 PolarHBondContact O-N 3.19Å; A494-A496 PolarHBondContact O-N 3.15Å; A496-A499 PolarHBondContact O-N 3.31Å; A496-I500 VanDerWaalsContact O-CG1 3.3Å; A496-I500 WeakPolarHBondContact O-CG1 3.36Å; A496-I500 PolarHBondContact O-N 3.3Å
497	L	96.7	Very high	93.2	Very high	12 Å²	12	12 Å²	12	6%	0.063	7%	0.065	C	C	.	.	H	α-helix	trans	-67.1	-40.6	174.4	-75.3	165.2	0	0	0	112.8	L479 V493 A494 A499 I500 A501 C520 I523 A524 M527	L479-L497 HydrophobicContact CD1-CG 4.33Å; L479-L497 HydrophobicContact CD2-CD2 3.77Å; L479-L497 HydrophobicContact CD2-CG 4.26Å; V493-L497 HydrophobicContact CG1-CD1 3.91Å; V493-L497 HydrophobicContact CG1-CG 4.49Å; V493-L497 WeakPolarHBondContact O-CG 3.49Å; V493-L497 PolarHBondContact O-N 3.44Å; A494-L497 PolarHBondContact O-N 3.04Å; L497-A499 VanDerWaalsContact C-N 3.32Å; L497-A499 PolarHBondContact O-N 3.39Å; L497-I500 PolarHBondContact O-N 3.36Å; L497-A501 WeakPolarHBondContact O-CB 3.33Å; L497-A501 PolarHBondContact O-N 2.9Å; L497-C520 HydrophobicContact CD2-CB 4.38Å; L497-I523 HydrophobicContact CD1-CB 4Å; L497-I523 HydrophobicContact CD1-CG2 3.52Å; L497-A524 HydrophobicContact CB-CB 3.96Å; L497-M527 HydrophobicContact CD1-SD 4.11Å
498	E	96.4	Very high	93.3	Very high	20 Å²	20	13.9 Å²	13.9	9%	0.093	7%	0.073	C	C	.	.	H	α-helix	trans	-58.7	-44.6	171.8	-172.5	-160.1	151.1	0	0	111	A494 A501 Y502 S541 R544 V545	A494-E498 PolarHBondContact O-N 3.18Å; E498-A501 PolarHBondContact O-N 2.94Å; E498-Y502 PolarHBondContact O-N 3.32Å; E498-S541 VanDerWaalsContact OE1-CB 3.27Å; E498-S541 WeakPolarHBondContact OE1-CB 3.42Å; E498-S541 PolarHBondContact OE1-OG 3.06Å; E498-R544 IonicContact OE1-NH2 2.74Å; E498-V545 HydrophobicContact CG-CB 4.46Å; E498-V545 HydrophobicContact CG-CG2 3.94Å
499	A	96.7	Very high	93.3	Very high	16 Å²	16	17.9 Å²	17.9	13%	0.132	9%	0.088	C	C	.	.	H	α-helix	trans	-65.2	-38.4	179.1	0	0	0	0	0	112.8	Y475 L495 A496 L497 A503	Y475-A499 HydrophobicContact CD1-CB 3.75Å; Y475-A499 HydrophobicContact CD2-CB 4.29Å; Y475-A499 WeakPolarHBondContact CD2-O 3.47Å; Y475-A499 HydrophobicContact CE1-CB 3.63Å; Y475-A499 HydrophobicContact CE2-CB 4.2Å; Y475-A499 HydrophobicContact CG-CB 4.07Å; L495-A499 WeakPolarHBondContact O-CB 3.3Å; L495-A499 PolarHBondContact O-N 2.97Å; A496-A499 PolarHBondContact O-N 3.31Å; L497-A499 VanDerWaalsContact C-N 3.32Å; L497-A499 PolarHBondContact O-N 3.39Å; A499-A503 VanDerWaalsContact O-CB 3.25Å; A499-A503 WeakPolarHBondContact O-CB 3.22Å; A499-A503 PolarHBondContact O-N 2.94Å
500	I	97.1	Very high	92.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64	-46.4	171.2	-67.9	167.1	0	0	0	110.6	R476 L479 A496 L497 Y502 A503 H504 Y516 C520	R476-I500 HydrophobicContact CG-CD1 3.97Å; R476-I500 HydrophobicContact CG-CG1 4.29Å; L479-I500 HydrophobicContact CB-CD1 3.9Å; L479-I500 HydrophobicContact CD2-CD1 3.45Å; L479-I500 VanDerWaalsContact CD2-CD1 3.45Å; L479-I500 HydrophobicContact CG-CD1 4.29Å; A496-I500 VanDerWaalsContact O-CG1 3.3Å; A496-I500 WeakPolarHBondContact O-CG1 3.36Å; A496-I500 PolarHBondContact O-N 3.3Å; L497-I500 PolarHBondContact O-N 3.36Å; I500-Y502 PolarHBondContact O-N 3.38Å; I500-A503 PolarHBondContact O-N 3.31Å; I500-H504 PolarHBondContact O-CD2 3.35Å; I500-H504 PolarHBondContact O-N 3.2Å; I500-Y516 HydrophobicContact CG2-CE1 3.61Å; I500-C520 HydrophobicContact CG2-CB 4.35Å
501	A	97.1	Very high	92.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59	-48	-179.5	0	0	0	0	0	111.9	L497 E498 H504 Y505 A517 C520 A521 V545 I549	L497-A501 WeakPolarHBondContact O-CB 3.33Å; L497-A501 PolarHBondContact O-N 2.9Å; E498-A501 PolarHBondContact O-N 2.94Å; A501-H504 PolarHBondContact O-N 3.1Å; A501-Y505 WeakPolarHBondContact O-CB 3.48Å; A501-Y505 PolarHBondContact O-N 2.98Å; A501-A517 VanDerWaalsContact CB-O 3.26Å; A501-A517 WeakPolarHBondContact CB-O 3.46Å; A501-C520 HydrophobicContact CB-CB 3.8Å; A501-A521 HydrophobicContact CB-CB 3.84Å; A501-V545 HydrophobicContact CB-CG1 3.84Å; A501-I549 HydrophobicContact CB-CD1 4.35Å
502	Y	95.7	Very high	92.5	Very high	36 Å²	36	28.8 Å²	28.8	14%	0.141	16%	0.164	C	C	.	.	H	α-helix	trans	-68.7	-34.8	176.9	-176.9	-126.2	0	0	0	112.5	L463 E498 I500 Y505 V506 T798	L463-Y502 HydrophobicContact CD2-CD1 3.67Å; L463-Y502 HydrophobicContact CD2-CE1 3.67Å; E498-Y502 PolarHBondContact O-N 3.32Å; I500-Y502 PolarHBondContact O-N 3.38Å; Y502-Y505 AromaticContact CD2-CD1 3.88Å; Y502-Y505 HydrophobicContact CD2-CD1 3.88Å; Y502-Y505 AromaticContact CE2-CD1 3.89Å; Y502-Y505 HydrophobicContact CE2-CD1 3.89Å; Y502-Y505 HydrophobicContact CE2-CE1 4.23Å; Y502-Y505 PolarHBondContact O-N 3Å; Y502-V506 HydrophobicContact CD2-CG2 4.37Å; Y502-V506 HydrophobicContact CE2-CG2 3.96Å; Y502-V506 WeakPolarHBondContact O-CG2 3.42Å; Y502-V506 PolarHBondContact O-N 3.22Å; Y502-T798 PolarHBondContact OH-O 3.35Å
503	A	95.1	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-38.6	174.7	0	0	0	0	0	113	A472 Y475 A499 I500 L507	A472-A503 HydrophobicContact CB-CB 4.18Å; Y475-A503 HydrophobicContact CD2-CB 3.7Å; Y475-A503 HydrophobicContact CE2-CB 3.79Å; A499-A503 VanDerWaalsContact O-CB 3.25Å; A499-A503 WeakPolarHBondContact O-CB 3.22Å; A499-A503 PolarHBondContact O-N 2.94Å; I500-A503 PolarHBondContact O-N 3.31Å; A503-L507 WeakPolarHBondContact O-CB 2.96Å; A503-L507 PolarHBondContact O-N 2.96Å; A503-L507 VanDerWaalsContact O-N 3.12Å
504	H	94.7	Very high	92.4	Very high	18 Å²	18	33 Å²	33	8%	0.083	19%	0.186	C	C	.	.	H	α-helix	trans	-75.9	-33.5	174.6	-82.8	-90.3	0	0	0	112.6	I500 A501 V506 L507 E508 Y516 A517	I500-H504 PolarHBondContact O-CD2 3.35Å; I500-H504 PolarHBondContact O-N 3.2Å; A501-H504 PolarHBondContact O-N 3.1Å; H504-V506 VanDerWaalsContact C-N 3.33Å; H504-V506 PolarHBondContact O-N 3.19Å; H504-L507 PolarHBondContact O-N 3.17Å; H504-L507 VanDerWaalsContact O-N 3.13Å; H504-E508 IonicContact ND1-OE1 2.69Å; H504-E508 WeakPolarHBondContact O-CB 2.96Å; H504-E508 WeakPolarHBondContact O-CG 3.45Å; H504-E508 PolarHBondContact O-N 3.48Å; H504-Y516 HydrophobicContact CB-CD1 4.38Å; H504-Y516 AromaticContact CD2-CD1 3.72Å; H504-Y516 AromaticContact CD2-CE1 3.62Å; H504-Y516 AromaticContact CE1-CD1 3.84Å; H504-Y516 AromaticContact CE1-CE1 3.98Å; H504-Y516 AromaticContact CG-CD1 3.72Å; H504-Y516 AromaticContact ND1-CD1 3.81Å; H504-Y516 AromaticContact NE2-CD1 3.8Å; H504-Y516 AromaticContact NE2-CE1 3.53Å; H504-A517 HydrophobicContact CB-CB 3.84Å
505	Y	94	Very high	92.4	Very high	3 Å²	3	36 Å²	36	1%	0.012	21%	0.211	C	C	.	.	H	α-helix	trans	-52.3	-49.8	168.4	162.8	-89.3	0	0	0	111.6	A501 Y502 L507 Y509 F514 L548 I549 E552 R601 Y800	A501-Y505 WeakPolarHBondContact O-CB 3.48Å; A501-Y505 PolarHBondContact O-N 2.98Å; Y502-Y505 AromaticContact CD2-CD1 3.88Å; Y502-Y505 HydrophobicContact CD2-CD1 3.88Å; Y502-Y505 AromaticContact CE2-CD1 3.89Å; Y502-Y505 HydrophobicContact CE2-CD1 3.89Å; Y502-Y505 HydrophobicContact CE2-CE1 4.23Å; Y502-Y505 PolarHBondContact O-N 3Å; Y505-L507 VanDerWaalsContact C-N 3.33Å; Y505-L507 PolarHBondContact O-N 3.16Å; Y505-Y509 HydrophobicContact CE2-CD2 4.38Å; Y505-Y509 PolarHBondContact O-N 3.37Å; Y505-F514 HydrophobicContact CD2-CE1 4.46Å; Y505-L548 HydrophobicContact CD2-CB 4.42Å; Y505-L548 HydrophobicContact CE2-CB 4.04Å; Y505-I549 HydrophobicContact CD2-CG1 3.86Å; Y505-I549 HydrophobicContact CG-CG1 4.28Å; Y505-E552 HydrophobicContact CD2-CG 4.35Å; Y505-E552 HydrophobicContact CE2-CG 3.71Å; Y505-E552 WeakPolarHBondContact CE2-OE1 3.34Å; Y505-E552 PolarHBondContact OH-OE1 3.48Å; Y505-R601 PolarHBondContact OH-NH1 3.03Å; Y505-Y800 PolarHBondContact OH-O 3.22Å
506	V	90.2	Very high	92.3	Very high	15 Å²	15	37.7 Å²	37.7	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-24	179.1	-168.8	0	0	0	0	112.5	L463 T468 Y502 H504 Y800	L463-V506 HydrophobicContact CD1-CB 4.3Å; L463-V506 HydrophobicContact CD1-CG2 4.39Å; T468-V506 HydrophobicContact CG2-CB 4.08Å; T468-V506 HydrophobicContact CG2-CG1 3.61Å; Y502-V506 HydrophobicContact CD2-CG2 4.37Å; Y502-V506 HydrophobicContact CE2-CG2 3.96Å; Y502-V506 WeakPolarHBondContact O-CG2 3.42Å; Y502-V506 PolarHBondContact O-N 3.22Å; H504-V506 VanDerWaalsContact C-N 3.33Å; H504-V506 PolarHBondContact O-N 3.19Å; V506-Y800 HydrophobicContact CG1-CD2 3.7Å; V506-Y800 HydrophobicContact CG1-CE2 4.38Å; V506-Y800 HydrophobicContact CG1-CG 4.18Å
507	L	88.5	Confident	92.3	Very high	33 Å²	33	37.6 Å²	37.6	17%	0.173	21%	0.213	C	C	.	.	H	α-helix	trans	-78.2	-44.4	178.6	-178.7	62.7	0	0	0	112.4	H469 A472 A503 H504 Y505 Y509	H469-L507 HydrophobicContact CB-CD1 3.97Å; A472-L507 HydrophobicContact CB-CD2 4.45Å; A503-L507 WeakPolarHBondContact O-CB 2.96Å; A503-L507 PolarHBondContact O-N 2.96Å; A503-L507 VanDerWaalsContact O-N 3.12Å; H504-L507 PolarHBondContact O-N 3.17Å; H504-L507 VanDerWaalsContact O-N 3.13Å; Y505-L507 VanDerWaalsContact C-N 3.33Å; Y505-L507 PolarHBondContact O-N 3.16Å; L507-Y509 VanDerWaalsContact C-N 3.34Å
508	E	89.8	Confident	92.2	Very high	47 Å²	47	38.7 Å²	38.7	22%	0.22	22%	0.219	C	C	.	.	H	α-helix	trans	-90	2.8	-172.9	-53.7	-54.9	157.7	0	0	113.1	H504 T510 S511 G512 D513 F514	H504-E508 IonicContact ND1-OE1 2.69Å; H504-E508 WeakPolarHBondContact O-CB 2.96Å; H504-E508 WeakPolarHBondContact O-CG 3.45Å; H504-E508 PolarHBondContact O-N 3.48Å; E508-T510 PolarHBondContact O-N 3Å; E508-S511 WeakPolarHBondContact CA-OG 3.32Å; E508-S511 WeakPolarHBondContact CB-OG 3.38Å; E508-S511 PolarHBondContact O-N 3.33Å; E508-S511 PolarHBondContact O-OG 3.09Å; E508-S511 PolarHBondContact OE2-OG 3.18Å; E508-G512 PolarHBondContact O-N 3.06Å; E508-D513 WeakPolarHBondContact CG-O 3.32Å; E508-F514 HydrophobicContact CB-CD1 4.22Å; E508-F514 HydrophobicContact CB-CE1 4.37Å
509	Y	83.3	Confident	92.1	Very high	83 Å²	83	40.5 Å²	40.5	33%	0.325	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.1	178.8	-160.7	-90.3	0	0	0	114.2	Y505 L507 E552 Y800	Y505-Y509 HydrophobicContact CE2-CD2 4.38Å; Y505-Y509 PolarHBondContact O-N 3.37Å; L507-Y509 VanDerWaalsContact C-N 3.34Å; Y509-E552 HydrophobicContact CE2-CG 4.34Å; Y509-Y800 WeakPolarHBondContact CE2-O 3.27Å; Y509-Y800 PolarHBondContact OH-OXT 3.28Å
510	T	78.8	Confident	92	Very high	140 Å²	140	39.9 Å²	39.9	86%	0.859	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-4	175.2	57.9	0	0	0	0	114.2	E508	E508-T510 PolarHBondContact O-N 3Å
511	S	87.9	Confident	91.9	Very high	69 Å²	69	40 Å²	40	48%	0.483	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-28.7	178.3	69.4	0	0	0	0	112.9	E508 D513	E508-S511 WeakPolarHBondContact CA-OG 3.32Å; E508-S511 WeakPolarHBondContact CB-OG 3.38Å; E508-S511 PolarHBondContact O-N 3.33Å; E508-S511 PolarHBondContact O-OG 3.09Å; E508-S511 PolarHBondContact OE2-OG 3.18Å; S511-D513 PolarHBondContact O-N 3.24Å; S511-D513 PolarHBondContact OG-N 3.07Å
512	G	87.8	Confident	91.6	Very high	33 Å²	33	41.5 Å²	41.5	34%	0.34	23%	0.231	S	C	.	.			trans	79	-3.7	-172.5	0	0	0	0	0	114.2	E508 F514	E508-G512 PolarHBondContact O-N 3.06Å; G512-F514 VanDerWaalsContact O-CD2 3.29Å; G512-F514 WeakPolarHBondContact O-CD2 3.32Å; G512-F514 PolarHBondContact O-N 3.32Å
513	D	91.7	Very high	91.4	Very high	97 Å²	97	40.2 Å²	40.2	52%	0.519	23%	0.227	S	C	.	.			trans	-83.1	65.4	-177.7	-169.5	5.4	0	0	0	112.5	E508 S511 A515	E508-D513 WeakPolarHBondContact CG-O 3.32Å; S511-D513 PolarHBondContact O-N 3.24Å; S511-D513 PolarHBondContact OG-N 3.07Å; D513-A515 PolarHBondContact O-N 3.27Å; D513-A515 WeakPolarHBondContact OD1-CB 3.45Å; D513-A515 PolarHBondContact OD1-N 2.78Å
514	F	94.7	Very high	91.2	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.026	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	4.1	177.1	-53.7	-71	0	0	0	113.8	Y505 E508 G512 Y516 A517 L518 I549 E552 I553	Y505-F514 HydrophobicContact CD2-CE1 4.46Å; E508-F514 HydrophobicContact CB-CD1 4.22Å; E508-F514 HydrophobicContact CB-CE1 4.37Å; G512-F514 VanDerWaalsContact O-CD2 3.29Å; G512-F514 WeakPolarHBondContact O-CD2 3.32Å; G512-F514 PolarHBondContact O-N 3.32Å; F514-Y516 PolarHBondContact O-N 3.01Å; F514-A517 WeakPolarHBondContact O-CB 3.48Å; F514-A517 PolarHBondContact O-N 3.35Å; F514-A517 VanDerWaalsContact O-N 3.12Å; F514-L518 WeakPolarHBondContact O-CB 3.42Å; F514-L518 PolarHBondContact O-N 3.49Å; F514-I549 HydrophobicContact CB-CG2 3.87Å; F514-E552 HydrophobicContact CD2-CB 3.98Å; F514-E552 HydrophobicContact CE1-CB 4.45Å; F514-E552 HydrophobicContact CE1-CG 4.28Å; F514-E552 HydrophobicContact CE2-CB 3.36Å; F514-E552 HydrophobicContact CE2-CG 4.06Å; F514-E552 HydrophobicContact CZ-CB 3.63Å; F514-E552 HydrophobicContact CZ-CG 3.79Å; F514-I553 HydrophobicContact CB-CD1 3.98Å; F514-I553 HydrophobicContact CB-CG1 3.97Å; F514-I553 HydrophobicContact CD2-CG1 3.9Å; F514-I553 HydrophobicContact CG-CG1 4.34Å
515	A	92.9	Very high	91	Very high	64 Å²	64	39.7 Å²	39.7	53%	0.529	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-40.8	-171.6	0	0	0	0	0	112.8	D513 N519	D513-A515 PolarHBondContact O-N 3.27Å; D513-A515 WeakPolarHBondContact OD1-CB 3.45Å; D513-A515 PolarHBondContact OD1-N 2.78Å; A515-N519 WeakPolarHBondContact O-CB 3.41Å; A515-N519 PolarHBondContact O-N 3.09Å; A515-N519 VanDerWaalsContact O-N 3.16Å
516	Y	93.5	Very high	90.6	Very high	98 Å²	98	40.4 Å²	40.4	38%	0.384	23%	0.23	S	C	.	.	H	α-helix	trans	-69	-40.8	175	-177	-108.5	0	0	0	112.1	I500 H504 F514 N519 C520	I500-Y516 HydrophobicContact CG2-CE1 3.61Å; H504-Y516 HydrophobicContact CB-CD1 4.38Å; H504-Y516 AromaticContact CD2-CD1 3.72Å; H504-Y516 AromaticContact CD2-CE1 3.62Å; H504-Y516 AromaticContact CE1-CD1 3.84Å; H504-Y516 AromaticContact CE1-CE1 3.98Å; H504-Y516 AromaticContact CG-CD1 3.72Å; H504-Y516 AromaticContact ND1-CD1 3.81Å; H504-Y516 AromaticContact NE2-CD1 3.8Å; H504-Y516 AromaticContact NE2-CE1 3.53Å; F514-Y516 PolarHBondContact O-N 3.01Å; Y516-N519 PolarHBondContact O-N 3.09Å; Y516-C520 PolarHBondContact O-N 3.43Å
517	A	95.1	Very high	90.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-48.4	178	0	0	0	0	0	111.6	A501 H504 F514 N519 C520 A521 I549	A501-A517 VanDerWaalsContact CB-O 3.26Å; A501-A517 WeakPolarHBondContact CB-O 3.46Å; H504-A517 HydrophobicContact CB-CB 3.84Å; F514-A517 WeakPolarHBondContact O-CB 3.48Å; F514-A517 PolarHBondContact O-N 3.35Å; F514-A517 VanDerWaalsContact O-N 3.12Å; A517-N519 PolarHBondContact O-N 2.89Å; A517-C520 PolarHBondContact O-N 3.2Å; A517-A521 PolarHBondContact O-N 3.04Å; A517-I549 HydrophobicContact CB-CD1 3.8Å; A517-I549 HydrophobicContact CB-CG1 4.33Å
518	L	95.6	Very high	90.6	Very high	35 Å²	35	38.6 Å²	38.6	18%	0.183	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-49.2	177.7	179.6	57.3	0	0	0	110.9	F514 C520 A521 E522 K546 I549 I550 I553	F514-L518 WeakPolarHBondContact O-CB 3.42Å; F514-L518 PolarHBondContact O-N 3.49Å; L518-C520 VanDerWaalsContact C-N 3.34Å; L518-C520 PolarHBondContact O-N 3.35Å; L518-A521 PolarHBondContact O-N 2.87Å; L518-E522 HydrophobicContact CD1-CG 4.14Å; L518-E522 HydrophobicContact CG-CG 4.48Å; L518-E522 WeakPolarHBondContact O-CB 3.3Å; L518-E522 WeakPolarHBondContact O-CG 3.21Å; L518-E522 PolarHBondContact O-N 2.76Å; L518-K546 HydrophobicContact CD1-CG 4.04Å; L518-I549 HydrophobicContact CB-CG2 3.73Å; L518-I549 HydrophobicContact CD1-CG2 4.18Å; L518-I549 HydrophobicContact CG-CG2 4.46Å; L518-I550 HydrophobicContact CD1-CD1 4.22Å; L518-I550 HydrophobicContact CD1-CG1 3.89Å; L518-I553 HydrophobicContact CB-CD1 4.46Å; L518-I553 HydrophobicContact CD2-CD1 3.86Å
519	N	94	Very high	90.5	Very high	58 Å²	58	43.3 Å²	43.3	31%	0.31	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-43.9	178.5	-177.5	53.7	0	0	0	111.8	A515 Y516 A517 E522 I523	A515-N519 WeakPolarHBondContact O-CB 3.41Å; A515-N519 PolarHBondContact O-N 3.09Å; A515-N519 VanDerWaalsContact O-N 3.16Å; Y516-N519 PolarHBondContact O-N 3.09Å; A517-N519 PolarHBondContact O-N 2.89Å; N519-E522 PolarHBondContact O-N 3.31Å; N519-I523 VanDerWaalsContact O-CD1 3.31Å; N519-I523 WeakPolarHBondContact O-CD1 3.31Å; N519-I523 WeakPolarHBondContact O-CG1 3.47Å; N519-I523 PolarHBondContact O-N 3.49Å
520	C	95	Very high	90.5	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-43.2	175.1	-78.3	0	0	0	0	113	L497 I500 A501 Y516 A517 L518 E522 I523 A524	L497-C520 HydrophobicContact CD2-CB 4.38Å; I500-C520 HydrophobicContact CG2-CB 4.35Å; A501-C520 HydrophobicContact CB-CB 3.8Å; Y516-C520 PolarHBondContact O-N 3.43Å; A517-C520 PolarHBondContact O-N 3.2Å; L518-C520 VanDerWaalsContact C-N 3.34Å; L518-C520 PolarHBondContact O-N 3.35Å; C520-E522 VanDerWaalsContact C-N 3.33Å; C520-E522 PolarHBondContact O-N 2.97Å; C520-I523 PolarHBondContact O-N 3.3Å; C520-A524 PolarHBondContact O-N 3.17Å
521	A	94.3	Very high	90.9	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-38.5	176.7	0	0	0	0	0	112.1	A501 A517 L518 A524 G525 V545 K546 I549	A501-A521 HydrophobicContact CB-CB 3.84Å; A517-A521 PolarHBondContact O-N 3.04Å; L518-A521 PolarHBondContact O-N 2.87Å; A521-A524 PolarHBondContact O-N 3.01Å; A521-G525 PolarHBondContact O-N 3.46Å; A521-G525 VanDerWaalsContact O-N 3.07Å; A521-V545 HydrophobicContact CB-CG1 4.33Å; A521-K546 HydrophobicContact CB-CB 3.99Å; A521-I549 HydrophobicContact CB-CD1 4.27Å
522	E	91.5	Very high	91	Very high	31 Å²	31	37.2 Å²	37.2	15%	0.145	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-40.7	177.3	-73	-174	113.1	0	0	113.2	K125 L518 N519 C520 A524 G525 L526 K546	K125-E522 WeakPolarHBondContact CE-OE2 3.43Å; K125-E522 IonicContact NZ-OE1 2.71Å; K125-E522 PolarHBondContact NZ-OE1 3.3Å; K125-E522 VanDerWaalsContact NZ-OE1 3.12Å; K125-E522 IonicContact NZ-OE2 3.66Å; K125-E522 PolarHBondContact NZ-OE2 2.75Å; L518-E522 HydrophobicContact CD1-CG 4.14Å; L518-E522 HydrophobicContact CG-CG 4.48Å; L518-E522 WeakPolarHBondContact O-CB 3.3Å; L518-E522 WeakPolarHBondContact O-CG 3.21Å; L518-E522 PolarHBondContact O-N 2.76Å; N519-E522 PolarHBondContact O-N 3.31Å; C520-E522 VanDerWaalsContact C-N 3.33Å; C520-E522 PolarHBondContact O-N 2.97Å; E522-A524 VanDerWaalsContact C-N 3.32Å; E522-G525 PolarHBondContact O-N 3.2Å; E522-L526 VanDerWaalsContact O-CB 3.31Å; E522-L526 WeakPolarHBondContact O-CB 3.32Å; E522-L526 VanDerWaalsContact O-CG 3.27Å; E522-L526 WeakPolarHBondContact O-CG 3.4Å; E522-L526 PolarHBondContact O-N 3.41Å; E522-K546 HydrophobicContact CG-CD 3.81Å; E522-K546 IonicContact OE1-NZ 3.65Å; E522-K546 PolarHBondContact OE1-NZ 3.39Å
523	I	90.2	Very high	91	Very high	10 Å²	10	36.9 Å²	36.9	5%	0.051	18%	0.183	C	C	.	.	H	α-helix	trans	-65.6	-38.7	175.2	-58.4	154.4	0	0	0	110.1	V123 L497 N519 C520 L526 M527	V123-I523 HydrophobicContact CB-CD1 4.34Å; V123-I523 HydrophobicContact CG1-CD1 3.67Å; V123-I523 HydrophobicContact CG1-CG1 3.94Å; V123-I523 HydrophobicContact CG2-CD1 3.97Å; V123-I523 HydrophobicContact CG2-CG1 4.47Å; L497-I523 HydrophobicContact CD1-CB 4Å; L497-I523 HydrophobicContact CD1-CG2 3.52Å; N519-I523 VanDerWaalsContact O-CD1 3.31Å; N519-I523 WeakPolarHBondContact O-CD1 3.31Å; N519-I523 WeakPolarHBondContact O-CG1 3.47Å; N519-I523 PolarHBondContact O-N 3.49Å; C520-I523 PolarHBondContact O-N 3.3Å; I523-L526 PolarHBondContact O-N 2.93Å; I523-M527 HydrophobicContact CG2-CE 4.33Å; I523-M527 HydrophobicContact CG2-CG 4.37Å; I523-M527 HydrophobicContact CG2-SD 4.49Å; I523-M527 WeakPolarHBondContact O-CB 3.42Å; I523-M527 WeakPolarHBondContact O-CG 3.46Å; I523-M527 PolarHBondContact O-N 3.07Å
524	A	91.9	Very high	90.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-51.3	174.8	0	0	0	0	0	111.8	A494 L497 C520 A521 E522 L526 M527 L528 A542	A494-A524 HydrophobicContact CB-CB 4.42Å; A494-A524 WeakPolarHBondContact O-CB 3.45Å; L497-A524 HydrophobicContact CB-CB 3.96Å; C520-A524 PolarHBondContact O-N 3.17Å; A521-A524 PolarHBondContact O-N 3.01Å; E522-A524 VanDerWaalsContact C-N 3.32Å; A524-L526 VanDerWaalsContact C-N 3.33Å; A524-L526 PolarHBondContact O-N 2.76Å; A524-M527 PolarHBondContact O-N 3.24Å; A524-L528 WeakPolarHBondContact O-CG 3.3Å; A524-L528 PolarHBondContact O-N 3.39Å; A524-A542 HydrophobicContact CB-CB 4.35Å
525	G	89.8	Confident	90	Very high	7 Å²	7	38.4 Å²	38.4	7%	0.072	20%	0.201	C	C	.	.	H	α-helix	trans	-68	-26.6	176.9	0	0	0	0	0	114.5	A521 E522 R529	A521-G525 PolarHBondContact O-N 3.46Å; A521-G525 VanDerWaalsContact O-N 3.07Å; E522-G525 PolarHBondContact O-N 3.2Å; G525-R529 WeakPolarHBondContact O-CB 3.46Å; G525-R529 WeakPolarHBondContact O-CG 3.28Å; G525-R529 PolarHBondContact O-N 3.07Å; G525-R529 PolarHBondContact O-NE 2.97Å; G525-R529 VanDerWaalsContact O-NE 3.12Å
526	L	86	Confident	89.8	Confident	17 Å²	17	36 Å²	36	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-73	-41.3	170.6	-79	165.6	0	0	0	111.8	K125 E522 I523 A524 R529 R530	K125-L526 HydrophobicContact CG-CD1 4.35Å; E522-L526 VanDerWaalsContact O-CB 3.31Å; E522-L526 WeakPolarHBondContact O-CB 3.32Å; E522-L526 VanDerWaalsContact O-CG 3.27Å; E522-L526 WeakPolarHBondContact O-CG 3.4Å; E522-L526 PolarHBondContact O-N 3.41Å; I523-L526 PolarHBondContact O-N 2.93Å; A524-L526 VanDerWaalsContact C-N 3.33Å; A524-L526 PolarHBondContact O-N 2.76Å; L526-R529 PolarHBondContact O-N 3.4Å; L526-R530 WeakPolarHBondContact O-CB 3.47Å; L526-R530 VanDerWaalsContact O-CG 3.31Å; L526-R530 WeakPolarHBondContact O-CG 3.37Å; L526-R530 PolarHBondContact O-N 3Å
527	M	87.4	Confident	89.6	Confident	7 Å²	7	32.4 Å²	32.4	3%	0.034	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-43.5	176.6	-78.8	-169	167.7	0	0	112.1	I122 G488 A489 V493 A494 L497 I523 A524 R529 R530 L531	I122-M527 HydrophobicContact CG2-CE 3.6Å; G488-M527 WeakPolarHBondContact O-CE 3.37Å; A489-M527 HydrophobicContact CB-CB 4.32Å; A489-M527 HydrophobicContact CB-CG 4.08Å; A489-M527 HydrophobicContact CB-SD 4.46Å; V493-M527 HydrophobicContact CB-SD 4.02Å; V493-M527 HydrophobicContact CG1-CE 3.81Å; V493-M527 HydrophobicContact CG1-SD 3.42Å; V493-M527 WeakPolarHBondContact CG1-SD 3.34Å; A494-M527 HydrophobicContact CB-CB 4.19Å; L497-M527 HydrophobicContact CD1-SD 4.11Å; I523-M527 HydrophobicContact CG2-CE 4.33Å; I523-M527 HydrophobicContact CG2-CG 4.37Å; I523-M527 HydrophobicContact CG2-SD 4.49Å; I523-M527 WeakPolarHBondContact O-CB 3.42Å; I523-M527 WeakPolarHBondContact O-CG 3.46Å; I523-M527 PolarHBondContact O-N 3.07Å; A524-M527 PolarHBondContact O-N 3.24Å; M527-R529 PolarHBondContact O-N 3.07Å; M527-R530 PolarHBondContact O-N 3.44Å; M527-L531 WeakPolarHBondContact O-CD1 3.32Å; M527-L531 VanDerWaalsContact O-CG 3.25Å; M527-L531 WeakPolarHBondContact O-CG 3.27Å; M527-L531 PolarHBondContact O-N 2.94Å; M527-L531 VanDerWaalsContact O-N 3.1Å
528	L	90.7	Very high	89.4	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-43.7	176.9	-68.7	169.3	0	0	0	111.6	I491 A494 A524 L531 Y533 Q538 A539 A542	I491-L528 HydrophobicContact CG1-CD2 4.31Å; A494-L528 HydrophobicContact CB-CD1 4.35Å; A494-L528 HydrophobicContact CB-CD2 4Å; A494-L528 HydrophobicContact CB-CG 3.82Å; A524-L528 WeakPolarHBondContact O-CG 3.3Å; A524-L528 PolarHBondContact O-N 3.39Å; L528-L531 PolarHBondContact O-N 3.36Å; L528-Y533 CarbonylContact O-C 3.44Å; L528-Y533 WeakPolarHBondContact O-CA 3.47Å; L528-Y533 PolarHBondContact O-N 2.99Å; L528-Q538 HydrophobicContact CD1-CB 3.76Å; L528-Q538 HydrophobicContact CD2-CB 4.09Å; L528-A539 HydrophobicContact CD1-CB 4.2Å; L528-A542 HydrophobicContact CD1-CB 4.49Å
529	R	87.6	Confident	89.1	Confident	146 Å²	146	31 Å²	31	55%	0.551	16%	0.16	S	C	*	.	H	α-helix	trans	-63.9	-39.2	173.6	-74.3	-177.1	-65.8	166.3	2.9	113.4	G525 L526 M527 L531 N532	G525-R529 WeakPolarHBondContact O-CB 3.46Å; G525-R529 WeakPolarHBondContact O-CG 3.28Å; G525-R529 PolarHBondContact O-N 3.07Å; G525-R529 PolarHBondContact O-NE 2.97Å; G525-R529 VanDerWaalsContact O-NE 3.12Å; L526-R529 PolarHBondContact O-N 3.4Å; M527-R529 PolarHBondContact O-N 3.07Å; R529-L531 PolarHBondContact O-N 3.29Å; R529-N532 PolarHBondContact O-N 2.97Å
530	R	83.8	Confident	88.9	Confident	54 Å²	54	28.5 Å²	28.5	20%	0.204	15%	0.147	C	C	.	.	H	α-helix	trans	-65.7	-17.5	174.2	-77.1	178.3	177.7	160.4	3.6	114.2	Y107 I122 F124 P135 L526 M527 N532	Y107-R530 VanDerWaalsContact OH-CD 3.23Å; Y107-R530 WeakPolarHBondContact OH-CD 3.36Å; Y107-R530 WeakPolarHBondContact OH-CG 3.45Å; Y107-R530 PolarHBondContact OH-NE 3.01Å; I122-R530 PolarHBondContact O-NH1 3.4Å; F124-R530 PolarHBondContact O-NH2 3.17Å; P135-R530 WeakPolarHBondContact CG-O 3.25Å; L526-R530 WeakPolarHBondContact O-CB 3.47Å; L526-R530 VanDerWaalsContact O-CG 3.31Å; L526-R530 WeakPolarHBondContact O-CG 3.37Å; L526-R530 PolarHBondContact O-N 3Å; M527-R530 PolarHBondContact O-N 3.44Å; R530-N532 VanDerWaalsContact C-N 3.35Å
531	L	88.4	Confident	88.7	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	14.9	173.6	-63.2	165.6	0	0	0	111.8	H103 H136 A489 I491 M527 L528 R529 Y533	H103-L531 WeakPolarHBondContact CE1-CD2 3.35Å; H136-L531 PolarHBondContact NE2-O 3.2Å; H136-L531 VanDerWaalsContact NE2-O 3.12Å; A489-L531 HydrophobicContact CB-CD1 4.28Å; A489-L531 HydrophobicContact CB-CD2 4.06Å; A489-L531 HydrophobicContact CB-CG 4.08Å; I491-L531 HydrophobicContact CG1-CD1 4.26Å; M527-L531 WeakPolarHBondContact O-CD1 3.32Å; M527-L531 VanDerWaalsContact O-CG 3.25Å; M527-L531 WeakPolarHBondContact O-CG 3.27Å; M527-L531 PolarHBondContact O-N 2.94Å; M527-L531 VanDerWaalsContact O-N 3.1Å; L528-L531 PolarHBondContact O-N 3.36Å; R529-L531 PolarHBondContact O-N 3.29Å; L531-Y533 HydrophobicContact CB-CD2 3.45Å; L531-Y533 VanDerWaalsContact CB-CD2 3.45Å; L531-Y533 HydrophobicContact CB-CE2 3.74Å; L531-Y533 HydrophobicContact CB-CG 4.4Å; L531-Y533 HydrophobicContact CD1-CD2 4.49Å; L531-Y533 VanDerWaalsContact O-CD2 3.27Å; L531-Y533 WeakPolarHBondContact O-CD2 3.22Å; L531-Y533 VanDerWaalsContact O-CE2 3.31Å; L531-Y533 WeakPolarHBondContact O-CE2 3.36Å; L531-Y533 PolarHBondContact O-N 2.77Å; L531-Y533 VanDerWaalsContact O-N 3.09Å
532	N	89.1	Confident	88.6	Confident	109 Å²	109	29.6 Å²	29.6	58%	0.583	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	21.7	-173.2	-61	-8.8	0	0	0	114.1	R529 R530	R529-N532 PolarHBondContact O-N 2.97Å; R530-N532 VanDerWaalsContact C-N 3.35Å
533	Y	88.7	Confident	88.6	Confident	26 Å²	26	29.3 Å²	29.3	10%	0.102	15%	0.154	C	C	.	.			trans	-103.3	46	173.3	-54.6	-52.8	0	0	0	110.9	H136 V185 H229 I491 L528 L531 V535 C536	H136-Y533 AromaticContact CE1-CE2 3.81Å; H136-Y533 AromaticContact NE2-CE2 3.39Å; H136-Y533 WeakPolarHBondContact NE2-CE2 3.45Å; H136-Y533 AromaticContact NE2-CZ 3.55Å; H136-Y533 PolarHBondContact NE2-OH 3.01Å; V185-Y533 HydrophobicContact CG2-CE1 3.88Å; H229-Y533 AromaticContact CE1-CD1 3.45Å; H229-Y533 VanDerWaalsContact CE1-CD1 3.45Å; H229-Y533 WeakPolarHBondContact CE1-CD1 3.44Å; H229-Y533 AromaticContact CE1-CD2 3.98Å; H229-Y533 AromaticContact CE1-CE1 3.77Å; H229-Y533 AromaticContact CE1-CG 3.59Å; H229-Y533 AromaticContact NE2-CD1 3.47Å; H229-Y533 WeakPolarHBondContact NE2-CD1 3.27Å; H229-Y533 AromaticContact NE2-CE1 3.5Å; H229-Y533 WeakPolarHBondContact NE2-CE1 3.48Å; I491-Y533 HydrophobicContact CD1-CD2 3.98Å; I491-Y533 HydrophobicContact CD1-CE2 3.81Å; I491-Y533 HydrophobicContact CG1-CD2 4.08Å; I491-Y533 HydrophobicContact CG1-CE2 4.26Å; L528-Y533 CarbonylContact O-C 3.44Å; L528-Y533 WeakPolarHBondContact O-CA 3.47Å; L528-Y533 PolarHBondContact O-N 2.99Å; L531-Y533 HydrophobicContact CB-CD2 3.45Å; L531-Y533 VanDerWaalsContact CB-CD2 3.45Å; L531-Y533 HydrophobicContact CB-CE2 3.74Å; L531-Y533 HydrophobicContact CB-CG 4.4Å; L531-Y533 HydrophobicContact CD1-CD2 4.49Å; L531-Y533 VanDerWaalsContact O-CD2 3.27Å; L531-Y533 WeakPolarHBondContact O-CD2 3.22Å; L531-Y533 VanDerWaalsContact O-CE2 3.31Å; L531-Y533 WeakPolarHBondContact O-CE2 3.36Å; L531-Y533 PolarHBondContact O-N 2.77Å; L531-Y533 VanDerWaalsContact O-N 3.09Å; Y533-V535 VanDerWaalsContact C-N 3.31Å; Y533-C536 PolarHBondContact O-SG 3.48Å
534	G	81.7	Confident	88.8	Confident	22 Å²	22	30.5 Å²	30.5	23%	0.227	16%	0.158	C	C	.	.	S	Bend	trans	-65.4	-34	176.6	0	0	0	0	0	113.3	A539	G534-A539 WeakPolarHBondContact O-CB 3.4Å
535	V	82.8	Confident	89	Confident	113 Å²	113	30.6 Å²	30.6	69%	0.685	16%	0.158	S	C	*	.	S	Bend	trans	-114.2	82.7	179.3	-173.1	0	0	0	0	109	Y533 L580	Y533-V535 VanDerWaalsContact C-N 3.31Å; V535-L580 HydrophobicContact CG1-CD1 4.04Å; V535-L580 HydrophobicContact CG1-CD2 4.32Å
536	C	89.1	Confident	89.3	Confident	14 Å²	14	32 Å²	32	10%	0.095	16%	0.163	C	C	.	.	S	Bend	trans	-147.8	164.6	176.8	73.3	0	0	0	0	111	Y533 Q538 A539 A540 L580	Y533-C536 PolarHBondContact O-SG 3.48Å; C536-Q538 PolarHBondContact O-N 3.2Å; C536-Q538 PolarHBondContact SG-OE1 2.95Å; C536-A539 WeakPolarHBondContact O-CA 3.4Å; C536-A539 WeakPolarHBondContact O-CB 3.32Å; C536-A539 PolarHBondContact O-N 3.46Å; C536-A539 PolarHBondContact SG-N 2.96Å; C536-A540 PolarHBondContact O-N 2.99Å; C536-L580 WeakPolarHBondContact O-CD2 3.49Å
537	M	89.4	Confident	89.8	Confident	21 Å²	21	31.2 Å²	31.2	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-25.3	-177.3	-71.6	-55	-60.8	0	0	113.8	N230 S541 L580 C581 T584 Y585	N230-M537 HydrophobicContact CB-CB 4.04Å; M537-S541 PolarHBondContact O-N 3.15Å; M537-L580 HydrophobicContact SD-CB 4.47Å; M537-L580 HydrophobicContact SD-CD2 4.08Å; M537-L580 HydrophobicContact SD-CG 3.85Å; M537-C581 HydrophobicContact CE-CB 4.37Å; M537-T584 HydrophobicContact CG-CG2 4.05Å; M537-T584 HydrophobicContact SD-CG2 4.23Å; M537-T584 PolarHBondContact SD-OG1 3.01Å; M537-T584 VanDerWaalsContact SD-OG1 3.34Å; M537-Y585 HydrophobicContact CE-CD2 4.39Å; M537-Y585 HydrophobicContact CE-CE2 3.55Å
538	Q	89.5	Confident	90.2	Very high	3 Å²	3	31.4 Å²	31.4	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-39	171	-59.6	79.6	-2.7	0	0	111	A228 H229 N230 I491 L495 L528 C536 S541 A542	A228-Q538 PolarHBondContact O-NE2 3.38Å; H229-Q538 VanDerWaalsContact CA-NE2 3.32Å; H229-Q538 PolarHBondContact O-NE2 3.04Å; H229-Q538 PolarHBondContact O-OE1 3.28Å; N230-Q538 PolarHBondContact ND2-NE2 3.45Å; N230-Q538 VanDerWaalsContact ND2-NE2 3.14Å; I491-Q538 HydrophobicContact CG2-CG 4.29Å; L495-Q538 HydrophobicContact CD2-CB 4.32Å; L495-Q538 HydrophobicContact CD2-CG 3.85Å; L495-Q538 HydrophobicContact CG-CG 4.38Å; L528-Q538 HydrophobicContact CD1-CB 3.76Å; L528-Q538 HydrophobicContact CD2-CB 4.09Å; C536-Q538 PolarHBondContact O-N 3.2Å; C536-Q538 PolarHBondContact SG-OE1 2.95Å; Q538-S541 PolarHBondContact O-N 2.69Å; Q538-A542 WeakPolarHBondContact O-CB 3.2Å; Q538-A542 PolarHBondContact O-N 3.27Å
539	A	89.2	Confident	90.5	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.033	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-42	176	0	0	0	0	0	110.8	L528 G534 C536 S541 A542 N543	L528-A539 HydrophobicContact CD1-CB 4.2Å; G534-A539 WeakPolarHBondContact O-CB 3.4Å; C536-A539 WeakPolarHBondContact O-CA 3.4Å; C536-A539 WeakPolarHBondContact O-CB 3.32Å; C536-A539 PolarHBondContact O-N 3.46Å; C536-A539 PolarHBondContact SG-N 2.96Å; A539-S541 VanDerWaalsContact C-N 3.34Å; A539-S541 PolarHBondContact O-N 3.04Å; A539-A542 PolarHBondContact O-N 3.22Å; A539-N543 VanDerWaalsContact O-CB 3.27Å; A539-N543 WeakPolarHBondContact O-CB 3.43Å; A539-N543 PolarHBondContact O-N 3.01Å; A539-N543 PolarHBondContact O-OD1 2.96Å
540	A	90.8	Very high	90.9	Very high	5 Å²	5	25 Å²	25	4%	0.041	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-37.5	171.6	0	0	0	0	0	112.9	C536 R544 S577 L580	C536-A540 PolarHBondContact O-N 2.99Å; A540-R544 VanDerWaalsContact O-CB 3.26Å; A540-R544 WeakPolarHBondContact O-CB 3.41Å; A540-R544 PolarHBondContact O-N 3.35Å; A540-S577 PolarHBondContact O-OG 3.38Å; A540-S577 VanDerWaalsContact O-OG 3.08Å; A540-L580 HydrophobicContact CB-CD2 4.09Å
541	S	90.8	Very high	91.5	Very high	27 Å²	27	22.4 Å²	22.4	19%	0.189	13%	0.126	C	C	.	.	H	α-helix	trans	-71.4	-40.4	175.2	-161.6	0	0	0	0	112.3	E498 M537 Q538 A539 R544 V545	E498-S541 VanDerWaalsContact OE1-CB 3.27Å; E498-S541 WeakPolarHBondContact OE1-CB 3.42Å; E498-S541 PolarHBondContact OE1-OG 3.06Å; M537-S541 PolarHBondContact O-N 3.15Å; Q538-S541 PolarHBondContact O-N 2.69Å; A539-S541 VanDerWaalsContact C-N 3.34Å; A539-S541 PolarHBondContact O-N 3.04Å; S541-R544 WeakPolarHBondContact O-CB 3.45Å; S541-R544 PolarHBondContact O-N 3.38Å; S541-R544 PolarHBondContact OG-NH2 3.38Å; S541-V545 WeakPolarHBondContact O-CG2 3.48Å; S541-V545 PolarHBondContact O-N 3.42Å
542	A	91.7	Very high	91.8	Very high	1 Å²	1	23 Å²	23	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-42.1	173.8	0	0	0	0	0	112.5	A524 L528 Q538 A539 V545 K546	A524-A542 HydrophobicContact CB-CB 4.35Å; L528-A542 HydrophobicContact CD1-CB 4.49Å; Q538-A542 WeakPolarHBondContact O-CB 3.2Å; Q538-A542 PolarHBondContact O-N 3.27Å; A539-A542 PolarHBondContact O-N 3.22Å; A542-V545 PolarHBondContact O-N 3.1Å; A542-K546 WeakPolarHBondContact O-CB 3.29Å; A542-K546 PolarHBondContact O-N 2.82Å
543	N	92.6	Very high	92	Very high	24 Å²	24	20.4 Å²	20.4	13%	0.128	11%	0.114	C	C	.	.	H	α-helix	trans	-66.5	-38	176.1	-71.8	-0.2	0	0	0	111.1	A539 K546 A547 L573 E576	A539-N543 VanDerWaalsContact O-CB 3.27Å; A539-N543 WeakPolarHBondContact O-CB 3.43Å; A539-N543 PolarHBondContact O-N 3.01Å; A539-N543 PolarHBondContact O-OD1 2.96Å; N543-K546 PolarHBondContact O-N 3.27Å; N543-A547 VanDerWaalsContact O-CB 3.25Å; N543-A547 WeakPolarHBondContact O-CB 3.38Å; N543-A547 PolarHBondContact O-N 3.25Å; N543-L573 HydrophobicContact CB-CB 4.4Å; N543-L573 HydrophobicContact CB-CD2 3.87Å; N543-E576 PolarHBondContact ND2-OE2 3.19Å
544	R	94.8	Very high	92.4	Very high	36 Å²	36	19.1 Å²	19.1	14%	0.136	11%	0.11	C	C	.	.	H	α-helix	trans	-60.4	-44.7	169.3	-179.7	-162.1	58.4	70.2	6	112.4	E498 A540 S541 A547 L548 H574	E498-R544 IonicContact OE1-NH2 2.74Å; A540-R544 VanDerWaalsContact O-CB 3.26Å; A540-R544 WeakPolarHBondContact O-CB 3.41Å; A540-R544 PolarHBondContact O-N 3.35Å; S541-R544 WeakPolarHBondContact O-CB 3.45Å; S541-R544 PolarHBondContact O-N 3.38Å; S541-R544 PolarHBondContact OG-NH2 3.38Å; R544-A547 PolarHBondContact O-N 2.98Å; R544-L548 WeakPolarHBondContact O-CG 3.47Å; R544-L548 PolarHBondContact O-N 3.39Å; R544-H574 PolarHBondContact O-CE1 2.82Å
545	V	95.1	Very high	92.8	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-65.8	-43.6	176.5	174.1	0	0	0	0	111.1	E498 A501 A521 S541 A542 A547 L548 I549	E498-V545 HydrophobicContact CG-CB 4.46Å; E498-V545 HydrophobicContact CG-CG2 3.94Å; A501-V545 HydrophobicContact CB-CG1 3.84Å; A521-V545 HydrophobicContact CB-CG1 4.33Å; S541-V545 WeakPolarHBondContact O-CG2 3.48Å; S541-V545 PolarHBondContact O-N 3.42Å; A542-V545 PolarHBondContact O-N 3.1Å; V545-A547 VanDerWaalsContact C-N 3.34Å; V545-A547 PolarHBondContact O-N 3.22Å; V545-L548 PolarHBondContact O-N 3.46Å; V545-I549 HydrophobicContact CG1-CD1 3.8Å; V545-I549 WeakPolarHBondContact O-CD1 3.48Å; V545-I549 WeakPolarHBondContact O-CG1 3.47Å; V545-I549 PolarHBondContact O-N 2.89Å
546	K	96.3	Very high	93.1	Very high	38 Å²	38	21.9 Å²	21.9	17%	0.165	11%	0.114	C	C	.	.	H	α-helix	trans	-60.1	-42.2	175.9	-178.9	170.2	174.4	170.9	0	112	L518 A521 E522 A542 N543 I549 I550 L573	L518-K546 HydrophobicContact CD1-CG 4.04Å; A521-K546 HydrophobicContact CB-CB 3.99Å; E522-K546 HydrophobicContact CG-CD 3.81Å; E522-K546 IonicContact OE1-NZ 3.65Å; E522-K546 PolarHBondContact OE1-NZ 3.39Å; A542-K546 WeakPolarHBondContact O-CB 3.29Å; A542-K546 PolarHBondContact O-N 2.82Å; N543-K546 PolarHBondContact O-N 3.27Å; K546-I549 PolarHBondContact O-N 2.84Å; K546-I550 HydrophobicContact CD-CD1 4.28Å; K546-I550 VanDerWaalsContact CE-CD1 3.41Å; K546-I550 HydrophobicContact CG-CD1 3.78Å; K546-I550 HydrophobicContact CG-CG1 4.36Å; K546-I550 WeakPolarHBondContact O-CB 3.48Å; K546-I550 VanDerWaalsContact O-CG1 3.32Å; K546-I550 WeakPolarHBondContact O-CG1 3.29Å; K546-I550 PolarHBondContact O-N 2.82Å; K546-L573 HydrophobicContact CB-CD1 4.5Å; K546-L573 HydrophobicContact CD-CD1 4.22Å; K546-L573 HydrophobicContact CG-CD1 4.09Å
547	A	96.9	Very high	93.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-45.1	179.3	0	0	0	0	0	112.7	N543 R544 V545 I549 I550 E551 A570 L573 H574	N543-A547 VanDerWaalsContact O-CB 3.25Å; N543-A547 WeakPolarHBondContact O-CB 3.38Å; N543-A547 PolarHBondContact O-N 3.25Å; R544-A547 PolarHBondContact O-N 2.98Å; V545-A547 VanDerWaalsContact C-N 3.34Å; V545-A547 PolarHBondContact O-N 3.22Å; A547-I549 VanDerWaalsContact C-N 3.31Å; A547-I549 PolarHBondContact O-N 2.9Å; A547-I550 PolarHBondContact O-N 2.92Å; A547-E551 PolarHBondContact O-N 3.47Å; A547-A570 HydrophobicContact CB-CB 4.14Å; A547-A570 WeakPolarHBondContact CB-O 3.2Å; A547-L573 HydrophobicContact CB-CB 3.96Å; A547-L573 HydrophobicContact CB-CD1 4.4Å; A547-H574 WeakPolarHBondContact CB-CE1 3.33Å; A547-H574 WeakPolarHBondContact CB-ND1 3.34Å
548	L	95.5	Very high	93.2	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-44.2	174.5	-69.2	170	0	0	0	111.6	Y505 R544 V545 E551 E552	Y505-L548 HydrophobicContact CD2-CB 4.42Å; Y505-L548 HydrophobicContact CE2-CB 4.04Å; R544-L548 WeakPolarHBondContact O-CG 3.47Å; R544-L548 PolarHBondContact O-N 3.39Å; V545-L548 PolarHBondContact O-N 3.46Å; L548-E551 WeakPolarHBondContact O-CB 3.34Å; L548-E551 PolarHBondContact O-N 2.85Å; L548-E552 PolarHBondContact O-N 3.13Å
549	I	96.4	Very high	93.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-41.1	178.7	-68.2	161.3	0	0	0	111.9	A501 Y505 F514 A517 L518 A521 V545 K546 A547 E551 I553	A501-I549 HydrophobicContact CB-CD1 4.35Å; Y505-I549 HydrophobicContact CD2-CG1 3.86Å; Y505-I549 HydrophobicContact CG-CG1 4.28Å; F514-I549 HydrophobicContact CB-CG2 3.87Å; A517-I549 HydrophobicContact CB-CD1 3.8Å; A517-I549 HydrophobicContact CB-CG1 4.33Å; L518-I549 HydrophobicContact CB-CG2 3.73Å; L518-I549 HydrophobicContact CD1-CG2 4.18Å; L518-I549 HydrophobicContact CG-CG2 4.46Å; A521-I549 HydrophobicContact CB-CD1 4.27Å; V545-I549 HydrophobicContact CG1-CD1 3.8Å; V545-I549 WeakPolarHBondContact O-CD1 3.48Å; V545-I549 WeakPolarHBondContact O-CG1 3.47Å; V545-I549 PolarHBondContact O-N 2.89Å; K546-I549 PolarHBondContact O-N 2.84Å; A547-I549 VanDerWaalsContact C-N 3.31Å; A547-I549 PolarHBondContact O-N 2.9Å; I549-E551 VanDerWaalsContact C-N 3.3Å; I549-I553 HydrophobicContact CG2-CD1 3.79Å; I549-I553 WeakPolarHBondContact O-CD1 3.49Å; I549-I553 VanDerWaalsContact O-CG1 3.27Å; I549-I553 WeakPolarHBondContact O-CG1 3.05Å; I549-I553 PolarHBondContact O-N 3.04Å
550	I	96.7	Very high	93.6	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-32.1	177.6	-72.4	177.9	0	0	0	111.4	L518 K546 A547 A554 D566 L569 A570 L573	L518-I550 HydrophobicContact CD1-CD1 4.22Å; L518-I550 HydrophobicContact CD1-CG1 3.89Å; K546-I550 HydrophobicContact CD-CD1 4.28Å; K546-I550 VanDerWaalsContact CE-CD1 3.41Å; K546-I550 HydrophobicContact CG-CD1 3.78Å; K546-I550 HydrophobicContact CG-CG1 4.36Å; K546-I550 WeakPolarHBondContact O-CB 3.48Å; K546-I550 VanDerWaalsContact O-CG1 3.32Å; K546-I550 WeakPolarHBondContact O-CG1 3.29Å; K546-I550 PolarHBondContact O-N 2.82Å; A547-I550 PolarHBondContact O-N 2.92Å; I550-A554 WeakPolarHBondContact O-CB 3.43Å; I550-A554 PolarHBondContact O-N 3.26Å; I550-D566 HydrophobicContact CG2-CB 3.84Å; I550-D566 WeakPolarHBondContact CG2-O 3.42Å; I550-L569 HydrophobicContact CD1-CD2 3.91Å; I550-L569 HydrophobicContact CD1-CG 4.26Å; I550-A570 HydrophobicContact CB-CB 4.4Å; I550-A570 HydrophobicContact CG2-CB 4.13Å; I550-L573 HydrophobicContact CD1-CD1 4.43Å
551	E	95.6	Very high	93.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-50.7	175	-174	177.6	177.3	0	0	111.7	A547 L548 I549 I553 A554 I555 L567 R601 L602 S605	A547-E551 PolarHBondContact O-N 3.47Å; L548-E551 WeakPolarHBondContact O-CB 3.34Å; L548-E551 PolarHBondContact O-N 2.85Å; I549-E551 VanDerWaalsContact C-N 3.3Å; E551-I553 PolarHBondContact O-N 3.47Å; E551-A554 PolarHBondContact O-N 3.04Å; E551-I555 HydrophobicContact CG-CD1 3.91Å; E551-I555 WeakPolarHBondContact O-CD1 3.37Å; E551-I555 VanDerWaalsContact O-CG1 3.28Å; E551-I555 WeakPolarHBondContact O-CG1 3.31Å; E551-I555 PolarHBondContact O-N 2.93Å; E551-L567 HydrophobicContact CG-CD2 4.02Å; E551-R601 IonicContact OE1-CZ 3.12Å; E551-R601 IonicContact OE1-NE 3.67Å; E551-R601 PolarHBondContact OE1-NE 3.35Å; E551-R601 IonicContact OE1-NH2 3.64Å; E551-R601 IonicContact OE2-CZ 2.59Å; E551-R601 VanDerWaalsContact OE2-CZ 3.29Å; E551-R601 IonicContact OE2-NE 3.52Å; E551-R601 PolarHBondContact OE2-NE 3.2Å; E551-R601 VanDerWaalsContact OE2-NE 3.07Å; E551-R601 IonicContact OE2-NH2 2.86Å; E551-R601 PolarHBondContact OE2-NH2 2.87Å; E551-L602 HydrophobicContact CB-CD1 4.09Å; E551-L602 HydrophobicContact CG-CD1 3.63Å; E551-L602 VanDerWaalsContact OE1-CA 3.3Å; E551-L602 WeakPolarHBondContact OE1-CA 3.41Å; E551-L602 PolarHBondContact OE1-N 3.39Å; E551-S605 WeakPolarHBondContact OE1-CB 3.02Å; E551-S605 PolarHBondContact OE1-OG 3.02Å
552	E	94.8	Very high	93.9	Very high	15 Å²	15	44.3 Å²	44.3	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-47.9	178.3	-45.6	-47.6	148.5	0	0	111.9	Y505 Y509 F514 L548 A554 I555 D556 R601	Y505-E552 HydrophobicContact CD2-CG 4.35Å; Y505-E552 HydrophobicContact CE2-CG 3.71Å; Y505-E552 WeakPolarHBondContact CE2-OE1 3.34Å; Y505-E552 PolarHBondContact OH-OE1 3.48Å; Y509-E552 HydrophobicContact CE2-CG 4.34Å; F514-E552 HydrophobicContact CD2-CB 3.98Å; F514-E552 HydrophobicContact CE1-CB 4.45Å; F514-E552 HydrophobicContact CE1-CG 4.28Å; F514-E552 HydrophobicContact CE2-CB 3.36Å; F514-E552 HydrophobicContact CE2-CG 4.06Å; F514-E552 HydrophobicContact CZ-CB 3.63Å; F514-E552 HydrophobicContact CZ-CG 3.79Å; L548-E552 PolarHBondContact O-N 3.13Å; E552-A554 PolarHBondContact O-N 3.41Å; E552-I555 PolarHBondContact O-N 2.91Å; E552-I555 VanDerWaalsContact O-N 3.08Å; E552-D556 PolarHBondContact O-N 3.33Å; E552-R601 IonicContact OE1-CZ 3.78Å; E552-R601 IonicContact OE1-NH1 3.76Å; E552-R601 PolarHBondContact OE1-NH1 3.42Å; E552-R601 IonicContact OE1-NH2 3.67Å; E552-R601 PolarHBondContact OE1-NH2 2.91Å
553	I	94.6	Very high	94.1	Very high	54 Å²	54	45.6 Å²	45.6	28%	0.277	24%	0.242	S	C	.	.	H	α-helix	trans	-57	-38.3	178.9	-65.9	168.2	0	0	0	110.7	F514 L518 I549 E551 D557	F514-I553 HydrophobicContact CB-CD1 3.98Å; F514-I553 HydrophobicContact CB-CG1 3.97Å; F514-I553 HydrophobicContact CD2-CG1 3.9Å; F514-I553 HydrophobicContact CG-CG1 4.34Å; L518-I553 HydrophobicContact CB-CD1 4.46Å; L518-I553 HydrophobicContact CD2-CD1 3.86Å; I549-I553 HydrophobicContact CG2-CD1 3.79Å; I549-I553 WeakPolarHBondContact O-CD1 3.49Å; I549-I553 VanDerWaalsContact O-CG1 3.27Å; I549-I553 WeakPolarHBondContact O-CG1 3.05Å; I549-I553 PolarHBondContact O-N 3.04Å; E551-I553 PolarHBondContact O-N 3.47Å; I553-D557 PolarHBondContact O-N 2.87Å
554	A	95.1	Very high	94.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-73.3	-32.7	179.5	0	0	0	0	0	113	I550 E551 E552 T563 D566 L567	I550-A554 WeakPolarHBondContact O-CB 3.43Å; I550-A554 PolarHBondContact O-N 3.26Å; E551-A554 PolarHBondContact O-N 3.04Å; E552-A554 PolarHBondContact O-N 3.41Å; A554-T563 HydrophobicContact CB-CG2 4.48Å; A554-T563 WeakPolarHBondContact O-CB 3.23Å; A554-T563 WeakPolarHBondContact O-CG2 3.34Å; A554-T563 PolarHBondContact O-OG1 3.05Å; A554-D566 HydrophobicContact CB-CB 3.91Å; A554-L567 HydrophobicContact CB-CD2 4Å; A554-L567 HydrophobicContact CB-CG 3.82Å
555	I	91.1	Very high	94.3	Very high	86 Å²	86	55.4 Å²	55.4	44%	0.441	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-40.1	176.7	-69.3	163.4	0	0	0	111.1	E551 E552	E551-I555 HydrophobicContact CG-CD1 3.91Å; E551-I555 WeakPolarHBondContact O-CD1 3.37Å; E551-I555 VanDerWaalsContact O-CG1 3.28Å; E551-I555 WeakPolarHBondContact O-CG1 3.31Å; E551-I555 PolarHBondContact O-N 2.93Å; E552-I555 PolarHBondContact O-N 2.91Å; E552-I555 VanDerWaalsContact O-N 3.08Å
556	D	89.5	Confident	94.4	Very high	107 Å²	107	57.4 Å²	57.4	57%	0.572	30%	0.298	S	S	*	.	H	α-helix	trans	-80.5	-11.8	178.9	-79.4	-22.7	0	0	0	113.8	E552 N558	E552-D556 PolarHBondContact O-N 3.33Å; D556-N558 PolarHBondContact O-ND2 3.27Å
557	D	89.6	Confident	94.4	Very high	41 Å²	41	56 Å²	56	22%	0.219	29%	0.292	C	S	.	.			trans	-74.7	135.9	179.6	-153.3	-55.5	0	0	0	112.6	I553 D559 R562 T563	I553-D557 PolarHBondContact O-N 2.87Å; D557-D559 VanDerWaalsContact C-N 3.29Å; D557-D559 PolarHBondContact O-N 2.89Å; D557-D559 WeakPolarHBondContact OD1-CB 3.39Å; D557-D559 PolarHBondContact OD1-N 3.28Å; D557-R562 VanDerWaalsContact CG-NH2 3.31Å; D557-R562 IonicContact OD1-CZ 2.78Å; D557-R562 IonicContact OD1-NH1 3.52Å; D557-R562 IonicContact OD1-NH2 3.88Å; D557-R562 PolarHBondContact OD1-NH2 3.12Å; D557-R562 IonicContact OD2-CZ 3.21Å; D557-R562 IonicContact OD2-NH1 2.78Å; D557-R562 PolarHBondContact OD2-NH1 3.42Å; D557-R562 IonicContact OD2-NH2 3.17Å; D557-R562 PolarHBondContact OD2-NH2 3.09Å; D557-R562 VanDerWaalsContact OD2-NH2 3.13Å; D557-T563 PolarHBondContact O-OG1 2.86Å
558	N	90.7	Very high	94.4	Very high	161 Å²	161	61.2 Å²	61.2	86%	0.861	32%	0.315	S	S	*	.	S	Bend	trans	-84.9	1.4	-178.8	-72.3	-110.8	0	0	0	113.2	D556 P560	D556-N558 PolarHBondContact O-ND2 3.27Å; N558-P560 WeakPolarHBondContact O-CD 3.28Å
559	D	94.4	Very high	94.5	Very high	48 Å²	48	64.1 Å²	64.1	26%	0.257	33%	0.33	S	S	.	.			trans	-108.2	102	178.2	-179.4	-11.8	0	0	0	111.8	D557 S561 R562 T563	D557-D559 VanDerWaalsContact C-N 3.29Å; D557-D559 PolarHBondContact O-N 2.89Å; D557-D559 WeakPolarHBondContact OD1-CB 3.39Å; D557-D559 PolarHBondContact OD1-N 3.28Å; D559-S561 PolarHBondContact O-N 3.49Å; D559-S561 VanDerWaalsContact OD1-CB 3.3Å; D559-S561 WeakPolarHBondContact OD1-CB 3.34Å; D559-S561 PolarHBondContact OD1-N 3.22Å; D559-S561 PolarHBondContact OD1-OG 3.22Å; D559-S561 PolarHBondContact OD2-OG 3.18Å; D559-R562 HydrophobicContact CB-CB 4.31Å; D559-R562 PolarHBondContact O-N 3.36Å; D559-R562 PolarHBondContact OD1-N 3.3Å; D559-R562 IonicContact OD2-CZ 2.71Å; D559-R562 IonicContact OD2-NE 3.42Å; D559-R562 PolarHBondContact OD2-NE 3.47Å; D559-R562 IonicContact OD2-NH2 2.94Å; D559-T563 PolarHBondContact O-N 3.44Å; D559-T563 PolarHBondContact O-OG1 3.46Å
560	P	92.8	Very high	94.6	Very high	101 Å²	101	64.1 Å²	64.1	66%	0.656	33%	0.33	S	S	*	.	H	α-helix	trans	-59.7	-16.8	-178.6	-25.6	35	0	0	0	115	N558 R564	N558-P560 WeakPolarHBondContact O-CD 3.28Å; P560-R564 VanDerWaalsContact O-CB 3.3Å; P560-R564 WeakPolarHBondContact O-CB 3.44Å; P560-R564 PolarHBondContact O-N 3.03Å
561	S	93.9	Very high	94.6	Very high	80 Å²	80	67.2 Å²	67.2	56%	0.559	34%	0.341	S	S	*	.	H	α-helix	trans	-78.5	-38.1	175.7	77.3	0	0	0	0	111.9	D559 S565	D559-S561 PolarHBondContact O-N 3.49Å; D559-S561 VanDerWaalsContact OD1-CB 3.3Å; D559-S561 WeakPolarHBondContact OD1-CB 3.34Å; D559-S561 PolarHBondContact OD1-N 3.22Å; D559-S561 PolarHBondContact OD1-OG 3.22Å; D559-S561 PolarHBondContact OD2-OG 3.18Å; S561-S565 PolarHBondContact O-N 3.08Å
562	R	93.8	Very high	94.7	Very high	113 Å²	113	70.3 Å²	70.3	43%	0.426	36%	0.358	S	S	.	.	H	α-helix	trans	-76.9	-46	175.7	-68.6	-174.5	-66.3	110	10.4	110.9	D557 D559 R564 S565 D566	D557-R562 VanDerWaalsContact CG-NH2 3.31Å; D557-R562 IonicContact OD1-CZ 2.78Å; D557-R562 IonicContact OD1-NH1 3.52Å; D557-R562 IonicContact OD1-NH2 3.88Å; D557-R562 PolarHBondContact OD1-NH2 3.12Å; D557-R562 IonicContact OD2-CZ 3.21Å; D557-R562 IonicContact OD2-NH1 2.78Å; D557-R562 PolarHBondContact OD2-NH1 3.42Å; D557-R562 IonicContact OD2-NH2 3.17Å; D557-R562 PolarHBondContact OD2-NH2 3.09Å; D557-R562 VanDerWaalsContact OD2-NH2 3.13Å; D559-R562 HydrophobicContact CB-CB 4.31Å; D559-R562 PolarHBondContact O-N 3.36Å; D559-R562 PolarHBondContact OD1-N 3.3Å; D559-R562 IonicContact OD2-CZ 2.71Å; D559-R562 IonicContact OD2-NE 3.42Å; D559-R562 PolarHBondContact OD2-NE 3.47Å; D559-R562 IonicContact OD2-NH2 2.94Å; R562-R564 VanDerWaalsContact C-N 3.26Å; R562-R564 PolarHBondContact O-N 3.39Å; R562-S565 WeakPolarHBondContact O-CA 3.45Å; R562-S565 WeakPolarHBondContact O-CB 3.46Å; R562-S565 PolarHBondContact O-N 2.97Å; R562-D566 WeakPolarHBondContact O-CB 3.37Å; R562-D566 PolarHBondContact O-N 3.33Å
563	T	95.5	Very high	94.7	Very high	29 Å²	29	70.6 Å²	70.6	18%	0.178	36%	0.36	C	S	.	.	H	α-helix	trans	-46.8	-48.8	169.5	-59	0	0	0	0	112.2	A554 D557 D559 D566 L567	A554-T563 HydrophobicContact CB-CG2 4.48Å; A554-T563 WeakPolarHBondContact O-CB 3.23Å; A554-T563 WeakPolarHBondContact O-CG2 3.34Å; A554-T563 PolarHBondContact O-OG1 3.05Å; D557-T563 PolarHBondContact O-OG1 2.86Å; D559-T563 PolarHBondContact O-N 3.44Å; D559-T563 PolarHBondContact O-OG1 3.46Å; T563-D566 PolarHBondContact O-N 3.5Å; T563-L567 HydrophobicContact CG2-CD1 3.73Å; T563-L567 HydrophobicContact CG2-CG 4.35Å; T563-L567 WeakPolarHBondContact O-CB 3.39Å; T563-L567 VanDerWaalsContact O-CG 3.25Å; T563-L567 WeakPolarHBondContact O-CG 3.48Å; T563-L567 PolarHBondContact O-N 3.19Å
564	R	95.1	Very high	94.8	Very high	196 Å²	196	68.1 Å²	68.1	74%	0.74	35%	0.347	S	S	*	.	H	α-helix	trans	-67.9	-35.2	178.9	-176.7	177.3	-66.1	-179.9	0	113.7	P560 R562 K568	P560-R564 VanDerWaalsContact O-CB 3.3Å; P560-R564 WeakPolarHBondContact O-CB 3.44Å; P560-R564 PolarHBondContact O-N 3.03Å; R562-R564 VanDerWaalsContact C-N 3.26Å; R562-R564 PolarHBondContact O-N 3.39Å; R564-K568 WeakPolarHBondContact O-CB 3.44Å; R564-K568 PolarHBondContact O-N 3.4Å
565	S	96.6	Very high	94.8	Very high	69 Å²	69	71.8 Å²	71.8	48%	0.483	37%	0.365	S	S	.	.	H	α-helix	trans	-64.7	-46	174.5	175.3	0	0	0	0	110.8	S561 R562 K568 L569	S561-S565 PolarHBondContact O-N 3.08Å; R562-S565 WeakPolarHBondContact O-CA 3.45Å; R562-S565 WeakPolarHBondContact O-CB 3.46Å; R562-S565 PolarHBondContact O-N 2.97Å; S565-K568 WeakPolarHBondContact O-CB 3.23Å; S565-K568 PolarHBondContact O-N 3.39Å; S565-L569 PolarHBondContact O-N 2.92Å
566	D	96.8	Very high	94.9	Very high	43 Å²	43	71.9 Å²	71.9	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-82.6	-37.3	-167	-65.2	-18.9	0	0	0	111.4	I550 A554 R562 T563 K568 L569 A570	I550-D566 HydrophobicContact CG2-CB 3.84Å; I550-D566 WeakPolarHBondContact CG2-O 3.42Å; A554-D566 HydrophobicContact CB-CB 3.91Å; R562-D566 WeakPolarHBondContact O-CB 3.37Å; R562-D566 PolarHBondContact O-N 3.33Å; T563-D566 PolarHBondContact O-N 3.5Å; D566-K568 VanDerWaalsContact C-N 3.26Å; D566-K568 PolarHBondContact O-N 2.9Å; D566-L569 WeakPolarHBondContact O-CB 3.25Å; D566-L569 PolarHBondContact O-N 2.86Å; D566-L569 VanDerWaalsContact O-N 3.11Å; D566-A570 PolarHBondContact O-N 2.81Å
567	L	97.8	Very high	95.1	Very high	9 Å²	9	66.8 Å²	66.8	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-35.9	166.2	-68.7	171.9	0	0	0	112.2	E551 A554 T563 R571 L602 M606	E551-L567 HydrophobicContact CG-CD2 4.02Å; A554-L567 HydrophobicContact CB-CD2 4Å; A554-L567 HydrophobicContact CB-CG 3.82Å; T563-L567 HydrophobicContact CG2-CD1 3.73Å; T563-L567 HydrophobicContact CG2-CG 4.35Å; T563-L567 WeakPolarHBondContact O-CB 3.39Å; T563-L567 VanDerWaalsContact O-CG 3.25Å; T563-L567 WeakPolarHBondContact O-CG 3.48Å; T563-L567 PolarHBondContact O-N 3.19Å; L567-R571 WeakPolarHBondContact O-CB 3.5Å; L567-R571 PolarHBondContact O-N 3.35Å; L567-L602 HydrophobicContact CB-CD1 4.47Å; L567-L602 HydrophobicContact CD2-CD1 3.63Å; L567-M606 HydrophobicContact CB-CG 3.85Å; L567-M606 HydrophobicContact CD1-CG 4.21Å; L567-M606 HydrophobicContact CG-CG 4.49Å
568	K	97.3	Very high	95.3	Very high	109 Å²	109	65.3 Å²	65.3	47%	0.474	33%	0.328	S	S	.	.	H	α-helix	trans	-67.5	-40.8	173.7	-173.1	-160.8	164.9	-161.2	0	111.2	R564 S565 D566 R571 D572	R564-K568 WeakPolarHBondContact O-CB 3.44Å; R564-K568 PolarHBondContact O-N 3.4Å; S565-K568 WeakPolarHBondContact O-CB 3.23Å; S565-K568 PolarHBondContact O-N 3.39Å; D566-K568 VanDerWaalsContact C-N 3.26Å; D566-K568 PolarHBondContact O-N 2.9Å; K568-R571 WeakPolarHBondContact O-CB 3.34Å; K568-R571 PolarHBondContact O-N 3.04Å; K568-D572 WeakPolarHBondContact CE-OD2 3.47Å; K568-D572 VanDerWaalsContact O-CG 3.24Å; K568-D572 PolarHBondContact O-N 3.44Å
569	L	97	Very high	95.4	Very high	73 Å²	73	62.2 Å²	62.2	38%	0.382	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-43.4	175.4	176.8	58.3	0	0	0	111.7	I550 S565 D566 R571 D572 L573	I550-L569 HydrophobicContact CD1-CD2 3.91Å; I550-L569 HydrophobicContact CD1-CG 4.26Å; S565-L569 PolarHBondContact O-N 2.92Å; D566-L569 WeakPolarHBondContact O-CB 3.25Å; D566-L569 PolarHBondContact O-N 2.86Å; D566-L569 VanDerWaalsContact O-N 3.11Å; L569-R571 VanDerWaalsContact C-N 3.27Å; L569-R571 PolarHBondContact O-N 3.05Å; L569-D572 PolarHBondContact O-N 2.91Å; L569-L573 HydrophobicContact CD1-CD1 4.24Å; L569-L573 HydrophobicContact CD1-CG 4.36Å; L569-L573 HydrophobicContact CG-CD1 4.21Å; L569-L573 WeakPolarHBondContact O-CB 3.09Å; L569-L573 VanDerWaalsContact O-CG 3.3Å; L569-L573 WeakPolarHBondContact O-CG 3.28Å; L569-L573 PolarHBondContact O-N 2.81Å; L569-L573 VanDerWaalsContact O-N 3.08Å
570	A	97.5	Very high	95.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-39.2	172.7	0	0	0	0	0	111.7	A547 I550 D566 H574 L602	A547-A570 HydrophobicContact CB-CB 4.14Å; A547-A570 WeakPolarHBondContact CB-O 3.2Å; I550-A570 HydrophobicContact CB-CB 4.4Å; I550-A570 HydrophobicContact CG2-CB 4.13Å; D566-A570 PolarHBondContact O-N 2.81Å; A570-H574 WeakPolarHBondContact O-CB 3.34Å; A570-H574 PolarHBondContact O-N 2.69Å; A570-L602 HydrophobicContact CB-CD1 3.99Å; A570-L602 HydrophobicContact CB-CD2 3.88Å
571	R	97.8	Very high	95	Very high	77 Å²	77	55.8 Å²	55.8	29%	0.291	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-47.8	178.7	-177.5	-157.2	69.1	164	2.3	111.2	L567 K568 L569 L573 H574 M575 L602 Y603 M606	L567-R571 WeakPolarHBondContact O-CB 3.5Å; L567-R571 PolarHBondContact O-N 3.35Å; K568-R571 WeakPolarHBondContact O-CB 3.34Å; K568-R571 PolarHBondContact O-N 3.04Å; L569-R571 VanDerWaalsContact C-N 3.27Å; L569-R571 PolarHBondContact O-N 3.05Å; R571-L573 VanDerWaalsContact C-N 3.3Å; R571-L573 PolarHBondContact O-N 3.04Å; R571-H574 PolarHBondContact O-N 2.7Å; R571-M575 HydrophobicContact CG-CG 4.39Å; R571-M575 WeakPolarHBondContact O-CB 3.45Å; R571-M575 VanDerWaalsContact O-CG 3.31Å; R571-M575 WeakPolarHBondContact O-CG 3.45Å; R571-M575 PolarHBondContact O-N 3.25Å; R571-L602 HydrophobicContact CB-CD2 3.68Å; R571-L602 HydrophobicContact CG-CD2 4.49Å; R571-Y603 HydrophobicContact CG-CE1 4.29Å; R571-M606 HydrophobicContact CB-SD 4.25Å; R571-M606 HydrophobicContact CG-SD 4.48Å
572	D	97.1	Very high	94.9	Very high	66 Å²	66	55.4 Å²	55.4	35%	0.353	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-39.2	-176.9	-64	-9.9	0	0	0	110.1	K568 L569 E576	K568-D572 WeakPolarHBondContact CE-OD2 3.47Å; K568-D572 VanDerWaalsContact O-CG 3.24Å; K568-D572 PolarHBondContact O-N 3.44Å; L569-D572 PolarHBondContact O-N 2.91Å; D572-E576 PolarHBondContact O-N 2.94Å; D572-E576 VanDerWaalsContact O-N 3.1Å
573	L	96	Very high	94.7	Very high	21 Å²	21	57.2 Å²	57.2	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-42.1	170.9	-70.2	168.4	0	0	0	113.4	N543 K546 A547 I550 L569 R571 S577	N543-L573 HydrophobicContact CB-CB 4.4Å; N543-L573 HydrophobicContact CB-CD2 3.87Å; K546-L573 HydrophobicContact CB-CD1 4.5Å; K546-L573 HydrophobicContact CD-CD1 4.22Å; K546-L573 HydrophobicContact CG-CD1 4.09Å; A547-L573 HydrophobicContact CB-CB 3.96Å; A547-L573 HydrophobicContact CB-CD1 4.4Å; I550-L573 HydrophobicContact CD1-CD1 4.43Å; L569-L573 HydrophobicContact CD1-CD1 4.24Å; L569-L573 HydrophobicContact CD1-CG 4.36Å; L569-L573 HydrophobicContact CG-CD1 4.21Å; L569-L573 WeakPolarHBondContact O-CB 3.09Å; L569-L573 VanDerWaalsContact O-CG 3.3Å; L569-L573 WeakPolarHBondContact O-CG 3.28Å; L569-L573 PolarHBondContact O-N 2.81Å; L569-L573 VanDerWaalsContact O-N 3.08Å; R571-L573 VanDerWaalsContact C-N 3.3Å; R571-L573 PolarHBondContact O-N 3.04Å; L573-S577 WeakPolarHBondContact O-CB 3.48Å; L573-S577 PolarHBondContact O-N 3.23Å; L573-S577 PolarHBondContact O-OG 3.31Å
574	H	95.7	Very high	94.2	Very high	1 Å²	1	56 Å²	56	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-34.8	177.7	-88.1	-19.6	0	0	0	112.9	R544 A547 A570 R571 S577 L578 L599	R544-H574 PolarHBondContact O-CE1 2.82Å; A547-H574 WeakPolarHBondContact CB-CE1 3.33Å; A547-H574 WeakPolarHBondContact CB-ND1 3.34Å; A570-H574 WeakPolarHBondContact O-CB 3.34Å; A570-H574 PolarHBondContact O-N 2.69Å; R571-H574 PolarHBondContact O-N 2.7Å; H574-S577 PolarHBondContact O-N 2.89Å; H574-L578 WeakPolarHBondContact O-CB 3.48Å; H574-L578 PolarHBondContact O-N 2.91Å; H574-L599 HydrophobicContact CB-CD2 3.59Å; H574-L599 HydrophobicContact CB-CG 3.98Å
575	M	95.8	Very high	93.7	Very high	78 Å²	78	48.5 Å²	48.5	38%	0.384	23%	0.23	S	C	.	.	H	α-helix	trans	-67	-48.4	174.8	-73.7	-62.1	-55	0	0	111.8	R571 S577 L578 E579 L599	R571-M575 HydrophobicContact CG-CG 4.39Å; R571-M575 WeakPolarHBondContact O-CB 3.45Å; R571-M575 VanDerWaalsContact O-CG 3.31Å; R571-M575 WeakPolarHBondContact O-CG 3.45Å; R571-M575 PolarHBondContact O-N 3.25Å; M575-S577 VanDerWaalsContact C-N 3.25Å; M575-S577 PolarHBondContact O-N 3.05Å; M575-L578 PolarHBondContact O-N 3.45Å; M575-L578 VanDerWaalsContact O-N 3.13Å; M575-E579 WeakPolarHBondContact O-CB 3.36Å; M575-E579 PolarHBondContact O-N 3.33Å; M575-L599 HydrophobicContact CG-CD2 4.16Å; M575-L599 HydrophobicContact SD-CD1 3.75Å; M575-L599 HydrophobicContact SD-CD2 3.93Å
576	E	93	Very high	93.4	Very high	87 Å²	87	46.7 Å²	46.7	41%	0.407	22%	0.221	S	C	.	.	H	α-helix	trans	-54.5	-44.7	172.6	178.2	-168.2	-153.4	0	0	111.1	N543 D572 L578 E579 L580	N543-E576 PolarHBondContact ND2-OE2 3.19Å; D572-E576 PolarHBondContact O-N 2.94Å; D572-E576 VanDerWaalsContact O-N 3.1Å; E576-L578 PolarHBondContact O-N 3.22Å; E576-E579 PolarHBondContact O-N 2.79Å; E576-L580 PolarHBondContact O-N 2.77Å
577	S	92.2	Very high	93.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-36.5	178.6	-54.7	0	0	0	0	112.8	A540 L573 H574 M575 C581	A540-S577 PolarHBondContact O-OG 3.38Å; A540-S577 VanDerWaalsContact O-OG 3.08Å; L573-S577 WeakPolarHBondContact O-CB 3.48Å; L573-S577 PolarHBondContact O-N 3.23Å; L573-S577 PolarHBondContact O-OG 3.31Å; H574-S577 PolarHBondContact O-N 2.89Å; M575-S577 VanDerWaalsContact C-N 3.25Å; M575-S577 PolarHBondContact O-N 3.05Å; S577-C581 VanDerWaalsContact O-CB 3.24Å; S577-C581 WeakPolarHBondContact O-CB 3.38Å; S577-C581 PolarHBondContact O-N 2.63Å
578	L	94.3	Very high	92.9	Very high	10 Å²	10	51 Å²	51	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-67.7	-46.9	174	174.4	63.8	0	0	0	111	H574 M575 E576 L580 C581 E582 T592 H595 F596 L599	H574-L578 WeakPolarHBondContact O-CB 3.48Å; H574-L578 PolarHBondContact O-N 2.91Å; M575-L578 PolarHBondContact O-N 3.45Å; M575-L578 VanDerWaalsContact O-N 3.13Å; E576-L578 PolarHBondContact O-N 3.22Å; L578-L580 VanDerWaalsContact C-N 3.34Å; L578-L580 PolarHBondContact O-N 3.49Å; L578-C581 CarbonylContact O-C 3.19Å; L578-C581 WeakPolarHBondContact O-CA 3.43Å; L578-C581 WeakPolarHBondContact O-CB 3.3Å; L578-C581 PolarHBondContact O-N 2.71Å; L578-E582 HydrophobicContact CD1-CG 4Å; L578-E582 HydrophobicContact CG-CG 4.37Å; L578-E582 PolarHBondContact O-N 3.24Å; L578-T592 HydrophobicContact CD1-CG2 3.85Å; L578-H595 HydrophobicContact CB-CB 4.01Å; L578-H595 HydrophobicContact CD1-CB 3.69Å; L578-H595 HydrophobicContact CG-CB 4.43Å; L578-F596 HydrophobicContact CD1-CD2 4.09Å; L578-F596 HydrophobicContact CD1-CE2 3.91Å; L578-F596 HydrophobicContact CD1-CG 4.48Å; L578-F596 HydrophobicContact CD1-CZ 4.15Å; L578-F596 HydrophobicContact CD2-CD1 4.19Å; L578-F596 HydrophobicContact CD2-CE1 3.8Å; L578-F596 HydrophobicContact CD2-CZ 3.98Å; L578-L599 HydrophobicContact CB-CD1 4.19Å; L578-L599 HydrophobicContact CD2-CD1 3.62Å; L578-L599 HydrophobicContact CG-CD1 4.49Å
579	E	93	Very high	92.5	Very high	97 Å²	97	46.3 Å²	46.3	45%	0.453	22%	0.217	S	C	.	.	H	α-helix	trans	-59.1	-42.9	-176.2	-172.2	-177.4	148.7	0	0	111.8	M575 E576 R583	M575-E579 WeakPolarHBondContact O-CB 3.36Å; M575-E579 PolarHBondContact O-N 3.33Å; E576-E579 PolarHBondContact O-N 2.79Å; E579-R583 WeakPolarHBondContact O-CG 3.16Å; E579-R583 PolarHBondContact O-N 3.45Å; E579-R583 IonicContact OE1-CZ 2.63Å; E579-R583 IonicContact OE1-NH1 3.49Å; E579-R583 PolarHBondContact OE1-NH1 3.45Å; E579-R583 IonicContact OE1-NH2 3.88Å; E579-R583 PolarHBondContact OE1-NH2 3.45Å
580	L	90	Very high	92.2	Very high	13 Å²	13	43 Å²	43	7%	0.068	20%	0.2	C	C	.	.	H	α-helix	trans	-70.9	-32.3	175.9	-166	64.7	0	0	0	112.6	L233 V535 C536 M537 A540 E576 L578 R583 T584	L233-L580 HydrophobicContact CD1-CD1 3.95Å; L233-L580 HydrophobicContact CD2-CD1 4.46Å; V535-L580 HydrophobicContact CG1-CD1 4.04Å; V535-L580 HydrophobicContact CG1-CD2 4.32Å; C536-L580 WeakPolarHBondContact O-CD2 3.49Å; M537-L580 HydrophobicContact SD-CB 4.47Å; M537-L580 HydrophobicContact SD-CD2 4.08Å; M537-L580 HydrophobicContact SD-CG 3.85Å; A540-L580 HydrophobicContact CB-CD2 4.09Å; E576-L580 PolarHBondContact O-N 2.77Å; L578-L580 VanDerWaalsContact C-N 3.34Å; L578-L580 PolarHBondContact O-N 3.49Å; L580-R583 PolarHBondContact O-N 2.88Å; L580-T584 WeakPolarHBondContact O-CB 3.39Å; L580-T584 PolarHBondContact O-N 3.13Å; L580-T584 PolarHBondContact O-OG1 2.97Å
581	C	89.7	Confident	91.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.8	-42.1	176.8	-158.1	0	0	0	0	111.4	M537 S577 L578 T584 Y585 H595	M537-C581 HydrophobicContact CE-CB 4.37Å; S577-C581 VanDerWaalsContact O-CB 3.24Å; S577-C581 WeakPolarHBondContact O-CB 3.38Å; S577-C581 PolarHBondContact O-N 2.63Å; L578-C581 CarbonylContact O-C 3.19Å; L578-C581 WeakPolarHBondContact O-CA 3.43Å; L578-C581 WeakPolarHBondContact O-CB 3.3Å; L578-C581 PolarHBondContact O-N 2.71Å; C581-T584 PolarHBondContact O-N 3.3Å; C581-Y585 PolarHBondContact O-N 3.07Å; C581-Y585 VanDerWaalsContact SG-CD2 3.57Å; C581-H595 VanDerWaalsContact SG-CD2 3.5Å
582	E	91.2	Very high	91.4	Very high	72 Å²	72	41.4 Å²	41.4	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-40.3	171.6	-76.9	-161.4	151.5	0	0	112.4	L578 G586 T592 F596	L578-E582 HydrophobicContact CD1-CG 4Å; L578-E582 HydrophobicContact CG-CG 4.37Å; L578-E582 PolarHBondContact O-N 3.24Å; E582-G586 WeakPolarHBondContact O-CA 3.48Å; E582-G586 PolarHBondContact O-N 3.44Å; E582-T592 HydrophobicContact CG-CG2 3.44Å; E582-T592 VanDerWaalsContact CG-CG2 3.44Å; E582-F596 WeakPolarHBondContact OE1-CE2 3.36Å; E582-F596 WeakPolarHBondContact OE1-CZ 3.47Å
583	R	89.6	Confident	91.3	Very high	151 Å²	151	38.3 Å²	38.3	57%	0.57	18%	0.179	S	C	*	.	H	α-helix	trans	-62.9	-45.2	174	-76.1	179.7	176.4	124.6	12.1	112.5	L233 E579 L580	L233-R583 HydrophobicContact CD1-CB 3.87Å; E579-R583 WeakPolarHBondContact O-CG 3.16Å; E579-R583 PolarHBondContact O-N 3.45Å; E579-R583 IonicContact OE1-CZ 2.63Å; E579-R583 IonicContact OE1-NH1 3.49Å; E579-R583 PolarHBondContact OE1-NH1 3.45Å; E579-R583 IonicContact OE1-NH2 3.88Å; E579-R583 PolarHBondContact OE1-NH2 3.45Å; L580-R583 PolarHBondContact O-N 2.88Å
584	T	85.1	Confident	91.1	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-79.2	-38.6	-171.8	-51.7	0	0	0	0	113.2	L233 M537 L580 C581	L233-T584 WeakPolarHBondContact CD1-OG1 3.33Å; M537-T584 HydrophobicContact CG-CG2 4.05Å; M537-T584 HydrophobicContact SD-CG2 4.23Å; M537-T584 PolarHBondContact SD-OG1 3.01Å; M537-T584 VanDerWaalsContact SD-OG1 3.34Å; L580-T584 WeakPolarHBondContact O-CB 3.39Å; L580-T584 PolarHBondContact O-N 3.13Å; L580-T584 PolarHBondContact O-OG1 2.97Å; C581-T584 PolarHBondContact O-N 3.3Å
585	Y	84.9	Confident	91	Very high	39 Å²	39	38.2 Å²	38.2	15%	0.153	18%	0.178	C	C	.	.	H	α-helix	trans	-116.2	-8	-173.6	-53.7	-46.7	0	0	0	114.5	Y232 M377 M537 C581 Q591	Y232-Y585 HydrophobicContact CD2-CE1 4.44Å; M377-Y585 HydrophobicContact CE-CD1 4Å; M377-Y585 HydrophobicContact SD-CD1 3.63Å; M377-Y585 HydrophobicContact SD-CE1 3.64Å; M537-Y585 HydrophobicContact CE-CD2 4.39Å; M537-Y585 HydrophobicContact CE-CE2 3.55Å; C581-Y585 PolarHBondContact O-N 3.07Å; C581-Y585 VanDerWaalsContact SG-CD2 3.57Å; Y585-Q591 HydrophobicContact CD2-CB 3.92Å; Y585-Q591 HydrophobicContact CD2-CG 4.3Å; Y585-Q591 HydrophobicContact CE2-CB 3.87Å; Y585-Q591 HydrophobicContact CE2-CG 3.95Å
586	G	89.9	Confident	91.1	Very high	30 Å²	30	35.4 Å²	35.4	31%	0.309	16%	0.164	S	C	.	.			trans	77	168.6	-169.5	0	0	0	0	0	113.7	E582 W588 T592	E582-G586 WeakPolarHBondContact O-CA 3.48Å; E582-G586 PolarHBondContact O-N 3.44Å; G586-W588 VanDerWaalsContact C-N 3.35Å; G586-W588 PolarHBondContact O-N 3.26Å; G586-T592 PolarHBondContact O-OG1 2.81Å
587	L	91.5	Very high	91.2	Very high	45 Å²	45	31.7 Å²	31.7	24%	0.236	15%	0.148	C	C	.	.	S	Bend	trans	-56.7	-45.5	174.1	171.4	65	0	0	0	112.3	N589 F596 I622	L587-N589 PolarHBondContact O-N 3.44Å; L587-F596 HydrophobicContact CD1-CE2 3.97Å; L587-F596 HydrophobicContact CD1-CZ 4.34Å; L587-I622 HydrophobicContact CD1-CD1 3.84Å
588	W	92.5	Very high	91.3	Very high	97 Å²	97	32.9 Å²	32.9	37%	0.367	16%	0.155	S	C	.	.	S	Bend	trans	-84.6	55.5	-174	-59	106.1	0	0	0	112	G586 E621 I622 R625 L626	G586-W588 VanDerWaalsContact C-N 3.35Å; G586-W588 PolarHBondContact O-N 3.26Å; W588-E621 WeakPolarHBondContact CH2-OE1 3.29Å; W588-E621 HydrophobicContact CZ3-CG 4.47Å; W588-I622 HydrophobicContact CE3-CB 4.39Å; W588-I622 HydrophobicContact CE3-CG1 4Å; W588-I622 HydrophobicContact CE3-CG2 4.29Å; W588-I622 HydrophobicContact CZ3-CG1 3.95Å; W588-R625 VanDerWaalsContact CH2-NH1 3.26Å; W588-R625 HydrophobicContact CZ3-CB 4.43Å; W588-R625 VanDerWaalsContact CZ3-CD 3.49Å; W588-L626 WeakPolarHBondContact O-CD1 3.48Å
589	N	89.2	Confident	91.4	Very high	11 Å²	11	32.4 Å²	32.4	6%	0.059	15%	0.152	C	C	.	.	S	Bend	trans	-130.9	151.9	174.7	-162.9	-77.6	0	0	0	112.2	M377 C378 L587 Q591 T592 A593	M377-N589 PolarHBondContact O-ND2 3.32Å; M377-N589 VanDerWaalsContact O-ND2 3.17Å; C378-N589 PolarHBondContact SG-OD1 3.27Å; C378-N589 VanDerWaalsContact SG-OD1 3.35Å; L587-N589 PolarHBondContact O-N 3.44Å; N589-Q591 PolarHBondContact OD1-N 3.28Å; N589-T592 WeakPolarHBondContact O-CB 3.03Å; N589-T592 PolarHBondContact O-N 3.24Å; N589-A593 PolarHBondContact O-N 3.38Å
590	I	89.8	Confident	91.6	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-36.8	-178.1	-51.9	167	0	0	0	111.3	C378 Y380 A593 K594 L626 L627 A794	C378-I590 HydrophobicContact CB-CB 4.5Å; C378-I590 HydrophobicContact CB-CD1 3.9Å; C378-I590 HydrophobicContact CB-CG1 4.34Å; Y380-I590 HydrophobicContact CD2-CD1 4.44Å; Y380-I590 HydrophobicContact CE2-CD1 3.53Å; I590-A593 PolarHBondContact O-N 3.41Å; I590-K594 WeakPolarHBondContact O-CG 3.41Å; I590-K594 PolarHBondContact O-N 2.87Å; I590-K594 VanDerWaalsContact O-N 3.07Å; I590-L626 HydrophobicContact CG1-CD1 4.06Å; I590-L627 HydrophobicContact CD1-CD1 4.37Å; I590-L627 HydrophobicContact CD1-CD2 3.69Å; I590-L627 HydrophobicContact CD1-CG 4.44Å; I590-L627 HydrophobicContact CG1-CD1 4.48Å; I590-L627 HydrophobicContact CG1-CD2 4.3Å; I590-A794 HydrophobicContact CD1-CB 4.15Å
591	Q	87.8	Confident	91.9	Very high	43 Å²	43	29 Å²	29	20%	0.201	13%	0.134	C	C	.	.	H	α-helix	trans	-65	-47.6	175.9	-56.4	-53.2	-27.4	0	0	109.9	C378 Y585 N589 A593 K594 H595	C378-Q591 PolarHBondContact SG-NE2 2.87Å; C378-Q591 VanDerWaalsContact SG-NE2 3.43Å; Y585-Q591 HydrophobicContact CD2-CB 3.92Å; Y585-Q591 HydrophobicContact CD2-CG 4.3Å; Y585-Q591 HydrophobicContact CE2-CB 3.87Å; Y585-Q591 HydrophobicContact CE2-CG 3.95Å; N589-Q591 PolarHBondContact OD1-N 3.28Å; Q591-A593 VanDerWaalsContact C-N 3.3Å; Q591-A593 PolarHBondContact O-N 2.88Å; Q591-K594 WeakPolarHBondContact O-CA 3.45Å; Q591-K594 WeakPolarHBondContact O-CB 3.3Å; Q591-K594 PolarHBondContact O-N 2.71Å; Q591-H595 PolarHBondContact O-CD2 3.05Å; Q591-H595 VanDerWaalsContact O-CD2 3.27Å; Q591-H595 PolarHBondContact O-N 2.86Å; Q591-H595 VanDerWaalsContact O-N 3.09Å
592	T	91.7	Very high	92.2	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-52.4	-47.5	173.8	-45.5	0	0	0	0	111.7	L578 E582 G586 N589 K594 H595 F596	L578-T592 HydrophobicContact CD1-CG2 3.85Å; E582-T592 HydrophobicContact CG-CG2 3.44Å; E582-T592 VanDerWaalsContact CG-CG2 3.44Å; G586-T592 PolarHBondContact O-OG1 2.81Å; N589-T592 WeakPolarHBondContact O-CB 3.03Å; N589-T592 PolarHBondContact O-N 3.24Å; T592-K594 PolarHBondContact O-N 3.29Å; T592-H595 PolarHBondContact O-N 3.29Å; T592-H595 VanDerWaalsContact O-N 3.09Å; T592-F596 HydrophobicContact CG2-CD2 4.23Å; T592-F596 HydrophobicContact CG2-CE2 3.9Å; T592-F596 WeakPolarHBondContact O-CD2 3.47Å; T592-F596 PolarHBondContact O-N 3.05Å
593	A	94.8	Very high	92.6	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.7	-24.9	175.6	0	0	0	0	0	114.2	N589 I590 Q591 G597 A619 I622 K623	N589-A593 PolarHBondContact O-N 3.38Å; I590-A593 PolarHBondContact O-N 3.41Å; Q591-A593 VanDerWaalsContact C-N 3.3Å; Q591-A593 PolarHBondContact O-N 2.88Å; A593-G597 PolarHBondContact O-N 3.36Å; A593-A619 VanDerWaalsContact O-CB 3.24Å; A593-A619 WeakPolarHBondContact O-CB 3.33Å; A593-I622 HydrophobicContact CB-CB 3.94Å; A593-I622 HydrophobicContact CB-CD1 4.42Å; A593-I622 HydrophobicContact CB-CG2 3.82Å; A593-K623 HydrophobicContact CB-CD 4.26Å; A593-K623 HydrophobicContact CB-CG 3.77Å
594	K	92.3	Very high	92.8	Very high	8 Å²	8	21.2 Å²	21.2	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-76	-36.2	172.2	-71.3	171.6	175.5	-160.2	0	112.1	I590 Q591 T592 G597 N598 E633 A794 S795 R796 S797	I590-K594 WeakPolarHBondContact O-CG 3.41Å; I590-K594 PolarHBondContact O-N 2.87Å; I590-K594 VanDerWaalsContact O-N 3.07Å; Q591-K594 WeakPolarHBondContact O-CA 3.45Å; Q591-K594 WeakPolarHBondContact O-CB 3.3Å; Q591-K594 PolarHBondContact O-N 2.71Å; T592-K594 PolarHBondContact O-N 3.29Å; K594-G597 PolarHBondContact O-N 3.26Å; K594-N598 PolarHBondContact O-N 2.91Å; K594-N598 PolarHBondContact O-ND2 3.45Å; K594-N598 VanDerWaalsContact O-ND2 3.17Å; K594-N598 PolarHBondContact O-OD1 2.95Å; K594-E633 WeakPolarHBondContact CE-OE1 3.42Å; K594-E633 WeakPolarHBondContact CE-OE2 3.45Å; K594-E633 IonicContact NZ-OE1 3.31Å; K594-E633 PolarHBondContact NZ-OE1 3.43Å; K594-E633 IonicContact NZ-OE2 2.79Å; K594-A794 PolarHBondContact NZ-O 3.25Å; K594-S795 PolarHBondContact NZ-O 3.06Å; K594-R796 VanDerWaalsContact NZ-C 3.3Å; K594-R796 PolarHBondContact NZ-O 3.16Å; K594-S797 WeakPolarHBondContact CD-OG 3.2Å
595	H	93.5	Very high	93.3	Very high	13 Å²	13	22.6 Å²	22.6	6%	0.06	11%	0.114	C	C	.	.	H	α-helix	trans	-64.4	-40.7	171.6	-73	-91.4	0	0	0	111.8	L578 C581 Q591 T592 G597 N598 L599	L578-H595 HydrophobicContact CB-CB 4.01Å; L578-H595 HydrophobicContact CD1-CB 3.69Å; L578-H595 HydrophobicContact CG-CB 4.43Å; C581-H595 VanDerWaalsContact SG-CD2 3.5Å; Q591-H595 PolarHBondContact O-CD2 3.05Å; Q591-H595 VanDerWaalsContact O-CD2 3.27Å; Q591-H595 PolarHBondContact O-N 2.86Å; Q591-H595 VanDerWaalsContact O-N 3.09Å; T592-H595 PolarHBondContact O-N 3.29Å; T592-H595 VanDerWaalsContact O-N 3.09Å; H595-G597 PolarHBondContact O-N 2.94Å; H595-N598 PolarHBondContact O-N 3.48Å; H595-L599 PolarHBondContact O-N 3.27Å
596	F	97.1	Very high	93.8	Very high	19 Å²	19	23.7 Å²	23.7	8%	0.083	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-45.5	168.2	-78.9	-65.8	0	0	0	112.3	L578 E582 L587 T592 N598 L599 G600 M615 R618 A619 I622	L578-F596 HydrophobicContact CD1-CD2 4.09Å; L578-F596 HydrophobicContact CD1-CE2 3.91Å; L578-F596 HydrophobicContact CD1-CG 4.48Å; L578-F596 HydrophobicContact CD1-CZ 4.15Å; L578-F596 HydrophobicContact CD2-CD1 4.19Å; L578-F596 HydrophobicContact CD2-CE1 3.8Å; L578-F596 HydrophobicContact CD2-CZ 3.98Å; E582-F596 WeakPolarHBondContact OE1-CE2 3.36Å; E582-F596 WeakPolarHBondContact OE1-CZ 3.47Å; L587-F596 HydrophobicContact CD1-CE2 3.97Å; L587-F596 HydrophobicContact CD1-CZ 4.34Å; T592-F596 HydrophobicContact CG2-CD2 4.23Å; T592-F596 HydrophobicContact CG2-CE2 3.9Å; T592-F596 WeakPolarHBondContact O-CD2 3.47Å; T592-F596 PolarHBondContact O-N 3.05Å; F596-N598 VanDerWaalsContact C-N 3.35Å; F596-N598 PolarHBondContact O-N 3.43Å; F596-L599 PolarHBondContact O-N 3.32Å; F596-G600 PolarHBondContact O-N 3.48Å; F596-M615 HydrophobicContact CD1-SD 3.61Å; F596-M615 HydrophobicContact CE1-SD 3.91Å; F596-M615 WeakPolarHBondContact O-CB 3.26Å; F596-R618 HydrophobicContact CD1-CB 4.31Å; F596-R618 HydrophobicContact CD1-CG 4.03Å; F596-R618 HydrophobicContact CD2-CG 4.16Å; F596-R618 HydrophobicContact CE1-CG 4Å; F596-R618 HydrophobicContact CE2-CG 4.13Å; F596-R618 HydrophobicContact CG-CB 4.47Å; F596-R618 HydrophobicContact CG-CG 4.13Å; F596-R618 HydrophobicContact CZ-CG 4.06Å; F596-A619 HydrophobicContact CB-CB 3.95Å; F596-I622 HydrophobicContact CD2-CD1 3.92Å; F596-I622 HydrophobicContact CE2-CD1 4.01Å
597	G	95.2	Very high	94	Very high	8 Å²	8	30.1 Å²	30.1	8%	0.082	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-38.9	177.6	0	0	0	0	0	114.2	A593 K594 H595 G600 R601 H616	A593-G597 PolarHBondContact O-N 3.36Å; K594-G597 PolarHBondContact O-N 3.26Å; H595-G597 PolarHBondContact O-N 2.94Å; G597-G600 PolarHBondContact O-N 3.26Å; G597-R601 PolarHBondContact O-N 2.93Å; G597-H616 PolarHBondContact O-CE1 3.24Å
598	N	94.7	Very high	94.3	Very high	25 Å²	25	30.7 Å²	30.7	13%	0.134	15%	0.146	C	C	.	.	H	α-helix	trans	-71.7	-40.9	177.2	-57.8	-28.1	0	0	0	111.7	K594 H595 F596 G600 R601 L602	K594-N598 PolarHBondContact O-N 2.91Å; K594-N598 PolarHBondContact O-ND2 3.45Å; K594-N598 VanDerWaalsContact O-ND2 3.17Å; K594-N598 PolarHBondContact O-OD1 2.95Å; H595-N598 PolarHBondContact O-N 3.48Å; F596-N598 VanDerWaalsContact C-N 3.35Å; F596-N598 PolarHBondContact O-N 3.43Å; N598-G600 VanDerWaalsContact C-N 3.26Å; N598-G600 PolarHBondContact O-N 3.41Å; N598-R601 PolarHBondContact O-N 3.44Å; N598-L602 PolarHBondContact O-N 3.47Å
599	L	96.7	Very high	94.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-34.2	172.9	-79.6	164.8	0	0	0	112.1	H574 M575 L578 H595 F596 L602 Y603 M615	H574-L599 HydrophobicContact CB-CD2 3.59Å; H574-L599 HydrophobicContact CB-CG 3.98Å; M575-L599 HydrophobicContact CG-CD2 4.16Å; M575-L599 HydrophobicContact SD-CD1 3.75Å; M575-L599 HydrophobicContact SD-CD2 3.93Å; L578-L599 HydrophobicContact CB-CD1 4.19Å; L578-L599 HydrophobicContact CD2-CD1 3.62Å; L578-L599 HydrophobicContact CG-CD1 4.49Å; H595-L599 PolarHBondContact O-N 3.27Å; F596-L599 PolarHBondContact O-N 3.32Å; L599-L602 PolarHBondContact O-N 2.72Å; L599-Y603 HydrophobicContact CB-CD2 4.5Å; L599-Y603 HydrophobicContact CB-CE2 4.4Å; L599-Y603 HydrophobicContact CD2-CE2 4.3Å; L599-Y603 WeakPolarHBondContact O-CB 3.08Å; L599-Y603 WeakPolarHBondContact O-CD2 3.48Å; L599-Y603 PolarHBondContact O-N 3.46Å; L599-M615 HydrophobicContact CB-CB 4.47Å; L599-M615 HydrophobicContact CB-CG 4.22Å
600	G	97.3	Very high	94.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-53	171.6	0	0	0	0	0	112.1	F596 G597 N598 L602 Y603 Q604 A612 H616	F596-G600 PolarHBondContact O-N 3.48Å; G597-G600 PolarHBondContact O-N 3.26Å; N598-G600 VanDerWaalsContact C-N 3.26Å; N598-G600 PolarHBondContact O-N 3.41Å; G600-L602 VanDerWaalsContact C-N 3.35Å; G600-L602 PolarHBondContact O-N 2.88Å; G600-Y603 PolarHBondContact O-N 2.92Å; G600-Q604 PolarHBondContact O-N 2.98Å; G600-A612 VanDerWaalsContact O-CB 3.28Å; G600-A612 WeakPolarHBondContact O-CB 3.28Å; G600-H616 WeakPolarHBondContact CA-NE2 3.23Å
601	R	95.4	Very high	95.3	Very high	39 Å²	39	37.9 Å²	37.9	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-57.1	-48	176.2	-167.5	-173.4	79.6	149.8	3.6	111.2	Y505 E551 E552 G597 N598 Y603 Q604 S605 H616	Y505-R601 PolarHBondContact OH-NH1 3.03Å; E551-R601 IonicContact OE1-CZ 3.12Å; E551-R601 IonicContact OE1-NE 3.67Å; E551-R601 PolarHBondContact OE1-NE 3.35Å; E551-R601 IonicContact OE1-NH2 3.64Å; E551-R601 IonicContact OE2-CZ 2.59Å; E551-R601 VanDerWaalsContact OE2-CZ 3.29Å; E551-R601 IonicContact OE2-NE 3.52Å; E551-R601 PolarHBondContact OE2-NE 3.2Å; E551-R601 VanDerWaalsContact OE2-NE 3.07Å; E551-R601 IonicContact OE2-NH2 2.86Å; E551-R601 PolarHBondContact OE2-NH2 2.87Å; E552-R601 IonicContact OE1-CZ 3.78Å; E552-R601 IonicContact OE1-NH1 3.76Å; E552-R601 PolarHBondContact OE1-NH1 3.42Å; E552-R601 IonicContact OE1-NH2 3.67Å; E552-R601 PolarHBondContact OE1-NH2 2.91Å; G597-R601 PolarHBondContact O-N 2.93Å; N598-R601 PolarHBondContact O-N 3.44Å; R601-Y603 VanDerWaalsContact C-N 3.34Å; R601-Y603 PolarHBondContact O-N 2.74Å; R601-Q604 WeakPolarHBondContact O-CA 3.42Å; R601-Q604 VanDerWaalsContact O-CB 3.23Å; R601-Q604 WeakPolarHBondContact O-CB 3.44Å; R601-Q604 PolarHBondContact O-N 3.11Å; R601-S605 PolarHBondContact O-N 3.09Å; R601-S605 PolarHBondContact O-OG 3.39Å; R601-S605 VanDerWaalsContact O-OG 3.13Å; R601-H616 PolarHBondContact N-CE1 2.98Å; R601-H616 PolarHBondContact N-NE2 3.39Å
602	L	97	Very high	95.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-37	-179.3	-176.9	65.8	0	0	0	113	E551 L567 A570 R571 N598 L599 G600 Q604 S605 M606	E551-L602 HydrophobicContact CB-CD1 4.09Å; E551-L602 HydrophobicContact CG-CD1 3.63Å; E551-L602 VanDerWaalsContact OE1-CA 3.3Å; E551-L602 WeakPolarHBondContact OE1-CA 3.41Å; E551-L602 PolarHBondContact OE1-N 3.39Å; L567-L602 HydrophobicContact CB-CD1 4.47Å; L567-L602 HydrophobicContact CD2-CD1 3.63Å; A570-L602 HydrophobicContact CB-CD1 3.99Å; A570-L602 HydrophobicContact CB-CD2 3.88Å; R571-L602 HydrophobicContact CB-CD2 3.68Å; R571-L602 HydrophobicContact CG-CD2 4.49Å; N598-L602 PolarHBondContact O-N 3.47Å; L599-L602 PolarHBondContact O-N 2.72Å; G600-L602 VanDerWaalsContact C-N 3.35Å; G600-L602 PolarHBondContact O-N 2.88Å; L602-Q604 VanDerWaalsContact C-N 3.31Å; L602-Q604 PolarHBondContact O-N 2.97Å; L602-S605 PolarHBondContact O-N 3.49Å; L602-M606 HydrophobicContact CG-SD 4.47Å; L602-M606 WeakPolarHBondContact O-CB 3.07Å; L602-M606 VanDerWaalsContact O-CG 3.28Å; L602-M606 WeakPolarHBondContact O-CG 3.21Å; L602-M606 PolarHBondContact O-N 3.11Å
603	Y	98.1	Very high	96.1	Very high	29 Å²	29	37.7 Å²	37.7	11%	0.114	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-29.3	174.1	-76.5	-54.5	0	0	0	112.7	R571 L599 G600 R601 M606 Q607 N608 E611 M615	R571-Y603 HydrophobicContact CG-CE1 4.29Å; L599-Y603 HydrophobicContact CB-CD2 4.5Å; L599-Y603 HydrophobicContact CB-CE2 4.4Å; L599-Y603 HydrophobicContact CD2-CE2 4.3Å; L599-Y603 WeakPolarHBondContact O-CB 3.08Å; L599-Y603 WeakPolarHBondContact O-CD2 3.48Å; L599-Y603 PolarHBondContact O-N 3.46Å; G600-Y603 PolarHBondContact O-N 2.92Å; R601-Y603 VanDerWaalsContact C-N 3.34Å; R601-Y603 PolarHBondContact O-N 2.74Å; Y603-M606 HydrophobicContact CD1-SD 4.17Å; Y603-M606 HydrophobicContact CE1-SD 4.33Å; Y603-M606 PolarHBondContact O-N 2.96Å; Y603-Q607 PolarHBondContact O-N 3.18Å; Y603-N608 HydrophobicContact CD1-CB 4.2Å; Y603-N608 CarbonylContact O-C 2.82Å; Y603-N608 WeakPolarHBondContact O-CA 3.38Å; Y603-N608 PolarHBondContact O-N 3.45Å; Y603-E611 HydrophobicContact CD1-CB 4.24Å; Y603-E611 HydrophobicContact CD2-CB 4.01Å; Y603-E611 HydrophobicContact CE2-CB 4.39Å; Y603-E611 HydrophobicContact CG-CB 3.96Å; Y603-M615 HydrophobicContact CD2-CG 3.97Å; Y603-M615 HydrophobicContact CE2-CE 4.27Å; Y603-M615 HydrophobicContact CE2-CG 4.14Å
604	Q	95.3	Very high	96.3	Very high	29 Å²	29	42.3 Å²	42.3	14%	0.136	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-49.3	168.6	-176.6	-178.1	0.8	0	0	110.2	G600 R601 L602 M606 Q607 A612 L644 D648	G600-Q604 PolarHBondContact O-N 2.98Å; R601-Q604 WeakPolarHBondContact O-CA 3.42Å; R601-Q604 VanDerWaalsContact O-CB 3.23Å; R601-Q604 WeakPolarHBondContact O-CB 3.44Å; R601-Q604 PolarHBondContact O-N 3.11Å; L602-Q604 VanDerWaalsContact C-N 3.31Å; L602-Q604 PolarHBondContact O-N 2.97Å; Q604-M606 PolarHBondContact O-N 3.47Å; Q604-Q607 WeakPolarHBondContact O-CA 3.05Å; Q604-Q607 PolarHBondContact O-N 3.31Å; Q604-A612 HydrophobicContact CB-CB 4.24Å; Q604-L644 HydrophobicContact CB-CD1 3.96Å; Q604-L644 HydrophobicContact CG-CD1 3.72Å; Q604-D648 WeakPolarHBondContact CG-OD2 3.45Å; Q604-D648 PolarHBondContact NE2-OD2 3.29Å
605	S	94.5	Very high	96.5	Very high	34 Å²	34	43.6 Å²	43.6	24%	0.238	21%	0.211	C	C	.	.	H	α-helix	trans	-60.2	-30.2	175	-53.4	0	0	0	0	113.3	E551 R601 L602 Q607	E551-S605 WeakPolarHBondContact OE1-CB 3.02Å; E551-S605 PolarHBondContact OE1-OG 3.02Å; R601-S605 PolarHBondContact O-N 3.09Å; R601-S605 PolarHBondContact O-OG 3.39Å; R601-S605 VanDerWaalsContact O-OG 3.13Å; L602-S605 PolarHBondContact O-N 3.49Å; S605-Q607 VanDerWaalsContact C-N 3.3Å; S605-Q607 PolarHBondContact O-N 3.49Å
606	M	96.1	Very high	96.8	Very high	61 Å²	61	43 Å²	43	30%	0.3	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	2.1	171.7	-69.2	-176.5	84.3	0	0	114.5	L567 R571 L602 Y603 Q604 N608	L567-M606 HydrophobicContact CB-CG 3.85Å; L567-M606 HydrophobicContact CD1-CG 4.21Å; L567-M606 HydrophobicContact CG-CG 4.49Å; R571-M606 HydrophobicContact CB-SD 4.25Å; R571-M606 HydrophobicContact CG-SD 4.48Å; L602-M606 HydrophobicContact CG-SD 4.47Å; L602-M606 WeakPolarHBondContact O-CB 3.07Å; L602-M606 VanDerWaalsContact O-CG 3.28Å; L602-M606 WeakPolarHBondContact O-CG 3.21Å; L602-M606 PolarHBondContact O-N 3.11Å; Y603-M606 HydrophobicContact CD1-SD 4.17Å; Y603-M606 HydrophobicContact CE1-SD 4.33Å; Y603-M606 PolarHBondContact O-N 2.96Å; Q604-M606 PolarHBondContact O-N 3.47Å; M606-N608 PolarHBondContact O-N 3.06Å
607	Q	94.5	Very high	96.8	Very high	166 Å²	166	45.9 Å²	45.9	78%	0.776	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	23.2	-173.8	-56.1	177.6	-5.1	0	0	114.1	Y603 Q604 S605 N609	Y603-Q607 PolarHBondContact O-N 3.18Å; Q604-Q607 WeakPolarHBondContact O-CA 3.05Å; Q604-Q607 PolarHBondContact O-N 3.31Å; S605-Q607 VanDerWaalsContact C-N 3.3Å; S605-Q607 PolarHBondContact O-N 3.49Å; Q607-N609 WeakPolarHBondContact CA-OD1 3.39Å; Q607-N609 PolarHBondContact O-N 3.47Å; Q607-N609 PolarHBondContact O-OD1 2.98Å
608	N	96.5	Very high	96.9	Very high	57 Å²	57	49.3 Å²	49.3	31%	0.305	24%	0.235	S	C	.	.			trans	-99.7	63.7	178.1	-164.5	14.8	0	0	0	111.4	Y603 M606 K610 E611 A612	Y603-N608 HydrophobicContact CD1-CB 4.2Å; Y603-N608 CarbonylContact O-C 2.82Å; Y603-N608 WeakPolarHBondContact O-CA 3.38Å; Y603-N608 PolarHBondContact O-N 3.45Å; M606-N608 PolarHBondContact O-N 3.06Å; N608-K610 PolarHBondContact O-N 3.48Å; N608-K610 VanDerWaalsContact O-N 3.11Å; N608-E611 PolarHBondContact ND2-OE1 2.99Å; N608-E611 PolarHBondContact O-N 2.96Å; N608-E611 VanDerWaalsContact O-N 3.11Å; N608-E611 PolarHBondContact OD1-OE1 2.89Å; N608-A612 PolarHBondContact O-N 3.49Å; N608-A612 VanDerWaalsContact O-N 3.09Å
609	N	97.2	Very high	97.1	Very high	36 Å²	36	48.1 Å²	48.1	19%	0.193	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-25.7	-159.7	-54.5	-6.7	0	0	0	113.5	Q607 A612 E613 L644 D648 M649	Q607-N609 WeakPolarHBondContact CA-OD1 3.39Å; Q607-N609 PolarHBondContact O-N 3.47Å; Q607-N609 PolarHBondContact O-OD1 2.98Å; N609-A612 WeakPolarHBondContact O-CB 3.49Å; N609-A612 PolarHBondContact O-N 3.31Å; N609-E613 WeakPolarHBondContact O-CB 3.47Å; N609-E613 PolarHBondContact O-N 3.3Å; N609-L644 HydrophobicContact CB-CD1 4.04Å; N609-D648 WeakPolarHBondContact ND2-CB 3.4Å; N609-D648 PolarHBondContact ND2-O 2.89Å; N609-M649 VanDerWaalsContact C-CE 3.46Å; N609-M649 HydrophobicContact CB-CE 3.63Å; N609-M649 HydrophobicContact CB-CG 4.22Å; N609-M649 WeakPolarHBondContact O-CE 3.45Å
610	K	97.5	Very high	97.2	Very high	153 Å²	153	48.7 Å²	48.7	67%	0.665	23%	0.231	S	C	*	.	H	α-helix	trans	-69.4	-45.8	175.9	-69.2	-178.8	-177.5	177.6	0	112.1	N608 A612 E613 I614	N608-K610 PolarHBondContact O-N 3.48Å; N608-K610 VanDerWaalsContact O-N 3.11Å; K610-A612 VanDerWaalsContact C-N 3.28Å; K610-A612 PolarHBondContact O-N 3.17Å; K610-E613 PolarHBondContact O-N 3.11Å; K610-I614 WeakPolarHBondContact O-CG1 3.42Å; K610-I614 PolarHBondContact O-N 3.18Å
611	E	97.8	Very high	97.2	Very high	74 Å²	74	52.6 Å²	52.6	35%	0.346	25%	0.25	S	C	.	.	H	α-helix	trans	-67.1	-34.6	175.5	-81	82.7	115.2	0	0	110.5	Y603 N608 I614 M615	Y603-E611 HydrophobicContact CD1-CB 4.24Å; Y603-E611 HydrophobicContact CD2-CB 4.01Å; Y603-E611 HydrophobicContact CE2-CB 4.39Å; Y603-E611 HydrophobicContact CG-CB 3.96Å; N608-E611 PolarHBondContact ND2-OE1 2.99Å; N608-E611 PolarHBondContact O-N 2.96Å; N608-E611 VanDerWaalsContact O-N 3.11Å; N608-E611 PolarHBondContact OD1-OE1 2.89Å; E611-I614 PolarHBondContact O-N 3Å; E611-M615 VanDerWaalsContact O-CG 3.22Å; E611-M615 WeakPolarHBondContact O-CG 3.4Å; E611-M615 PolarHBondContact O-N 3.48Å
612	A	98	Very high	97.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.9	-48.1	170.4	0	0	0	0	0	112.6	G600 Q604 N608 N609 K610 I614 M615 H616 L644	G600-A612 VanDerWaalsContact O-CB 3.28Å; G600-A612 WeakPolarHBondContact O-CB 3.28Å; Q604-A612 HydrophobicContact CB-CB 4.24Å; N608-A612 PolarHBondContact O-N 3.49Å; N608-A612 VanDerWaalsContact O-N 3.09Å; N609-A612 WeakPolarHBondContact O-CB 3.49Å; N609-A612 PolarHBondContact O-N 3.31Å; K610-A612 VanDerWaalsContact C-N 3.28Å; K610-A612 PolarHBondContact O-N 3.17Å; A612-I614 PolarHBondContact O-N 3.49Å; A612-M615 PolarHBondContact O-N 2.88Å; A612-H616 WeakPolarHBondContact O-CB 3.5Å; A612-H616 PolarHBondContact O-CD2 3.15Å; A612-H616 PolarHBondContact O-N 3.44Å; A612-L644 HydrophobicContact CB-CD1 3.84Å; A612-L644 HydrophobicContact CB-CD2 3.69Å; A612-L644 HydrophobicContact CB-CG 4.44Å
613	E	98.5	Very high	97.1	Very high	40 Å²	40	51 Å²	51	19%	0.187	24%	0.244	C	C	.	.	H	α-helix	trans	-58.8	-45.6	176.7	174.9	175.5	-158.8	0	0	111.4	N609 K610 M615 H616 L617 L644 Y645 M649 R651	N609-E613 WeakPolarHBondContact O-CB 3.47Å; N609-E613 PolarHBondContact O-N 3.3Å; K610-E613 PolarHBondContact O-N 3.11Å; E613-M615 PolarHBondContact O-N 3.31Å; E613-H616 PolarHBondContact O-N 3.43Å; E613-L617 HydrophobicContact CG-CD1 3.72Å; E613-L617 HydrophobicContact CG-CG 4.36Å; E613-L617 VanDerWaalsContact O-CB 3.3Å; E613-L617 WeakPolarHBondContact O-CB 3.48Å; E613-L617 VanDerWaalsContact O-CG 3.23Å; E613-L617 WeakPolarHBondContact O-CG 3.5Å; E613-L617 PolarHBondContact O-N 3.11Å; E613-L644 HydrophobicContact CB-CD2 3.89Å; E613-L644 VanDerWaalsContact N-CD2 3.33Å; E613-Y645 HydrophobicContact CG-CE1 4.11Å; E613-Y645 PolarHBondContact OE1-OH 3.49Å; E613-Y645 VanDerWaalsContact OE1-OH 3.06Å; E613-M649 HydrophobicContact CB-CE 3.91Å; E613-M649 WeakPolarHBondContact OE2-CE 3.41Å; E613-R651 IonicContact OE1-CZ 2.76Å; E613-R651 IonicContact OE1-NH1 3.14Å; E613-R651 PolarHBondContact OE1-NH1 3.35Å; E613-R651 IonicContact OE1-NH2 3.51Å; E613-R651 PolarHBondContact OE1-NH2 3.47Å; E613-R651 IonicContact OE2-NH1 3.53Å; E613-R651 PolarHBondContact OE2-NH1 3.39Å
614	I	98.4	Very high	97	Very high	96 Å²	96	52.5 Å²	52.5	49%	0.492	25%	0.252	S	S	.	.	H	α-helix	trans	-58.8	-48.1	176.9	-69.5	164.8	0	0	0	111.4	K610 E611 A612 R618	K610-I614 WeakPolarHBondContact O-CG1 3.42Å; K610-I614 PolarHBondContact O-N 3.18Å; E611-I614 PolarHBondContact O-N 3Å; A612-I614 PolarHBondContact O-N 3.49Å; I614-R618 WeakPolarHBondContact O-CB 3.24Å; I614-R618 PolarHBondContact O-N 3.19Å
615	M	98.1	Very high	97	Very high	36 Å²	36	59.6 Å²	59.6	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-69.4	-39.4	-177	-62	-61.8	157.2	0	0	112	F596 L599 Y603 E611 A612 E613 R618 A619	F596-M615 HydrophobicContact CD1-SD 3.61Å; F596-M615 HydrophobicContact CE1-SD 3.91Å; F596-M615 WeakPolarHBondContact O-CB 3.26Å; L599-M615 HydrophobicContact CB-CB 4.47Å; L599-M615 HydrophobicContact CB-CG 4.22Å; Y603-M615 HydrophobicContact CD2-CG 3.97Å; Y603-M615 HydrophobicContact CE2-CE 4.27Å; Y603-M615 HydrophobicContact CE2-CG 4.14Å; E611-M615 VanDerWaalsContact O-CG 3.22Å; E611-M615 WeakPolarHBondContact O-CG 3.4Å; E611-M615 PolarHBondContact O-N 3.48Å; A612-M615 PolarHBondContact O-N 2.88Å; E613-M615 PolarHBondContact O-N 3.31Å; M615-R618 PolarHBondContact O-N 3.31Å; M615-A619 WeakPolarHBondContact O-CB 3.23Å; M615-A619 PolarHBondContact O-N 2.98Å
616	H	98.1	Very high	96.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-44.5	174.7	-76.1	-54.4	0	0	0	112.8	G597 G600 R601 A612 E613 R618 A619 I620 L641	G597-H616 PolarHBondContact O-CE1 3.24Å; G600-H616 WeakPolarHBondContact CA-NE2 3.23Å; R601-H616 PolarHBondContact N-CE1 2.98Å; R601-H616 PolarHBondContact N-NE2 3.39Å; A612-H616 WeakPolarHBondContact O-CB 3.5Å; A612-H616 PolarHBondContact O-CD2 3.15Å; A612-H616 PolarHBondContact O-N 3.44Å; E613-H616 PolarHBondContact O-N 3.43Å; H616-R618 VanDerWaalsContact C-N 3.28Å; H616-R618 PolarHBondContact O-N 2.92Å; H616-A619 WeakPolarHBondContact O-CB 3.3Å; H616-A619 PolarHBondContact O-N 3.04Å; H616-I620 VanDerWaalsContact O-CG1 3.29Å; H616-I620 WeakPolarHBondContact O-CG1 3.22Å; H616-I620 PolarHBondContact O-N 2.99Å; H616-L641 HydrophobicContact CB-CB 4.16Å; H616-L641 HydrophobicContact CB-CD1 3.93Å
617	L	98.5	Very high	96.1	Very high	80 Å²	80	57.9 Å²	57.9	42%	0.419	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-40.3	175	-74.2	171	0	0	0	111.3	E613 I620 E621 L641	E613-L617 HydrophobicContact CG-CD1 3.72Å; E613-L617 HydrophobicContact CG-CG 4.36Å; E613-L617 VanDerWaalsContact O-CB 3.3Å; E613-L617 WeakPolarHBondContact O-CB 3.48Å; E613-L617 VanDerWaalsContact O-CG 3.23Å; E613-L617 WeakPolarHBondContact O-CG 3.5Å; E613-L617 PolarHBondContact O-N 3.11Å; L617-I620 PolarHBondContact O-N 2.89Å; L617-E621 WeakPolarHBondContact O-CB 3.4Å; L617-E621 PolarHBondContact O-N 2.75Å; L617-L641 HydrophobicContact CD2-CD2 3.62Å; L617-L641 HydrophobicContact CG-CD2 4.12Å
618	R	97.9	Very high	95.8	Very high	80 Å²	80	50.7 Å²	50.7	30%	0.302	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-41.3	176.1	-170.9	54.5	154.7	-166.7	-9.2	112.7	F596 I614 M615 H616 I620 E621 I622	F596-R618 HydrophobicContact CD1-CB 4.31Å; F596-R618 HydrophobicContact CD1-CG 4.03Å; F596-R618 HydrophobicContact CD2-CG 4.16Å; F596-R618 HydrophobicContact CE1-CG 4Å; F596-R618 HydrophobicContact CE2-CG 4.13Å; F596-R618 HydrophobicContact CG-CB 4.47Å; F596-R618 HydrophobicContact CG-CG 4.13Å; F596-R618 HydrophobicContact CZ-CG 4.06Å; I614-R618 WeakPolarHBondContact O-CB 3.24Å; I614-R618 PolarHBondContact O-N 3.19Å; M615-R618 PolarHBondContact O-N 3.31Å; H616-R618 VanDerWaalsContact C-N 3.28Å; H616-R618 PolarHBondContact O-N 2.92Å; R618-I620 VanDerWaalsContact C-N 3.33Å; R618-I620 PolarHBondContact O-N 2.98Å; R618-E621 WeakPolarHBondContact CD-OE2 3.34Å; R618-E621 IonicContact CZ-OE2 3.06Å; R618-E621 IonicContact NE-OE2 3.45Å; R618-E621 VanDerWaalsContact NH1-CD 3.34Å; R618-E621 IonicContact NH1-OE1 2.72Å; R618-E621 PolarHBondContact NH1-OE1 2.91Å; R618-E621 IonicContact NH1-OE2 2.67Å; R618-E621 PolarHBondContact NH1-OE2 3.03Å; R618-E621 PolarHBondContact O-N 2.74Å; R618-I622 HydrophobicContact CG-CD1 4.02Å; R618-I622 WeakPolarHBondContact O-CD1 3.3Å; R618-I622 VanDerWaalsContact O-CG1 3.32Å; R618-I622 WeakPolarHBondContact O-CG1 3.43Å; R618-I622 PolarHBondContact O-N 2.97Å
619	A	97.4	Very high	95.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-41.2	173.5	0	0	0	0	0	112.1	A593 F596 M615 H616 K623	A593-A619 VanDerWaalsContact O-CB 3.24Å; A593-A619 WeakPolarHBondContact O-CB 3.33Å; F596-A619 HydrophobicContact CB-CB 3.95Å; M615-A619 WeakPolarHBondContact O-CB 3.23Å; M615-A619 PolarHBondContact O-N 2.98Å; H616-A619 WeakPolarHBondContact O-CB 3.3Å; H616-A619 PolarHBondContact O-N 3.04Å; A619-K623 WeakPolarHBondContact O-CB 3.44Å; A619-K623 WeakPolarHBondContact O-CD 3.27Å; A619-K623 VanDerWaalsContact O-CG 3.22Å; A619-K623 WeakPolarHBondContact O-CG 3.34Å; A619-K623 PolarHBondContact O-N 2.71Å
620	I	98.3	Very high	95.4	Very high	11 Å²	11	53 Å²	53	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-51.6	176.5	-67.4	163	0	0	0	110.6	H616 L617 R618 I622 K623 E624 V638 L641	H616-I620 VanDerWaalsContact O-CG1 3.29Å; H616-I620 WeakPolarHBondContact O-CG1 3.22Å; H616-I620 PolarHBondContact O-N 2.99Å; L617-I620 PolarHBondContact O-N 2.89Å; R618-I620 VanDerWaalsContact C-N 3.33Å; R618-I620 PolarHBondContact O-N 2.98Å; I620-I622 VanDerWaalsContact C-N 3.34Å; I620-I622 PolarHBondContact O-N 3.3Å; I620-K623 PolarHBondContact O-N 3.33Å; I620-K623 VanDerWaalsContact O-N 3.15Å; I620-E624 HydrophobicContact CG2-CG 3.94Å; I620-E624 WeakPolarHBondContact CG2-OE1 3.33Å; I620-E624 WeakPolarHBondContact O-CB 3.48Å; I620-E624 WeakPolarHBondContact O-CG 3.32Å; I620-E624 PolarHBondContact O-N 3.19Å; I620-V638 HydrophobicContact CD1-CG2 4.01Å; I620-V638 HydrophobicContact CG1-CG2 4.19Å; I620-V638 HydrophobicContact CG2-CG2 4.32Å; I620-L641 HydrophobicContact CD1-CB 4.05Å; I620-L641 HydrophobicContact CD1-CD2 3.67Å
621	E	98.2	Very high	94.9	Very high	82 Å²	82	45.8 Å²	45.8	38%	0.383	22%	0.224	S	C	.	.	H	α-helix	trans	-51.3	-49.3	179.4	-178.2	-163.1	175.6	0	0	112.3	W588 L617 R618 R625	W588-E621 WeakPolarHBondContact CH2-OE1 3.29Å; W588-E621 HydrophobicContact CZ3-CG 4.47Å; L617-E621 WeakPolarHBondContact O-CB 3.4Å; L617-E621 PolarHBondContact O-N 2.75Å; R618-E621 WeakPolarHBondContact CD-OE2 3.34Å; R618-E621 IonicContact CZ-OE2 3.06Å; R618-E621 IonicContact NE-OE2 3.45Å; R618-E621 VanDerWaalsContact NH1-CD 3.34Å; R618-E621 IonicContact NH1-OE1 2.72Å; R618-E621 PolarHBondContact NH1-OE1 2.91Å; R618-E621 IonicContact NH1-OE2 2.67Å; R618-E621 PolarHBondContact NH1-OE2 3.03Å; R618-E621 PolarHBondContact O-N 2.74Å; E621-R625 WeakPolarHBondContact O-CB 3.23Å; E621-R625 PolarHBondContact O-N 2.96Å; E621-R625 VanDerWaalsContact O-N 3.11Å
622	I	96	Very high	94.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-44.7	-179.2	-62.7	161.3	0	0	0	110.5	L587 W588 A593 F596 R618 I620 R625 L626	L587-I622 HydrophobicContact CD1-CD1 3.84Å; W588-I622 HydrophobicContact CE3-CB 4.39Å; W588-I622 HydrophobicContact CE3-CG1 4Å; W588-I622 HydrophobicContact CE3-CG2 4.29Å; W588-I622 HydrophobicContact CZ3-CG1 3.95Å; A593-I622 HydrophobicContact CB-CB 3.94Å; A593-I622 HydrophobicContact CB-CD1 4.42Å; A593-I622 HydrophobicContact CB-CG2 3.82Å; F596-I622 HydrophobicContact CD2-CD1 3.92Å; F596-I622 HydrophobicContact CE2-CD1 4.01Å; R618-I622 HydrophobicContact CG-CD1 4.02Å; R618-I622 WeakPolarHBondContact O-CD1 3.3Å; R618-I622 VanDerWaalsContact O-CG1 3.32Å; R618-I622 WeakPolarHBondContact O-CG1 3.43Å; R618-I622 PolarHBondContact O-N 2.97Å; I620-I622 VanDerWaalsContact C-N 3.34Å; I620-I622 PolarHBondContact O-N 3.3Å; I622-R625 PolarHBondContact O-N 3.14Å; I622-L626 HydrophobicContact CG2-CD1 3.69Å; I622-L626 HydrophobicContact CG2-CG 4.44Å; I622-L626 WeakPolarHBondContact O-CB 3.47Å; I622-L626 VanDerWaalsContact O-CG 3.23Å; I622-L626 WeakPolarHBondContact O-CG 3.47Å; I622-L626 PolarHBondContact O-N 3.41Å; I622-L626 VanDerWaalsContact O-N 3.11Å
623	K	94.3	Very high	93.9	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-41.5	-179.1	-70.9	171.8	178.7	-162.3	0	112.4	A593 A619 I620 R625 L626 L627 E633 V634 S637	A593-K623 HydrophobicContact CB-CD 4.26Å; A593-K623 HydrophobicContact CB-CG 3.77Å; A619-K623 WeakPolarHBondContact O-CB 3.44Å; A619-K623 WeakPolarHBondContact O-CD 3.27Å; A619-K623 VanDerWaalsContact O-CG 3.22Å; A619-K623 WeakPolarHBondContact O-CG 3.34Å; A619-K623 PolarHBondContact O-N 2.71Å; I620-K623 PolarHBondContact O-N 3.33Å; I620-K623 VanDerWaalsContact O-N 3.15Å; K623-R625 VanDerWaalsContact C-N 3.34Å; K623-R625 PolarHBondContact O-N 3.18Å; K623-L626 PolarHBondContact O-N 2.94Å; K623-L627 HydrophobicContact CB-CD1 4.45Å; K623-L627 VanDerWaalsContact O-CB 3.27Å; K623-L627 WeakPolarHBondContact O-CB 3.49Å; K623-L627 WeakPolarHBondContact O-CG 3.25Å; K623-L627 PolarHBondContact O-N 3.18Å; K623-E633 HydrophobicContact CD-CB 4.1Å; K623-E633 WeakPolarHBondContact CD-O 3.35Å; K623-E633 WeakPolarHBondContact CE-OE2 3.5Å; K623-E633 PolarHBondContact NZ-O 3.49Å; K623-E633 IonicContact NZ-OE2 2.81Å; K623-E633 PolarHBondContact NZ-OE2 2.97Å; K623-V634 HydrophobicContact CB-CG2 3.74Å; K623-S637 VanDerWaalsContact CD-OG 3.26Å; K623-S637 WeakPolarHBondContact CD-OG 3.36Å; K623-S637 PolarHBondContact NZ-OG 3.4Å
624	E	96.4	Very high	93.7	Very high	60 Å²	60	40.8 Å²	40.8	28%	0.28	20%	0.201	S	C	.	.	H	α-helix	trans	-60.7	-44	175.7	-74.2	-173.9	170	0	0	111.6	I620 L626 G628 V634 R661	I620-E624 HydrophobicContact CG2-CG 3.94Å; I620-E624 WeakPolarHBondContact CG2-OE1 3.33Å; I620-E624 WeakPolarHBondContact O-CB 3.48Å; I620-E624 WeakPolarHBondContact O-CG 3.32Å; I620-E624 PolarHBondContact O-N 3.19Å; E624-L626 PolarHBondContact O-N 3.07Å; E624-G628 VanDerWaalsContact O-CA 3.26Å; E624-G628 WeakPolarHBondContact O-CA 3.4Å; E624-G628 PolarHBondContact O-N 2.97Å; E624-V634 HydrophobicContact CB-CG2 4.43Å; E624-V634 HydrophobicContact CG-CB 4.42Å; E624-V634 HydrophobicContact CG-CG1 3.65Å; E624-V634 HydrophobicContact CG-CG2 3.81Å; E624-R661 IonicContact OE1-CZ 3.65Å; E624-R661 IonicContact OE1-NH1 2.71Å; E624-R661 PolarHBondContact OE1-NH1 2.92Å; E624-R661 IonicContact OE1-NH2 3.13Å; E624-R661 PolarHBondContact OE1-NH2 3.35Å
625	R	94.1	Very high	93.5	Very high	177 Å²	177	36.2 Å²	36.2	67%	0.668	18%	0.177	S	C	*	.	H	α-helix	trans	-67.1	-33.9	179.7	-171.3	178.2	-177.5	173.7	2.4	113.2	W588 E621 I622 K623	W588-R625 VanDerWaalsContact CH2-NH1 3.26Å; W588-R625 HydrophobicContact CZ3-CB 4.43Å; W588-R625 VanDerWaalsContact CZ3-CD 3.49Å; E621-R625 WeakPolarHBondContact O-CB 3.23Å; E621-R625 PolarHBondContact O-N 2.96Å; E621-R625 VanDerWaalsContact O-N 3.11Å; I622-R625 PolarHBondContact O-N 3.14Å; K623-R625 VanDerWaalsContact C-N 3.34Å; K623-R625 PolarHBondContact O-N 3.18Å
626	L	87.3	Confident	93.2	Very high	56 Å²	56	36 Å²	36	29%	0.293	18%	0.177	S	C	.	.	H	α-helix	trans	-89.1	-29.5	-177.4	-67.5	173.8	0	0	0	114.1	W588 I590 I622 K623 E624	W588-L626 WeakPolarHBondContact O-CD1 3.48Å; I590-L626 HydrophobicContact CG1-CD1 4.06Å; I622-L626 HydrophobicContact CG2-CD1 3.69Å; I622-L626 HydrophobicContact CG2-CG 4.44Å; I622-L626 WeakPolarHBondContact O-CB 3.47Å; I622-L626 VanDerWaalsContact O-CG 3.23Å; I622-L626 WeakPolarHBondContact O-CG 3.47Å; I622-L626 PolarHBondContact O-N 3.41Å; I622-L626 VanDerWaalsContact O-N 3.11Å; K623-L626 PolarHBondContact O-N 2.94Å; E624-L626 PolarHBondContact O-N 3.07Å
627	L	84.6	Confident	93.1	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-121.4	-16.7	-167.8	-51.5	175.8	0	0	0	114	I590 K623 D631 E633 S790 M792	I590-L627 HydrophobicContact CD1-CD1 4.37Å; I590-L627 HydrophobicContact CD1-CD2 3.69Å; I590-L627 HydrophobicContact CD1-CG 4.44Å; I590-L627 HydrophobicContact CG1-CD1 4.48Å; I590-L627 HydrophobicContact CG1-CD2 4.3Å; K623-L627 HydrophobicContact CB-CD1 4.45Å; K623-L627 VanDerWaalsContact O-CB 3.27Å; K623-L627 WeakPolarHBondContact O-CB 3.49Å; K623-L627 WeakPolarHBondContact O-CG 3.25Å; K623-L627 PolarHBondContact O-N 3.18Å; L627-D631 HydrophobicContact CB-CB 3.61Å; L627-D631 HydrophobicContact CD1-CB 4.36Å; L627-E633 HydrophobicContact CD1-CB 3.66Å; L627-E633 HydrophobicContact CD1-CG 4.25Å; L627-S790 WeakPolarHBondContact O-CB 3.24Å; L627-M792 HydrophobicContact CB-CB 4.08Å; L627-M792 HydrophobicContact CD2-CB 3.62Å; L627-M792 HydrophobicContact CD2-CE 4.32Å; L627-M792 HydrophobicContact CG-CB 4.49Å
628	G	89.8	Confident	93	Very high	14 Å²	14	32.5 Å²	32.5	14%	0.144	16%	0.159	C	C	.	.			trans	90.7	154.7	-170.4	0	0	0	0	0	112.8	E624 T630 D631	E624-G628 VanDerWaalsContact O-CA 3.26Å; E624-G628 WeakPolarHBondContact O-CA 3.4Å; E624-G628 PolarHBondContact O-N 2.97Å; G628-T630 PolarHBondContact O-N 3.43Å; G628-D631 PolarHBondContact O-N 3.27Å
629	P	93.5	Very high	93	Very high	74 Å²	74	29.1 Å²	29.1	48%	0.481	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-2.1	-169.9	29.9	-37.1	0	0	0	115	R661	P629-R661 PolarHBondContact O-NH2 3.19Å
630	T	91.5	Very high	92.9	Very high	67 Å²	67	32.2 Å²	32.2	41%	0.411	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	9.4	178.9	68.8	0	0	0	0	113.5	G628 S790	G628-T630 PolarHBondContact O-N 3.43Å; T630-S790 PolarHBondContact OG1-OG 2.83Å
631	D	86.7	Confident	92.9	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.011	16%	0.161	C	C	.	.	S	Bend	trans	-73.9	153.1	176.8	-162.8	-88.5	0	0	0	112.1	L627 G628 E633 V634 G635 M792 E793	L627-D631 HydrophobicContact CB-CB 3.61Å; L627-D631 HydrophobicContact CD1-CB 4.36Å; G628-D631 PolarHBondContact O-N 3.27Å; D631-E633 VanDerWaalsContact C-N 3.28Å; D631-E633 PolarHBondContact O-N 3.17Å; D631-E633 PolarHBondContact OD1-N 3.46Å; D631-V634 HydrophobicContact CB-CG2 4.45Å; D631-V634 WeakPolarHBondContact O-CB 3.45Å; D631-V634 PolarHBondContact O-N 3.44Å; D631-G635 PolarHBondContact O-N 3.12Å; D631-M792 PolarHBondContact OD2-N 3.2Å; D631-E793 WeakPolarHBondContact OD2-CA 3.38Å; D631-E793 PolarHBondContact OD2-N 2.9Å
632	F	86.1	Confident	92.9	Very high	7 Å²	7	28 Å²	28	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-31.3	-179.8	86.7	-106.9	0	0	0	113	R424 V634 G635 L636 L669 F670 E793 A794	R424-F632 HydrophobicContact CG-CE1 4.19Å; R424-F632 VanDerWaalsContact NE-CE1 3.25Å; F632-V634 VanDerWaalsContact C-N 3.25Å; F632-V634 PolarHBondContact O-N 3.21Å; F632-G635 PolarHBondContact O-N 3.19Å; F632-L636 HydrophobicContact CD2-CD1 3.77Å; F632-L636 HydrophobicContact CD2-CG 4.39Å; F632-L636 HydrophobicContact CE2-CD1 3.94Å; F632-L636 WeakPolarHBondContact O-CG 3.29Å; F632-L636 PolarHBondContact O-N 3.3Å; F632-L669 HydrophobicContact CB-CD1 3.72Å; F632-F670 HydrophobicContact CB-CE2 3.63Å; F632-F670 HydrophobicContact CB-CZ 3.51Å; F632-F670 HydrophobicContact CD1-CZ 4.01Å; F632-F670 HydrophobicContact CG-CE2 4.33Å; F632-F670 AromaticContact CG-CZ 3.9Å; F632-F670 HydrophobicContact CG-CZ 3.9Å; F632-E793 HydrophobicContact CD1-CB 3.97Å; F632-E793 HydrophobicContact CD1-CG 4.3Å; F632-E793 HydrophobicContact CE1-CB 3.92Å; F632-A794 VanDerWaalsContact CE1-N 3.26Å; F632-A794 VanDerWaalsContact CZ-C 3.49Å; F632-A794 WeakPolarHBondContact CZ-O 3.18Å
633	E	87.8	Confident	92.9	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.009	16%	0.156	C	C	.	.	H	α-helix	trans	-66	-33.1	177	-82.9	-66.8	156.3	0	0	111.2	K594 K623 L627 D631 S637 A794	K594-E633 WeakPolarHBondContact CE-OE1 3.42Å; K594-E633 WeakPolarHBondContact CE-OE2 3.45Å; K594-E633 IonicContact NZ-OE1 3.31Å; K594-E633 PolarHBondContact NZ-OE1 3.43Å; K594-E633 IonicContact NZ-OE2 2.79Å; K623-E633 HydrophobicContact CD-CB 4.1Å; K623-E633 WeakPolarHBondContact CD-O 3.35Å; K623-E633 WeakPolarHBondContact CE-OE2 3.5Å; K623-E633 PolarHBondContact NZ-O 3.49Å; K623-E633 IonicContact NZ-OE2 2.81Å; K623-E633 PolarHBondContact NZ-OE2 2.97Å; L627-E633 HydrophobicContact CD1-CB 3.66Å; L627-E633 HydrophobicContact CD1-CG 4.25Å; D631-E633 VanDerWaalsContact C-N 3.28Å; D631-E633 PolarHBondContact O-N 3.17Å; D631-E633 PolarHBondContact OD1-N 3.46Å; E633-S637 WeakPolarHBondContact O-CB 3.43Å; E633-S637 PolarHBondContact O-N 2.91Å; E633-S637 PolarHBondContact O-OG 3.17Å; E633-A794 WeakPolarHBondContact CG-O 3.2Å; E633-A794 VanDerWaalsContact OE1-O 3.08Å
634	V	93.9	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.5	-48.3	168.8	177.1	0	0	0	0	110	K623 E624 D631 F632 L636 S637 V638	K623-V634 HydrophobicContact CB-CG2 3.74Å; E624-V634 HydrophobicContact CB-CG2 4.43Å; E624-V634 HydrophobicContact CG-CB 4.42Å; E624-V634 HydrophobicContact CG-CG1 3.65Å; E624-V634 HydrophobicContact CG-CG2 3.81Å; D631-V634 HydrophobicContact CB-CG2 4.45Å; D631-V634 WeakPolarHBondContact O-CB 3.45Å; D631-V634 PolarHBondContact O-N 3.44Å; F632-V634 VanDerWaalsContact C-N 3.25Å; F632-V634 PolarHBondContact O-N 3.21Å; V634-L636 PolarHBondContact O-N 2.79Å; V634-S637 PolarHBondContact O-N 3.25Å; V634-S637 VanDerWaalsContact O-N 3.12Å; V634-V638 HydrophobicContact CG1-CG2 4.03Å; V634-V638 WeakPolarHBondContact O-CB 3.45Å; V634-V638 WeakPolarHBondContact O-CG2 3.33Å; V634-V638 PolarHBondContact O-N 3.38Å
635	G	94.4	Very high	93.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-51.8	-52.7	178.1	0	0	0	0	0	113.5	D631 F632 S637 V638 G639 S662	D631-G635 PolarHBondContact O-N 3.12Å; F632-G635 PolarHBondContact O-N 3.19Å; G635-S637 VanDerWaalsContact C-N 3.34Å; G635-S637 PolarHBondContact O-N 3.38Å; G635-V638 PolarHBondContact O-N 3.28Å; G635-G639 PolarHBondContact O-N 3.02Å; G635-S662 PolarHBondContact O-OG 3.06Å
636	L	92.1	Very high	93.4	Very high	33 Å²	33	18.7 Å²	18.7	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-56	-46.5	175.5	-71.2	172.7	0	0	0	112.1	F632 V634 V638 G639 H640	F632-L636 HydrophobicContact CD2-CD1 3.77Å; F632-L636 HydrophobicContact CD2-CG 4.39Å; F632-L636 HydrophobicContact CE2-CD1 3.94Å; F632-L636 WeakPolarHBondContact O-CG 3.29Å; F632-L636 PolarHBondContact O-N 3.3Å; V634-L636 PolarHBondContact O-N 2.79Å; L636-V638 VanDerWaalsContact C-N 3.33Å; L636-V638 PolarHBondContact O-N 3.38Å; L636-G639 PolarHBondContact O-N 2.76Å; L636-H640 PolarHBondContact O-CD2 2.82Å; L636-H640 PolarHBondContact O-N 3.17Å
637	S	95.3	Very high	93.7	Very high	6 Å²	6	20.7 Å²	20.7	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-67.9	-34.7	-177.6	-47.8	0	0	0	0	112.1	K623 E633 V634 G635 H640 L641	K623-S637 VanDerWaalsContact CD-OG 3.26Å; K623-S637 WeakPolarHBondContact CD-OG 3.36Å; K623-S637 PolarHBondContact NZ-OG 3.4Å; E633-S637 WeakPolarHBondContact O-CB 3.43Å; E633-S637 PolarHBondContact O-N 2.91Å; E633-S637 PolarHBondContact O-OG 3.17Å; V634-S637 PolarHBondContact O-N 3.25Å; V634-S637 VanDerWaalsContact O-N 3.12Å; G635-S637 VanDerWaalsContact C-N 3.34Å; G635-S637 PolarHBondContact O-N 3.38Å; S637-H640 PolarHBondContact O-N 3.22Å; S637-L641 PolarHBondContact O-N 2.67Å
638	V	98.2	Very high	94.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.2	-41.9	172.8	163.2	0	0	0	0	111.3	I620 V634 G635 L636 H640 L641 A642 L658 R661	I620-V638 HydrophobicContact CD1-CG2 4.01Å; I620-V638 HydrophobicContact CG1-CG2 4.19Å; I620-V638 HydrophobicContact CG2-CG2 4.32Å; V634-V638 HydrophobicContact CG1-CG2 4.03Å; V634-V638 WeakPolarHBondContact O-CB 3.45Å; V634-V638 WeakPolarHBondContact O-CG2 3.33Å; V634-V638 PolarHBondContact O-N 3.38Å; G635-V638 PolarHBondContact O-N 3.28Å; L636-V638 VanDerWaalsContact C-N 3.33Å; L636-V638 PolarHBondContact O-N 3.38Å; V638-H640 VanDerWaalsContact C-N 3.34Å; V638-H640 PolarHBondContact O-N 3.3Å; V638-L641 PolarHBondContact O-N 3.31Å; V638-A642 WeakPolarHBondContact O-CB 3.16Å; V638-A642 PolarHBondContact O-N 3.06Å; V638-L658 HydrophobicContact CG1-CB 3.97Å; V638-L658 HydrophobicContact CG1-CD2 4.03Å; V638-L658 WeakPolarHBondContact CG1-O 3.32Å; V638-R661 HydrophobicContact CG1-CB 4.21Å; V638-R661 HydrophobicContact CG1-CG 4.27Å
639	G	96.7	Very high	94.6	Very high	9 Å²	9	24.7 Å²	24.7	9%	0.093	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-37.1	174.3	0	0	0	0	0	113.1	G635 L636 A642 S643	G635-G639 PolarHBondContact O-N 3.02Å; L636-G639 PolarHBondContact O-N 2.76Å; G639-A642 WeakPolarHBondContact O-CB 3.43Å; G639-A642 PolarHBondContact O-N 2.82Å; G639-S643 PolarHBondContact O-N 3.26Å
640	H	95.3	Very high	94.8	Very high	65 Å²	65	25.9 Å²	25.9	30%	0.301	14%	0.135	S	C	.	.	H	α-helix	trans	-65.3	-44.5	174.2	-65.5	-166.6	0	0	0	111.5	L636 S637 V638 A642 S643 L644	L636-H640 PolarHBondContact O-CD2 2.82Å; L636-H640 PolarHBondContact O-N 3.17Å; S637-H640 PolarHBondContact O-N 3.22Å; V638-H640 VanDerWaalsContact C-N 3.34Å; V638-H640 PolarHBondContact O-N 3.3Å; H640-A642 VanDerWaalsContact C-N 3.32Å; H640-A642 PolarHBondContact O-N 3.01Å; H640-S643 WeakPolarHBondContact O-CA 3.37Å; H640-S643 WeakPolarHBondContact O-CB 3.4Å; H640-S643 PolarHBondContact O-N 2.97Å; H640-S643 VanDerWaalsContact O-N 3.11Å; H640-L644 PolarHBondContact O-N 2.79Å; H640-L644 VanDerWaalsContact O-N 3.1Å
641	L	98.3	Very high	95.1	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-64.2	-36.2	174.7	-175.8	60.5	0	0	0	112.4	H616 L617 I620 S637 V638 S643 L644 Y645 L658	H616-L641 HydrophobicContact CB-CB 4.16Å; H616-L641 HydrophobicContact CB-CD1 3.93Å; L617-L641 HydrophobicContact CD2-CD2 3.62Å; L617-L641 HydrophobicContact CG-CD2 4.12Å; I620-L641 HydrophobicContact CD1-CB 4.05Å; I620-L641 HydrophobicContact CD1-CD2 3.67Å; S637-L641 PolarHBondContact O-N 2.67Å; V638-L641 PolarHBondContact O-N 3.31Å; L641-S643 VanDerWaalsContact C-N 3.27Å; L641-S643 PolarHBondContact O-N 3.19Å; L641-L644 HydrophobicContact CD1-CD2 4.09Å; L641-L644 PolarHBondContact O-N 3.07Å; L641-Y645 HydrophobicContact CD1-CD1 4.11Å; L641-Y645 HydrophobicContact CD1-CE1 3.53Å; L641-Y645 HydrophobicContact CG-CE1 4.13Å; L641-Y645 HydrophobicContact CG-CE2 4.26Å; L641-Y645 PolarHBondContact O-N 2.7Å; L641-L658 HydrophobicContact CB-CD1 4.1Å; L641-L658 HydrophobicContact CD2-CD1 3.82Å; L641-L658 HydrophobicContact CG-CD1 3.66Å
642	A	98.3	Very high	95.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-37.8	172.4	0	0	0	0	0	111.8	V638 G639 H640 Y645 N646 A655 L658 Y659	V638-A642 WeakPolarHBondContact O-CB 3.16Å; V638-A642 PolarHBondContact O-N 3.06Å; G639-A642 WeakPolarHBondContact O-CB 3.43Å; G639-A642 PolarHBondContact O-N 2.82Å; H640-A642 VanDerWaalsContact C-N 3.32Å; H640-A642 PolarHBondContact O-N 3.01Å; A642-Y645 PolarHBondContact O-N 3.33Å; A642-N646 WeakPolarHBondContact O-CB 3.4Å; A642-N646 PolarHBondContact O-N 3.21Å; A642-A655 WeakPolarHBondContact O-CB 3.43Å; A642-L658 HydrophobicContact CB-CB 3.58Å; A642-Y659 HydrophobicContact CB-CD1 3.46Å; A642-Y659 VanDerWaalsContact CB-CD1 3.46Å; A642-Y659 HydrophobicContact CB-CD2 3.79Å; A642-Y659 HydrophobicContact CB-CE1 3.57Å; A642-Y659 HydrophobicContact CB-CE2 3.88Å; A642-Y659 HydrophobicContact CB-CG 3.58Å
643	S	97	Very high	96.2	Very high	37 Å²	37	33.7 Å²	33.7	26%	0.259	16%	0.162	S	C	.	.	H	α-helix	trans	-60.6	-54.1	173.4	-158.7	0	0	0	0	111.6	G639 H640 L641 Y645 N646 Y647 Y659	G639-S643 PolarHBondContact O-N 3.26Å; H640-S643 WeakPolarHBondContact O-CA 3.37Å; H640-S643 WeakPolarHBondContact O-CB 3.4Å; H640-S643 PolarHBondContact O-N 2.97Å; H640-S643 VanDerWaalsContact O-N 3.11Å; L641-S643 VanDerWaalsContact C-N 3.27Å; L641-S643 PolarHBondContact O-N 3.19Å; S643-Y645 VanDerWaalsContact C-N 3.27Å; S643-Y645 PolarHBondContact O-N 3.45Å; S643-N646 PolarHBondContact O-N 3.36Å; S643-Y647 WeakPolarHBondContact O-CD2 3.43Å; S643-Y647 PolarHBondContact O-N 3.28Å; S643-Y659 WeakPolarHBondContact CA-OH 3.49Å
644	L	97.5	Very high	96.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-52.9	-43.8	176.6	177	68.5	0	0	0	112.5	Q604 N609 A612 E613 H640 L641 D648 M649	Q604-L644 HydrophobicContact CB-CD1 3.96Å; Q604-L644 HydrophobicContact CG-CD1 3.72Å; N609-L644 HydrophobicContact CB-CD1 4.04Å; A612-L644 HydrophobicContact CB-CD1 3.84Å; A612-L644 HydrophobicContact CB-CD2 3.69Å; A612-L644 HydrophobicContact CB-CG 4.44Å; E613-L644 HydrophobicContact CB-CD2 3.89Å; E613-L644 VanDerWaalsContact N-CD2 3.33Å; H640-L644 PolarHBondContact O-N 2.79Å; H640-L644 VanDerWaalsContact O-N 3.1Å; L641-L644 HydrophobicContact CD1-CD2 4.09Å; L641-L644 PolarHBondContact O-N 3.07Å; L644-D648 HydrophobicContact CD1-CB 4.28Å; L644-D648 PolarHBondContact O-N 3.43Å; L644-M649 HydrophobicContact CD1-CE 4.5Å; L644-M649 HydrophobicContact CD2-CE 4.05Å; L644-M649 HydrophobicContact CG-CE 4.19Å; L644-M649 PolarHBondContact O-N 2.71Å
645	Y	98.6	Very high	96.9	Very high	14 Å²	14	37.6 Å²	37.6	6%	0.055	18%	0.18	C	C	.	.	H	α-helix	trans	-69.1	-31.5	178.8	-73.4	3.4	0	0	0	113.3	E613 L641 A642 S643 M649 D650 R651 E654 L658	E613-Y645 HydrophobicContact CG-CE1 4.11Å; E613-Y645 PolarHBondContact OE1-OH 3.49Å; E613-Y645 VanDerWaalsContact OE1-OH 3.06Å; L641-Y645 HydrophobicContact CD1-CD1 4.11Å; L641-Y645 HydrophobicContact CD1-CE1 3.53Å; L641-Y645 HydrophobicContact CG-CE1 4.13Å; L641-Y645 HydrophobicContact CG-CE2 4.26Å; L641-Y645 PolarHBondContact O-N 2.7Å; A642-Y645 PolarHBondContact O-N 3.33Å; S643-Y645 VanDerWaalsContact C-N 3.27Å; S643-Y645 PolarHBondContact O-N 3.45Å; Y645-M649 HydrophobicContact CD1-SD 3.8Å; Y645-M649 HydrophobicContact CE1-SD 4.03Å; Y645-D650 PolarHBondContact O-N 3.37Å; Y645-R651 HydrophobicContact CG-CB 4.24Å; Y645-R651 PolarHBondContact O-N 3.44Å; Y645-R651 PolarHBondContact OH-NH2 3.48Å; Y645-E654 HydrophobicContact CD2-CB 3.62Å; Y645-E654 HydrophobicContact CE2-CB 3.92Å; Y645-L658 HydrophobicContact CD2-CD1 3.62Å; Y645-L658 HydrophobicContact CE2-CD1 3.59Å
646	N	97.7	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-85.8	-40.9	-177.3	-175.3	22.8	0	0	0	113.1	A642 S643 F652 A655 Y659 G683 R686 V687	A642-N646 WeakPolarHBondContact O-CB 3.4Å; A642-N646 PolarHBondContact O-N 3.21Å; S643-N646 PolarHBondContact O-N 3.36Å; N646-F652 WeakPolarHBondContact O-CE1 3.4Å; N646-A655 HydrophobicContact CB-CB 3.84Å; N646-Y659 HydrophobicContact CB-CE2 3.88Å; N646-Y659 WeakPolarHBondContact ND2-CE2 3.02Å; N646-Y659 PolarHBondContact ND2-OH 3.31Å; N646-Y659 VanDerWaalsContact ND2-OH 3.17Å; N646-G683 PolarHBondContact ND2-O 3.13Å; N646-R686 PolarHBondContact O-NE 3.02Å; N646-R686 VanDerWaalsContact O-NE 3.09Å; N646-R686 PolarHBondContact O-NH2 3.49Å; N646-R686 WeakPolarHBondContact OD1-CD 3.39Å; N646-R686 WeakPolarHBondContact OD1-CG 3.44Å; N646-V687 HydrophobicContact CB-CG2 4.21Å; N646-V687 WeakPolarHBondContact OD1-CG2 3.4Å
647	Y	95.2	Very high	97.4	Very high	97 Å²	97	45 Å²	45	38%	0.38	21%	0.214	S	C	.	.	H	α-helix	trans	-92.2	-34.4	-170.8	-75.1	-96.6	0	0	0	113.2	S643 R686	S643-Y647 WeakPolarHBondContact O-CD2 3.43Å; S643-Y647 PolarHBondContact O-N 3.28Å; Y647-R686 PolarHBondContact O-NH2 2.9Å
648	D	95.8	Very high	97.5	Very high	60 Å²	60	46.2 Å²	46.2	32%	0.321	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-7.2	-165.4	-48.8	-91.3	0	0	0	114.9	Q604 N609 L644	Q604-D648 WeakPolarHBondContact CG-OD2 3.45Å; Q604-D648 PolarHBondContact NE2-OD2 3.29Å; N609-D648 WeakPolarHBondContact ND2-CB 3.4Å; N609-D648 PolarHBondContact ND2-O 2.89Å; L644-D648 HydrophobicContact CD1-CB 4.28Å; L644-D648 PolarHBondContact O-N 3.43Å
649	M	97.3	Very high	97.5	Very high	42 Å²	42	46.4 Å²	46.4	21%	0.207	22%	0.22	C	C	.	.	S	Bend	trans	-122.7	-7.1	175.5	-62.3	-165.9	172.4	0	0	115	N609 E613 L644 Y645 R651	N609-M649 VanDerWaalsContact C-CE 3.46Å; N609-M649 HydrophobicContact CB-CE 3.63Å; N609-M649 HydrophobicContact CB-CG 4.22Å; N609-M649 WeakPolarHBondContact O-CE 3.45Å; E613-M649 HydrophobicContact CB-CE 3.91Å; E613-M649 WeakPolarHBondContact OE2-CE 3.41Å; L644-M649 HydrophobicContact CD1-CE 4.5Å; L644-M649 HydrophobicContact CD2-CE 4.05Å; L644-M649 HydrophobicContact CG-CE 4.19Å; L644-M649 PolarHBondContact O-N 2.71Å; Y645-M649 HydrophobicContact CD1-SD 3.8Å; Y645-M649 HydrophobicContact CE1-SD 4.03Å; M649-R651 HydrophobicContact CB-CB 4.36Å; M649-R651 HydrophobicContact CB-CG 3.97Å; M649-R651 PolarHBondContact O-N 3.07Å; M649-R651 VanDerWaalsContact O-N 3.08Å; M649-R651 PolarHBondContact SD-NH1 2.72Å; M649-R651 VanDerWaalsContact SD-NH1 3.35Å
650	D	96.3	Very high	97.6	Very high	100 Å²	100	49 Å²	49	54%	0.535	23%	0.232	S	C	.	.			trans	52.8	26.4	-175.1	-57.5	-39.7	0	0	0	114.6	Y645 F652 R686	Y645-D650 PolarHBondContact O-N 3.37Å; D650-F652 HydrophobicContact CB-CE1 4.4Å; D650-F652 HydrophobicContact CB-CE2 3.71Å; D650-F652 HydrophobicContact CB-CZ 3.61Å; D650-F652 VanDerWaalsContact O-CD2 3.27Å; D650-F652 WeakPolarHBondContact O-CD2 3.32Å; D650-F652 WeakPolarHBondContact O-CE2 3.2Å; D650-F652 PolarHBondContact O-N 3.31Å; D650-F652 VanDerWaalsContact OD1-CZ 3.3Å; D650-F652 WeakPolarHBondContact OD1-CZ 3.2Å; D650-R686 IonicContact OD1-NH2 2.81Å
651	R	98	Very high	97.7	Very high	64 Å²	64	49.4 Å²	49.4	24%	0.242	23%	0.23	C	C	.	.			trans	-84.9	49.4	179.2	-74	168	72.3	-176.6	-2.1	111.3	E613 Y645 M649 K653 E654 A655	E613-R651 IonicContact OE1-CZ 2.76Å; E613-R651 IonicContact OE1-NH1 3.14Å; E613-R651 PolarHBondContact OE1-NH1 3.35Å; E613-R651 IonicContact OE1-NH2 3.51Å; E613-R651 PolarHBondContact OE1-NH2 3.47Å; E613-R651 IonicContact OE2-NH1 3.53Å; E613-R651 PolarHBondContact OE2-NH1 3.39Å; Y645-R651 HydrophobicContact CG-CB 4.24Å; Y645-R651 PolarHBondContact O-N 3.44Å; Y645-R651 PolarHBondContact OH-NH2 3.48Å; M649-R651 HydrophobicContact CB-CB 4.36Å; M649-R651 HydrophobicContact CB-CG 3.97Å; M649-R651 PolarHBondContact O-N 3.07Å; M649-R651 VanDerWaalsContact O-N 3.08Å; M649-R651 PolarHBondContact SD-NH1 2.72Å; M649-R651 VanDerWaalsContact SD-NH1 3.35Å; R651-K653 VanDerWaalsContact C-N 3.29Å; R651-K653 PolarHBondContact O-N 3.43Å; R651-E654 HydrophobicContact CB-CB 4.44Å; R651-E654 IonicContact CZ-OE1 3.38Å; R651-E654 IonicContact CZ-OE2 4Å; R651-E654 IonicContact NE-OE1 2.76Å; R651-E654 IonicContact NE-OE2 2.68Å; R651-E654 PolarHBondContact NE-OE2 2.81Å; R651-E654 IonicContact NH2-OE1 3.95Å; R651-E654 PolarHBondContact NH2-OE1 3.05Å; R651-E654 IonicContact NH2-OE2 3.59Å; R651-E654 PolarHBondContact O-N 3.38Å; R651-A655 PolarHBondContact O-N 2.91Å
652	F	98	Very high	97.7	Very high	31 Å²	31	49.4 Å²	49.4	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-53	-37.1	-166.8	-54	-61.7	0	0	0	115	N646 D650 E654 A655 E656 V687 E690 L691	N646-F652 WeakPolarHBondContact O-CE1 3.4Å; D650-F652 HydrophobicContact CB-CE1 4.4Å; D650-F652 HydrophobicContact CB-CE2 3.71Å; D650-F652 HydrophobicContact CB-CZ 3.61Å; D650-F652 VanDerWaalsContact O-CD2 3.27Å; D650-F652 WeakPolarHBondContact O-CD2 3.32Å; D650-F652 WeakPolarHBondContact O-CE2 3.2Å; D650-F652 PolarHBondContact O-N 3.31Å; D650-F652 VanDerWaalsContact OD1-CZ 3.3Å; D650-F652 WeakPolarHBondContact OD1-CZ 3.2Å; F652-E654 PolarHBondContact O-N 3.3Å; F652-A655 PolarHBondContact O-N 3.35Å; F652-E656 WeakPolarHBondContact O-CB 3.46Å; F652-E656 PolarHBondContact O-N 3.39Å; F652-V687 HydrophobicContact CB-CG1 4.37Å; F652-V687 WeakPolarHBondContact O-CG1 3.49Å; F652-E690 HydrophobicContact CD1-CB 3.99Å; F652-E690 HydrophobicContact CD1-CG 4.27Å; F652-E690 HydrophobicContact CD2-CB 3.83Å; F652-E690 HydrophobicContact CE1-CB 3.82Å; F652-E690 HydrophobicContact CE1-CG 3.7Å; F652-E690 HydrophobicContact CE2-CB 3.64Å; F652-E690 HydrophobicContact CE2-CG 4.17Å; F652-E690 HydrophobicContact CG-CB 4Å; F652-E690 HydrophobicContact CZ-CB 3.64Å; F652-E690 HydrophobicContact CZ-CG 3.65Å; F652-L691 HydrophobicContact CB-CD1 4.21Å; F652-L691 HydrophobicContact CB-CD2 3.98Å; F652-L691 HydrophobicContact CB-CG 3.87Å
653	K	98	Very high	97.7	Very high	145 Å²	145	49.9 Å²	49.9	63%	0.63	23%	0.234	S	C	*	.	H	α-helix	trans	-71.3	-26.8	178.6	-65	-173.8	179.1	178.2	0	114.1	R651 Q657 L691	R651-K653 VanDerWaalsContact C-N 3.29Å; R651-K653 PolarHBondContact O-N 3.43Å; K653-Q657 WeakPolarHBondContact O-CG 3.46Å; K653-L691 HydrophobicContact CG-CD1 4.3Å; K653-L691 HydrophobicContact CG-CD2 3.85Å
654	E	98.1	Very high	97.7	Very high	83 Å²	83	53 Å²	53	39%	0.388	24%	0.244	S	C	.	.	H	α-helix	trans	-84.3	-38.9	175.9	-63.5	171.4	86.8	0	0	109.6	Y645 R651 F652 E656 Q657 L658	Y645-E654 HydrophobicContact CD2-CB 3.62Å; Y645-E654 HydrophobicContact CE2-CB 3.92Å; R651-E654 HydrophobicContact CB-CB 4.44Å; R651-E654 IonicContact CZ-OE1 3.38Å; R651-E654 IonicContact CZ-OE2 4Å; R651-E654 IonicContact NE-OE1 2.76Å; R651-E654 IonicContact NE-OE2 2.68Å; R651-E654 PolarHBondContact NE-OE2 2.81Å; R651-E654 IonicContact NH2-OE1 3.95Å; R651-E654 PolarHBondContact NH2-OE1 3.05Å; R651-E654 IonicContact NH2-OE2 3.59Å; R651-E654 PolarHBondContact O-N 3.38Å; F652-E654 PolarHBondContact O-N 3.3Å; E654-E656 VanDerWaalsContact C-N 3.31Å; E654-E656 PolarHBondContact O-N 2.65Å; E654-Q657 PolarHBondContact O-N 3.39Å; E654-L658 WeakPolarHBondContact O-CG 3.5Å; E654-L658 PolarHBondContact O-N 3.09Å; E654-L658 VanDerWaalsContact O-N 3.14Å
655	A	98.3	Very high	97.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-42.5	168.6	0	0	0	0	0	112.3	A642 N646 R651 F652 Q657 L658 Y659 V687	A642-A655 WeakPolarHBondContact O-CB 3.43Å; N646-A655 HydrophobicContact CB-CB 3.84Å; R651-A655 PolarHBondContact O-N 2.91Å; F652-A655 PolarHBondContact O-N 3.35Å; A655-Q657 PolarHBondContact O-N 3.17Å; A655-L658 PolarHBondContact O-N 2.95Å; A655-Y659 HydrophobicContact CB-CD2 4.28Å; A655-Y659 HydrophobicContact CB-CE2 4.18Å; A655-Y659 WeakPolarHBondContact O-CD2 3.49Å; A655-Y659 PolarHBondContact O-N 3.24Å; A655-V687 HydrophobicContact CB-CG2 3.88Å
656	E	98.4	Very high	97.2	Very high	50 Å²	50	53.1 Å²	53.1	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-51.9	-52.4	174.7	-167	-173.2	174.3	0	0	111.3	F652 E654 L658 Y659 L660 L684 V687 Y688	F652-E656 WeakPolarHBondContact O-CB 3.46Å; F652-E656 PolarHBondContact O-N 3.39Å; E654-E656 VanDerWaalsContact C-N 3.31Å; E654-E656 PolarHBondContact O-N 2.65Å; E656-L658 VanDerWaalsContact C-N 3.35Å; E656-L658 PolarHBondContact O-N 3.35Å; E656-Y659 PolarHBondContact O-N 3.17Å; E656-L660 HydrophobicContact CG-CD1 3.95Å; E656-L660 HydrophobicContact CG-CG 4.47Å; E656-L660 VanDerWaalsContact O-CB 3.32Å; E656-L660 WeakPolarHBondContact O-CB 3.29Å; E656-L660 WeakPolarHBondContact O-CG 3.5Å; E656-L660 PolarHBondContact O-N 2.79Å; E656-L684 HydrophobicContact CG-CD2 4.35Å; E656-V687 HydrophobicContact CB-CG1 3.82Å; E656-V687 HydrophobicContact CG-CG1 4.22Å; E656-Y688 HydrophobicContact CG-CE1 4.06Å; E656-Y688 WeakPolarHBondContact CG-OH 3.48Å; E656-Y688 WeakPolarHBondContact OE1-CE1 3.46Å; E656-Y688 VanDerWaalsContact OE1-CZ 3.32Å; E656-Y688 PolarHBondContact OE1-OH 3.45Å
657	Q	98.4	Very high	97	Very high	140 Å²	140	55.9 Å²	55.9	65%	0.654	26%	0.261	S	S	*	.	H	α-helix	trans	-64.2	-39	-177.5	-66.7	175.1	17.5	0	0	112.2	K653 E654 A655 R661	K653-Q657 WeakPolarHBondContact O-CG 3.46Å; E654-Q657 PolarHBondContact O-N 3.39Å; A655-Q657 PolarHBondContact O-N 3.17Å; Q657-R661 WeakPolarHBondContact O-CB 3.24Å; Q657-R661 PolarHBondContact O-N 3.4Å; Q657-R661 VanDerWaalsContact O-N 3.14Å
658	L	98.5	Very high	96.8	Very high	30 Å²	30	56.8 Å²	56.8	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-71.9	-45.8	178.5	-65.2	176.3	0	0	0	112	V638 L641 A642 Y645 E654 A655 E656 R661 S662	V638-L658 HydrophobicContact CG1-CB 3.97Å; V638-L658 HydrophobicContact CG1-CD2 4.03Å; V638-L658 WeakPolarHBondContact CG1-O 3.32Å; L641-L658 HydrophobicContact CB-CD1 4.1Å; L641-L658 HydrophobicContact CD2-CD1 3.82Å; L641-L658 HydrophobicContact CG-CD1 3.66Å; A642-L658 HydrophobicContact CB-CB 3.58Å; Y645-L658 HydrophobicContact CD2-CD1 3.62Å; Y645-L658 HydrophobicContact CE2-CD1 3.59Å; E654-L658 WeakPolarHBondContact O-CG 3.5Å; E654-L658 PolarHBondContact O-N 3.09Å; E654-L658 VanDerWaalsContact O-N 3.14Å; A655-L658 PolarHBondContact O-N 2.95Å; E656-L658 VanDerWaalsContact C-N 3.35Å; E656-L658 PolarHBondContact O-N 3.35Å; L658-R661 WeakPolarHBondContact O-CB 3.01Å; L658-R661 PolarHBondContact O-N 3.33Å; L658-S662 PolarHBondContact O-N 3.12Å
659	Y	98.4	Very high	96.2	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-44.7	175	-75.4	-56.9	0	0	0	112	A642 S643 N646 A655 E656 R661 S662 V663 D680 G683 L684 V687	A642-Y659 HydrophobicContact CB-CD1 3.46Å; A642-Y659 VanDerWaalsContact CB-CD1 3.46Å; A642-Y659 HydrophobicContact CB-CD2 3.79Å; A642-Y659 HydrophobicContact CB-CE1 3.57Å; A642-Y659 HydrophobicContact CB-CE2 3.88Å; A642-Y659 HydrophobicContact CB-CG 3.58Å; S643-Y659 WeakPolarHBondContact CA-OH 3.49Å; N646-Y659 HydrophobicContact CB-CE2 3.88Å; N646-Y659 WeakPolarHBondContact ND2-CE2 3.02Å; N646-Y659 PolarHBondContact ND2-OH 3.31Å; N646-Y659 VanDerWaalsContact ND2-OH 3.17Å; A655-Y659 HydrophobicContact CB-CD2 4.28Å; A655-Y659 HydrophobicContact CB-CE2 4.18Å; A655-Y659 WeakPolarHBondContact O-CD2 3.49Å; A655-Y659 PolarHBondContact O-N 3.24Å; E656-Y659 PolarHBondContact O-N 3.17Å; Y659-R661 PolarHBondContact O-N 3.44Å; Y659-S662 PolarHBondContact O-N 3.02Å; Y659-S662 VanDerWaalsContact O-N 3.09Å; Y659-V663 WeakPolarHBondContact O-CG2 3.35Å; Y659-V663 PolarHBondContact O-N 3.36Å; Y659-D680 HydrophobicContact CD1-CB 4.37Å; Y659-D680 WeakPolarHBondContact CD1-OD1 3.49Å; Y659-G683 WeakPolarHBondContact OH-CA 3.47Å; Y659-L684 HydrophobicContact CD2-CD2 4.3Å; Y659-L684 HydrophobicContact CD2-CG 4.23Å; Y659-L684 HydrophobicContact CG-CD2 4.41Å; Y659-L684 HydrophobicContact CG-CG 4.1Å; Y659-V687 HydrophobicContact CD2-CG2 4.11Å; Y659-V687 HydrophobicContact CE2-CG2 3.99Å
660	L	98.4	Very high	95.5	Very high	63 Å²	63	56.7 Å²	56.7	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-57.6	-37.1	175.9	-72.7	174.5	0	0	0	111.5	E656 Q664 L684 Y700	E656-L660 HydrophobicContact CG-CD1 3.95Å; E656-L660 HydrophobicContact CG-CG 4.47Å; E656-L660 VanDerWaalsContact O-CB 3.32Å; E656-L660 WeakPolarHBondContact O-CB 3.29Å; E656-L660 WeakPolarHBondContact O-CG 3.5Å; E656-L660 PolarHBondContact O-N 2.79Å; L660-Q664 VanDerWaalsContact O-CB 3.25Å; L660-Q664 WeakPolarHBondContact O-CB 3.42Å; L660-Q664 PolarHBondContact O-N 3.48Å; L660-L684 HydrophobicContact CD2-CD1 4.24Å; L660-L684 HydrophobicContact CD2-CD2 4.44Å; L660-L684 HydrophobicContact CG-CD2 4.31Å; L660-Y700 WeakPolarHBondContact CD2-OH 3.41Å
661	R	98	Very high	95.1	Very high	73 Å²	73	53 Å²	53	28%	0.275	26%	0.255	S	S	.	.	H	α-helix	trans	-67.1	-45.2	172.9	-179	179.5	177.4	-161.1	-1.6	112.5	E624 P629 V638 Q657 L658 Y659 Q664 I665	E624-R661 IonicContact OE1-CZ 3.65Å; E624-R661 IonicContact OE1-NH1 2.71Å; E624-R661 PolarHBondContact OE1-NH1 2.92Å; E624-R661 IonicContact OE1-NH2 3.13Å; E624-R661 PolarHBondContact OE1-NH2 3.35Å; P629-R661 PolarHBondContact O-NH2 3.19Å; V638-R661 HydrophobicContact CG1-CB 4.21Å; V638-R661 HydrophobicContact CG1-CG 4.27Å; Q657-R661 WeakPolarHBondContact O-CB 3.24Å; Q657-R661 PolarHBondContact O-N 3.4Å; Q657-R661 VanDerWaalsContact O-N 3.14Å; L658-R661 WeakPolarHBondContact O-CB 3.01Å; L658-R661 PolarHBondContact O-N 3.33Å; Y659-R661 PolarHBondContact O-N 3.44Å; R661-Q664 PolarHBondContact O-N 2.81Å; R661-I665 HydrophobicContact CG-CD1 4.02Å; R661-I665 WeakPolarHBondContact O-CG1 3.46Å; R661-I665 PolarHBondContact O-N 3.12Å
662	S	97.3	Very high	94.7	Very high	4 Å²	4	53 Å²	53	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-46.5	176.8	-179.2	0	0	0	0	111.8	G635 L658 Y659 Q664 I665 S666 D680	G635-S662 PolarHBondContact O-OG 3.06Å; L658-S662 PolarHBondContact O-N 3.12Å; Y659-S662 PolarHBondContact O-N 3.02Å; Y659-S662 VanDerWaalsContact O-N 3.09Å; S662-Q664 PolarHBondContact O-N 3.3Å; S662-I665 PolarHBondContact O-N 2.74Å; S662-S666 VanDerWaalsContact O-CB 3.28Å; S662-S666 WeakPolarHBondContact O-CB 3.27Å; S662-S666 PolarHBondContact O-N 2.89Å; S662-S666 PolarHBondContact O-OG 2.74Å; S662-D680 WeakPolarHBondContact CB-OD1 3.41Å; S662-D680 VanDerWaalsContact CB-OD2 3.3Å; S662-D680 WeakPolarHBondContact CB-OD2 3.44Å; S662-D680 VanDerWaalsContact OG-CG 3.28Å; S662-D680 PolarHBondContact OG-OD1 3.02Å; S662-D680 VanDerWaalsContact OG-OD1 3.13Å; S662-D680 PolarHBondContact OG-OD2 2.72Å
663	V	97.8	Very high	94.1	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.055	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-46.8	174	172.7	0	0	0	0	110.9	Y659 I665 S666 L667 L677 D680 Y681 L684	Y659-V663 WeakPolarHBondContact O-CG2 3.35Å; Y659-V663 PolarHBondContact O-N 3.36Å; V663-I665 PolarHBondContact O-N 2.81Å; V663-S666 PolarHBondContact O-N 2.81Å; V663-L667 HydrophobicContact CG1-CD1 3.61Å; V663-L667 HydrophobicContact CG1-CG 4.09Å; V663-L667 WeakPolarHBondContact O-CB 3.45Å; V663-L667 VanDerWaalsContact O-CG 3.29Å; V663-L667 WeakPolarHBondContact O-CG 3.37Å; V663-L667 PolarHBondContact O-N 2.94Å; V663-L677 HydrophobicContact CG1-CD2 4.33Å; V663-L677 HydrophobicContact CG2-CD2 4.47Å; V663-D680 HydrophobicContact CG2-CB 3.52Å; V663-D680 PolarHBondContact N-OD2 2.71Å; V663-Y681 HydrophobicContact CG1-CE1 3.94Å; V663-Y681 HydrophobicContact CG2-CD1 4.17Å; V663-Y681 HydrophobicContact CG2-CE1 4Å; V663-L684 HydrophobicContact CG2-CD1 4.07Å
664	Q	97.5	Very high	93.6	Very high	104 Å²	104	48 Å²	48	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-64.5	-38.8	-178.2	-175.9	60.1	87	0	0	112.5	L660 R661 S662 N668	L660-Q664 VanDerWaalsContact O-CB 3.25Å; L660-Q664 WeakPolarHBondContact O-CB 3.42Å; L660-Q664 PolarHBondContact O-N 3.48Å; R661-Q664 PolarHBondContact O-N 2.81Å; S662-Q664 PolarHBondContact O-N 3.3Å; Q664-N668 VanDerWaalsContact NE2-CG 3.34Å; Q664-N668 PolarHBondContact NE2-ND2 3.42Å; Q664-N668 PolarHBondContact NE2-OD1 2.79Å; Q664-N668 WeakPolarHBondContact O-CB 3.36Å; Q664-N668 PolarHBondContact O-N 3.32Å; Q664-N668 PolarHBondContact O-ND2 2.8Å
665	I	94	Very high	92.8	Very high	10 Å²	10	45 Å²	45	5%	0.051	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-51.1	173.1	-70	169.9	0	0	0	110.1	R661 S662 V663 L667 N668 L669	R661-I665 HydrophobicContact CG-CD1 4.02Å; R661-I665 WeakPolarHBondContact O-CG1 3.46Å; R661-I665 PolarHBondContact O-N 3.12Å; S662-I665 PolarHBondContact O-N 2.74Å; V663-I665 PolarHBondContact O-N 2.81Å; I665-L667 PolarHBondContact O-N 2.95Å; I665-N668 PolarHBondContact O-N 2.9Å; I665-L669 HydrophobicContact CG2-CD1 3.89Å; I665-L669 WeakPolarHBondContact O-CG 3.26Å; I665-L669 PolarHBondContact O-N 2.7Å; I665-L669 VanDerWaalsContact O-N 3.08Å
666	S	91.6	Very high	92.1	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-44.7	-178.3	-71	0	0	0	0	112.9	S662 V663 F670	S662-S666 VanDerWaalsContact O-CB 3.28Å; S662-S666 WeakPolarHBondContact O-CB 3.27Å; S662-S666 PolarHBondContact O-N 2.89Å; S662-S666 PolarHBondContact O-OG 2.74Å; V663-S666 PolarHBondContact O-N 2.81Å; S666-F670 WeakPolarHBondContact O-CB 3.46Å; S666-F670 PolarHBondContact O-N 3Å
667	L	93.4	Very high	91.8	Very high	58 Å²	58	43.4 Å²	43.4	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-66.8	-39.6	177.2	-71.3	176.2	0	0	0	112.3	V663 I665 G671 P672 L677	V663-L667 HydrophobicContact CG1-CD1 3.61Å; V663-L667 HydrophobicContact CG1-CG 4.09Å; V663-L667 WeakPolarHBondContact O-CB 3.45Å; V663-L667 VanDerWaalsContact O-CG 3.29Å; V663-L667 WeakPolarHBondContact O-CG 3.37Å; V663-L667 PolarHBondContact O-N 2.94Å; I665-L667 PolarHBondContact O-N 2.95Å; L667-G671 WeakPolarHBondContact O-CA 3.19Å; L667-G671 PolarHBondContact O-N 2.78Å; L667-P672 HydrophobicContact CD2-CB 4.27Å; L667-L677 HydrophobicContact CD2-CD1 3.85Å; L667-L677 HydrophobicContact CD2-CD2 4.36Å; L667-L677 HydrophobicContact CG-CD2 4.33Å
668	N	90.4	Very high	91.5	Very high	116 Å²	116	39.2 Å²	39.2	62%	0.62	21%	0.21	S	C	*	.	H	α-helix	trans	-67.4	-35	179.7	-76.6	-10.5	0	0	0	112.9	Q664 I665	Q664-N668 VanDerWaalsContact NE2-CG 3.34Å; Q664-N668 PolarHBondContact NE2-ND2 3.42Å; Q664-N668 PolarHBondContact NE2-OD1 2.79Å; Q664-N668 WeakPolarHBondContact O-CB 3.36Å; Q664-N668 PolarHBondContact O-N 3.32Å; Q664-N668 PolarHBondContact O-ND2 2.8Å; I665-N668 PolarHBondContact O-N 2.9Å
669	L	83.7	Confident	91.1	Very high	50 Å²	50	42.7 Å²	42.7	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-90.6	-33.9	-177.3	-62.8	177.5	0	0	0	113.4	F632 I665	F632-L669 HydrophobicContact CB-CD1 3.72Å; I665-L669 HydrophobicContact CG2-CD1 3.89Å; I665-L669 WeakPolarHBondContact O-CG 3.26Å; I665-L669 PolarHBondContact O-N 2.7Å; I665-L669 VanDerWaalsContact O-N 3.08Å
670	F	82.3	Confident	91	Very high	50 Å²	50	42.8 Å²	42.8	22%	0.219	22%	0.223	C	C	.	.	H	α-helix	trans	-128.9	-9.1	-167	-48.9	-49.4	0	0	0	114.9	R424 F632 S666 Y674	R424-F670 VanDerWaalsContact CD-CZ 3.46Å; R424-F670 VanDerWaalsContact CZ-CZ 3.45Å; F632-F670 HydrophobicContact CB-CE2 3.63Å; F632-F670 HydrophobicContact CB-CZ 3.51Å; F632-F670 HydrophobicContact CD1-CZ 4.01Å; F632-F670 HydrophobicContact CG-CE2 4.33Å; F632-F670 AromaticContact CG-CZ 3.9Å; F632-F670 HydrophobicContact CG-CZ 3.9Å; S666-F670 WeakPolarHBondContact O-CB 3.46Å; S666-F670 PolarHBondContact O-N 3Å; F670-Y674 HydrophobicContact CB-CD2 4Å; F670-Y674 HydrophobicContact CB-CG 3.86Å; F670-Y674 AromaticContact CD2-CD1 3.83Å; F670-Y674 HydrophobicContact CD2-CD1 3.83Å; F670-Y674 AromaticContact CD2-CD2 3.73Å; F670-Y674 HydrophobicContact CD2-CD2 3.73Å; F670-Y674 AromaticContact CD2-CE1 3.93Å; F670-Y674 HydrophobicContact CD2-CE1 3.93Å; F670-Y674 AromaticContact CD2-CE2 3.89Å; F670-Y674 HydrophobicContact CD2-CE2 3.89Å; F670-Y674 AromaticContact CD2-CG 3.7Å; F670-Y674 HydrophobicContact CD2-CG 3.7Å; F670-Y674 AromaticContact CD2-CZ 3.95Å; F670-Y674 HydrophobicContact CE2-CE1 4.29Å; F670-Y674 HydrophobicContact CE2-CE2 4.28Å; F670-Y674 AromaticContact CG-CD2 3.96Å; F670-Y674 HydrophobicContact CG-CD2 3.96Å; F670-Y674 HydrophobicContact CG-CE2 4.41Å; F670-Y674 HydrophobicContact CG-CG 4.09Å
671	G	88	Confident	91	Very high	21 Å²	21	40.2 Å²	40.2	22%	0.216	21%	0.209	C	C	.	.			trans	72.2	-173.8	-178	0	0	0	0	0	114.6	L667 T673	L667-G671 WeakPolarHBondContact O-CA 3.19Å; L667-G671 PolarHBondContact O-N 2.78Å; G671-T673 PolarHBondContact O-N 3.06Å; G671-T673 VanDerWaalsContact O-N 3.12Å
672	P	90.1	Very high	90.9	Very high	66 Å²	66	42.7 Å²	42.7	43%	0.429	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	2.6	-164.3	31	-37.3	0	0	0	115.8	L667	L667-P672 HydrophobicContact CD2-CB 4.27Å
673	T	86.1	Confident	90.9	Very high	43 Å²	43	42.5 Å²	42.5	26%	0.264	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	7	-177.6	56.3	0	0	0	0	113.6	G671 E710 R711 L714	G671-T673 PolarHBondContact O-N 3.06Å; G671-T673 VanDerWaalsContact O-N 3.12Å; T673-E710 HydrophobicContact CG2-CB 3.83Å; T673-R711 VanDerWaalsContact O-CD 3.25Å; T673-R711 WeakPolarHBondContact O-CD 3.37Å; T673-R711 PolarHBondContact O-NH1 3.33Å; T673-L714 HydrophobicContact CG2-CD1 3.87Å
674	Y	85.9	Confident	90.9	Very high	28 Å²	28	42.1 Å²	42.1	11%	0.11	21%	0.214	C	C	.	.			trans	-62	140.9	179.1	178	-123.5	0	0	0	113.3	R424 F670 G676 L677 W707	R424-Y674 PolarHBondContact NH1-OH 3.44Å; R424-Y674 PolarHBondContact NH2-OH 3.2Å; R424-Y674 VanDerWaalsContact NH2-OH 3.11Å; F670-Y674 HydrophobicContact CB-CD2 4Å; F670-Y674 HydrophobicContact CB-CG 3.86Å; F670-Y674 AromaticContact CD2-CD1 3.83Å; F670-Y674 HydrophobicContact CD2-CD1 3.83Å; F670-Y674 AromaticContact CD2-CD2 3.73Å; F670-Y674 HydrophobicContact CD2-CD2 3.73Å; F670-Y674 AromaticContact CD2-CE1 3.93Å; F670-Y674 HydrophobicContact CD2-CE1 3.93Å; F670-Y674 AromaticContact CD2-CE2 3.89Å; F670-Y674 HydrophobicContact CD2-CE2 3.89Å; F670-Y674 AromaticContact CD2-CG 3.7Å; F670-Y674 HydrophobicContact CD2-CG 3.7Å; F670-Y674 AromaticContact CD2-CZ 3.95Å; F670-Y674 HydrophobicContact CE2-CE1 4.29Å; F670-Y674 HydrophobicContact CE2-CE2 4.28Å; F670-Y674 AromaticContact CG-CD2 3.96Å; F670-Y674 HydrophobicContact CG-CD2 3.96Å; F670-Y674 HydrophobicContact CG-CE2 4.41Å; F670-Y674 HydrophobicContact CG-CG 4.09Å; Y674-G676 PolarHBondContact O-N 2.67Å; Y674-L677 HydrophobicContact CD1-CG 4.33Å; Y674-L677 PolarHBondContact O-N 3.38Å; Y674-W707 PolarHBondContact O-NE1 3.32Å
675	S	82.3	Confident	90.9	Very high	19 Å²	19	38.6 Å²	38.6	13%	0.133	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-43.7	-173.6	-35.6	0	0	0	0	112.7	D466 L677 E678 R711 Y800	D466-S675 PolarHBondContact OD2-OG 2.71Å; S675-L677 PolarHBondContact O-N 3.48Å; S675-L677 VanDerWaalsContact O-N 3.15Å; S675-E678 PolarHBondContact O-N 2.69Å; S675-R711 PolarHBondContact OG-NH1 3.01Å; S675-R711 PolarHBondContact OG-NH2 3.18Å; S675-Y800 WeakPolarHBondContact CB-OH 3.27Å
676	G	84.1	Confident	91.1	Very high	17 Å²	17	41.6 Å²	41.6	18%	0.175	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.5	-175.8	0	0	0	0	0	115.3	Y674 E678 Y679	Y674-G676 PolarHBondContact O-N 2.67Å; G676-E678 PolarHBondContact O-N 3.25Å; G676-Y679 PolarHBondContact O-N 2.96Å
677	L	91.5	Very high	91.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-20.9	176.5	-66.1	171	0	0	0	112.7	V663 L667 Y674 S675 Y681	V663-L677 HydrophobicContact CG1-CD2 4.33Å; V663-L677 HydrophobicContact CG2-CD2 4.47Å; L667-L677 HydrophobicContact CD2-CD1 3.85Å; L667-L677 HydrophobicContact CD2-CD2 4.36Å; L667-L677 HydrophobicContact CG-CD2 4.33Å; Y674-L677 HydrophobicContact CD1-CG 4.33Å; Y674-L677 PolarHBondContact O-N 3.38Å; S675-L677 PolarHBondContact O-N 3.48Å; S675-L677 VanDerWaalsContact O-N 3.15Å; L677-Y681 HydrophobicContact CB-CD2 4.21Å; L677-Y681 HydrophobicContact CB-CE2 3.88Å; L677-Y681 HydrophobicContact CD2-CE1 4.32Å; L677-Y681 VanDerWaalsContact O-CB 3.29Å; L677-Y681 WeakPolarHBondContact O-CB 3.1Å; L677-Y681 VanDerWaalsContact O-CD2 3.32Å; L677-Y681 WeakPolarHBondContact O-CD2 3.2Å; L677-Y681 PolarHBondContact O-N 3.11Å
678	E	92.7	Very high	91.7	Very high	51 Å²	51	38.9 Å²	38.9	24%	0.238	19%	0.194	C	C	.	.	H	α-helix	trans	-56.8	-53	174.3	172.5	139.4	-134.1	0	0	112.2	S675 G676 R682 F704 W707	S675-E678 PolarHBondContact O-N 2.69Å; G676-E678 PolarHBondContact O-N 3.25Å; E678-R682 WeakPolarHBondContact O-CB 3.25Å; E678-R682 VanDerWaalsContact O-CG 3.25Å; E678-R682 WeakPolarHBondContact O-CG 3.49Å; E678-R682 PolarHBondContact O-N 3.33Å; E678-R682 IonicContact OE1-CZ 3.65Å; E678-R682 VanDerWaalsContact OE1-CZ 3.24Å; E678-R682 IonicContact OE1-NE 3.44Å; E678-R682 PolarHBondContact OE1-NE 3.24Å; E678-R682 IonicContact OE1-NH2 3.2Å; E678-R682 PolarHBondContact OE1-NH2 3.32Å; E678-F704 HydrophobicContact CG-CE2 4.01Å; E678-F704 WeakPolarHBondContact OE1-CE2 2.87Å; E678-W707 HydrophobicContact CB-CH2 3.65Å; E678-W707 HydrophobicContact CB-CZ2 3.84Å; E678-W707 HydrophobicContact CB-CZ3 4.09Å; E678-W707 HydrophobicContact CG-CH2 4.18Å; E678-W707 HydrophobicContact CG-CZ3 4.39Å; E678-W707 VanDerWaalsContact OE2-CH2 3.25Å; E678-W707 WeakPolarHBondContact OE2-CH2 3.45Å
679	Y	90.2	Very high	92	Very high	104 Å²	104	37.7 Å²	37.7	41%	0.408	18%	0.184	S	C	.	.	H	α-helix	trans	-67.3	-43	-177.5	-64.4	-96.9	0	0	0	111.1	G676 G683 Y800	G676-Y679 PolarHBondContact O-N 2.96Å; Y679-G683 PolarHBondContact O-N 2.82Å; Y679-Y800 HydrophobicContact CE2-CD1 4.24Å; Y679-Y800 HydrophobicContact CE2-CE1 4.46Å; Y679-Y800 WeakPolarHBondContact OH-CD1 3.08Å; Y679-Y800 PolarHBondContact OH-OXT 2.68Å
680	D	95.2	Very high	92.7	Very high	7 Å²	7	40 Å²	40	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-62.2	-44.1	177.4	-75.9	-24.2	0	0	0	112.3	Y659 S662 V663 G683 L684	Y659-D680 HydrophobicContact CD1-CB 4.37Å; Y659-D680 WeakPolarHBondContact CD1-OD1 3.49Å; S662-D680 WeakPolarHBondContact CB-OD1 3.41Å; S662-D680 VanDerWaalsContact CB-OD2 3.3Å; S662-D680 WeakPolarHBondContact CB-OD2 3.44Å; S662-D680 VanDerWaalsContact OG-CG 3.28Å; S662-D680 PolarHBondContact OG-OD1 3.02Å; S662-D680 VanDerWaalsContact OG-OD1 3.13Å; S662-D680 PolarHBondContact OG-OD2 2.72Å; V663-D680 HydrophobicContact CG2-CB 3.52Å; V663-D680 PolarHBondContact N-OD2 2.71Å; D680-G683 PolarHBondContact O-N 3.02Å; D680-L684 WeakPolarHBondContact O-CB 3.21Å; D680-L684 WeakPolarHBondContact O-CG 3.4Å; D680-L684 PolarHBondContact O-N 3.1Å
681	Y	98	Very high	93.4	Very high	8 Å²	8	40.4 Å²	40.4	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-70.6	-41.8	179.9	-66.9	-20.3	0	0	0	112.3	V663 L677 G683 L684 Q685 Y700 L703 F704 W707	V663-Y681 HydrophobicContact CG1-CE1 3.94Å; V663-Y681 HydrophobicContact CG2-CD1 4.17Å; V663-Y681 HydrophobicContact CG2-CE1 4Å; L677-Y681 HydrophobicContact CB-CD2 4.21Å; L677-Y681 HydrophobicContact CB-CE2 3.88Å; L677-Y681 HydrophobicContact CD2-CE1 4.32Å; L677-Y681 VanDerWaalsContact O-CB 3.29Å; L677-Y681 WeakPolarHBondContact O-CB 3.1Å; L677-Y681 VanDerWaalsContact O-CD2 3.32Å; L677-Y681 WeakPolarHBondContact O-CD2 3.2Å; L677-Y681 PolarHBondContact O-N 3.11Å; Y681-G683 VanDerWaalsContact C-N 3.31Å; Y681-G683 PolarHBondContact O-N 3.24Å; Y681-L684 PolarHBondContact O-N 3.36Å; Y681-Q685 WeakPolarHBondContact O-CG 3.49Å; Y681-Q685 PolarHBondContact O-N 2.89Å; Y681-Y700 AromaticContact CD1-CD1 3.73Å; Y681-Y700 HydrophobicContact CD1-CD1 3.73Å; Y681-Y700 AromaticContact CD1-CE1 3.92Å; Y681-Y700 HydrophobicContact CD1-CE1 3.92Å; Y681-Y700 HydrophobicContact CE1-CD1 4.26Å; Y681-Y700 HydrophobicContact CE1-CE1 4.08Å; Y681-Y700 HydrophobicContact CG-CD1 4.44Å; Y681-L703 HydrophobicContact CD2-CB 4.45Å; Y681-L703 HydrophobicContact CE2-CB 4.18Å; Y681-F704 HydrophobicContact CD2-CB 4.31Å; Y681-W707 HydrophobicContact CD2-CB 4.41Å; Y681-W707 HydrophobicContact CE2-CB 4.02Å; Y681-W707 HydrophobicContact CE2-CG 4.33Å
682	R	96.2	Very high	93.8	Very high	126 Å²	126	41.2 Å²	41.2	48%	0.475	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-40	172.6	-71.4	170.1	177.7	-115.6	13.9	111.4	E678 Q685 R686 F704	E678-R682 WeakPolarHBondContact O-CB 3.25Å; E678-R682 VanDerWaalsContact O-CG 3.25Å; E678-R682 WeakPolarHBondContact O-CG 3.49Å; E678-R682 PolarHBondContact O-N 3.33Å; E678-R682 IonicContact OE1-CZ 3.65Å; E678-R682 VanDerWaalsContact OE1-CZ 3.24Å; E678-R682 IonicContact OE1-NE 3.44Å; E678-R682 PolarHBondContact OE1-NE 3.24Å; E678-R682 IonicContact OE1-NH2 3.2Å; E678-R682 PolarHBondContact OE1-NH2 3.32Å; R682-Q685 WeakPolarHBondContact O-CB 3.43Å; R682-Q685 PolarHBondContact O-N 3.23Å; R682-R686 PolarHBondContact O-N 3.12Å; R682-R686 VanDerWaalsContact O-N 3.17Å; R682-F704 HydrophobicContact CG-CD2 4.47Å; R682-F704 HydrophobicContact CG-CE2 4.23Å
683	G	97.3	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-50.2	174.6	0	0	0	0	0	112.7	N646 Y659 Y679 D680 Y681 Q685 R686 V687	N646-G683 PolarHBondContact ND2-O 3.13Å; Y659-G683 WeakPolarHBondContact OH-CA 3.47Å; Y679-G683 PolarHBondContact O-N 2.82Å; D680-G683 PolarHBondContact O-N 3.02Å; Y681-G683 VanDerWaalsContact C-N 3.31Å; Y681-G683 PolarHBondContact O-N 3.24Å; G683-Q685 VanDerWaalsContact C-N 3.34Å; G683-Q685 PolarHBondContact O-N 3.38Å; G683-R686 PolarHBondContact O-N 2.98Å; G683-V687 WeakPolarHBondContact O-CG2 3.46Å; G683-V687 PolarHBondContact O-N 3.5Å
684	L	98.5	Very high	94.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-34.2	176.6	-76.2	164.8	0	0	0	113.2	E656 Y659 L660 V663 D680 Y681 V687 Y688 Y700	E656-L684 HydrophobicContact CG-CD2 4.35Å; Y659-L684 HydrophobicContact CD2-CD2 4.3Å; Y659-L684 HydrophobicContact CD2-CG 4.23Å; Y659-L684 HydrophobicContact CG-CD2 4.41Å; Y659-L684 HydrophobicContact CG-CG 4.1Å; L660-L684 HydrophobicContact CD2-CD1 4.24Å; L660-L684 HydrophobicContact CD2-CD2 4.44Å; L660-L684 HydrophobicContact CG-CD2 4.31Å; V663-L684 HydrophobicContact CG2-CD1 4.07Å; D680-L684 WeakPolarHBondContact O-CB 3.21Å; D680-L684 WeakPolarHBondContact O-CG 3.4Å; D680-L684 PolarHBondContact O-N 3.1Å; Y681-L684 PolarHBondContact O-N 3.36Å; L684-V687 PolarHBondContact O-N 3.35Å; L684-Y688 HydrophobicContact CB-CD2 4.38Å; L684-Y688 HydrophobicContact CB-CE2 4.26Å; L684-Y688 HydrophobicContact CD2-CE2 3.94Å; L684-Y688 WeakPolarHBondContact O-CD2 3.48Å; L684-Y688 PolarHBondContact O-N 3.24Å; L684-Y700 HydrophobicContact CB-CD1 4.02Å; L684-Y700 HydrophobicContact CB-CD2 4.37Å; L684-Y700 HydrophobicContact CB-CE1 4.43Å; L684-Y700 HydrophobicContact CB-CG 4Å; L684-Y700 HydrophobicContact CD1-CD1 3.86Å; L684-Y700 HydrophobicContact CD1-CE1 3.45Å; L684-Y700 VanDerWaalsContact CD1-CE1 3.45Å; L684-Y700 HydrophobicContact CD1-CE2 4.41Å; L684-Y700 HydrophobicContact CD1-CG 4.49Å
685	Q	98.3	Very high	95.2	Very high	30 Å²	30	47.8 Å²	47.8	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-46.7	171.6	-70.5	157.6	14	0	0	111.3	Y681 R682 G683 H689 Y700 F704	Y681-Q685 WeakPolarHBondContact O-CG 3.49Å; Y681-Q685 PolarHBondContact O-N 2.89Å; R682-Q685 WeakPolarHBondContact O-CB 3.43Å; R682-Q685 PolarHBondContact O-N 3.23Å; G683-Q685 VanDerWaalsContact C-N 3.34Å; G683-Q685 PolarHBondContact O-N 3.38Å; Q685-H689 WeakPolarHBondContact O-CB 3.47Å; Q685-H689 PolarHBondContact O-N 3.11Å; Q685-Y700 PolarHBondContact NE2-O 3.44Å; Q685-F704 VanDerWaalsContact NE2-CB 3.26Å
686	R	97.9	Very high	95.9	Very high	74 Å²	74	49 Å²	49	28%	0.279	24%	0.239	S	C	.	.	H	α-helix	trans	-61.5	-50.1	173.5	177.1	178.6	166.1	156.5	-1.8	111.4	N646 Y647 D650 R682 G683 Y688 H689 E690	N646-R686 PolarHBondContact O-NE 3.02Å; N646-R686 VanDerWaalsContact O-NE 3.09Å; N646-R686 PolarHBondContact O-NH2 3.49Å; N646-R686 WeakPolarHBondContact OD1-CD 3.39Å; N646-R686 WeakPolarHBondContact OD1-CG 3.44Å; Y647-R686 PolarHBondContact O-NH2 2.9Å; D650-R686 IonicContact OD1-NH2 2.81Å; R682-R686 PolarHBondContact O-N 3.12Å; R682-R686 VanDerWaalsContact O-N 3.17Å; G683-R686 PolarHBondContact O-N 2.98Å; R686-Y688 VanDerWaalsContact C-N 3.29Å; R686-Y688 PolarHBondContact O-N 3.44Å; R686-H689 WeakPolarHBondContact O-CB 3.27Å; R686-H689 PolarHBondContact O-N 3.44Å; R686-H689 VanDerWaalsContact O-N 3.08Å; R686-E690 HydrophobicContact CG-CG 4.26Å; R686-E690 PolarHBondContact O-N 2.82Å
687	V	98.4	Very high	96.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-53.4	-46.2	179.6	164.9	0	0	0	0	111.6	N646 F652 A655 E656 Y659 G683 L684 L691	N646-V687 HydrophobicContact CB-CG2 4.21Å; N646-V687 WeakPolarHBondContact OD1-CG2 3.4Å; F652-V687 HydrophobicContact CB-CG1 4.37Å; F652-V687 WeakPolarHBondContact O-CG1 3.49Å; A655-V687 HydrophobicContact CB-CG2 3.88Å; E656-V687 HydrophobicContact CB-CG1 3.82Å; E656-V687 HydrophobicContact CG-CG1 4.22Å; Y659-V687 HydrophobicContact CD2-CG2 4.11Å; Y659-V687 HydrophobicContact CE2-CG2 3.99Å; G683-V687 WeakPolarHBondContact O-CG2 3.46Å; G683-V687 PolarHBondContact O-N 3.5Å; L684-V687 PolarHBondContact O-N 3.35Å; V687-L691 HydrophobicContact CG1-CD1 3.74Å; V687-L691 VanDerWaalsContact O-CB 3.32Å; V687-L691 WeakPolarHBondContact O-CB 3.3Å; V687-L691 VanDerWaalsContact O-CG 3.23Å; V687-L691 WeakPolarHBondContact O-CG 3.17Å; V687-L691 PolarHBondContact O-N 3.39Å
688	Y	98.5	Very high	96.9	Very high	7 Å²	7	56.8 Å²	56.8	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-76.4	-23.9	-180	-69.1	-51.2	0	0	0	114.2	E656 L684 R686 G692 N693 E696 Y700	E656-Y688 HydrophobicContact CG-CE1 4.06Å; E656-Y688 WeakPolarHBondContact CG-OH 3.48Å; E656-Y688 WeakPolarHBondContact OE1-CE1 3.46Å; E656-Y688 VanDerWaalsContact OE1-CZ 3.32Å; E656-Y688 PolarHBondContact OE1-OH 3.45Å; L684-Y688 HydrophobicContact CB-CD2 4.38Å; L684-Y688 HydrophobicContact CB-CE2 4.26Å; L684-Y688 HydrophobicContact CD2-CE2 3.94Å; L684-Y688 WeakPolarHBondContact O-CD2 3.48Å; L684-Y688 PolarHBondContact O-N 3.24Å; R686-Y688 VanDerWaalsContact C-N 3.29Å; R686-Y688 PolarHBondContact O-N 3.44Å; Y688-G692 PolarHBondContact O-N 3.41Å; Y688-N693 HydrophobicContact CD1-CB 3.96Å; Y688-N693 CarbonylContact O-C 3.54Å; Y688-N693 PolarHBondContact O-N 2.9Å; Y688-E696 HydrophobicContact CD1-CB 3.85Å; Y688-E696 HydrophobicContact CD2-CB 3.65Å; Y688-E696 HydrophobicContact CE1-CB 3.93Å; Y688-E696 HydrophobicContact CE1-CG 4.44Å; Y688-E696 HydrophobicContact CE2-CB 3.74Å; Y688-E696 HydrophobicContact CG-CB 3.72Å; Y688-Y700 AromaticContact CD2-CD2 3.92Å; Y688-Y700 HydrophobicContact CD2-CD2 3.92Å; Y688-Y700 HydrophobicContact CD2-CE2 4.48Å; Y688-Y700 AromaticContact CE2-CD2 3.57Å; Y688-Y700 HydrophobicContact CE2-CD2 3.57Å; Y688-Y700 AromaticContact CE2-CE2 3.68Å; Y688-Y700 HydrophobicContact CE2-CE2 3.68Å
689	H	97.6	Very high	97.2	Very high	90 Å²	90	61.1 Å²	61.1	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-65.4	-53.4	168.3	-177.6	-94.5	0	0	0	110.9	Q685 R686 L691 G692 M697	Q685-H689 WeakPolarHBondContact O-CB 3.47Å; Q685-H689 PolarHBondContact O-N 3.11Å; R686-H689 WeakPolarHBondContact O-CB 3.27Å; R686-H689 PolarHBondContact O-N 3.44Å; R686-H689 VanDerWaalsContact O-N 3.08Å; H689-L691 VanDerWaalsContact C-N 3.32Å; H689-L691 PolarHBondContact O-N 3.18Å; H689-G692 WeakPolarHBondContact O-CA 3.33Å; H689-G692 PolarHBondContact O-N 3.16Å; H689-M697 HydrophobicContact CB-SD 4.05Å
690	E	97.7	Very high	97.5	Very high	98 Å²	98	56.9 Å²	56.9	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-68.3	-29.4	-178.1	-58.6	-47.8	125.6	0	0	113.1	F652 R686 G692	F652-E690 HydrophobicContact CD1-CB 3.99Å; F652-E690 HydrophobicContact CD1-CG 4.27Å; F652-E690 HydrophobicContact CD2-CB 3.83Å; F652-E690 HydrophobicContact CE1-CB 3.82Å; F652-E690 HydrophobicContact CE1-CG 3.7Å; F652-E690 HydrophobicContact CE2-CB 3.64Å; F652-E690 HydrophobicContact CE2-CG 4.17Å; F652-E690 HydrophobicContact CG-CB 4Å; F652-E690 HydrophobicContact CZ-CB 3.64Å; F652-E690 HydrophobicContact CZ-CG 3.65Å; R686-E690 HydrophobicContact CG-CG 4.26Å; R686-E690 PolarHBondContact O-N 2.82Å; E690-G692 PolarHBondContact O-N 3.41Å
691	L	97.1	Very high	97.7	Very high	59 Å²	59	60.4 Å²	60.4	31%	0.309	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-2.8	170	-68.2	174.1	0	0	0	113.9	F652 K653 V687 H689 N693	F652-L691 HydrophobicContact CB-CD1 4.21Å; F652-L691 HydrophobicContact CB-CD2 3.98Å; F652-L691 HydrophobicContact CB-CG 3.87Å; K653-L691 HydrophobicContact CG-CD1 4.3Å; K653-L691 HydrophobicContact CG-CD2 3.85Å; V687-L691 HydrophobicContact CG1-CD1 3.74Å; V687-L691 VanDerWaalsContact O-CB 3.32Å; V687-L691 WeakPolarHBondContact O-CB 3.3Å; V687-L691 VanDerWaalsContact O-CG 3.23Å; V687-L691 WeakPolarHBondContact O-CG 3.17Å; V687-L691 PolarHBondContact O-N 3.39Å; H689-L691 VanDerWaalsContact C-N 3.32Å; H689-L691 PolarHBondContact O-N 3.18Å; L691-N693 PolarHBondContact O-N 3.31Å
692	G	96.4	Very high	97.7	Very high	39 Å²	39	61.9 Å²	61.9	40%	0.402	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	14.3	-178.1	0	0	0	0	0	114.8	Y688 H689 E690 Y694	Y688-G692 PolarHBondContact O-N 3.41Å; H689-G692 WeakPolarHBondContact O-CA 3.33Å; H689-G692 PolarHBondContact O-N 3.16Å; E690-G692 PolarHBondContact O-N 3.41Å; G692-Y694 VanDerWaalsContact C-N 3.34Å; G692-Y694 WeakPolarHBondContact O-CD2 3.39Å; G692-Y694 WeakPolarHBondContact O-CE2 3.37Å; G692-Y694 PolarHBondContact O-N 3.23Å
693	N	97.4	Very high	97.7	Very high	61 Å²	61	58.7 Å²	58.7	33%	0.326	30%	0.295	S	S	.	.			trans	-90.1	67.4	-179.7	-173.1	1.4	0	0	0	111	Y688 L691 S695 E696 M697	Y688-N693 HydrophobicContact CD1-CB 3.96Å; Y688-N693 CarbonylContact O-C 3.54Å; Y688-N693 PolarHBondContact O-N 2.9Å; L691-N693 PolarHBondContact O-N 3.31Å; N693-S695 PolarHBondContact O-N 2.82Å; N693-E696 VanDerWaalsContact ND2-CG 3.27Å; N693-E696 WeakPolarHBondContact ND2-CG 3.49Å; N693-E696 PolarHBondContact O-N 3.08Å; N693-E696 VanDerWaalsContact O-N 3.16Å; N693-E696 PolarHBondContact OD1-N 3.46Å; N693-M697 PolarHBondContact O-N 2.91Å
694	Y	96.7	Very high	97.7	Very high	134 Å²	134	60.1 Å²	60.1	53%	0.525	30%	0.301	S	S	.	.	H	α-helix	trans	-58	-20.8	-178.3	-56.8	-76.6	0	0	0	114.3	G692 M697 Q698	G692-Y694 VanDerWaalsContact C-N 3.34Å; G692-Y694 WeakPolarHBondContact O-CD2 3.39Å; G692-Y694 WeakPolarHBondContact O-CE2 3.37Å; G692-Y694 PolarHBondContact O-N 3.23Å; Y694-M697 HydrophobicContact CD1-CE 4.32Å; Y694-M697 HydrophobicContact CD1-SD 4.13Å; Y694-Q698 WeakPolarHBondContact O-CB 3.25Å; Y694-Q698 VanDerWaalsContact O-CG 3.28Å; Y694-Q698 WeakPolarHBondContact O-CG 3.38Å; Y694-Q698 PolarHBondContact O-N 3Å
695	S	97.7	Very high	97.7	Very high	80 Å²	80	63.1 Å²	63.1	56%	0.559	32%	0.317	S	S	*	.	H	α-helix	trans	-67	-54	174.6	-176.3	0	0	0	0	111.5	N693 M697 Q698 R699	N693-S695 PolarHBondContact O-N 2.82Å; S695-M697 VanDerWaalsContact C-N 3.34Å; S695-Q698 PolarHBondContact O-N 2.98Å; S695-R699 PolarHBondContact O-N 3.14Å
696	E	97.5	Very high	97.6	Very high	44 Å²	44	67.3 Å²	67.3	21%	0.206	33%	0.333	C	S	.	.	H	α-helix	trans	-72.3	-30.5	178.5	-64.4	-57.3	107	0	0	111.6	Y688 N693 Q698 R699 Y700	Y688-E696 HydrophobicContact CD1-CB 3.85Å; Y688-E696 HydrophobicContact CD2-CB 3.65Å; Y688-E696 HydrophobicContact CE1-CB 3.93Å; Y688-E696 HydrophobicContact CE1-CG 4.44Å; Y688-E696 HydrophobicContact CE2-CB 3.74Å; Y688-E696 HydrophobicContact CG-CB 3.72Å; N693-E696 VanDerWaalsContact ND2-CG 3.27Å; N693-E696 WeakPolarHBondContact ND2-CG 3.49Å; N693-E696 PolarHBondContact O-N 3.08Å; N693-E696 VanDerWaalsContact O-N 3.16Å; N693-E696 PolarHBondContact OD1-N 3.46Å; E696-Q698 PolarHBondContact O-N 3.07Å; E696-R699 WeakPolarHBondContact O-CB 3.21Å; E696-R699 PolarHBondContact O-N 2.9Å; E696-R699 IonicContact OE1-NH1 3.76Å; E696-R699 WeakPolarHBondContact OE2-CD 3.39Å; E696-R699 IonicContact OE2-CZ 3.83Å; E696-R699 IonicContact OE2-NE 2.69Å; E696-R699 IonicContact OE2-NH1 3.65Å; E696-R699 PolarHBondContact OE2-NH1 2.81Å; E696-Y700 WeakPolarHBondContact O-CD2 3.41Å; E696-Y700 PolarHBondContact O-N 3.33Å
697	M	97.9	Very high	97.5	Very high	46 Å²	46	64.1 Å²	64.1	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-56	-48.7	169.3	-169.6	-158.5	77.7	0	0	111.6	H689 N693 Y694 S695 R699 Y700 Q701	H689-M697 HydrophobicContact CB-SD 4.05Å; N693-M697 PolarHBondContact O-N 2.91Å; Y694-M697 HydrophobicContact CD1-CE 4.32Å; Y694-M697 HydrophobicContact CD1-SD 4.13Å; S695-M697 VanDerWaalsContact C-N 3.34Å; M697-R699 PolarHBondContact O-N 3.26Å; M697-Y700 PolarHBondContact O-N 2.85Å; M697-Q701 PolarHBondContact O-N 2.76Å
698	Q	97.9	Very high	97.4	Very high	135 Å²	135	66.4 Å²	66.4	63%	0.631	34%	0.337	S	S	*	.	H	α-helix	trans	-65.8	-35.8	176.5	-74.8	177.1	22	0	0	112.6	Y694 S695 E696 Q701 G702	Y694-Q698 WeakPolarHBondContact O-CB 3.25Å; Y694-Q698 VanDerWaalsContact O-CG 3.28Å; Y694-Q698 WeakPolarHBondContact O-CG 3.38Å; Y694-Q698 PolarHBondContact O-N 3Å; S695-Q698 PolarHBondContact O-N 2.98Å; E696-Q698 PolarHBondContact O-N 3.07Å; Q698-Q701 PolarHBondContact O-N 3.45Å; Q698-G702 PolarHBondContact O-N 3.28Å
699	R	98.2	Very high	97.2	Very high	142 Å²	142	72 Å²	72	54%	0.536	36%	0.361	S	S	.	.	H	α-helix	trans	-60	-46.7	173.3	-175.6	-169	177.1	-172.7	-4.2	111.4	S695 E696 M697 G702 L703	S695-R699 PolarHBondContact O-N 3.14Å; E696-R699 WeakPolarHBondContact O-CB 3.21Å; E696-R699 PolarHBondContact O-N 2.9Å; E696-R699 IonicContact OE1-NH1 3.76Å; E696-R699 WeakPolarHBondContact OE2-CD 3.39Å; E696-R699 IonicContact OE2-CZ 3.83Å; E696-R699 IonicContact OE2-NE 2.69Å; E696-R699 IonicContact OE2-NH1 3.65Å; E696-R699 PolarHBondContact OE2-NH1 2.81Å; M697-R699 PolarHBondContact O-N 3.26Å; R699-G702 PolarHBondContact O-N 2.83Å; R699-L703 WeakPolarHBondContact O-CG 3.25Å; R699-L703 PolarHBondContact O-N 2.71Å
700	Y	97.8	Very high	97	Very high	14 Å²	14	69.6 Å²	69.6	6%	0.055	35%	0.35	C	S	.	.	H	α-helix	trans	-75.3	-23.9	178.8	-82	-81.4	0	0	0	113.8	L660 Y681 L684 Q685 Y688 E696 M697 L703 F704	L660-Y700 WeakPolarHBondContact CD2-OH 3.41Å; Y681-Y700 AromaticContact CD1-CD1 3.73Å; Y681-Y700 HydrophobicContact CD1-CD1 3.73Å; Y681-Y700 AromaticContact CD1-CE1 3.92Å; Y681-Y700 HydrophobicContact CD1-CE1 3.92Å; Y681-Y700 HydrophobicContact CE1-CD1 4.26Å; Y681-Y700 HydrophobicContact CE1-CE1 4.08Å; Y681-Y700 HydrophobicContact CG-CD1 4.44Å; L684-Y700 HydrophobicContact CB-CD1 4.02Å; L684-Y700 HydrophobicContact CB-CD2 4.37Å; L684-Y700 HydrophobicContact CB-CE1 4.43Å; L684-Y700 HydrophobicContact CB-CG 4Å; L684-Y700 HydrophobicContact CD1-CD1 3.86Å; L684-Y700 HydrophobicContact CD1-CE1 3.45Å; L684-Y700 VanDerWaalsContact CD1-CE1 3.45Å; L684-Y700 HydrophobicContact CD1-CE2 4.41Å; L684-Y700 HydrophobicContact CD1-CG 4.49Å; Q685-Y700 PolarHBondContact NE2-O 3.44Å; Y688-Y700 AromaticContact CD2-CD2 3.92Å; Y688-Y700 HydrophobicContact CD2-CD2 3.92Å; Y688-Y700 HydrophobicContact CD2-CE2 4.48Å; Y688-Y700 AromaticContact CE2-CD2 3.57Å; Y688-Y700 HydrophobicContact CE2-CD2 3.57Å; Y688-Y700 AromaticContact CE2-CE2 3.68Å; Y688-Y700 HydrophobicContact CE2-CE2 3.68Å; E696-Y700 WeakPolarHBondContact O-CD2 3.41Å; E696-Y700 PolarHBondContact O-N 3.33Å; M697-Y700 PolarHBondContact O-N 2.85Å; Y700-L703 HydrophobicContact CD1-CD1 3.8Å; Y700-L703 HydrophobicContact CE1-CD1 3.69Å; Y700-L703 HydrophobicContact CG-CD1 4.35Å; Y700-F704 WeakPolarHBondContact O-CB 3.25Å; Y700-F704 PolarHBondContact O-N 3.21Å; Y700-F704 VanDerWaalsContact O-N 3.1Å
701	Q	98.1	Very high	96.5	Very high	81 Å²	81	66.4 Å²	66.4	38%	0.379	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-49.1	163.1	-173.1	65.5	56.7	0	0	110.9	M697 Q698 L703 F704 D705	M697-Q701 PolarHBondContact O-N 2.76Å; Q698-Q701 PolarHBondContact O-N 3.45Å; Q701-L703 VanDerWaalsContact C-N 3.31Å; Q701-L703 PolarHBondContact O-N 3.06Å; Q701-F704 PolarHBondContact O-N 3.45Å; Q701-D705 PolarHBondContact NE2-OD1 2.68Å; Q701-D705 WeakPolarHBondContact O-CB 3.41Å; Q701-D705 PolarHBondContact O-N 3.21Å
702	G	98	Very high	96.1	Very high	40 Å²	40	70 Å²	70	41%	0.412	35%	0.349	S	S	.	.	H	α-helix	trans	-61.1	-36.2	178.8	0	0	0	0	0	113.9	Q698 R699 Y706	Q698-G702 PolarHBondContact O-N 3.28Å; R699-G702 PolarHBondContact O-N 2.83Å; G702-Y706 WeakPolarHBondContact O-CB 3.41Å; G702-Y706 PolarHBondContact O-N 3.37Å; G702-Y706 VanDerWaalsContact O-N 3.09Å
703	L	97.5	Very high	95.8	Very high	59 Å²	59	74.7 Å²	74.7	31%	0.309	36%	0.355	S	S	.	.	H	α-helix	trans	-67	-43.6	173.5	-71.8	171.3	0	0	0	112.3	Y681 R699 Y700 Q701 Y706 W707	Y681-L703 HydrophobicContact CD2-CB 4.45Å; Y681-L703 HydrophobicContact CE2-CB 4.18Å; R699-L703 WeakPolarHBondContact O-CG 3.25Å; R699-L703 PolarHBondContact O-N 2.71Å; Y700-L703 HydrophobicContact CD1-CD1 3.8Å; Y700-L703 HydrophobicContact CE1-CD1 3.69Å; Y700-L703 HydrophobicContact CG-CD1 4.35Å; Q701-L703 VanDerWaalsContact C-N 3.31Å; Q701-L703 PolarHBondContact O-N 3.06Å; L703-Y706 PolarHBondContact O-N 2.93Å; L703-W707 WeakPolarHBondContact O-CB 3.41Å; L703-W707 PolarHBondContact O-N 3.38Å
704	F	97.5	Very high	95	Very high	29 Å²	29	75.5 Å²	75.5	13%	0.127	36%	0.359	C	S	.	.	H	α-helix	trans	-63.9	-45	175.4	177.1	-100.4	0	0	0	112.3	E678 Y681 R682 Q685 Y700 Q701 Y706 W707 S708	E678-F704 HydrophobicContact CG-CE2 4.01Å; E678-F704 WeakPolarHBondContact OE1-CE2 2.87Å; Y681-F704 HydrophobicContact CD2-CB 4.31Å; R682-F704 HydrophobicContact CG-CD2 4.47Å; R682-F704 HydrophobicContact CG-CE2 4.23Å; Q685-F704 VanDerWaalsContact NE2-CB 3.26Å; Y700-F704 WeakPolarHBondContact O-CB 3.25Å; Y700-F704 PolarHBondContact O-N 3.21Å; Y700-F704 VanDerWaalsContact O-N 3.1Å; Q701-F704 PolarHBondContact O-N 3.45Å; F704-Y706 VanDerWaalsContact C-N 3.27Å; F704-Y706 PolarHBondContact O-N 3.32Å; F704-W707 AromaticContact CD2-CE3 3.9Å; F704-W707 HydrophobicContact CD2-CE3 3.9Å; F704-W707 HydrophobicContact CD2-CZ3 4.24Å; F704-W707 AromaticContact CE2-CE3 3.8Å; F704-W707 HydrophobicContact CE2-CE3 3.8Å; F704-W707 AromaticContact CE2-CZ3 3.66Å; F704-W707 HydrophobicContact CE2-CZ3 3.66Å; F704-W707 HydrophobicContact CZ-CZ3 4.27Å; F704-W707 PolarHBondContact O-N 3.03Å; F704-S708 VanDerWaalsContact O-CB 3.27Å; F704-S708 WeakPolarHBondContact O-CB 3.38Å; F704-S708 PolarHBondContact O-N 3.33Å
705	D	97.7	Very high	94	Very high	64 Å²	64	76.3 Å²	76.3	34%	0.342	36%	0.361	S	S	.	.	H	α-helix	trans	-59.4	-37.3	175.9	-78.4	14.8	0	0	0	112.2	Q701 K709	Q701-D705 PolarHBondContact NE2-OD1 2.68Å; Q701-D705 WeakPolarHBondContact O-CB 3.41Å; Q701-D705 PolarHBondContact O-N 3.21Å; D705-K709 WeakPolarHBondContact O-CD 3.39Å; D705-K709 WeakPolarHBondContact O-CG 3.42Å; D705-K709 PolarHBondContact O-N 3.15Å
706	Y	96.9	Very high	93	Very high	117 Å²	117	76.9 Å²	76.9	46%	0.459	36%	0.364	S	S	.	.	H	α-helix	trans	-71.7	-49.7	176.2	174.7	-107.2	0	0	0	111.8	G702 L703 F704 S708 K709 E710	G702-Y706 WeakPolarHBondContact O-CB 3.41Å; G702-Y706 PolarHBondContact O-N 3.37Å; G702-Y706 VanDerWaalsContact O-N 3.09Å; L703-Y706 PolarHBondContact O-N 2.93Å; F704-Y706 VanDerWaalsContact C-N 3.27Å; F704-Y706 PolarHBondContact O-N 3.32Å; Y706-S708 VanDerWaalsContact C-N 3.28Å; Y706-S708 PolarHBondContact O-N 2.69Å; Y706-K709 PolarHBondContact O-N 3.28Å; Y706-E710 HydrophobicContact CD2-CG 4.4Å; Y706-E710 HydrophobicContact CE1-CG 4.29Å; Y706-E710 HydrophobicContact CE2-CG 3.75Å; Y706-E710 PolarHBondContact O-N 2.82Å
707	W	95.6	Very high	91.9	Very high	7 Å²	7	80.4 Å²	80.4	3%	0.027	38%	0.384	C	S	.	.	H	α-helix	trans	-53.1	-46.6	175.2	165.7	93.1	0	0	0	111.5	Y674 E678 Y681 L703 F704 K709 E710 R711	Y674-W707 PolarHBondContact O-NE1 3.32Å; E678-W707 HydrophobicContact CB-CH2 3.65Å; E678-W707 HydrophobicContact CB-CZ2 3.84Å; E678-W707 HydrophobicContact CB-CZ3 4.09Å; E678-W707 HydrophobicContact CG-CH2 4.18Å; E678-W707 HydrophobicContact CG-CZ3 4.39Å; E678-W707 VanDerWaalsContact OE2-CH2 3.25Å; E678-W707 WeakPolarHBondContact OE2-CH2 3.45Å; Y681-W707 HydrophobicContact CD2-CB 4.41Å; Y681-W707 HydrophobicContact CE2-CB 4.02Å; Y681-W707 HydrophobicContact CE2-CG 4.33Å; L703-W707 WeakPolarHBondContact O-CB 3.41Å; L703-W707 PolarHBondContact O-N 3.38Å; F704-W707 AromaticContact CD2-CE3 3.9Å; F704-W707 HydrophobicContact CD2-CE3 3.9Å; F704-W707 HydrophobicContact CD2-CZ3 4.24Å; F704-W707 AromaticContact CE2-CE3 3.8Å; F704-W707 HydrophobicContact CE2-CE3 3.8Å; F704-W707 AromaticContact CE2-CZ3 3.66Å; F704-W707 HydrophobicContact CE2-CZ3 3.66Å; F704-W707 HydrophobicContact CZ-CZ3 4.27Å; F704-W707 PolarHBondContact O-N 3.03Å; W707-K709 PolarHBondContact O-N 3.32Å; W707-E710 PolarHBondContact O-N 2.97Å; W707-R711 HydrophobicContact CZ2-CG 4.15Å; W707-R711 WeakPolarHBondContact O-CB 3.49Å; W707-R711 PolarHBondContact O-N 3.5Å
708	S	95	Very high	90	Very high	48 Å²	48	82.4 Å²	82.4	34%	0.336	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-43.5	-179.1	-177.2	0	0	0	0	111.6	F704 Y706 R711 Q712	F704-S708 VanDerWaalsContact O-CB 3.27Å; F704-S708 WeakPolarHBondContact O-CB 3.38Å; F704-S708 PolarHBondContact O-N 3.33Å; Y706-S708 VanDerWaalsContact C-N 3.28Å; Y706-S708 PolarHBondContact O-N 2.69Å; S708-R711 PolarHBondContact O-N 2.96Å; S708-Q712 WeakPolarHBondContact O-CB 3.46Å; S708-Q712 PolarHBondContact O-N 3.38Å
709	K	95.5	Very high	87.9	Confident	124 Å²	124	81 Å²	81	54%	0.539	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-46.7	176.2	-73.5	162.6	-166.7	153.5	0	112.2	D705 Y706 W707 R711 Q712 R713	D705-K709 WeakPolarHBondContact O-CD 3.39Å; D705-K709 WeakPolarHBondContact O-CG 3.42Å; D705-K709 PolarHBondContact O-N 3.15Å; Y706-K709 PolarHBondContact O-N 3.28Å; W707-K709 PolarHBondContact O-N 3.32Å; K709-R711 VanDerWaalsContact C-N 3.31Å; K709-R711 PolarHBondContact O-N 3.44Å; K709-Q712 PolarHBondContact O-N 3.43Å; K709-R713 VanDerWaalsContact O-CB 3.29Å; K709-R713 WeakPolarHBondContact O-CB 3.41Å; K709-R713 PolarHBondContact O-N 3.09Å
710	E	92.5	Very high	85.4	Confident	41 Å²	41	79.8 Å²	79.8	19%	0.192	41%	0.408	C	S	.	.	H	α-helix	trans	-67.3	-31.5	176.2	-69.7	-61.4	145.9	0	0	111.9	T673 Y706 W707 R713 L714	T673-E710 HydrophobicContact CG2-CB 3.83Å; Y706-E710 HydrophobicContact CD2-CG 4.4Å; Y706-E710 HydrophobicContact CE1-CG 4.29Å; Y706-E710 HydrophobicContact CE2-CG 3.75Å; Y706-E710 PolarHBondContact O-N 2.82Å; W707-E710 PolarHBondContact O-N 2.97Å; E710-R713 PolarHBondContact O-N 2.85Å; E710-R713 IonicContact OE1-NH1 3.82Å; E710-R713 PolarHBondContact OE1-NH1 3.13Å; E710-R713 VanDerWaalsContact OE2-CD 3.29Å; E710-R713 WeakPolarHBondContact OE2-CD 3.28Å; E710-R713 IonicContact OE2-CZ 2.63Å; E710-R713 IonicContact OE2-NE 3.69Å; E710-R713 IonicContact OE2-NH1 2.97Å; E710-R713 PolarHBondContact OE2-NH1 2.69Å; E710-L714 WeakPolarHBondContact O-CB 3.3Å; E710-L714 VanDerWaalsContact O-CG 3.31Å; E710-L714 WeakPolarHBondContact O-CG 3.19Å; E710-L714 PolarHBondContact O-N 3.44Å
711	R	88.7	Confident	83.1	Confident	30 Å²	30	82.3 Å²	82.3	11%	0.113	42%	0.42	C	S	.	.	H	α-helix	trans	-75	-29.1	173.7	-84.9	-68.7	-75.4	-110.8	8	114.8	D466 T673 S675 W707 S708 K709 R715	D466-R711 IonicContact OD2-CZ 3.24Å; D466-R711 IonicContact OD2-NH1 2.96Å; D466-R711 IonicContact OD2-NH2 2.69Å; D466-R711 PolarHBondContact OD2-NH2 3.22Å; T673-R711 VanDerWaalsContact O-CD 3.25Å; T673-R711 WeakPolarHBondContact O-CD 3.37Å; T673-R711 PolarHBondContact O-NH1 3.33Å; S675-R711 PolarHBondContact OG-NH1 3.01Å; S675-R711 PolarHBondContact OG-NH2 3.18Å; W707-R711 HydrophobicContact CZ2-CG 4.15Å; W707-R711 WeakPolarHBondContact O-CB 3.49Å; W707-R711 PolarHBondContact O-N 3.5Å; S708-R711 PolarHBondContact O-N 2.96Å; K709-R711 VanDerWaalsContact C-N 3.31Å; K709-R711 PolarHBondContact O-N 3.44Å; R711-R715 WeakPolarHBondContact O-CG 3.46Å; R711-R715 PolarHBondContact O-N 3.04Å; R711-R715 PolarHBondContact O-NE 3.3Å
712	Q	87.7	Confident	80.3	Confident	136 Å²	136	82.9 Å²	82.9	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-70.5	-43.7	168	-170.7	178.9	17.2	0	0	110.3	S708 K709 R715 S716	S708-Q712 WeakPolarHBondContact O-CB 3.46Å; S708-Q712 PolarHBondContact O-N 3.38Å; K709-Q712 PolarHBondContact O-N 3.43Å; Q712-R715 PolarHBondContact O-N 2.94Å; Q712-S716 PolarHBondContact O-N 2.93Å
713	R	89.2	Confident	77.5	Confident	137 Å²	137	86.1 Å²	86.1	52%	0.517	45%	0.449	S	S	.	.	H	α-helix	trans	-59.1	-47.3	176	-177.3	-171.3	176.7	-164	1.8	112.1	K709 E710 S716 L717	K709-R713 VanDerWaalsContact O-CB 3.29Å; K709-R713 WeakPolarHBondContact O-CB 3.41Å; K709-R713 PolarHBondContact O-N 3.09Å; E710-R713 PolarHBondContact O-N 2.85Å; E710-R713 IonicContact OE1-NH1 3.82Å; E710-R713 PolarHBondContact OE1-NH1 3.13Å; E710-R713 VanDerWaalsContact OE2-CD 3.29Å; E710-R713 WeakPolarHBondContact OE2-CD 3.28Å; E710-R713 IonicContact OE2-CZ 2.63Å; E710-R713 IonicContact OE2-NE 3.69Å; E710-R713 IonicContact OE2-NH1 2.97Å; E710-R713 PolarHBondContact OE2-NH1 2.69Å; R713-S716 WeakPolarHBondContact CA-OG 3.27Å; R713-S716 CarbonylContact O-C 3.6Å; R713-S716 PolarHBondContact O-N 3.32Å; R713-S716 VanDerWaalsContact O-N 3.1Å; R713-S716 PolarHBondContact O-OG 3.01Å; R713-L717 HydrophobicContact CG-CD1 4.1Å; R713-L717 WeakPolarHBondContact O-CG 3.3Å; R713-L717 PolarHBondContact O-N 3.17Å
714	L	81.4	Confident	74.9	Confident	77 Å²	77	86.8 Å²	86.8	40%	0.403	45%	0.453	S	S	.	.	H	α-helix	trans	-58.4	-48.6	175.7	-77.1	169.6	0	0	0	111.3	T673 E710 S716 L717 E718	T673-L714 HydrophobicContact CG2-CD1 3.87Å; E710-L714 WeakPolarHBondContact O-CB 3.3Å; E710-L714 VanDerWaalsContact O-CG 3.31Å; E710-L714 WeakPolarHBondContact O-CG 3.19Å; E710-L714 PolarHBondContact O-N 3.44Å; L714-S716 PolarHBondContact O-N 2.87Å; L714-L717 PolarHBondContact O-N 3.08Å; L714-E718 PolarHBondContact O-N 3.04Å
715	R	75.5	Confident	72.6	Confident	152 Å²	152	87.7 Å²	87.7	57%	0.574	46%	0.463	S	S	*	.	H	α-helix	trans	-61.3	-25.9	175.1	-76.6	-174.8	-89.7	-154.9	-0.2	113.7	R711 Q712	R711-R715 WeakPolarHBondContact O-CG 3.46Å; R711-R715 PolarHBondContact O-N 3.04Å; R711-R715 PolarHBondContact O-NE 3.3Å; Q712-R715 PolarHBondContact O-N 2.94Å
716	S	76.6	Confident	70.5	Confident	91 Å²	91	86.2 Å²	86.2	64%	0.636	46%	0.455	S	S	*	.	H	α-helix	trans	-85.1	-11.7	172.9	72.5	0	0	0	0	114.9	Q712 R713 L714	Q712-S716 PolarHBondContact O-N 2.93Å; R713-S716 WeakPolarHBondContact CA-OG 3.27Å; R713-S716 CarbonylContact O-C 3.6Å; R713-S716 PolarHBondContact O-N 3.32Å; R713-S716 VanDerWaalsContact O-N 3.1Å; R713-S716 PolarHBondContact O-OG 3.01Å; L714-S716 PolarHBondContact O-N 2.87Å
717	L	73.9	Confident	68	Low	118 Å²	118	87.4 Å²	87.4	62%	0.618	47%	0.465	S	S	*	.	H	α-helix	trans	-97.3	-16.1	174.8	-73.4	169.8	0	0	0	112.6	R713 L714	R713-L717 HydrophobicContact CG-CD1 4.1Å; R713-L717 WeakPolarHBondContact O-CG 3.3Å; R713-L717 PolarHBondContact O-N 3.17Å; L714-L717 PolarHBondContact O-N 3.08Å
718	E	59.3	Low	65.8	Low	88 Å²	88	89.7 Å²	89.7	41%	0.411	48%	0.475	S	S	.	.	S	Bend	trans	-60.1	137.6	165.1	-62.2	-161.5	92.8	0	0	109.4	K467 L714 C720	K467-E718 WeakPolarHBondContact CE-OE1 3.37Å; K467-E718 IonicContact NZ-OE1 2.71Å; K467-E718 PolarHBondContact NZ-OE1 3.12Å; L714-E718 PolarHBondContact O-N 3.04Å; E718-C720 PolarHBondContact O-N 3.44Å
719	P	54.1	Low	63.2	Low	106 Å²	106	92.5 Å²	92.5	69%	0.688	50%	0.495	S	S	*	.			trans	-53.9	138.5	167.4	-22.2	32.9	0	0	0	109.2	E721	P719-E721 PolarHBondContact O-N 2.86Å
720	C	45.9	Very low	60.8	Low	117 Å²	117	90.4 Å²	90.4	79%	0.791	49%	0.489	S	S	*	.			trans	-57.7	110.1	158.6	-96.3	0	0	0	0	107.1	E718 S722	E718-C720 PolarHBondContact O-N 3.44Å; C720-S722 PolarHBondContact O-N 2.86Å; C720-S722 PolarHBondContact O-OG 3.26Å
721	E	48.6	Very low	58.6	Low	66 Å²	66	94.6 Å²	94.6	31%	0.308	51%	0.509	S	S	.	.			trans	-72.6	44.5	169.7	-68.4	-179.5	-162.1	0	0	110.1	K467 P719 S723 D724	K467-E721 IonicContact NZ-OE1 2.71Å; K467-E721 PolarHBondContact NZ-OE1 3.27Å; P719-E721 PolarHBondContact O-N 2.86Å; E721-S723 PolarHBondContact O-N 3.19Å; E721-D724 HydrophobicContact CB-CB 4.23Å; E721-D724 HydrophobicContact CG-CB 4.49Å; E721-D724 PolarHBondContact O-N 3.4Å
722	S	38.4	Very low	56.6	Low	93 Å²	93	100.8 Å²	100.8	65%	0.65	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	94.6	174.4	53.7	0	0	0	0	108.3	C720	C720-S722 PolarHBondContact O-N 2.86Å; C720-S722 PolarHBondContact O-OG 3.26Å
723	S	40.8	Very low	54.8	Low	108 Å²	108	99.5 Å²	99.5	76%	0.755	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	53.8	-171.2	51.7	0	0	0	0	113.9	E721 S725	E721-S723 PolarHBondContact O-N 3.19Å; S723-S725 PolarHBondContact O-N 2.86Å
724	D	43.1	Very low	53.1	Low	74 Å²	74	98.6 Å²	98.6	40%	0.396	55%	0.546	S	S	.	.			trans	-69.2	72.9	140.6	-140.4	48.3	0	0	0	105.6	K434 K470 E721	K434-D724 IonicContact NZ-OD2 2.68Å; K434-D724 PolarHBondContact NZ-OD2 3.14Å; K470-D724 PolarHBondContact NZ-O 3.47Å; E721-D724 HydrophobicContact CB-CB 4.23Å; E721-D724 HydrophobicContact CG-CB 4.49Å; E721-D724 PolarHBondContact O-N 3.4Å
725	S	47.9	Very low	52.2	Low	48 Å²	48	98.5 Å²	98.5	34%	0.336	55%	0.545	S	S	.	.			trans	-66.8	149.7	174.5	45.7	0	0	0	0	108.3	S723 E727	S723-S725 PolarHBondContact O-N 2.86Å; S725-E727 CarbonylContact O-C 3.52Å; S725-E727 PolarHBondContact O-N 3.48Å; S725-E727 VanDerWaalsContact O-N 3.1Å; S725-E727 PolarHBondContact OG-O 3.09Å
726	L	53.4	Low	51.8	Low	33 Å²	33	92.8 Å²	92.8	17%	0.173	53%	0.533	C	S	.	.	S	Bend	trans	-66	-11.3	174.4	-73.4	154.8	0	0	0	112	L455 Y458 I474 I477 F728	L455-L726 HydrophobicContact CD2-CD2 3.86Å; Y458-L726 HydrophobicContact CD1-CD2 4.39Å; Y458-L726 HydrophobicContact CE1-CD2 4.04Å; I474-L726 HydrophobicContact CG1-CD1 4.28Å; I477-L726 HydrophobicContact CD1-CD1 3.48Å; I477-L726 VanDerWaalsContact CD1-CD1 3.48Å; I477-L726 HydrophobicContact CG2-CD1 4.36Å; L726-F728 VanDerWaalsContact O-CD2 3.29Å; L726-F728 WeakPolarHBondContact O-CD2 3.19Å; L726-F728 PolarHBondContact O-N 2.9Å
727	E	44.7	Very low	51.5	Low	142 Å²	142	93 Å²	93	66%	0.664	53%	0.526	S	S	*	.	S	Bend	trans	-66.8	78	156.2	-58.5	173.1	163.1	0	0	110.4	S725 S729	S725-E727 CarbonylContact O-C 3.52Å; S725-E727 PolarHBondContact O-N 3.48Å; S725-E727 VanDerWaalsContact O-N 3.1Å; S725-E727 PolarHBondContact OG-O 3.09Å; E727-S729 PolarHBondContact O-N 3.34Å
728	F	49.9	Very low	51.4	Low	55 Å²	55	92.1 Å²	92.1	24%	0.241	53%	0.527	C	S	.	.			trans	-46.6	120.5	160	-59.8	-101.2	0	0	0	107.6	L437 M438 R441 L726 D730	L437-F728 HydrophobicContact CB-CE2 4.37Å; L437-F728 HydrophobicContact CB-CZ 4.2Å; M438-F728 HydrophobicContact CG-CD1 3.69Å; M438-F728 HydrophobicContact CG-CE1 3.45Å; M438-F728 VanDerWaalsContact CG-CE1 3.45Å; M438-F728 HydrophobicContact CG-CE2 4.33Å; M438-F728 HydrophobicContact CG-CG 4.23Å; M438-F728 HydrophobicContact CG-CZ 3.81Å; M438-F728 HydrophobicContact SD-CD1 3.98Å; M438-F728 HydrophobicContact SD-CE1 3.82Å; R441-F728 PolarHBondContact NH1-O 2.89Å; L726-F728 VanDerWaalsContact O-CD2 3.29Å; L726-F728 WeakPolarHBondContact O-CD2 3.19Å; L726-F728 PolarHBondContact O-N 2.9Å; F728-D730 PolarHBondContact O-N 3.44Å
729	S	40.7	Very low	52.2	Low	107 Å²	107	93.2 Å²	93.2	75%	0.748	53%	0.532	S	S	*	.	S	Bend	trans	-62.5	-17.8	-156.1	53.4	0	0	0	0	115.6	E727 E731	E727-S729 PolarHBondContact O-N 3.34Å; S729-E731 PolarHBondContact O-N 2.92Å
730	D	45.1	Very low	53.1	Low	80 Å²	80	89.7 Å²	89.7	43%	0.428	51%	0.506	S	S	.	.			trans	-104.7	72.4	-165	-66.3	12.4	0	0	0	111.7	F728 N732 N733	F728-D730 PolarHBondContact O-N 3.44Å; D730-N732 PolarHBondContact O-N 3.01Å; D730-N733 HydrophobicContact CB-CB 3.83Å; D730-N733 PolarHBondContact O-N 3.29Å; D730-N733 PolarHBondContact OD2-ND2 2.98Å
731	E	46.7	Very low	54.5	Low	129 Å²	129	85.1 Å²	85.1	60%	0.603	48%	0.475	S	S	*	.	S	Bend	trans	-63.2	-15.3	160.6	-57.8	-145.5	129.6	0	0	111.9	R441 S729 I734	R441-E731 IonicContact CZ-OE1 2.79Å; R441-E731 IonicContact NH2-OE1 2.7Å; R441-E731 PolarHBondContact NH2-OE1 3.07Å; S729-E731 PolarHBondContact O-N 2.92Å; E731-I734 WeakPolarHBondContact O-CD1 3.36Å; E731-I734 WeakPolarHBondContact O-CG1 3.4Å
732	N	45.6	Very low	56	Low	160 Å²	160	86.4 Å²	86.4	86%	0.856	48%	0.481	S	S	*	.	S	Bend	trans	-90.3	-22.2	177.4	-65.2	-41.4	0	0	0	114.4	D730	D730-N732 PolarHBondContact O-N 3.01Å
733	N	49.4	Very low	58.1	Low	108 Å²	108	85.9 Å²	85.9	58%	0.578	47%	0.471	S	S	*	.			trans	-101.8	46.6	174.1	-65.6	-42.6	0	0	0	111.2	D730 I735	D730-N733 HydrophobicContact CB-CB 3.83Å; D730-N733 PolarHBondContact O-N 3.29Å; D730-N733 PolarHBondContact OD2-ND2 2.98Å; N733-I735 PolarHBondContact O-N 3.28Å
734	I	54.1	Low	60	Low	118 Å²	118	81.2 Å²	81.2	61%	0.605	44%	0.437	S	S	*	.			trans	-72.4	79.5	165.5	-57.4	174.4	0	0	0	108	E731	E731-I734 WeakPolarHBondContact O-CD1 3.36Å; E731-I734 WeakPolarHBondContact O-CG1 3.4Å
735	I	63.6	Low	61.9	Low	76 Å²	76	77.9 Å²	77.9	39%	0.39	42%	0.419	S	S	.	.			trans	-44.6	138.8	163	-66.4	169.7	0	0	0	108	N733 E739 Q740	N733-I735 PolarHBondContact O-N 3.28Å; I735-E739 HydrophobicContact CG2-CB 3.36Å; I735-E739 HydrophobicContact CG2-CG 4.44Å; I735-Q740 HydrophobicContact CB-CG 3.73Å; I735-Q740 HydrophobicContact CG2-CG 3.63Å; I735-Q740 WeakPolarHBondContact O-CG 3.43Å; I735-Q740 PolarHBondContact O-NE2 2.82Å
736	G	67	Low	63.6	Low	31 Å²	31	81.3 Å²	81.3	32%	0.32	43%	0.43	S	S	.	.			trans	-61.4	149.1	-172.4	0	0	0	0	0	112.6	T738 E739 Q740	G736-T738 PolarHBondContact O-N 3.1Å; G736-E739 PolarHBondContact N-OE2 3.14Å; G736-E739 CarbonylContact O-C 3.57Å; G736-E739 WeakPolarHBondContact O-CA 3.44Å; G736-E739 WeakPolarHBondContact O-CB 3.41Å; G736-E739 PolarHBondContact O-N 2.95Å; G736-Q740 PolarHBondContact O-N 3.23Å
737	L	68.4	Low	65.1	Low	95 Å²	95	81 Å²	81	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-50.3	-36.7	-178.8	-79.7	161.7	0	0	0	113.5	V443 S741	V443-L737 HydrophobicContact CB-CD2 4.44Å; V443-L737 HydrophobicContact CG2-CD2 3.72Å; L737-S741 VanDerWaalsContact O-CB 3.31Å; L737-S741 WeakPolarHBondContact O-CB 3.31Å; L737-S741 PolarHBondContact O-N 2.71Å; L737-S741 PolarHBondContact O-OG 3.27Å
738	T	72.1	Confident	67	Low	101 Å²	101	74.3 Å²	74.3	62%	0.62	40%	0.397	S	S	*	.	H	α-helix	trans	-66.5	-47.8	174.5	-49.5	0	0	0	0	112.2	G736 S741 Q742	G736-T738 PolarHBondContact O-N 3.1Å; T738-S741 PolarHBondContact O-N 3.35Å; T738-Q742 WeakPolarHBondContact O-CG 3.47Å; T738-Q742 PolarHBondContact O-N 3.02Å
739	E	75.7	Confident	68.7	Low	111 Å²	111	75.6 Å²	75.6	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-67.6	-39.7	-179.3	-62.8	169.3	147.6	0	0	111.1	I735 G736 Q742 L743	I735-E739 HydrophobicContact CG2-CB 3.36Å; I735-E739 HydrophobicContact CG2-CG 4.44Å; G736-E739 PolarHBondContact N-OE2 3.14Å; G736-E739 CarbonylContact O-C 3.57Å; G736-E739 WeakPolarHBondContact O-CA 3.44Å; G736-E739 WeakPolarHBondContact O-CB 3.41Å; G736-E739 PolarHBondContact O-N 2.95Å; E739-Q742 WeakPolarHBondContact O-CB 3.4Å; E739-Q742 PolarHBondContact O-N 3.3Å; E739-L743 WeakPolarHBondContact O-CB 3.45Å; E739-L743 PolarHBondContact O-N 3.06Å
740	Q	74.5	Confident	70.8	Confident	31 Å²	31	73.8 Å²	73.8	15%	0.145	38%	0.383	C	S	.	.	H	α-helix	trans	-65.7	-37.8	172.4	-66.4	-168.4	5.9	0	0	112.1	S442 I735 G736 Q742 L744	S442-Q740 PolarHBondContact OG-OE1 2.79Å; I735-Q740 HydrophobicContact CB-CG 3.73Å; I735-Q740 HydrophobicContact CG2-CG 3.63Å; I735-Q740 WeakPolarHBondContact O-CG 3.43Å; I735-Q740 PolarHBondContact O-NE2 2.82Å; G736-Q740 PolarHBondContact O-N 3.23Å; Q740-Q742 VanDerWaalsContact C-N 3.34Å; Q740-L744 VanDerWaalsContact O-CB 3.23Å; Q740-L744 WeakPolarHBondContact O-CB 3.37Å; Q740-L744 PolarHBondContact O-N 2.97Å
741	S	74.8	Confident	72.8	Confident	22 Å²	22	70 Å²	70	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-67.5	-35.4	174.3	-60.6	0	0	0	0	111.6	L737 T738 M745	L737-S741 VanDerWaalsContact O-CB 3.31Å; L737-S741 WeakPolarHBondContact O-CB 3.31Å; L737-S741 PolarHBondContact O-N 2.71Å; L737-S741 PolarHBondContact O-OG 3.27Å; T738-S741 PolarHBondContact O-N 3.35Å; S741-M745 WeakPolarHBondContact O-CB 3.27Å; S741-M745 WeakPolarHBondContact O-CG 3.5Å; S741-M745 PolarHBondContact O-N 3.45Å
742	Q	80.3	Confident	74.6	Confident	93 Å²	93	65.2 Å²	65.2	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-64.9	-53.4	172.2	-73.7	169.1	-15.1	0	0	111.1	F398 T738 E739 Q740 L744 M745 E746	F398-Q742 HydrophobicContact CE2-CG 4.07Å; F398-Q742 HydrophobicContact CZ-CG 4.11Å; T738-Q742 WeakPolarHBondContact O-CG 3.47Å; T738-Q742 PolarHBondContact O-N 3.02Å; E739-Q742 WeakPolarHBondContact O-CB 3.4Å; E739-Q742 PolarHBondContact O-N 3.3Å; Q740-Q742 VanDerWaalsContact C-N 3.34Å; Q742-L744 VanDerWaalsContact C-N 3.32Å; Q742-L744 PolarHBondContact O-N 3.45Å; Q742-M745 CarbonylContact O-C 3.3Å; Q742-M745 PolarHBondContact O-N 2.81Å; Q742-E746 PolarHBondContact O-N 3.29Å
743	L	81.5	Confident	76.5	Confident	82 Å²	82	66 Å²	66	43%	0.429	33%	0.332	S	S	.	.	H	α-helix	trans	-55.1	-45.6	177.1	176.5	60.4	0	0	0	111.7	E739 M745 E746 L747	E739-L743 WeakPolarHBondContact O-CB 3.45Å; E739-L743 PolarHBondContact O-N 3.06Å; L743-M745 VanDerWaalsContact C-N 3.33Å; L743-M745 PolarHBondContact O-N 3.37Å; L743-E746 PolarHBondContact O-N 2.85Å; L743-L747 HydrophobicContact CD1-CD1 4.07Å; L743-L747 HydrophobicContact CD1-CG 4.35Å; L743-L747 HydrophobicContact CG-CD1 3.91Å; L743-L747 WeakPolarHBondContact O-CB 3.21Å; L743-L747 WeakPolarHBondContact O-CD1 3.34Å; L743-L747 VanDerWaalsContact O-CG 3.29Å; L743-L747 WeakPolarHBondContact O-CG 3.29Å; L743-L747 PolarHBondContact O-N 3.17Å
744	L	80.5	Confident	78.1	Confident	9 Å²	9	63.8 Å²	63.8	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-36.8	176.8	-177.2	60	0	0	0	112.4	T409 L413 Y439 Q740 Q742 L748	T409-L744 HydrophobicContact CG2-CD2 3.71Å; T409-L744 HydrophobicContact CG2-CG 4.46Å; L413-L744 HydrophobicContact CD1-CD1 4.09Å; L413-L744 HydrophobicContact CD1-CD2 4.2Å; Y439-L744 HydrophobicContact CD1-CD2 3.5Å; Y439-L744 VanDerWaalsContact CD1-CD2 3.5Å; Y439-L744 HydrophobicContact CD2-CD2 3.62Å; Y439-L744 HydrophobicContact CE1-CD2 3.74Å; Y439-L744 HydrophobicContact CE2-CD2 3.87Å; Y439-L744 HydrophobicContact CG-CD2 3.42Å; Y439-L744 VanDerWaalsContact CG-CD2 3.42Å; Q740-L744 VanDerWaalsContact O-CB 3.23Å; Q740-L744 WeakPolarHBondContact O-CB 3.37Å; Q740-L744 PolarHBondContact O-N 2.97Å; Q742-L744 VanDerWaalsContact C-N 3.32Å; Q742-L744 PolarHBondContact O-N 3.45Å; L744-L748 VanDerWaalsContact O-CB 3.25Å; L744-L748 WeakPolarHBondContact O-CB 3.34Å; L744-L748 PolarHBondContact O-N 2.87Å
745	M	84.1	Confident	79.4	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.02	29%	0.289	C	S	.	.	H	α-helix	trans	-77.5	-18.3	177	-71.9	-58.7	-53.8	0	0	113.7	L394 F398 P404 S741 Q742 L743 L748 K749	L394-M745 VanDerWaalsContact C-CE 3.48Å; L394-M745 HydrophobicContact CB-CE 3.98Å; L394-M745 HydrophobicContact CB-SD 4.22Å; L394-M745 VanDerWaalsContact O-CE 3.32Å; L394-M745 WeakPolarHBondContact O-CE 3.31Å; F398-M745 HydrophobicContact CB-CE 3.86Å; F398-M745 HydrophobicContact CB-CG 4.37Å; F398-M745 HydrophobicContact CD1-CB 4.37Å; F398-M745 HydrophobicContact CD2-CB 3.8Å; F398-M745 HydrophobicContact CD2-CG 3.6Å; F398-M745 HydrophobicContact CE1-CB 4.41Å; F398-M745 HydrophobicContact CE2-CB 3.82Å; F398-M745 HydrophobicContact CE2-CG 4.03Å; F398-M745 HydrophobicContact CG-CB 4.07Å; F398-M745 HydrophobicContact CG-CE 4.26Å; F398-M745 HydrophobicContact CG-CG 4.02Å; F398-M745 HydrophobicContact CZ-CB 4.13Å; P404-M745 HydrophobicContact CG-SD 4Å; S741-M745 WeakPolarHBondContact O-CB 3.27Å; S741-M745 WeakPolarHBondContact O-CG 3.5Å; S741-M745 PolarHBondContact O-N 3.45Å; Q742-M745 CarbonylContact O-C 3.3Å; Q742-M745 PolarHBondContact O-N 2.81Å; L743-M745 VanDerWaalsContact C-N 3.33Å; L743-M745 PolarHBondContact O-N 3.37Å; M745-L748 HydrophobicContact CE-CD2 3.69Å; M745-L748 HydrophobicContact SD-CD2 3.68Å; M745-K749 WeakPolarHBondContact O-CD 3.13Å; M745-K749 WeakPolarHBondContact O-CE 3.49Å; M745-K749 WeakPolarHBondContact O-CG 3.45Å
746	E	84.6	Confident	80.4	Confident	121 Å²	121	57.7 Å²	57.7	57%	0.565	28%	0.284	S	S	*	.	H	α-helix	trans	-77.5	-48.8	166.3	-70.1	-176.9	167	0	0	111.1	Q742 L743 L748 K749 E750	Q742-E746 PolarHBondContact O-N 3.29Å; L743-E746 PolarHBondContact O-N 2.85Å; E746-L748 PolarHBondContact O-N 2.97Å; E746-K749 WeakPolarHBondContact O-CB 3.46Å; E746-K749 PolarHBondContact O-N 2.93Å; E746-E750 PolarHBondContact O-N 2.98Å
747	L	83.5	Confident	81.1	Confident	26 Å²	26	59.1 Å²	59.1	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-38.8	172	-72	162.2	0	0	0	111.8	H435 L743 K749 E750 Y751	H435-L747 WeakPolarHBondContact ND1-CD1 3.39Å; L743-L747 HydrophobicContact CD1-CD1 4.07Å; L743-L747 HydrophobicContact CD1-CG 4.35Å; L743-L747 HydrophobicContact CG-CD1 3.91Å; L743-L747 WeakPolarHBondContact O-CB 3.21Å; L743-L747 WeakPolarHBondContact O-CD1 3.34Å; L743-L747 VanDerWaalsContact O-CG 3.29Å; L743-L747 WeakPolarHBondContact O-CG 3.29Å; L743-L747 PolarHBondContact O-N 3.17Å; L747-K749 VanDerWaalsContact C-N 3.25Å; L747-K749 PolarHBondContact O-N 3.12Å; L747-E750 WeakPolarHBondContact O-CB 3.32Å; L747-E750 PolarHBondContact O-N 3.28Å; L747-Y751 HydrophobicContact CB-CD2 4.46Å; L747-Y751 HydrophobicContact CB-CE2 4.02Å; L747-Y751 WeakPolarHBondContact O-CB 3.46Å; L747-Y751 WeakPolarHBondContact O-CD2 3.36Å; L747-Y751 PolarHBondContact O-N 3.39Å
748	L	84.4	Confident	81.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-32.3	176.8	-170.5	69.5	0	0	0	112.2	I391 L394 L413 M416 L744 M745 E746 K752	I391-L748 HydrophobicContact CG1-CD1 4.36Å; I391-L748 HydrophobicContact CG2-CD1 4.17Å; I391-L748 HydrophobicContact CG2-CD2 4.08Å; I391-L748 HydrophobicContact CG2-CG 3.9Å; L394-L748 HydrophobicContact CB-CD2 3.79Å; L394-L748 HydrophobicContact CD1-CD2 3.66Å; L394-L748 HydrophobicContact CG-CD2 4.38Å; L413-L748 HydrophobicContact CD2-CD1 4.12Å; M416-L748 HydrophobicContact CE-CD1 4.22Å; M416-L748 HydrophobicContact SD-CD1 3.86Å; L744-L748 VanDerWaalsContact O-CB 3.25Å; L744-L748 WeakPolarHBondContact O-CB 3.34Å; L744-L748 PolarHBondContact O-N 2.87Å; M745-L748 HydrophobicContact CE-CD2 3.69Å; M745-L748 HydrophobicContact SD-CD2 3.68Å; E746-L748 PolarHBondContact O-N 2.97Å; L748-K752 WeakPolarHBondContact O-CB 3.41Å; L748-K752 PolarHBondContact O-N 3.41Å
749	K	85.2	Confident	81.5	Confident	82 Å²	82	51.1 Å²	51.1	36%	0.357	24%	0.242	S	C	.	.	H	α-helix	trans	-71.7	-41.7	174.5	-63.9	160.9	-169.6	165.2	0	111.3	M745 E746 L747 K752 Y753	M745-K749 WeakPolarHBondContact O-CD 3.13Å; M745-K749 WeakPolarHBondContact O-CE 3.49Å; M745-K749 WeakPolarHBondContact O-CG 3.45Å; E746-K749 WeakPolarHBondContact O-CB 3.46Å; E746-K749 PolarHBondContact O-N 2.93Å; L747-K749 VanDerWaalsContact C-N 3.25Å; L747-K749 PolarHBondContact O-N 3.12Å; K749-K752 PolarHBondContact O-N 3.44Å; K749-Y753 PolarHBondContact O-N 3.45Å; K749-Y753 VanDerWaalsContact O-N 3.13Å
750	E	86.3	Confident	80.9	Confident	70 Å²	70	51.7 Å²	51.7	33%	0.327	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-49.2	173.1	-168.3	-142.8	132	0	0	110.6	R431 E746 L747 Y753 Q754	R431-E750 IonicContact CZ-OE1 3.65Å; R431-E750 IonicContact NH1-OE1 3.92Å; R431-E750 PolarHBondContact NH1-OE1 2.94Å; R431-E750 IonicContact NH1-OE2 3.87Å; R431-E750 IonicContact NH2-OE1 3.73Å; E746-E750 PolarHBondContact O-N 2.98Å; L747-E750 WeakPolarHBondContact O-CB 3.32Å; L747-E750 PolarHBondContact O-N 3.28Å; E750-Y753 PolarHBondContact O-N 2.84Å; E750-Q754 PolarHBondContact O-N 3.21Å; E750-Q754 VanDerWaalsContact O-N 3.12Å; E750-Q754 PolarHBondContact OE1-NE2 3.42Å
751	Y	85.7	Confident	79.7	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-43.6	177.9	-62.1	-22.8	0	0	0	111.7	L428 R431 I432 H435 L747 Y753 Q754 F755	L428-Y751 HydrophobicContact CD1-CD1 3.56Å; L428-Y751 HydrophobicContact CD1-CE1 4.13Å; L428-Y751 HydrophobicContact CD1-CG 4.18Å; R431-Y751 HydrophobicContact CB-CE1 4.3Å; R431-Y751 PolarHBondContact O-OH 3.09Å; I432-Y751 HydrophobicContact CB-CE2 4.38Å; I432-Y751 HydrophobicContact CD1-CD2 4.48Å; I432-Y751 HydrophobicContact CD1-CG 4.42Å; I432-Y751 HydrophobicContact CG1-CD1 4.25Å; I432-Y751 HydrophobicContact CG1-CD2 3.6Å; I432-Y751 HydrophobicContact CG1-CE1 4.38Å; I432-Y751 HydrophobicContact CG1-CE2 3.72Å; I432-Y751 HydrophobicContact CG1-CG 3.87Å; H435-Y751 PolarHBondContact CE1-OH 3.03Å; H435-Y751 AromaticContact ND1-CZ 3.9Å; H435-Y751 PolarHBondContact ND1-OH 3.2Å; L747-Y751 HydrophobicContact CB-CD2 4.46Å; L747-Y751 HydrophobicContact CB-CE2 4.02Å; L747-Y751 WeakPolarHBondContact O-CB 3.46Å; L747-Y751 WeakPolarHBondContact O-CD2 3.36Å; L747-Y751 PolarHBondContact O-N 3.39Å; Y751-Y753 VanDerWaalsContact C-N 3.27Å; Y751-Y753 PolarHBondContact O-N 2.95Å; Y751-Q754 CarbonylContact O-C 3.47Å; Y751-Q754 PolarHBondContact O-N 3.08Å; Y751-F755 WeakPolarHBondContact O-CA 3.34Å; Y751-F755 WeakPolarHBondContact O-CB 3.32Å; Y751-F755 PolarHBondContact O-N 3Å
752	K	84.5	Confident	78.2	Confident	27 Å²	27	53.5 Å²	53.5	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-55.8	-42	175.8	-175.1	-171.1	176.5	-168	0	112.2	I391 E392 E395 L748 K749 F755 K756	I391-K752 HydrophobicContact CG2-CB 3.94Å; I391-K752 HydrophobicContact CG2-CD 3.84Å; I391-K752 HydrophobicContact CG2-CG 3.87Å; E392-K752 VanDerWaalsContact CG-CE 3.45Å; E392-K752 WeakPolarHBondContact OE1-CE 3.36Å; E392-K752 IonicContact OE1-NZ 3.16Å; E392-K752 PolarHBondContact OE1-NZ 3.17Å; E395-K752 WeakPolarHBondContact OE1-CD 3.48Å; E395-K752 IonicContact OE1-NZ 3.83Å; E395-K752 PolarHBondContact OE1-NZ 2.93Å; E395-K752 IonicContact OE2-NZ 2.71Å; E395-K752 PolarHBondContact OE2-NZ 2.86Å; L748-K752 WeakPolarHBondContact O-CB 3.41Å; L748-K752 PolarHBondContact O-N 3.41Å; K749-K752 PolarHBondContact O-N 3.44Å; K752-F755 PolarHBondContact O-N 3.01Å; K752-K756 WeakPolarHBondContact O-CG 3.29Å; K752-K756 PolarHBondContact O-N 2.94Å
753	Y	86.3	Confident	75.6	Confident	177 Å²	177	58.2 Å²	58.2	69%	0.694	28%	0.28	S	S	*	.	H	α-helix	trans	-63.6	-50.6	176.6	176.5	-109.3	0	0	0	111.5	K749 E750 Y751 F755 K756 S757	K749-Y753 PolarHBondContact O-N 3.45Å; K749-Y753 VanDerWaalsContact O-N 3.13Å; E750-Y753 PolarHBondContact O-N 2.84Å; Y751-Y753 VanDerWaalsContact C-N 3.27Å; Y751-Y753 PolarHBondContact O-N 2.95Å; Y753-F755 PolarHBondContact O-N 3.44Å; Y753-K756 PolarHBondContact O-N 2.92Å; Y753-S757 PolarHBondContact O-N 3.25Å
754	Q	82.7	Confident	73.3	Confident	61 Å²	61	57.8 Å²	57.8	29%	0.285	28%	0.281	S	S	.	.	H	α-helix	trans	-71.5	-17.3	178.5	-65.1	170.9	23.5	0	0	113.9	L428 E750 Y751 S757 I758	L428-Q754 HydrophobicContact CD1-CB 4.36Å; L428-Q754 HydrophobicContact CD2-CB 4.06Å; E750-Q754 PolarHBondContact O-N 3.21Å; E750-Q754 VanDerWaalsContact O-N 3.12Å; E750-Q754 PolarHBondContact OE1-NE2 3.42Å; Y751-Q754 CarbonylContact O-C 3.47Å; Y751-Q754 PolarHBondContact O-N 3.08Å; Q754-S757 PolarHBondContact O-OG 3.24Å; Q754-I758 WeakPolarHBondContact O-CG1 3.23Å
755	F	82.7	Confident	70.8	Confident	1 Å²	1	62.8 Å²	62.8	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-84.2	-40.6	175.2	-167.8	-98.5	0	0	0	110.3	F384 T387 V388 I391 M416 V419 Y751 K752 Y753 S757 I758	F384-F755 AromaticContact CD2-CD1 3.88Å; F384-F755 HydrophobicContact CD2-CD1 3.88Å; F384-F755 AromaticContact CD2-CE1 3.37Å; F384-F755 HydrophobicContact CD2-CE1 3.37Å; F384-F755 AromaticContact CD2-CZ 3.93Å; F384-F755 HydrophobicContact CD2-CZ 3.93Å; F384-F755 AromaticContact CE2-CD1 3.54Å; F384-F755 HydrophobicContact CE2-CD1 3.54Å; F384-F755 AromaticContact CE2-CE1 3.56Å; F384-F755 HydrophobicContact CE2-CE1 3.56Å; F384-F755 HydrophobicContact CE2-CG 4.39Å; F384-F755 HydrophobicContact CE2-CZ 4.41Å; F384-F755 VanDerWaalsContact CE2-O 3.24Å; F384-F755 WeakPolarHBondContact CE2-O 3.45Å; T387-F755 HydrophobicContact CG2-CE1 3.59Å; T387-F755 HydrophobicContact CG2-CZ 3.51Å; V388-F755 HydrophobicContact CG2-CD1 4.06Å; V388-F755 HydrophobicContact CG2-CE1 4.15Å; I391-F755 HydrophobicContact CD1-CD1 4.23Å; M416-F755 HydrophobicContact CB-CE2 4.08Å; M416-F755 HydrophobicContact CE-CD2 4.42Å; M416-F755 HydrophobicContact CE-CG 4.5Å; M416-F755 HydrophobicContact CG-CE2 4.2Å; M416-F755 HydrophobicContact CG-CZ 4.3Å; V419-F755 HydrophobicContact CB-CE2 3.83Å; V419-F755 HydrophobicContact CB-CZ 3.72Å; V419-F755 HydrophobicContact CG1-CE2 3.77Å; V419-F755 HydrophobicContact CG1-CZ 3.59Å; V419-F755 HydrophobicContact CG2-CZ 4.24Å; Y751-F755 WeakPolarHBondContact O-CA 3.34Å; Y751-F755 WeakPolarHBondContact O-CB 3.32Å; Y751-F755 PolarHBondContact O-N 3Å; K752-F755 PolarHBondContact O-N 3.01Å; Y753-F755 PolarHBondContact O-N 3.44Å; F755-S757 VanDerWaalsContact C-N 3.31Å; F755-S757 PolarHBondContact O-N 3.5Å; F755-I758 HydrophobicContact CB-CD1 4.41Å; F755-I758 HydrophobicContact CD2-CD1 3.62Å; F755-I758 HydrophobicContact CE2-CD1 4.15Å; F755-I758 HydrophobicContact CG-CD1 4.12Å; F755-I758 WeakPolarHBondContact O-CB 3.25Å; F755-I758 WeakPolarHBondContact O-CG1 3.34Å; F755-I758 PolarHBondContact O-N 3.49Å; F755-I758 VanDerWaalsContact O-N 3.09Å
756	K	84.5	Confident	68.2	Low	66 Å²	66	70.9 Å²	70.9	29%	0.287	34%	0.339	S	S	.	.	H	α-helix	trans	-59.2	-42.1	175.6	-78.2	-168.9	178.5	-166.3	0	112	V388 E392 K752 Y753 I758 F759 E760	V388-K756 VanDerWaalsContact CG1-CE 3.46Å; V388-K756 HydrophobicContact CG2-CG 4.37Å; E392-K756 IonicContact OE1-NZ 3.9Å; E392-K756 PolarHBondContact OE1-NZ 3.08Å; K752-K756 WeakPolarHBondContact O-CG 3.29Å; K752-K756 PolarHBondContact O-N 2.94Å; Y753-K756 PolarHBondContact O-N 2.92Å; K756-I758 PolarHBondContact O-N 3.42Å; K756-F759 PolarHBondContact O-N 2.99Å; K756-E760 WeakPolarHBondContact CB-OE1 3.43Å; K756-E760 WeakPolarHBondContact O-CG 3.21Å; K756-E760 PolarHBondContact O-N 2.97Å
757	S	81.6	Confident	65.6	Low	60 Å²	60	71.5 Å²	71.5	42%	0.42	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-8	177.1	64.1	0	0	0	0	115.7	Y753 Q754 F755 F759 E760	Y753-S757 PolarHBondContact O-N 3.25Å; Q754-S757 PolarHBondContact O-OG 3.24Å; F755-S757 VanDerWaalsContact C-N 3.31Å; F755-S757 PolarHBondContact O-N 3.5Å; S757-F759 VanDerWaalsContact C-N 3.29Å; S757-F759 PolarHBondContact O-N 3.23Å; S757-E760 VanDerWaalsContact CA-OE2 3.3Å; S757-E760 WeakPolarHBondContact CA-OE2 3.19Å; S757-E760 WeakPolarHBondContact CB-OE2 3.32Å
758	I	76.9	Confident	62.9	Low	10 Å²	10	75.6 Å²	75.6	5%	0.051	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-35	174.4	-60.7	-179.9	0	0	0	111.7	K423 K425 L428 Q754 F755 K756	K423-I758 HydrophobicContact CB-CG2 3.48Å; K423-I758 VanDerWaalsContact CB-CG2 3.48Å; K423-I758 HydrophobicContact CD-CG2 3.85Å; K423-I758 HydrophobicContact CG-CG2 3.39Å; K425-I758 HydrophobicContact CG-CD1 4.05Å; K425-I758 HydrophobicContact CG-CG1 4.07Å; K425-I758 HydrophobicContact CG-CG2 4.41Å; L428-I758 HydrophobicContact CD2-CD1 4.19Å; Q754-I758 WeakPolarHBondContact O-CG1 3.23Å; F755-I758 HydrophobicContact CB-CD1 4.41Å; F755-I758 HydrophobicContact CD2-CD1 3.62Å; F755-I758 HydrophobicContact CE2-CD1 4.15Å; F755-I758 HydrophobicContact CG-CD1 4.12Å; F755-I758 WeakPolarHBondContact O-CB 3.25Å; F755-I758 WeakPolarHBondContact O-CG1 3.34Å; F755-I758 PolarHBondContact O-N 3.49Å; F755-I758 VanDerWaalsContact O-N 3.09Å; K756-I758 PolarHBondContact O-N 3.42Å
759	F	70.7	Confident	60.3	Low	18 Å²	18	83.5 Å²	83.5	8%	0.079	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-2	-179.8	-72.3	-102.8	0	0	0	113.5	Q381 F384 V419 K423 K756 S757 S761 L762	Q381-F759 HydrophobicContact CB-CE1 4.38Å; Q381-F759 HydrophobicContact CG-CD1 3.95Å; Q381-F759 HydrophobicContact CG-CE1 3.7Å; F384-F759 HydrophobicContact CB-CD2 3.94Å; F384-F759 HydrophobicContact CB-CE2 3.47Å; F384-F759 VanDerWaalsContact CB-CE2 3.47Å; F384-F759 HydrophobicContact CB-CZ 3.78Å; F384-F759 HydrophobicContact CD1-CB 4.07Å; F384-F759 HydrophobicContact CD1-CD1 4.42Å; F384-F759 AromaticContact CD1-CD2 3.58Å; F384-F759 HydrophobicContact CD1-CD2 3.58Å; F384-F759 HydrophobicContact CD1-CE2 4.05Å; F384-F759 AromaticContact CD1-CG 3.79Å; F384-F759 HydrophobicContact CD1-CG 3.79Å; F384-F759 AromaticContact CD2-CD2 3.38Å; F384-F759 HydrophobicContact CD2-CD2 3.38Å; F384-F759 AromaticContact CD2-CE2 3.53Å; F384-F759 HydrophobicContact CD2-CE2 3.53Å; F384-F759 HydrophobicContact CD2-CG 4.38Å; F384-F759 HydrophobicContact CE1-CB 3.71Å; F384-F759 AromaticContact CE1-CD2 3.84Å; F384-F759 HydrophobicContact CE1-CD2 3.84Å; F384-F759 AromaticContact CE1-CG 3.94Å; F384-F759 HydrophobicContact CE1-CG 3.94Å; F384-F759 AromaticContact CE2-CD2 3.66Å; F384-F759 HydrophobicContact CE2-CD2 3.66Å; F384-F759 HydrophobicContact CE2-CE2 4.26Å; F384-F759 AromaticContact CG-CD2 3.32Å; F384-F759 HydrophobicContact CG-CD2 3.32Å; F384-F759 AromaticContact CG-CE2 3.4Å; F384-F759 HydrophobicContact CG-CE2 3.4Å; F384-F759 HydrophobicContact CG-CG 4.01Å; F384-F759 HydrophobicContact CG-CZ 4.12Å; F384-F759 HydrophobicContact CZ-CB 4.01Å; F384-F759 AromaticContact CZ-CD2 3.86Å; F384-F759 HydrophobicContact CZ-CD2 3.86Å; F384-F759 HydrophobicContact CZ-CG 4.29Å; V419-F759 HydrophobicContact CG1-CE2 4.12Å; K423-F759 HydrophobicContact CD-CE2 4.27Å; K423-F759 HydrophobicContact CD-CZ 4.14Å; K423-F759 VanDerWaalsContact CE-CE1 3.44Å; K423-F759 HydrophobicContact CG-CE2 4.04Å; K423-F759 HydrophobicContact CG-CZ 4.17Å; K756-F759 PolarHBondContact O-N 2.99Å; S757-F759 VanDerWaalsContact C-N 3.29Å; S757-F759 PolarHBondContact O-N 3.23Å; F759-S761 PolarHBondContact O-N 3.22Å; F759-S761 VanDerWaalsContact O-N 3.12Å; F759-L762 HydrophobicContact CD1-CD1 3.74Å; F759-L762 HydrophobicContact CE1-CD1 4.49Å; F759-L762 WeakPolarHBondContact O-CB 3.41Å; F759-L762 PolarHBondContact O-N 3.28Å
760	E	63.4	Low	57.7	Low	123 Å²	123	85.3 Å²	85.3	58%	0.575	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-14.4	176.8	-76.1	165.7	-174.1	0	0	113.9	K756 S757 L762	K756-E760 WeakPolarHBondContact CB-OE1 3.43Å; K756-E760 WeakPolarHBondContact O-CG 3.21Å; K756-E760 PolarHBondContact O-N 2.97Å; S757-E760 VanDerWaalsContact CA-OE2 3.3Å; S757-E760 WeakPolarHBondContact CA-OE2 3.19Å; S757-E760 WeakPolarHBondContact CB-OE2 3.32Å; E760-L762 PolarHBondContact O-N 3.5Å
761	S	50.2	Low	54.8	Low	66 Å²	66	89.1 Å²	89.1	46%	0.462	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.1	167.7	57.4	0	0	0	0	113.7	F759 S789 T791	F759-S761 PolarHBondContact O-N 3.22Å; F759-S761 VanDerWaalsContact O-N 3.12Å; S761-S789 PolarHBondContact O-OG 3.38Å; S761-T791 PolarHBondContact OG-OG1 3.03Å
762	L	41.8	Very low	52.1	Low	25 Å²	25	94.9 Å²	94.9	13%	0.131	47%	0.473	C	S	.	.			trans	-103.4	83.4	-176.5	-67.7	160	0	0	0	110.8	F759 E760 V764 S789 T791	F759-L762 HydrophobicContact CD1-CD1 3.74Å; F759-L762 HydrophobicContact CE1-CD1 4.49Å; F759-L762 WeakPolarHBondContact O-CB 3.41Å; F759-L762 PolarHBondContact O-N 3.28Å; E760-L762 PolarHBondContact O-N 3.5Å; L762-V764 HydrophobicContact CB-CG2 4.24Å; L762-V764 PolarHBondContact O-N 2.88Å; L762-S789 WeakPolarHBondContact CD2-O 3.29Å; L762-T791 WeakPolarHBondContact CD1-OG1 3.2Å; L762-T791 WeakPolarHBondContact CD2-OG1 3.46Å; L762-T791 WeakPolarHBondContact CG-OG1 3.42Å
763	H	27.5	Very low	49.4	Very low	192 Å²	192	99.5 Å²	99.5	89%	0.889	50%	0.5	S	S	*	.			trans	-69.6	68.5	161.4	-107.8	-70.2	0	0	0	110.3
764	V	32.7	Very low	46.5	Very low	74 Å²	74	96.4 Å²	96.4	45%	0.448	50%	0.499	S	S	.	.			trans	-89.2	111	169.1	176.7	0	0	0	0	107.5	L762 Y766	L762-V764 HydrophobicContact CB-CG2 4.24Å; L762-V764 PolarHBondContact O-N 2.88Å; V764-Y766 VanDerWaalsContact O-CD2 3.3Å; V764-Y766 WeakPolarHBondContact O-CD2 3.29Å; V764-Y766 PolarHBondContact O-N 3.4Å
765	D	26.8	Very low	43.8	Very low	113 Å²	113	98.1 Å²	98.1	60%	0.604	52%	0.524	S	S	*	.			trans	-76.5	103.8	-179.2	-149.1	-35.8	0	0	0	109.7	N767	D765-N767 PolarHBondContact O-N 2.86Å; D765-N767 PolarHBondContact OD1-ND2 3.01Å
766	Y	31.2	Very low	41	Very low	174 Å²	174	103.6 Å²	103.6	68%	0.682	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-3.6	-173	-87.7	-99.7	0	0	0	114.3	Q381 V764 N768	Q381-Y766 PolarHBondContact OE1-OH 2.81Å; V764-Y766 VanDerWaalsContact O-CD2 3.3Å; V764-Y766 WeakPolarHBondContact O-CD2 3.29Å; V764-Y766 PolarHBondContact O-N 3.4Å; Y766-N768 PolarHBondContact O-N 2.86Å
767	N	29.9	Very low	38.1	Very low	134 Å²	134	106.1 Å²	106.1	72%	0.717	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-2.5	-179.4	-66.2	-61.5	0	0	0	114.6	D765 E769	D765-N767 PolarHBondContact O-N 2.86Å; D765-N767 PolarHBondContact OD1-ND2 3.01Å; N767-E769 PolarHBondContact O-N 3.33Å
768	N	26.5	Very low	35.4	Very low	112 Å²	112	109.5 Å²	109.5	60%	0.599	60%	0.597	S	S	*	*			trans	-88.9	84.4	179.3	-108.2	-38.4	0	0	0	112.2	Y766 N770 M771	Y766-N768 PolarHBondContact O-N 2.86Å; N768-N770 PolarHBondContact O-N 3.33Å; N768-M771 PolarHBondContact O-N 3.35Å
769	E	29.8	Very low	33	Very low	168 Å²	168	118.1 Å²	118.1	79%	0.785	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-58.7	-15.7	-178	-62.5	-171.1	130.1	0	0	115	N767 M771 V772	N767-E769 PolarHBondContact O-N 3.33Å; E769-M771 PolarHBondContact O-N 2.91Å; E769-V772 PolarHBondContact O-N 3.36Å
770	N	29.8	Very low	30.7	Very low	120 Å²	120	124.9 Å²	124.9	64%	0.642	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-61.9	-12.4	-179.9	-69.1	-34.8	0	0	0	115	N768 V772 T774	N768-N770 PolarHBondContact O-N 3.33Å; N770-V772 VanDerWaalsContact C-N 3.31Å; N770-V772 PolarHBondContact O-N 3.09Å; N770-T774 WeakPolarHBondContact O-CG2 3.45Å; N770-T774 PolarHBondContact O-OG1 2.92Å
771	M	26.7	Very low	28.9	Very low	150 Å²	150	125.2 Å²	125.2	74%	0.739	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-70.9	-18.5	176.6	-83.4	-73.2	159.2	0	0	114.5	N768 E769	N768-M771 PolarHBondContact O-N 3.35Å; E769-M771 PolarHBondContact O-N 2.91Å
772	V	28.9	Very low	27.6	Very low	121 Å²	121	129.2 Å²	129.2	73%	0.733	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-31.3	-176.6	-177.7	0	0	0	0	112.8	E769 N770	E769-V772 PolarHBondContact O-N 3.36Å; N770-V772 VanDerWaalsContact C-N 3.31Å; N770-V772 PolarHBondContact O-N 3.09Å
773	N	26.3	Very low	26.7	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	74%	0.736	S	S	*	*	S	Bend	trans	-97.6	0.3	-170.1	-70.5	-26.4	0	0	0	115.1	A775	N773-A775 VanDerWaalsContact C-N 3.32Å; N773-A775 PolarHBondContact O-N 3.39Å
774	T	25	Very low	26.4	Very low	112 Å²	112	133.6 Å²	133.6	69%	0.687	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	7.6	-173.2	34.8	0	0	0	0	115.1	N770	N770-T774 WeakPolarHBondContact O-CG2 3.45Å; N770-T774 PolarHBondContact O-OG1 2.92Å
775	A	26.5	Very low	25.8	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-17.8	175.5	0	0	0	0	0	114.4	N773	N773-A775 VanDerWaalsContact C-N 3.32Å; N773-A775 PolarHBondContact O-N 3.39Å
776	T	25.2	Very low	25.7	Very low	117 Å²	117	141.1 Å²	141.1	72%	0.718	76%	0.756	S	S	*	*	S	Bend	trans	-140.5	49.9	-165	59.1	0	0	0	0	116.3
777	T	22.5	Very low	25.2	Very low	119 Å²	119	136.3 Å²	136.3	73%	0.73	76%	0.76	S	S	*	*	S	Bend	trans	-156.6	128.4	151.7	7.2	0	0	0	0	114.1
778	T	25.7	Very low	24.9	Very low	130 Å²	130	134 Å²	134	80%	0.798	77%	0.767	S	S	*	*			trans	41.2	133.5	147.8	50.3	0	0	0	0	121.6	D780	T778-D780 PolarHBondContact O-N 3.49Å
779	Q	25.5	Very low	24.7	Very low	192 Å²	192	131.9 Å²	131.9	90%	0.897	76%	0.761	S	S	*	*			trans	-57.3	124.1	166	-60.6	160.5	-57.9	0	0	111.7
780	D	23.6	Very low	24.5	Very low	159 Å²	159	125.7 Å²	125.7	85%	0.85	74%	0.737	S	S	*	*			trans	-161.3	155.9	137.3	-114.3	-29.9	0	0	0	110.9	T778 L782	T778-D780 PolarHBondContact O-N 3.49Å; D780-L782 PolarHBondContact O-N 3.33Å
781	T	25.9	Very low	24.3	Very low	131 Å²	131	121.8 Å²	121.8	80%	0.804	72%	0.717	S	S	*	*			trans	-80.2	117.1	-167.3	53.9	0	0	0	0	113.6
782	L	22.2	Very low	24.2	Very low	149 Å²	149	117.2 Å²	117.2	78%	0.78	70%	0.695	S	S	*	*			trans	-127.9	110.1	166.6	-78	173.9	0	0	0	111.8	D780 M784	D780-L782 PolarHBondContact O-N 3.33Å; L782-M784 VanDerWaalsContact C-N 3.33Å; L782-M784 PolarHBondContact O-N 2.98Å
783	N	22.3	Very low	24.2	Very low	165 Å²	165	112.3 Å²	112.3	88%	0.882	66%	0.664	S	S	*	*			trans	-71.3	84.6	170.5	-76.9	-17.4	0	0	0	110.5	N785	N783-N785 PolarHBondContact O-N 3.19Å
784	M	22.1	Very low	24.2	Very low	145 Å²	145	106.3 Å²	106.3	71%	0.714	63%	0.632	S	S	*	*			trans	-78	105.4	167	-71.9	-59.7	-145.4	0	0	109.9	L782 F786	L782-M784 VanDerWaalsContact C-N 3.33Å; L782-M784 PolarHBondContact O-N 2.98Å; M784-F786 WeakPolarHBondContact O-CD2 3.4Å; M784-F786 PolarHBondContact O-N 3.1Å
785	N	20.4	Very low	24.3	Very low	163 Å²	163	101.1 Å²	101.1	87%	0.872	60%	0.6	S	S	*	*			trans	-65.3	100.2	170.1	-83.4	-17.2	0	0	0	109.8	N783 G787	N783-N785 PolarHBondContact O-N 3.19Å; N785-G787 PolarHBondContact O-N 3.35Å
786	F	24.9	Very low	24.3	Very low	181 Å²	181	102.7 Å²	102.7	79%	0.794	59%	0.586	S	S	*	*			trans	-64.7	115.2	169.7	-75.4	-89.5	0	0	0	109.8	M784 G788	M784-F786 WeakPolarHBondContact O-CD2 3.4Å; M784-F786 PolarHBondContact O-N 3.1Å; F786-G788 PolarHBondContact O-N 3Å
787	G	20.4	Very low	24.4	Very low	74 Å²	74	98.6 Å²	98.6	76%	0.763	56%	0.562	S	S	*	*			trans	-61.7	124.4	170.9	0	0	0	0	0	110	N785 S789	N785-G787 PolarHBondContact O-N 3.35Å; G787-S789 PolarHBondContact O-N 2.92Å
788	G	22.1	Very low	24.6	Very low	84 Å²	84	94.3 Å²	94.3	87%	0.866	54%	0.536	S	S	*	.	S	Bend	trans	-64.9	104.5	-169.6	0	0	0	0	0	113.8	F786	F786-G788 PolarHBondContact O-N 3Å
789	S	23.5	Very low	24.5	Very low	68 Å²	68	90.1 Å²	90.1	48%	0.476	52%	0.518	S	S	.	.			trans	-151.4	64.9	165.8	-164.7	0	0	0	0	110.1	S761 L762 G787	S761-S789 PolarHBondContact O-OG 3.38Å; L762-S789 WeakPolarHBondContact CD2-O 3.29Å; G787-S789 PolarHBondContact O-N 2.92Å
790	S	25.5	Very low	24.5	Very low	38 Å²	38	83.9 Å²	83.9	27%	0.266	49%	0.487	S	S	.	.			trans	-103.2	102.1	-176.7	43.7	0	0	0	0	111.7	L627 T630	L627-S790 WeakPolarHBondContact O-CB 3.24Å; T630-S790 PolarHBondContact OG1-OG 2.83Å
791	T	24.4	Very low	24.5	Very low	38 Å²	38	80.2 Å²	80.2	23%	0.233	47%	0.468	C	S	.	.			trans	-124.3	54.2	171.6	53.9	0	0	0	0	111.2	K423 S761 L762 E793	K423-T791 PolarHBondContact NZ-O 3.3Å; S761-T791 PolarHBondContact OG-OG1 3.03Å; L762-T791 WeakPolarHBondContact CD1-OG1 3.2Å; L762-T791 WeakPolarHBondContact CD2-OG1 3.46Å; L762-T791 WeakPolarHBondContact CG-OG1 3.42Å; T791-E793 VanDerWaalsContact C-N 3.34Å; T791-E793 PolarHBondContact O-N 3.27Å
792	M	25.4	Very low	24.4	Very low	54 Å²	54	77.5 Å²	77.5	27%	0.266	45%	0.451	S	S	.	.			trans	-90.4	17.6	-173.8	-70.3	-160.1	62.5	0	0	115.8	K423 L627 D631 A794	K423-M792 VanDerWaalsContact NZ-CA 3.34Å; K423-M792 PolarHBondContact NZ-O 3.45Å; L627-M792 HydrophobicContact CB-CB 4.08Å; L627-M792 HydrophobicContact CD2-CB 3.62Å; L627-M792 HydrophobicContact CD2-CE 4.32Å; L627-M792 HydrophobicContact CG-CB 4.49Å; D631-M792 PolarHBondContact OD2-N 3.2Å; M792-A794 PolarHBondContact O-N 2.96Å
793	E	28.3	Very low	24.6	Very low	18 Å²	18	73.5 Å²	73.5	8%	0.084	43%	0.433	C	S	.	.			trans	-30.6	125.3	177.3	-53.2	170.6	172.8	0	0	113.9	I422 K423 K425 D631 F632 T791	I422-E793 CarbonylContact C-O 3.54Å; I422-E793 CarbonylContact O-C 3.53Å; K423-E793 VanDerWaalsContact C-OE2 3.26Å; K423-E793 WeakPolarHBondContact CA-OE2 3.34Å; K423-E793 HydrophobicContact CD-CB 4.26Å; K423-E793 PolarHBondContact NZ-O 2.65Å; K425-E793 IonicContact NZ-OE1 3.2Å; K425-E793 IonicContact NZ-OE2 2.79Å; K425-E793 PolarHBondContact NZ-OE2 3.2Å; K425-E793 VanDerWaalsContact NZ-OE2 3.16Å; D631-E793 WeakPolarHBondContact OD2-CA 3.38Å; D631-E793 PolarHBondContact OD2-N 2.9Å; F632-E793 HydrophobicContact CD1-CB 3.97Å; F632-E793 HydrophobicContact CD1-CG 4.3Å; F632-E793 HydrophobicContact CE1-CB 3.92Å; T791-E793 VanDerWaalsContact C-N 3.34Å; T791-E793 PolarHBondContact O-N 3.27Å
794	A	26.6	Very low	24.7	Very low	0 Å²	0	68.1 Å²	68.1	0%	0	41%	0.406	C	S	.	.			trans	-148.7	99.3	-173.7	0	0	0	0	0	116	Y380 I422 I590 K594 F632 E633 M792	Y380-A794 HydrophobicContact CD2-CB 3.94Å; Y380-A794 HydrophobicContact CE2-CB 3.22Å; I422-A794 HydrophobicContact CG1-CB 4.31Å; I422-A794 WeakPolarHBondContact O-CA 3.37Å; I422-A794 PolarHBondContact O-N 2.79Å; I590-A794 HydrophobicContact CD1-CB 4.15Å; K594-A794 PolarHBondContact NZ-O 3.25Å; F632-A794 VanDerWaalsContact CE1-N 3.26Å; F632-A794 VanDerWaalsContact CZ-C 3.49Å; F632-A794 WeakPolarHBondContact CZ-O 3.18Å; E633-A794 WeakPolarHBondContact CG-O 3.2Å; E633-A794 VanDerWaalsContact OE1-O 3.08Å; M792-A794 PolarHBondContact O-N 2.96Å
795	S	26.7	Very low	24.8	Very low	3 Å²	3	63.3 Å²	63.3	2%	0.021	39%	0.387	C	S	.	.			trans	-55	-169.8	179.1	78.9	0	0	0	0	120	I421 I422 K594	I421-S795 WeakPolarHBondContact CG2-OG 3.46Å; I421-S795 WeakPolarHBondContact O-CB 3.28Å; I422-S795 WeakPolarHBondContact CA-OG 3.45Å; I422-S795 WeakPolarHBondContact CD1-OG 3.45Å; I422-S795 PolarHBondContact N-OG 3.18Å; I422-S795 PolarHBondContact O-N 3.02Å; K594-S795 PolarHBondContact NZ-O 3.06Å
796	R	27	Very low	25.1	Very low	128 Å²	128	56.7 Å²	56.7	48%	0.483	36%	0.355	S	S	.	.	S	Bend	trans	64.1	66.6	-172.5	-76.8	-165	171.1	-152.8	-2	114.4	K594	K594-R796 VanDerWaalsContact NZ-C 3.3Å; K594-R796 PolarHBondContact NZ-O 3.16Å
797	S	28	Very low	25.2	Very low	31 Å²	31	47.8 Å²	47.8	22%	0.217	32%	0.323	C	S	.	.			trans	170.9	91.2	132.5	54.6	0	0	0	0	108.1	K594 G799	K594-S797 WeakPolarHBondContact CD-OG 3.2Å; S797-G799 PolarHBondContact O-N 3.04Å
798	T	25.9	Very low	25.5	Very low	30 Å²	30	45.8 Å²	45.8	18%	0.184	29%	0.289	C	S	.	.			trans	-68.4	97.3	151.1	31.9	0	0	0	0	106.1	Y502 Y800	Y502-T798 PolarHBondContact OH-O 3.35Å; T798-Y800 VanDerWaalsContact C-N 3.29Å; T798-Y800 HydrophobicContact CG2-CE2 4.43Å; T798-Y800 PolarHBondContact O-N 3.32Å; T798-Y800 VanDerWaalsContact O-N 3.17Å
799	G	23.7	Very low	25.8	Very low	41 Å²	41	42.6 Å²	42.6	42%	0.423	24%	0.241	S	C	.	.			trans	-63.1	104.9	147.8	0	0	0	0	0	105.7	S797	S797-G799 PolarHBondContact O-N 3.04Å
800	Y	24.8	Very low	26	Very low	62 Å²	62	40.3 Å²	40.3	24%	0.243	22%	0.22	C	C	.	.			trans	-89.7	0	156.5	-96.8	-78.4	0	0	0	106.7	D466 Y505 V506 Y509 S675 Y679 T798	D466-Y800 PolarHBondContact OD2-OH 3.36Å; Y505-Y800 PolarHBondContact OH-O 3.22Å; V506-Y800 HydrophobicContact CG1-CD2 3.7Å; V506-Y800 HydrophobicContact CG1-CE2 4.38Å; V506-Y800 HydrophobicContact CG1-CG 4.18Å; Y509-Y800 WeakPolarHBondContact CE2-O 3.27Å; Y509-Y800 PolarHBondContact OH-OXT 3.28Å; S675-Y800 WeakPolarHBondContact CB-OH 3.27Å; Y679-Y800 HydrophobicContact CE2-CD1 4.24Å; Y679-Y800 HydrophobicContact CE2-CE1 4.46Å; Y679-Y800 WeakPolarHBondContact OH-CD1 3.08Å; Y679-Y800 PolarHBondContact OH-OXT 2.68Å; T798-Y800 VanDerWaalsContact C-N 3.29Å; T798-Y800 HydrophobicContact CG2-CE2 4.43Å; T798-Y800 PolarHBondContact O-N 3.32Å; T798-Y800 VanDerWaalsContact O-N 3.17Å

Retrieved 800 of 800 residues in 587.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).