A0A096MB61_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A096MB61, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 662 aa.

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	29.3	Very low	32.3	Very low	192 Å²	192	173.7 Å²	173.7	95%	0.946	85%	0.848	S	S	*	*				0	144.4	0	-67.1	171.7	176.8	0	0	110.3
2	K	27.3	Very low	32.4	Very low	195 Å²	195	168.9 Å²	168.9	85%	0.848	85%	0.845	S	S	*	*			trans	-125.6	134.1	163.3	-75.4	-175	176.4	-179.1	0	108.3
3	K	28.9	Very low	32.2	Very low	216 Å²	216	162.7 Å²	162.7	94%	0.939	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-78.4	121.4	178.3	-67.1	179.9	178.6	178.8	0	108.8
4	F	32.3	Very low	31.9	Very low	196 Å²	196	156.3 Å²	156.3	86%	0.86	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-75.7	125.2	169.8	-74.4	-90.4	0	0	0	109.1
5	S	29.1	Very low	31.8	Very low	119 Å²	119	158.3 Å²	158.3	83%	0.832	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-74.6	132.3	176.9	-166.8	0	0	0	0	110.2
6	R	36.1	Very low	31.6	Very low	231 Å²	231	153.6 Å²	153.6	87%	0.872	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-70.9	167.6	159.9	-75.5	179.5	167.5	170.5	-5.2	109.8
7	M	39.8	Very low	31.5	Very low	133 Å²	133	149.3 Å²	149.3	66%	0.655	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-52.2	132.3	173.8	-68.5	178.5	173.3	0	0	111
8	P	30.5	Very low	31.5	Very low	122 Å²	122	146.6 Å²	146.6	79%	0.792	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-69.1	137.6	164.5	30.4	-32.7	0	0	0	109.4
9	K	34.1	Very low	31.5	Very low	192 Å²	192	145.4 Å²	145.4	84%	0.835	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-84.1	132.5	164.4	-70	-176.7	176.7	-177.8	0	108.3
10	S	36.8	Very low	31.7	Very low	118 Å²	118	142 Å²	142	83%	0.825	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-82	124.9	168.7	52	0	0	0	0	109.9
11	E	31.3	Very low	31.7	Very low	197 Å²	197	142.5 Å²	142.5	92%	0.921	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-86.9	136.8	172.3	-64.5	-175.3	130.7	0	0	111
12	S	33.6	Very low	32	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	84%	0.842	S	S	*	*			trans	-150.7	108.8	165.8	59.3	0	0	0	0	107.9
13	G	29.2	Very low	32.4	Very low	88 Å²	88	134.7 Å²	134.7	91%	0.907	84%	0.841	S	S	*	*			trans	-81.7	157.4	-173.3	0	0	0	0	0	114
14	G	28.2	Very low	32.9	Very low	73 Å²	73	128.9 Å²	128.9	75%	0.753	83%	0.828	S	S	*	*			trans	162.9	76	174.7	0	0	0	0	0	115.8
15	L	30.1	Very low	33.4	Very low	186 Å²	186	124.2 Å²	124.2	97%	0.974	82%	0.819	S	S	*	*			trans	37.6	123.8	150.1	-59.2	169.3	0	0	0	120.7
16	G	29.4	Very low	34.5	Very low	84 Å²	84	120.9 Å²	120.9	87%	0.866	80%	0.803	S	S	*	*			trans	134.3	96.3	141	0	0	0	0	0	119.7
17	G	29.1	Very low	35.1	Very low	80 Å²	80	112.4 Å²	112.4	83%	0.825	78%	0.777	S	S	*	*			trans	77	97.3	131.4	0	0	0	0	0	122.1
18	A	31.2	Very low	36	Very low	100 Å²	100	109.6 Å²	109.6	83%	0.826	77%	0.771	S	S	*	*			trans	77.7	153.7	140.9	0	0	0	0	0	122.4
19	S	32.5	Very low	38	Very low	125 Å²	125	106.7 Å²	106.7	87%	0.874	75%	0.753	S	S	*	*			trans	66.4	107	165.2	-60.1	0	0	0	0	117.9
20	G	35.7	Very low	40.2	Very low	77 Å²	77	99.7 Å²	99.7	79%	0.794	72%	0.722	S	S	*	*			trans	-85.6	157.1	-168.3	0	0	0	0	0	116.9
21	T	31.7	Very low	42.6	Very low	152 Å²	152	98.4 Å²	98.4	93%	0.933	70%	0.702	S	S	*	*			trans	-157.7	140.3	149.9	8.8	0	0	0	0	107.9
22	S	34.5	Very low	45.4	Very low	106 Å²	106	91.5 Å²	91.5	74%	0.741	68%	0.683	S	S	*	*			trans	-101	148.8	-172.9	40.9	0	0	0	0	113.9
23	S	37	Very low	48.4	Very low	118 Å²	118	90.1 Å²	90.1	83%	0.825	66%	0.662	S	S	*	*	S	Bend	trans	63.3	48.3	156.8	46.6	0	0	0	0	119.9
24	S	38.2	Very low	51.5	Low	94 Å²	94	90 Å²	90	66%	0.657	64%	0.644	S	S	*	*			trans	-125.7	-0.4	160.2	67.2	0	0	0	0	114.9	G26	S24-G26 PolarHBondContact O-N 3.48Å
25	S	42.7	Very low	54.8	Low	98 Å²	98	87.6 Å²	87.6	69%	0.685	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	5.2	-159.2	55.1	0	0	0	0	117.7
26	G	51.8	Low	58	Low	48 Å²	48	81.8 Å²	81.8	50%	0.495	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-53.8	172.3	0	0	0	0	0	113	S24 S29	S24-G26 PolarHBondContact O-N 3.48Å; G26-S29 WeakPolarHBondContact O-CB 3.43Å
27	V	48.8	Very low	61.2	Low	53 Å²	53	77.8 Å²	77.8	32%	0.321	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-42.8	-171.5	-179.7	0	0	0	0	111.6	S29 Y30 F31 L47	V27-S29 PolarHBondContact O-N 2.92Å; V27-Y30 PolarHBondContact O-N 3.41Å; V27-Y30 VanDerWaalsContact O-N 3.1Å; V27-F31 HydrophobicContact CG1-CE1 4.49Å; V27-F31 HydrophobicContact CG1-CE2 4.38Å; V27-F31 HydrophobicContact CG1-CZ 3.77Å; V27-L47 HydrophobicContact CG1-CB 3.99Å; V27-L47 HydrophobicContact CG1-CD2 3.66Å; V27-L47 HydrophobicContact CG1-CG 4.45Å; V27-L47 HydrophobicContact CG2-CD2 4.02Å
28	S	59.4	Low	64.3	Low	75 Å²	75	76.2 Å²	76.2	52%	0.524	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-57.7	-22.9	179.5	-168	0	0	0	0	113.5	Y30	S28-Y30 PolarHBondContact O-N 2.87Å; S28-Y30 VanDerWaalsContact O-N 3.14Å
29	S	71.8	Confident	67.4	Low	61 Å²	61	80.4 Å²	80.4	43%	0.427	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-63.8	-16.8	177.5	-164.7	0	0	0	0	114.1	G26 V27 K33	G26-S29 WeakPolarHBondContact O-CB 3.43Å; V27-S29 PolarHBondContact O-N 2.92Å; S29-K33 WeakPolarHBondContact O-CD 3.48Å; S29-K33 WeakPolarHBondContact O-CE 3.31Å; S29-K33 PolarHBondContact O-NZ 2.77Å; S29-K33 PolarHBondContact OG-NZ 3.24Å
30	Y	80.7	Confident	70.5	Confident	45 Å²	45	77.6 Å²	77.6	18%	0.176	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-97.5	-19.7	-174.3	-65.1	-71.3	0	0	0	115	V27 S28 K33 V44 F57 R71	V27-Y30 PolarHBondContact O-N 3.41Å; V27-Y30 VanDerWaalsContact O-N 3.1Å; S28-Y30 PolarHBondContact O-N 2.87Å; S28-Y30 VanDerWaalsContact O-N 3.14Å; Y30-K33 HydrophobicContact CD1-CD 4.21Å; Y30-K33 WeakPolarHBondContact O-CB 3.5Å; Y30-K33 PolarHBondContact O-N 2.95Å; Y30-V44 WeakPolarHBondContact O-CB 3.49Å; Y30-V44 WeakPolarHBondContact O-CG1 3.35Å; Y30-F57 HydrophobicContact CD1-CZ 4.21Å; Y30-F57 HydrophobicContact CD2-CE1 4.17Å; Y30-F57 HydrophobicContact CD2-CZ 4.08Å; Y30-F57 AromaticContact CG-CE1 3.92Å; Y30-F57 HydrophobicContact CG-CE1 3.92Å; Y30-F57 AromaticContact CG-CZ 3.83Å; Y30-F57 HydrophobicContact CG-CZ 3.83Å; Y30-R71 VanDerWaalsContact CE1-NH1 3.31Å
31	F	88.6	Confident	73.4	Confident	91 Å²	91	79.8 Å²	79.8	40%	0.399	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	136.2	-178.5	-52.4	-42.9	0	0	0	111.1	V27 K33 V44 E45	V27-F31 HydrophobicContact CG1-CE1 4.49Å; V27-F31 HydrophobicContact CG1-CE2 4.38Å; V27-F31 HydrophobicContact CG1-CZ 3.77Å; F31-K33 PolarHBondContact O-N 3.2Å; F31-V44 HydrophobicContact CD1-CG1 4.24Å; F31-E45 WeakPolarHBondContact CD1-O 3.29Å
32	G	90.2	Very high	76.6	Confident	51 Å²	51	72.6 Å²	72.6	53%	0.526	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	-6.1	-174.6	0	0	0	0	0	115.5	V44	G32-V44 PolarHBondContact N-O 3.41Å
33	K	94.7	Very high	79.6	Confident	87 Å²	87	70.2 Å²	70.2	38%	0.378	43%	0.426	S	S	.	.			trans	-68.9	134.5	173.1	-75.1	-174.3	173.4	146.8	0	110.7	S29 Y30 F31 F35 T43 V44	S29-K33 WeakPolarHBondContact O-CD 3.48Å; S29-K33 WeakPolarHBondContact O-CE 3.31Å; S29-K33 PolarHBondContact O-NZ 2.77Å; S29-K33 PolarHBondContact OG-NZ 3.24Å; Y30-K33 HydrophobicContact CD1-CD 4.21Å; Y30-K33 WeakPolarHBondContact O-CB 3.5Å; Y30-K33 PolarHBondContact O-N 2.95Å; F31-K33 PolarHBondContact O-N 3.2Å; K33-F35 HydrophobicContact CB-CE2 3.95Å; K33-T43 WeakPolarHBondContact O-CA 3.48Å; K33-V44 PolarHBondContact O-N 3.2Å
34	V	96	Very high	82.5	Confident	86 Å²	86	64.8 Å²	64.8	52%	0.521	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.6	177.1	-175.1	0	0	0	0	109.6	Q41 V42 T43	V34-Q41 HydrophobicContact CG1-CB 4.37Å; V34-V42 CarbonylContact C-O 3.53Å; V34-V42 WeakPolarHBondContact CA-O 3.43Å; V34-T43 HydrophobicContact CG2-CG2 4.35Å
35	F	96.5	Very high	85.2	Confident	23 Å²	23	62.9 Å²	62.9	10%	0.101	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.3	174.3	-68.6	-90.9	0	0	0	110.3	K33 V37 Q41 V42 V44 L69 L118	K33-F35 HydrophobicContact CB-CE2 3.95Å; F35-V37 HydrophobicContact CB-CG2 4.29Å; F35-Q41 WeakPolarHBondContact O-CA 3.46Å; F35-V42 HydrophobicContact CB-CG2 4.23Å; F35-V42 PolarHBondContact N-O 3.32Å; F35-V42 PolarHBondContact O-N 2.93Å; F35-V44 HydrophobicContact CD2-CG2 3.93Å; F35-V44 HydrophobicContact CE2-CG2 3.8Å; F35-L69 HydrophobicContact CB-CD2 4.25Å; F35-L69 HydrophobicContact CD2-CD2 3.95Å; F35-L69 HydrophobicContact CG-CD2 4.15Å; F35-L118 HydrophobicContact CB-CD1 4.28Å; F35-L118 HydrophobicContact CD1-CD1 3.9Å; F35-L118 HydrophobicContact CD1-CD2 4.42Å; F35-L118 HydrophobicContact CG-CD1 4.47Å
36	A	96.7	Very high	87.7	Confident	64 Å²	64	62.7 Å²	62.7	53%	0.529	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.6	165	0	0	0	0	0	109	Y40	A36-Y40 WeakPolarHBondContact CA-O 3.47Å
37	V	97.5	Very high	89.7	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	97.9	178.7	-166.1	0	0	0	0	108.6	F35 R39 Y40 V42 L69 L118 L120	F35-V37 HydrophobicContact CB-CG2 4.29Å; V37-R39 PolarHBondContact O-N 3.09Å; V37-R39 VanDerWaalsContact O-N 3.13Å; V37-Y40 PolarHBondContact N-O 3.38Å; V37-Y40 PolarHBondContact O-N 2.91Å; V37-V42 HydrophobicContact CG2-CG2 4.33Å; V37-L69 HydrophobicContact CG2-CD1 3.92Å; V37-L118 HydrophobicContact CG1-CB 4.01Å; V37-L118 HydrophobicContact CG2-CB 4Å; V37-L118 HydrophobicContact CG2-CD1 3.9Å; V37-L120 HydrophobicContact CB-CB 4.36Å; V37-L120 HydrophobicContact CG1-CB 3.93Å
38	G	95	Very high	91.8	Very high	47 Å²	47	64 Å²	64	49%	0.485	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-113.8	-173.4	0	0	0	0	0	110.9	T106	G38-T106 PolarHBondContact N-OG1 3.2Å
39	R	95.3	Very high	93.2	Very high	188 Å²	188	62.4 Å²	62.4	71%	0.709	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-5.2	179.6	-61.6	163.4	-64.1	151	9.1	114.2	V37 L103 D104	V37-R39 PolarHBondContact O-N 3.09Å; V37-R39 VanDerWaalsContact O-N 3.13Å; R39-L103 PolarHBondContact NH2-O 3.04Å; R39-D104 IonicContact CZ-OD2 2.81Å; R39-D104 PolarHBondContact N-OD2 3.41Å; R39-D104 VanDerWaalsContact N-OD2 3.1Å; R39-D104 IonicContact NE-OD2 3.82Å; R39-D104 PolarHBondContact NE-OD2 3.44Å; R39-D104 IonicContact NH2-OD2 2.84Å; R39-D104 PolarHBondContact NH2-OD2 2.91Å; R39-D104 VanDerWaalsContact NH2-OD2 3.17Å
40	Y	97.1	Very high	94	Very high	65 Å²	65	65.9 Å²	65.9	26%	0.255	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144	-176.3	-61.6	-94.4	0	0	0	111.5	A36 V37 T61 L103 D104 L120	A36-Y40 WeakPolarHBondContact CA-O 3.47Å; V37-Y40 PolarHBondContact N-O 3.38Å; V37-Y40 PolarHBondContact O-N 2.91Å; Y40-T61 HydrophobicContact CD1-CG2 3.83Å; Y40-T61 HydrophobicContact CE1-CG2 4.39Å; Y40-L103 HydrophobicContact CE2-CB 4.21Å; Y40-D104 HydrophobicContact CD2-CB 3.66Å; Y40-D104 HydrophobicContact CE2-CB 3.86Å; Y40-L120 HydrophobicContact CD1-CD2 4.34Å; Y40-L120 HydrophobicContact CD2-CD2 3.95Å; Y40-L120 HydrophobicContact CG-CD2 3.79Å
41	Q	97.1	Very high	93.7	Very high	124 Å²	124	65.5 Å²	65.5	58%	0.579	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.3	155.1	-66.4	-175.1	16.8	0	0	107.9	V34 F35 H62	V34-Q41 HydrophobicContact CG1-CB 4.37Å; F35-Q41 WeakPolarHBondContact O-CA 3.46Å; Q41-H62 PolarHBondContact O-N 3.13Å
42	V	98.1	Very high	93	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.4	-176.7	-57.8	0	0	0	0	111.5	V34 F35 V37 A59 R60 T61 L69 L120	V34-V42 CarbonylContact C-O 3.53Å; V34-V42 WeakPolarHBondContact CA-O 3.43Å; F35-V42 HydrophobicContact CB-CG2 4.23Å; F35-V42 PolarHBondContact N-O 3.32Å; F35-V42 PolarHBondContact O-N 2.93Å; V37-V42 HydrophobicContact CG2-CG2 4.33Å; V42-A59 HydrophobicContact CB-CB 3.99Å; V42-A59 HydrophobicContact CG2-CB 4.04Å; V42-R60 CarbonylContact C-O 3.58Å; V42-R60 VanDerWaalsContact CA-O 3.26Å; V42-R60 WeakPolarHBondContact CA-O 3.3Å; V42-T61 HydrophobicContact CG1-CG2 3.98Å; V42-L69 HydrophobicContact CG2-CD2 4.07Å; V42-L120 HydrophobicContact CG1-CD1 4Å; V42-L120 HydrophobicContact CG1-CD2 3.83Å; V42-L120 HydrophobicContact CG2-CD1 4.12Å
43	T	97.9	Very high	92.4	Very high	57 Å²	57	70.2 Å²	70.2	35%	0.35	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.5	175.1	-50.1	0	0	0	0	109.3	K33 V34 A59 R60	K33-T43 WeakPolarHBondContact O-CA 3.48Å; V34-T43 HydrophobicContact CG2-CG2 4.35Å; T43-A59 CarbonylContact O-C 3.28Å; T43-A59 WeakPolarHBondContact O-CA 3.36Å; T43-A59 WeakPolarHBondContact O-CB 3.42Å; T43-R60 PolarHBondContact N-O 2.82Å; T43-R60 PolarHBondContact O-N 2.76Å
44	V	97.8	Very high	92.1	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.4	176.7	168.3	0	0	0	0	110.8	Y30 F31 G32 K33 F35 F57 L69	Y30-V44 WeakPolarHBondContact O-CB 3.49Å; Y30-V44 WeakPolarHBondContact O-CG1 3.35Å; F31-V44 HydrophobicContact CD1-CG1 4.24Å; G32-V44 PolarHBondContact N-O 3.41Å; K33-V44 PolarHBondContact O-N 3.2Å; F35-V44 HydrophobicContact CD2-CG2 3.93Å; F35-V44 HydrophobicContact CE2-CG2 3.8Å; V44-F57 HydrophobicContact CG1-CB 4.01Å; V44-F57 HydrophobicContact CG1-CD1 3.61Å; V44-F57 HydrophobicContact CG1-CE1 4.33Å; V44-F57 HydrophobicContact CG1-CG 3.98Å; V44-F57 HydrophobicContact CG2-CB 4.08Å; V44-F57 HydrophobicContact CG2-CD1 4.48Å; V44-F57 HydrophobicContact CG2-CG 4.12Å; V44-L69 HydrophobicContact CG2-CD2 4.24Å
45	E	95.8	Very high	92	Very high	55 Å²	55	64.8 Å²	64.8	26%	0.257	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-54.1	174.8	-53.2	-158.8	119.9	0	0	111.7	F31 L58 R60 R66	F31-E45 WeakPolarHBondContact CD1-O 3.29Å; E45-L58 HydrophobicContact CB-CD2 4.33Å; E45-L58 HydrophobicContact CB-CG 4.17Å; E45-L58 PolarHBondContact N-O 2.65Å; E45-R60 HydrophobicContact CG-CB 4.16Å; E45-R60 IonicContact OE1-CZ 2.67Å; E45-R60 IonicContact OE1-NE 3.75Å; E45-R60 PolarHBondContact OE1-NE 2.71Å; E45-R60 IonicContact OE1-NH2 2.76Å; E45-R60 PolarHBondContact OE1-NH2 3.25Å; E45-R60 IonicContact OE2-CZ 3.93Å; E45-R60 IonicContact OE2-NE 2.72Å; E45-R60 IonicContact OE2-NH2 3.14Å; E45-R60 PolarHBondContact OE2-NH2 2.93Å; E45-R66 IonicContact OE1-NH2 2.68Å; E45-R66 IonicContact OE2-CZ 2.98Å; E45-R66 IonicContact OE2-NE 3.18Å; E45-R66 PolarHBondContact OE2-NE 3.4Å; E45-R66 IonicContact OE2-NH2 3.29Å; E45-R66 PolarHBondContact OE2-NH2 3.08Å
46	E	95.1	Very high	92	Very high	94 Å²	94	65.1 Å²	65.1	44%	0.439	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.7	-167.9	-60.5	166.9	-155.4	0	0	111.2	F57 L58 R66	E46-F57 CarbonylContact O-C 3.52Å; E46-F57 WeakPolarHBondContact O-CA 3.43Å; E46-L58 HydrophobicContact CB-CB 4.12Å; E46-L58 HydrophobicContact CB-CD2 4.34Å; E46-L58 HydrophobicContact CG-CD2 4.29Å; E46-L58 PolarHBondContact N-O 3.39Å; E46-L58 PolarHBondContact O-N 3.28Å; E46-R66 IonicContact OE1-NH2 2.73Å
47	L	94.3	Very high	92	Very high	55 Å²	55	62.1 Å²	62.1	29%	0.288	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.1	168.4	174.5	62.6	0	0	0	108.7	V27 A49 V55 F57	V27-L47 HydrophobicContact CG1-CB 3.99Å; V27-L47 HydrophobicContact CG1-CD2 3.66Å; V27-L47 HydrophobicContact CG1-CG 4.45Å; V27-L47 HydrophobicContact CG2-CD2 4.02Å; L47-A49 WeakPolarHBondContact CD1-O 3.31Å; L47-V55 HydrophobicContact CD1-CG1 3.31Å; L47-F57 HydrophobicContact CD1-CD1 4.28Å; L47-F57 HydrophobicContact CD1-CE1 4.16Å
48	V	92.6	Very high	92	Very high	72 Å²	72	62.2 Å²	62.2	44%	0.436	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-40.9	-179.4	171.6	0	0	0	0	111.5	V56 L58 Y123	V48-V56 WeakPolarHBondContact CA-O 3.36Å; V48-V56 HydrophobicContact CB-CG1 4.4Å; V48-V56 WeakPolarHBondContact CB-O 3.44Å; V48-V56 PolarHBondContact N-O 2.98Å; V48-L58 HydrophobicContact CG2-CB 3.68Å; V48-Y123 HydrophobicContact CG2-CE2 4.04Å
49	A	88.8	Confident	92.2	Very high	43 Å²	43	60 Å²	60	36%	0.355	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	147	175	0	0	0	0	0	111.5	L47 V56	L47-A49 WeakPolarHBondContact CD1-O 3.31Å; A49-V56 HydrophobicContact CB-CB 4.31Å; A49-V56 PolarHBondContact N-O 3.36Å; A49-V56 PolarHBondContact O-N 2.93Å
50	E	88.3	Confident	92.3	Very high	133 Å²	133	55 Å²	55	62%	0.621	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.8	168.8	-176	170.4	172.3	0	0	109.1	V55	E50-V55 HydrophobicContact CG-CG2 4.43Å
51	G	75.6	Confident	92.3	Very high	37 Å²	37	52.2 Å²	52.2	38%	0.381	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	161.8	174.2	0	0	0	0	0	110.3	F53 S54	G51-F53 PolarHBondContact O-N 3.06Å; G51-S54 PolarHBondContact N-O 2.94Å; G51-S54 PolarHBondContact O-N 3.05Å; G51-S54 VanDerWaalsContact O-N 3.11Å; G51-S54 VanDerWaalsContact O-O 3.08Å
52	G	73.1	Confident	92	Very high	79 Å²	79	53.5 Å²	53.5	81%	0.814	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-13.8	-167	0	0	0	0	0	117.5
53	F	77.4	Confident	91.8	Very high	163 Å²	163	57.2 Å²	57.2	72%	0.715	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	-2.8	177.4	-51.5	-72.9	0	0	0	114.2	G51	G51-F53 PolarHBondContact O-N 3.06Å
54	S	89.2	Confident	91.6	Very high	31 Å²	31	56.2 Å²	56.2	22%	0.217	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	137.2	-171.1	64.1	0	0	0	0	111.9	G51 R71 M72	G51-S54 PolarHBondContact N-O 2.94Å; G51-S54 PolarHBondContact O-N 3.05Å; G51-S54 VanDerWaalsContact O-N 3.11Å; G51-S54 VanDerWaalsContact O-O 3.08Å; S54-R71 WeakPolarHBondContact CA-O 3.16Å; S54-M72 VanDerWaalsContact CB-CG 3.47Å
55	V	93.8	Very high	91.5	Very high	27 Å²	27	60.2 Å²	60.2	16%	0.164	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.2	173	-166.7	0	0	0	0	108.9	L47 E50 F57 R71	L47-V55 HydrophobicContact CD1-CG1 3.31Å; E50-V55 HydrophobicContact CG-CG2 4.43Å; V55-F57 HydrophobicContact CB-CE2 3.85Å; V55-F57 HydrophobicContact CB-CZ 4.02Å; V55-F57 HydrophobicContact CG1-CD2 4.29Å; V55-F57 HydrophobicContact CG1-CE1 3.88Å; V55-F57 HydrophobicContact CG1-CE2 3.63Å; V55-F57 HydrophobicContact CG1-CZ 3.41Å; V55-F57 VanDerWaalsContact CG1-CZ 3.41Å; V55-R71 PolarHBondContact N-O 3.33Å; V55-R71 PolarHBondContact O-N 3.42Å
56	V	96.1	Very high	91.6	Very high	30 Å²	30	62.3 Å²	62.3	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.3	176.4	-174.3	0	0	0	0	109.1	V48 A49 A68 L69 K70	V48-V56 WeakPolarHBondContact CA-O 3.36Å; V48-V56 HydrophobicContact CB-CG1 4.4Å; V48-V56 WeakPolarHBondContact CB-O 3.44Å; V48-V56 PolarHBondContact N-O 2.98Å; A49-V56 HydrophobicContact CB-CB 4.31Å; A49-V56 PolarHBondContact N-O 3.36Å; A49-V56 PolarHBondContact O-N 2.93Å; V56-A68 HydrophobicContact CG1-CB 4.39Å; V56-L69 WeakPolarHBondContact CA-O 3.29Å; V56-K70 HydrophobicContact CG2-CB 4.26Å; V56-K70 HydrophobicContact CG2-CG 4.18Å
57	F	97.4	Very high	91.7	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.009	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	148.9	177.5	-58.4	-83.3	0	0	0	111.2	Y30 V44 E46 L47 V55 A68 L69 R71	Y30-F57 HydrophobicContact CD1-CZ 4.21Å; Y30-F57 HydrophobicContact CD2-CE1 4.17Å; Y30-F57 HydrophobicContact CD2-CZ 4.08Å; Y30-F57 AromaticContact CG-CE1 3.92Å; Y30-F57 HydrophobicContact CG-CE1 3.92Å; Y30-F57 AromaticContact CG-CZ 3.83Å; Y30-F57 HydrophobicContact CG-CZ 3.83Å; V44-F57 HydrophobicContact CG1-CB 4.01Å; V44-F57 HydrophobicContact CG1-CD1 3.61Å; V44-F57 HydrophobicContact CG1-CE1 4.33Å; V44-F57 HydrophobicContact CG1-CG 3.98Å; V44-F57 HydrophobicContact CG2-CB 4.08Å; V44-F57 HydrophobicContact CG2-CD1 4.48Å; V44-F57 HydrophobicContact CG2-CG 4.12Å; E46-F57 CarbonylContact O-C 3.52Å; E46-F57 WeakPolarHBondContact O-CA 3.43Å; L47-F57 HydrophobicContact CD1-CD1 4.28Å; L47-F57 HydrophobicContact CD1-CE1 4.16Å; V55-F57 HydrophobicContact CB-CE2 3.85Å; V55-F57 HydrophobicContact CB-CZ 4.02Å; V55-F57 HydrophobicContact CG1-CD2 4.29Å; V55-F57 HydrophobicContact CG1-CE1 3.88Å; V55-F57 HydrophobicContact CG1-CE2 3.63Å; V55-F57 HydrophobicContact CG1-CZ 3.41Å; V55-F57 VanDerWaalsContact CG1-CZ 3.41Å; F57-A68 WeakPolarHBondContact O-CA 3.3Å; F57-L69 HydrophobicContact CB-CB 4.41Å; F57-L69 PolarHBondContact N-O 3.03Å; F57-L69 PolarHBondContact O-N 3.49Å; F57-R71 HydrophobicContact CD2-CB 4.45Å; F57-R71 HydrophobicContact CE2-CB 4.15Å
58	L	97.6	Very high	91.9	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	124.7	153.8	169.8	60.7	0	0	0	106.8	E45 E46 V48 R66 Y123	E45-L58 HydrophobicContact CB-CD2 4.33Å; E45-L58 HydrophobicContact CB-CG 4.17Å; E45-L58 PolarHBondContact N-O 2.65Å; E46-L58 HydrophobicContact CB-CB 4.12Å; E46-L58 HydrophobicContact CB-CD2 4.34Å; E46-L58 HydrophobicContact CG-CD2 4.29Å; E46-L58 PolarHBondContact N-O 3.39Å; E46-L58 PolarHBondContact O-N 3.28Å; V48-L58 HydrophobicContact CG2-CB 3.68Å; L58-R66 HydrophobicContact CD1-CB 3.92Å; L58-R66 HydrophobicContact CD1-CG 3.94Å; L58-Y123 HydrophobicContact CB-CE2 4.27Å; L58-Y123 HydrophobicContact CD1-CD1 4Å; L58-Y123 HydrophobicContact CD1-CD2 3.7Å; L58-Y123 HydrophobicContact CD1-CE1 4.14Å; L58-Y123 HydrophobicContact CD1-CE2 3.86Å; L58-Y123 HydrophobicContact CD1-CG 3.76Å; L58-Y123 HydrophobicContact CG-CE2 4.44Å
59	A	97.9	Very high	92.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	161.6	174.8	0	0	0	0	0	110.6	V42 T43 R66 C67 L69	V42-A59 HydrophobicContact CB-CB 3.99Å; V42-A59 HydrophobicContact CG2-CB 4.04Å; T43-A59 CarbonylContact O-C 3.28Å; T43-A59 WeakPolarHBondContact O-CA 3.36Å; T43-A59 WeakPolarHBondContact O-CB 3.42Å; A59-R66 WeakPolarHBondContact O-CA 3.3Å; A59-C67 PolarHBondContact N-O 2.94Å; A59-C67 PolarHBondContact O-N 3.37Å; A59-C67 VanDerWaalsContact O-O 3.08Å; A59-C67 PolarHBondContact O-SG 2.73Å; A59-L69 HydrophobicContact CB-CB 4.21Å
60	R	97.8	Very high	92.6	Very high	83 Å²	83	51 Å²	51	31%	0.313	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.2	177.6	-168.4	-175.5	-63.9	-90.1	5.7	110.6	V42 T43 E45 G64 V65	V42-R60 CarbonylContact C-O 3.58Å; V42-R60 VanDerWaalsContact CA-O 3.26Å; V42-R60 WeakPolarHBondContact CA-O 3.3Å; T43-R60 PolarHBondContact N-O 2.82Å; T43-R60 PolarHBondContact O-N 2.76Å; E45-R60 HydrophobicContact CG-CB 4.16Å; E45-R60 IonicContact OE1-CZ 2.67Å; E45-R60 IonicContact OE1-NE 3.75Å; E45-R60 PolarHBondContact OE1-NE 2.71Å; E45-R60 IonicContact OE1-NH2 2.76Å; E45-R60 PolarHBondContact OE1-NH2 3.25Å; E45-R60 IonicContact OE2-CZ 3.93Å; E45-R60 IonicContact OE2-NE 2.72Å; E45-R60 IonicContact OE2-NH2 3.14Å; E45-R60 PolarHBondContact OE2-NH2 2.93Å; R60-G64 WeakPolarHBondContact CG-O 3.44Å; R60-G64 PolarHBondContact NH1-O 3.37Å; R60-V65 CarbonylContact C-O 3.43Å; R60-V65 WeakPolarHBondContact CA-O 3.4Å
61	T	96.7	Very high	92.9	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.043	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	160.1	171.2	63.3	0	0	0	0	111.2	Y40 V42 S63 G64 V65	Y40-T61 HydrophobicContact CD1-CG2 3.83Å; Y40-T61 HydrophobicContact CE1-CG2 4.39Å; V42-T61 HydrophobicContact CG1-CG2 3.98Å; T61-S63 PolarHBondContact O-N 3.49Å; T61-S63 VanDerWaalsContact O-N 3.07Å; T61-S63 PolarHBondContact OG1-N 2.8Å; T61-S63 PolarHBondContact OG1-OG 2.59Å; T61-G64 PolarHBondContact O-N 3.07Å; T61-V65 PolarHBondContact N-O 3.01Å; T61-V65 WeakPolarHBondContact OG1-CB 3.43Å; T61-V65 PolarHBondContact OG1-N 3.3Å; T61-V65 VanDerWaalsContact OG1-N 3.12Å; T61-V65 PolarHBondContact OG1-O 3.37Å
62	H	91.6	Very high	93.8	Very high	151 Å²	151	44.1 Å²	44.1	70%	0.699	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.3	170.7	65.4	-101.1	0	0	0	113.6	Q41 G64	Q41-H62 PolarHBondContact O-N 3.13Å; H62-G64 PolarHBondContact O-N 2.91Å
63	S	93.2	Very high	94.8	Very high	79 Å²	79	45.3 Å²	45.3	55%	0.552	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	8	176.1	58.3	0	0	0	0	114.2	T61 V65	T61-S63 PolarHBondContact O-N 3.49Å; T61-S63 VanDerWaalsContact O-N 3.07Å; T61-S63 PolarHBondContact OG1-N 2.8Å; T61-S63 PolarHBondContact OG1-OG 2.59Å; S63-V65 VanDerWaalsContact C-N 3.29Å; S63-V65 PolarHBondContact O-N 3.08Å
64	G	93.8	Very high	95.6	Very high	35 Å²	35	37.9 Å²	37.9	36%	0.361	20%	0.198	S	C	.	.	S	Bend	trans	84.2	-8.3	177	0	0	0	0	0	115.5	R60 T61 H62	R60-G64 WeakPolarHBondContact CG-O 3.44Å; R60-G64 PolarHBondContact NH1-O 3.37Å; T61-G64 PolarHBondContact O-N 3.07Å; H62-G64 PolarHBondContact O-N 2.91Å
65	V	95.9	Very high	95.8	Very high	87 Å²	87	41.8 Å²	41.8	53%	0.527	22%	0.216	S	C	.	.			trans	-72.9	134.3	-177.5	-177.7	0	0	0	0	110.6	R60 T61 S63	R60-V65 CarbonylContact C-O 3.43Å; R60-V65 WeakPolarHBondContact CA-O 3.4Å; T61-V65 PolarHBondContact N-O 3.01Å; T61-V65 WeakPolarHBondContact OG1-CB 3.43Å; T61-V65 PolarHBondContact OG1-N 3.3Å; T61-V65 VanDerWaalsContact OG1-N 3.12Å; T61-V65 PolarHBondContact OG1-O 3.37Å; S63-V65 VanDerWaalsContact C-N 3.29Å; S63-V65 PolarHBondContact O-N 3.08Å
66	R	97.4	Very high	95.7	Very high	100 Å²	100	42.6 Å²	42.6	38%	0.377	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.2	175.6	-78.4	-179.5	157.4	173.8	-12.1	111.8	E45 E46 L58 A59 Y123	E45-R66 IonicContact OE1-NH2 2.68Å; E45-R66 IonicContact OE2-CZ 2.98Å; E45-R66 IonicContact OE2-NE 3.18Å; E45-R66 PolarHBondContact OE2-NE 3.4Å; E45-R66 IonicContact OE2-NH2 3.29Å; E45-R66 PolarHBondContact OE2-NH2 3.08Å; E46-R66 IonicContact OE1-NH2 2.73Å; L58-R66 HydrophobicContact CD1-CB 3.92Å; L58-R66 HydrophobicContact CD1-CG 3.94Å; A59-R66 WeakPolarHBondContact O-CA 3.3Å; R66-Y123 HydrophobicContact CB-CD1 4.38Å
67	C	97.8	Very high	95.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	152.9	-175.5	45.4	0	0	0	0	110.7	A59 L103 L120 M121	A59-C67 PolarHBondContact N-O 2.94Å; A59-C67 PolarHBondContact O-N 3.37Å; A59-C67 VanDerWaalsContact O-O 3.08Å; A59-C67 PolarHBondContact O-SG 2.73Å; C67-L103 HydrophobicContact CB-CD1 3.92Å; C67-L120 HydrophobicContact CB-CD1 4.04Å; C67-L120 HydrophobicContact CB-CG 4.17Å; C67-M121 CarbonylContact C-O 3.59Å; C67-M121 WeakPolarHBondContact CA-O 3.33Å; C67-M121 VanDerWaalsContact CB-O 3.26Å; C67-M121 WeakPolarHBondContact CB-O 3.28Å
68	A	98.1	Very high	95.2	Very high	12 Å²	12	49.1 Å²	49.1	10%	0.099	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.9	172.9	0	0	0	0	0	109.8	V56 F57 M121	V56-A68 HydrophobicContact CG1-CB 4.39Å; F57-A68 WeakPolarHBondContact O-CA 3.3Å; A68-M121 HydrophobicContact CB-CB 4.39Å; A68-M121 HydrophobicContact CB-CE 4.18Å; A68-M121 PolarHBondContact N-O 3.25Å; A68-M121 PolarHBondContact O-N 3.27Å
69	L	98.1	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	102.7	178.9	175.2	59.4	0	0	0	109.5	F35 V37 V42 V44 V56 F57 A59 L118 L120	F35-L69 HydrophobicContact CB-CD2 4.25Å; F35-L69 HydrophobicContact CD2-CD2 3.95Å; F35-L69 HydrophobicContact CG-CD2 4.15Å; V37-L69 HydrophobicContact CG2-CD1 3.92Å; V42-L69 HydrophobicContact CG2-CD2 4.07Å; V44-L69 HydrophobicContact CG2-CD2 4.24Å; V56-L69 WeakPolarHBondContact CA-O 3.29Å; F57-L69 HydrophobicContact CB-CB 4.41Å; F57-L69 PolarHBondContact N-O 3.03Å; F57-L69 PolarHBondContact O-N 3.49Å; A59-L69 HydrophobicContact CB-CB 4.21Å; L69-L118 HydrophobicContact CD1-CB 4.15Å; L69-L118 HydrophobicContact CD1-CD2 4.32Å; L69-L120 HydrophobicContact CB-CD1 4.09Å; L69-L120 HydrophobicContact CD1-CD1 4.1Å
70	K	97.1	Very high	94.7	Very high	14 Å²	14	51.2 Å²	51.2	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	122.5	170.4	-175.3	178	-178.1	-169.4	0	108.5	V56 M72 E86 I119 M121 D189	V56-K70 HydrophobicContact CG2-CB 4.26Å; V56-K70 HydrophobicContact CG2-CG 4.18Å; K70-M72 HydrophobicContact CD-CE 4.37Å; K70-M72 HydrophobicContact CD-SD 4.06Å; K70-M72 VanDerWaalsContact CE-SD 3.53Å; K70-M72 HydrophobicContact CG-CE 4.08Å; K70-M72 HydrophobicContact CG-SD 4.01Å; K70-E86 IonicContact NZ-OE1 3.06Å; K70-E86 PolarHBondContact NZ-OE1 3.09Å; K70-E86 IonicContact NZ-OE2 3.22Å; K70-E86 PolarHBondContact NZ-OE2 3.04Å; K70-I119 HydrophobicContact CB-CB 4.42Å; K70-I119 PolarHBondContact N-O 3.03Å; K70-I119 PolarHBondContact O-N 3.45Å; K70-M121 HydrophobicContact CB-CE 3.67Å; K70-D189 IonicContact NZ-OD1 2.7Å; K70-D189 PolarHBondContact NZ-OD1 3.28Å
71	R	95.8	Very high	94.6	Very high	23 Å²	23	50.8 Å²	50.8	9%	0.087	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.7	-174.8	176.9	166.7	-169.7	-104.3	2.1	110.1	Y30 S54 V55 F57 Y73 E116 V117 L118	Y30-R71 VanDerWaalsContact CE1-NH1 3.31Å; S54-R71 WeakPolarHBondContact CA-O 3.16Å; V55-R71 PolarHBondContact N-O 3.33Å; V55-R71 PolarHBondContact O-N 3.42Å; F57-R71 HydrophobicContact CD2-CB 4.45Å; F57-R71 HydrophobicContact CE2-CB 4.15Å; R71-Y73 PolarHBondContact NH2-OH 2.92Å; R71-E116 IonicContact CZ-OE1 2.71Å; R71-E116 IonicContact NE-OE1 2.72Å; R71-E116 PolarHBondContact NE-OE1 3.36Å; R71-E116 IonicContact NH2-OE1 3.5Å; R71-E116 PolarHBondContact NH2-OE1 3.08Å; R71-V117 WeakPolarHBondContact CA-O 3.43Å; R71-L118 HydrophobicContact CB-CD2 3.83Å; R71-L118 HydrophobicContact CG-CD2 3.57Å
72	M	95	Very high	94.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.6	-175.3	-65.5	146.8	-56.5	0	0	110.1	S54 K70 Y83 E116 V117 I119	S54-M72 VanDerWaalsContact CB-CG 3.47Å; K70-M72 HydrophobicContact CD-CE 4.37Å; K70-M72 HydrophobicContact CD-SD 4.06Å; K70-M72 VanDerWaalsContact CE-SD 3.53Å; K70-M72 HydrophobicContact CG-CE 4.08Å; K70-M72 HydrophobicContact CG-SD 4.01Å; M72-Y83 HydrophobicContact CB-CE1 4.33Å; M72-Y83 HydrophobicContact CE-CD1 4.12Å; M72-Y83 HydrophobicContact CG-CE1 4Å; M72-Y83 HydrophobicContact SD-CD1 3.39Å; M72-Y83 WeakPolarHBondContact SD-CD1 3.28Å; M72-Y83 HydrophobicContact SD-CE1 3.27Å; M72-Y83 WeakPolarHBondContact SD-CE1 3.49Å; M72-Y83 HydrophobicContact SD-CG 4.29Å; M72-E116 WeakPolarHBondContact O-CA 3.16Å; M72-V117 HydrophobicContact CB-CB 4.45Å; M72-V117 HydrophobicContact CE-CB 4Å; M72-V117 HydrophobicContact CE-CG1 3.79Å; M72-V117 PolarHBondContact N-O 3.04Å; M72-V117 PolarHBondContact O-N 3.35Å; M72-I119 HydrophobicContact CE-CD1 3.81Å; M72-I119 HydrophobicContact CE-CG1 3.93Å
73	Y	93.4	Very high	94.6	Very high	104 Å²	104	45.6 Å²	45.6	41%	0.408	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	139.9	167.5	-78.4	-76.3	0	0	0	109.3	R71 V110 V114 W115 E116	R71-Y73 PolarHBondContact NH2-OH 2.92Å; Y73-V110 HydrophobicContact CE1-CG2 4.32Å; Y73-V114 HydrophobicContact CD1-CG1 4.19Å; Y73-W115 WeakPolarHBondContact CA-O 3.47Å; Y73-E116 HydrophobicContact CD1-CB 4.18Å; Y73-E116 HydrophobicContact CE1-CB 3.96Å; Y73-E116 HydrophobicContact CE1-CG 4.46Å
74	V	93.7	Very high	94.8	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.7	-178.9	65.4	0	0	0	0	110.7	D79 L80 Y83 V114 W115 V117	V74-D79 HydrophobicContact CG2-CB 3.34Å; V74-L80 HydrophobicContact CG1-CB 4.03Å; V74-L80 HydrophobicContact CG1-CD1 3.84Å; V74-L80 HydrophobicContact CG2-CB 4.46Å; V74-Y83 HydrophobicContact CB-CD2 4.18Å; V74-Y83 HydrophobicContact CB-CE2 3.86Å; V74-Y83 HydrophobicContact CG1-CD2 4.25Å; V74-Y83 HydrophobicContact CG1-CE2 4.42Å; V74-Y83 HydrophobicContact CG2-CD2 4.35Å; V74-Y83 HydrophobicContact CG2-CE2 3.99Å; V74-V114 WeakPolarHBondContact O-CA 3.48Å; V74-W115 HydrophobicContact CG1-CB 3.86Å; V74-W115 HydrophobicContact CG1-CE3 4.35Å; V74-W115 PolarHBondContact N-O 3.34Å; V74-W115 PolarHBondContact O-N 3.24Å; V74-V117 HydrophobicContact CG1-CG2 4.29Å
75	N	92.8	Very high	94.9	Very high	113 Å²	113	47.5 Å²	47.5	60%	0.604	24%	0.238	S	C	*	.			trans	-113.5	13.5	-172.2	70.5	-9.9	0	0	0	113.9	S113 V114	N75-S113 CarbonylContact C-O 3.55Å; N75-S113 WeakPolarHBondContact CA-O 3.41Å; N75-V114 HydrophobicContact CB-CG2 4.27Å
76	N	92.1	Very high	95	Very high	44 Å²	44	43.5 Å²	43.5	24%	0.235	21%	0.214	C	C	.	.	S	Bend	trans	-153.6	148.2	-177.4	70.7	87.3	0	0	0	112	P78 D79 L80	N76-P78 WeakPolarHBondContact OD1-CD 3.36Å; N76-D79 PolarHBondContact ND2-OD2 2.96Å; N76-D79 WeakPolarHBondContact OD1-CB 3.41Å; N76-D79 PolarHBondContact OD1-N 3.26Å; N76-D79 PolarHBondContact OD1-OD2 3.25Å; N76-L80 WeakPolarHBondContact O-CB 3.41Å; N76-L80 PolarHBondContact O-N 3.16Å; N76-L80 VanDerWaalsContact O-N 3.08Å
77	V	92.3	Very high	95	Very high	77 Å²	77	39.1 Å²	39.1	47%	0.467	20%	0.198	S	C	.	.	H	α-helix	trans	-65.7	-38.9	-177	179.1	0	0	0	0	113.7	D79 L80 N81 W115	V77-D79 PolarHBondContact O-N 2.99Å; V77-L80 PolarHBondContact O-N 2.94Å; V77-N81 VanDerWaalsContact O-CG 3.24Å; V77-N81 PolarHBondContact O-N 3.3Å; V77-N81 PolarHBondContact O-ND2 3.33Å; V77-W115 HydrophobicContact CG2-CH2 3.77Å; V77-W115 HydrophobicContact CG2-CZ2 4.41Å; V77-W115 HydrophobicContact CG2-CZ3 4.39Å
78	P	91.8	Very high	95	Very high	93 Å²	93	42.2 Å²	42.2	60%	0.604	22%	0.216	S	C	*	.	H	α-helix	trans	-54.7	-49.5	174.5	-29.2	36.3	0	0	0	113.5	N76 N81 I82	N76-P78 WeakPolarHBondContact OD1-CD 3.36Å; P78-N81 PolarHBondContact O-N 2.88Å; P78-I82 PolarHBondContact O-N 2.99Å
79	D	90.9	Very high	95	Very high	39 Å²	39	41.6 Å²	41.6	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-70.7	-36.1	179.2	-71.8	-28.5	0	0	0	112.1	V74 N76 V77 N81 I82 Y83 K214	V74-D79 HydrophobicContact CG2-CB 3.34Å; N76-D79 PolarHBondContact ND2-OD2 2.96Å; N76-D79 WeakPolarHBondContact OD1-CB 3.41Å; N76-D79 PolarHBondContact OD1-N 3.26Å; N76-D79 PolarHBondContact OD1-OD2 3.25Å; V77-D79 PolarHBondContact O-N 2.99Å; D79-N81 PolarHBondContact O-N 2.61Å; D79-I82 HydrophobicContact CB-CD1 4.25Å; D79-I82 WeakPolarHBondContact O-CA 3.48Å; D79-I82 VanDerWaalsContact O-CB 3.26Å; D79-I82 WeakPolarHBondContact O-CB 3.28Å; D79-I82 PolarHBondContact O-N 3.49Å; D79-I82 VanDerWaalsContact OD1-CD1 3.3Å; D79-I82 WeakPolarHBondContact OD1-CD1 3.4Å; D79-Y83 VanDerWaalsContact O-CD2 3.32Å; D79-Y83 WeakPolarHBondContact O-CD2 3.14Å; D79-Y83 PolarHBondContact O-N 3.07Å; D79-K214 IonicContact OD1-NZ 3.82Å; D79-K214 PolarHBondContact OD1-NZ 3.45Å; D79-K214 IonicContact OD2-NZ 2.65Å
80	L	93.9	Very high	95	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-35.3	173	178	64.8	0	0	0	111.9	V74 N76 V77 I82 Y83 K84 I107 W115 V117	V74-L80 HydrophobicContact CG1-CB 4.03Å; V74-L80 HydrophobicContact CG1-CD1 3.84Å; V74-L80 HydrophobicContact CG2-CB 4.46Å; N76-L80 WeakPolarHBondContact O-CB 3.41Å; N76-L80 PolarHBondContact O-N 3.16Å; N76-L80 VanDerWaalsContact O-N 3.08Å; V77-L80 PolarHBondContact O-N 2.94Å; L80-I82 VanDerWaalsContact C-N 3.26Å; L80-I82 PolarHBondContact O-N 2.92Å; L80-Y83 PolarHBondContact O-N 3.04Å; L80-K84 HydrophobicContact CG-CD 4.44Å; L80-K84 WeakPolarHBondContact O-CG 3.49Å; L80-K84 PolarHBondContact O-N 3.06Å; L80-I107 HydrophobicContact CD1-CD1 4.4Å; L80-I107 HydrophobicContact CD1-CG2 3.86Å; L80-W115 HydrophobicContact CD1-CB 4.11Å; L80-W115 HydrophobicContact CD1-CG 4.21Å; L80-W115 HydrophobicContact CD2-CD2 3.7Å; L80-W115 HydrophobicContact CD2-CE3 4.12Å; L80-W115 HydrophobicContact CD2-CG 3.94Å; L80-W115 HydrophobicContact CD2-CZ2 4.32Å; L80-V117 HydrophobicContact CD1-CG2 4Å
81	N	95.2	Very high	94.9	Very high	75 Å²	75	46.2 Å²	46.2	40%	0.401	23%	0.232	S	C	.	.	H	α-helix	trans	-73.8	-14.1	177	-67.7	-23.2	0	0	0	113.3	V77 P78 D79 K84 R85	V77-N81 VanDerWaalsContact O-CG 3.24Å; V77-N81 PolarHBondContact O-N 3.3Å; V77-N81 PolarHBondContact O-ND2 3.33Å; P78-N81 PolarHBondContact O-N 2.88Å; D79-N81 PolarHBondContact O-N 2.61Å; N81-K84 PolarHBondContact OD1-NZ 3.13Å; N81-R85 PolarHBondContact O-N 2.73Å
82	I	93.6	Very high	94.9	Very high	18 Å²	18	49.6 Å²	49.6	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-72.8	-53.6	167.2	-50.9	166.5	0	0	0	109	P78 D79 L80 K84 R85 E86 G191 Y215	P78-I82 PolarHBondContact O-N 2.99Å; D79-I82 HydrophobicContact CB-CD1 4.25Å; D79-I82 WeakPolarHBondContact O-CA 3.48Å; D79-I82 VanDerWaalsContact O-CB 3.26Å; D79-I82 WeakPolarHBondContact O-CB 3.28Å; D79-I82 PolarHBondContact O-N 3.49Å; D79-I82 VanDerWaalsContact OD1-CD1 3.3Å; D79-I82 WeakPolarHBondContact OD1-CD1 3.4Å; L80-I82 VanDerWaalsContact C-N 3.26Å; L80-I82 PolarHBondContact O-N 2.92Å; I82-K84 VanDerWaalsContact C-N 3.28Å; I82-K84 PolarHBondContact O-N 2.79Å; I82-R85 CarbonylContact O-C 3.14Å; I82-R85 WeakPolarHBondContact O-CA 3.18Å; I82-R85 VanDerWaalsContact O-CB 3.29Å; I82-R85 WeakPolarHBondContact O-CB 3.41Å; I82-R85 PolarHBondContact O-N 3.16Å; I82-E86 PolarHBondContact O-N 3.21Å; I82-G191 WeakPolarHBondContact CG2-O 3.48Å; I82-Y215 HydrophobicContact CD1-CE1 3.81Å; I82-Y215 WeakPolarHBondContact CD1-OH 3.43Å
83	Y	94.8	Very high	94.9	Very high	31 Å²	31	49.6 Å²	49.6	12%	0.122	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-32.9	-178.9	-57.7	-59.4	0	0	0	112.6	M72 V74 D79 L80 E86 I87	M72-Y83 HydrophobicContact CB-CE1 4.33Å; M72-Y83 HydrophobicContact CE-CD1 4.12Å; M72-Y83 HydrophobicContact CG-CE1 4Å; M72-Y83 HydrophobicContact SD-CD1 3.39Å; M72-Y83 WeakPolarHBondContact SD-CD1 3.28Å; M72-Y83 HydrophobicContact SD-CE1 3.27Å; M72-Y83 WeakPolarHBondContact SD-CE1 3.49Å; M72-Y83 HydrophobicContact SD-CG 4.29Å; V74-Y83 HydrophobicContact CB-CD2 4.18Å; V74-Y83 HydrophobicContact CB-CE2 3.86Å; V74-Y83 HydrophobicContact CG1-CD2 4.25Å; V74-Y83 HydrophobicContact CG1-CE2 4.42Å; V74-Y83 HydrophobicContact CG2-CD2 4.35Å; V74-Y83 HydrophobicContact CG2-CE2 3.99Å; D79-Y83 VanDerWaalsContact O-CD2 3.32Å; D79-Y83 WeakPolarHBondContact O-CD2 3.14Å; D79-Y83 PolarHBondContact O-N 3.07Å; L80-Y83 PolarHBondContact O-N 3.04Å; Y83-E86 PolarHBondContact O-N 2.71Å; Y83-I87 WeakPolarHBondContact O-CD1 3.28Å; Y83-I87 VanDerWaalsContact O-CG1 3.3Å; Y83-I87 WeakPolarHBondContact O-CG1 3.46Å; Y83-I87 PolarHBondContact O-N 2.85Å
84	K	97.1	Very high	94.8	Very high	85 Å²	85	46.8 Å²	46.8	37%	0.37	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-41.1	168	-73.9	172.7	-177.1	167.4	0	112.5	L80 N81 I82 I87 T88 I107	L80-K84 HydrophobicContact CG-CD 4.44Å; L80-K84 WeakPolarHBondContact O-CG 3.49Å; L80-K84 PolarHBondContact O-N 3.06Å; N81-K84 PolarHBondContact OD1-NZ 3.13Å; I82-K84 VanDerWaalsContact C-N 3.28Å; I82-K84 PolarHBondContact O-N 2.79Å; K84-I87 PolarHBondContact O-N 3.47Å; K84-T88 PolarHBondContact O-N 3.24Å; K84-T88 PolarHBondContact O-OG1 3Å; K84-I107 HydrophobicContact CG-CD1 3.6Å
85	R	97.1	Very high	94.8	Very high	68 Å²	68	49.6 Å²	49.6	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-43.1	176.3	-169.2	-158	-56.7	160.5	3.4	111.3	N81 I82 I87 T88 I89 S193	N81-R85 PolarHBondContact O-N 2.73Å; I82-R85 CarbonylContact O-C 3.14Å; I82-R85 WeakPolarHBondContact O-CA 3.18Å; I82-R85 VanDerWaalsContact O-CB 3.29Å; I82-R85 WeakPolarHBondContact O-CB 3.41Å; I82-R85 PolarHBondContact O-N 3.16Å; R85-I87 VanDerWaalsContact C-N 3.34Å; R85-I87 PolarHBondContact O-N 2.84Å; R85-T88 PolarHBondContact O-N 3.22Å; R85-I89 HydrophobicContact CG-CD1 3.86Å; R85-I89 HydrophobicContact CG-CG1 4.38Å; R85-I89 WeakPolarHBondContact O-CB 3.39Å; R85-I89 WeakPolarHBondContact O-CG1 3.43Å; R85-I89 PolarHBondContact O-N 3.24Å; R85-S193 VanDerWaalsContact CD-O 3.32Å; R85-S193 WeakPolarHBondContact CD-O 3.34Å; R85-S193 PolarHBondContact NH1-O 3.44Å
86	E	96.9	Very high	95.1	Very high	3 Å²	3	46.5 Å²	46.5	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-54.3	-51	173.5	-177.6	179	178	0	0	110.4	K70 I82 Y83 T88 I89 M90 I119 F190 G191	K70-E86 IonicContact NZ-OE1 3.06Å; K70-E86 PolarHBondContact NZ-OE1 3.09Å; K70-E86 IonicContact NZ-OE2 3.22Å; K70-E86 PolarHBondContact NZ-OE2 3.04Å; I82-E86 PolarHBondContact O-N 3.21Å; Y83-E86 PolarHBondContact O-N 2.71Å; E86-T88 VanDerWaalsContact C-N 3.34Å; E86-T88 PolarHBondContact O-N 2.89Å; E86-I89 PolarHBondContact O-N 3.06Å; E86-M90 HydrophobicContact CG-SD 4.48Å; E86-M90 WeakPolarHBondContact O-CB 3.48Å; E86-M90 VanDerWaalsContact O-CG 3.3Å; E86-M90 WeakPolarHBondContact O-CG 3.05Å; E86-M90 PolarHBondContact O-N 3.25Å; E86-I119 HydrophobicContact CG-CD1 4.15Å; E86-F190 HydrophobicContact CG-CB 4.11Å; E86-G191 WeakPolarHBondContact OE2-CA 3.22Å
87	I	97.8	Very high	95.4	Very high	9 Å²	9	48.1 Å²	48.1	5%	0.046	26%	0.262	C	S	.	.	H	α-helix	trans	-58.7	-41.8	176.6	-71.6	164.8	0	0	0	112.2	Y83 K84 R85 K91 Y102 S105 I107 V117 I119	Y83-I87 WeakPolarHBondContact O-CD1 3.28Å; Y83-I87 VanDerWaalsContact O-CG1 3.3Å; Y83-I87 WeakPolarHBondContact O-CG1 3.46Å; Y83-I87 PolarHBondContact O-N 2.85Å; K84-I87 PolarHBondContact O-N 3.47Å; R85-I87 VanDerWaalsContact C-N 3.34Å; R85-I87 PolarHBondContact O-N 2.84Å; I87-K91 HydrophobicContact CG2-CD 4.11Å; I87-K91 VanDerWaalsContact O-CG 3.28Å; I87-K91 WeakPolarHBondContact O-CG 3.44Å; I87-K91 PolarHBondContact O-N 2.95Å; I87-K91 VanDerWaalsContact O-N 3.08Å; I87-Y102 HydrophobicContact CG2-CE2 4.41Å; I87-S105 VanDerWaalsContact CG2-OG 3.3Å; I87-S105 WeakPolarHBondContact CG2-OG 3.42Å; I87-I107 HydrophobicContact CD1-CD1 4.22Å; I87-I107 HydrophobicContact CD1-CG1 4.28Å; I87-V117 HydrophobicContact CD1-CG1 3.89Å; I87-I119 HydrophobicContact CD1-CD1 4.27Å; I87-I119 HydrophobicContact CD1-CG1 4.11Å; I87-I119 HydrophobicContact CG1-CD1 3.63Å; I87-I119 HydrophobicContact CG1-CG1 3.8Å
88	T	97.9	Very high	95.7	Very high	64 Å²	64	44.5 Å²	44.5	39%	0.393	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-49	176.8	-65.2	0	0	0	0	111.8	K84 R85 E86 M90 K91 E92	K84-T88 PolarHBondContact O-N 3.24Å; K84-T88 PolarHBondContact O-OG1 3Å; R85-T88 PolarHBondContact O-N 3.22Å; E86-T88 VanDerWaalsContact C-N 3.34Å; E86-T88 PolarHBondContact O-N 2.89Å; T88-M90 VanDerWaalsContact C-N 3.32Å; T88-M90 PolarHBondContact O-N 3.46Å; T88-K91 WeakPolarHBondContact O-CB 3.37Å; T88-K91 PolarHBondContact O-N 2.97Å; T88-K91 VanDerWaalsContact O-N 3.08Å; T88-E92 HydrophobicContact CG2-CG 4.45Å; T88-E92 VanDerWaalsContact CG2-OE1 3.31Å; T88-E92 WeakPolarHBondContact CG2-OE1 3.39Å; T88-E92 WeakPolarHBondContact O-CG 3.15Å; T88-E92 PolarHBondContact O-N 3.22Å
89	I	97.8	Very high	96	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-45.6	177.4	-75.2	173.9	0	0	0	110.4	R85 E86 K91 E92 L93 I167 F190	R85-I89 HydrophobicContact CG-CD1 3.86Å; R85-I89 HydrophobicContact CG-CG1 4.38Å; R85-I89 WeakPolarHBondContact O-CB 3.39Å; R85-I89 WeakPolarHBondContact O-CG1 3.43Å; R85-I89 PolarHBondContact O-N 3.24Å; E86-I89 PolarHBondContact O-N 3.06Å; I89-K91 VanDerWaalsContact C-N 3.3Å; I89-K91 PolarHBondContact O-N 3.34Å; I89-E92 PolarHBondContact O-N 3.28Å; I89-L93 HydrophobicContact CG2-CD1 3.53Å; I89-L93 HydrophobicContact CG2-CG 4.34Å; I89-L93 WeakPolarHBondContact O-CB 3.48Å; I89-L93 VanDerWaalsContact O-CG 3.23Å; I89-L93 WeakPolarHBondContact O-CG 3.44Å; I89-L93 PolarHBondContact O-N 3.27Å; I89-I167 HydrophobicContact CD1-CG2 4.14Å; I89-I167 HydrophobicContact CG1-CD1 4.31Å; I89-I167 HydrophobicContact CG2-CD1 4.24Å; I89-I167 HydrophobicContact CG2-CG2 4.5Å; I89-F190 HydrophobicContact CG2-CB 3.97Å; I89-F190 HydrophobicContact CG2-CD1 3.9Å; I89-F190 HydrophobicContact CG2-CG 4Å
90	M	97.6	Very high	96.3	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-33.8	176.5	-73.5	-159.7	75.6	0	0	113.4	E86 T88 S94 V100 Y102 I119 M121 F190	E86-M90 HydrophobicContact CG-SD 4.48Å; E86-M90 WeakPolarHBondContact O-CB 3.48Å; E86-M90 VanDerWaalsContact O-CG 3.3Å; E86-M90 WeakPolarHBondContact O-CG 3.05Å; E86-M90 PolarHBondContact O-N 3.25Å; T88-M90 VanDerWaalsContact C-N 3.32Å; T88-M90 PolarHBondContact O-N 3.46Å; M90-S94 WeakPolarHBondContact O-CB 3.47Å; M90-S94 PolarHBondContact O-N 3.47Å; M90-S94 VanDerWaalsContact O-N 3.13Å; M90-V100 HydrophobicContact CE-CG1 3.89Å; M90-Y102 HydrophobicContact CB-CD2 3.98Å; M90-Y102 HydrophobicContact CB-CG 4.44Å; M90-I119 HydrophobicContact SD-CG2 4.07Å; M90-M121 HydrophobicContact CE-CG 3.82Å; M90-M121 HydrophobicContact CE-SD 3.75Å; M90-M121 HydrophobicContact SD-SD 4.26Å; M90-F190 HydrophobicContact CE-CD2 4.31Å; M90-F190 HydrophobicContact CE-CE2 4.49Å; M90-F190 HydrophobicContact CG-CB 4.28Å; M90-F190 HydrophobicContact CG-CD2 3.55Å; M90-F190 HydrophobicContact CG-CE2 4.33Å; M90-F190 HydrophobicContact CG-CG 4.2Å; M90-F190 HydrophobicContact SD-CD2 4.12Å
91	K	96.2	Very high	96.5	Very high	107 Å²	107	43.7 Å²	43.7	47%	0.465	22%	0.222	S	C	.	.	H	α-helix	trans	-70.5	-43.2	173.7	-74.8	167.1	-179.3	174.1	0	112.3	I87 T88 I89 L93 Y102	I87-K91 HydrophobicContact CG2-CD 4.11Å; I87-K91 VanDerWaalsContact O-CG 3.28Å; I87-K91 WeakPolarHBondContact O-CG 3.44Å; I87-K91 PolarHBondContact O-N 2.95Å; I87-K91 VanDerWaalsContact O-N 3.08Å; T88-K91 WeakPolarHBondContact O-CB 3.37Å; T88-K91 PolarHBondContact O-N 2.97Å; T88-K91 VanDerWaalsContact O-N 3.08Å; I89-K91 VanDerWaalsContact C-N 3.3Å; I89-K91 PolarHBondContact O-N 3.34Å; K91-L93 VanDerWaalsContact C-N 3.31Å; K91-L93 PolarHBondContact O-N 2.73Å; K91-Y102 WeakPolarHBondContact CE-OH 3.23Å; K91-Y102 HydrophobicContact CG-CD1 4.04Å; K91-Y102 HydrophobicContact CG-CD2 4.36Å; K91-Y102 HydrophobicContact CG-CE1 3.8Å; K91-Y102 HydrophobicContact CG-CE2 4.1Å; K91-Y102 HydrophobicContact CG-CG 4.33Å
92	E	94.9	Very high	96.6	Very high	95 Å²	95	41.5 Å²	41.5	44%	0.444	21%	0.208	S	C	.	.	H	α-helix	trans	-68.8	-27.6	179.9	-71.1	177.7	-168.1	0	0	113.2	T88 I89 R159 H195	T88-E92 HydrophobicContact CG2-CG 4.45Å; T88-E92 VanDerWaalsContact CG2-OE1 3.31Å; T88-E92 WeakPolarHBondContact CG2-OE1 3.39Å; T88-E92 WeakPolarHBondContact O-CG 3.15Å; T88-E92 PolarHBondContact O-N 3.22Å; I89-E92 PolarHBondContact O-N 3.28Å; E92-R159 PolarHBondContact O-NH2 2.97Å; E92-H195 IonicContact OE2-CE1 3.79Å
93	L	95.3	Very high	96.8	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-98.2	-12.6	-178.5	-61.4	175.3	0	0	0	114.3	I89 K91 I99 R159 L160 I167 F190	I89-L93 HydrophobicContact CG2-CD1 3.53Å; I89-L93 HydrophobicContact CG2-CG 4.34Å; I89-L93 WeakPolarHBondContact O-CB 3.48Å; I89-L93 VanDerWaalsContact O-CG 3.23Å; I89-L93 WeakPolarHBondContact O-CG 3.44Å; I89-L93 PolarHBondContact O-N 3.27Å; K91-L93 VanDerWaalsContact C-N 3.31Å; K91-L93 PolarHBondContact O-N 2.73Å; L93-I99 HydrophobicContact CB-CD1 3.94Å; L93-I99 HydrophobicContact CB-CG2 4.15Å; L93-I99 HydrophobicContact CD1-CD1 4.29Å; L93-I99 HydrophobicContact CD2-CD1 4.33Å; L93-I99 HydrophobicContact CG-CD1 4.43Å; L93-R159 HydrophobicContact CD2-CG 3.98Å; L93-L160 HydrophobicContact CD1-CD1 3.68Å; L93-L160 HydrophobicContact CD1-CG 3.86Å; L93-L160 HydrophobicContact CD2-CD1 4.29Å; L93-L160 HydrophobicContact CD2-CG 4.48Å; L93-I167 HydrophobicContact CD1-CD1 4.1Å; L93-I167 HydrophobicContact CD2-CD1 4.05Å; L93-I167 HydrophobicContact CG-CD1 4.22Å; L93-F190 HydrophobicContact CD1-CD1 4.24Å; L93-F190 HydrophobicContact CD1-CE1 3.94Å; L93-F190 HydrophobicContact CD1-CZ 4.4Å
94	S	91.3	Very high	96.9	Very high	45 Å²	45	41.1 Å²	41.1	32%	0.315	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	143.7	-176.2	-159.8	0	0	0	0	112.8	M90 Y102	M90-S94 WeakPolarHBondContact O-CB 3.47Å; M90-S94 PolarHBondContact O-N 3.47Å; M90-S94 VanDerWaalsContact O-N 3.13Å; S94-Y102 PolarHBondContact OG-N 3.36Å; S94-Y102 PolarHBondContact OG-O 3.05Å
95	G	94.1	Very high	97	Very high	67 Å²	67	37.8 Å²	37.8	69%	0.691	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.7	-8.4	-178.6	0	0	0	0	0	114.9
96	H	98	Very high	97	Very high	48 Å²	48	36.3 Å²	36.3	22%	0.222	19%	0.194	C	C	.	.			trans	-75.8	130.6	169.3	-173.7	-97.5	0	0	0	111.1	N98 I99 E155 R159	H96-N98 PolarHBondContact ND1-N 3.36Å; H96-N98 PolarHBondContact O-N 2.89Å; H96-I99 HydrophobicContact CB-CB 4.29Å; H96-I99 HydrophobicContact CB-CD1 4.15Å; H96-I99 HydrophobicContact CB-CG1 4.35Å; H96-I99 PolarHBondContact O-N 2.96Å; H96-E155 PolarHBondContact CE1-O 3.46Å; H96-R159 HydrophobicContact CB-CG 4.04Å
97	K	98.1	Very high	97	Very high	78 Å²	78	39.3 Å²	39.3	34%	0.339	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.8	-169.8	74.8	174.9	175.2	63	0	115.2	D152 E155 V186	K97-D152 IonicContact NZ-OD1 3.65Å; K97-D152 PolarHBondContact NZ-OD1 3.05Å; K97-D152 VanDerWaalsContact NZ-OD1 3.09Å; K97-E155 WeakPolarHBondContact CE-OE2 3.1Å; K97-E155 IonicContact NZ-OE1 3.09Å; K97-E155 PolarHBondContact NZ-OE1 3.36Å; K97-E155 IonicContact NZ-OE2 3.86Å; K97-E155 PolarHBondContact NZ-OE2 2.98Å; K97-V186 WeakPolarHBondContact O-CG1 2.98Å
98	N	98.8	Very high	96.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	18.4	-179.7	-54.1	108.8	0	0	0	114.2	H96 D152 E155 A156 Y185 V186 L187	H96-N98 PolarHBondContact ND1-N 3.36Å; H96-N98 PolarHBondContact O-N 2.89Å; N98-D152 VanDerWaalsContact CB-O 3.22Å; N98-D152 WeakPolarHBondContact CB-O 3.47Å; N98-D152 VanDerWaalsContact CG-O 3.29Å; N98-D152 WeakPolarHBondContact ND2-CB 3.33Å; N98-D152 PolarHBondContact ND2-OD1 3.36Å; N98-D152 PolarHBondContact ND2-OD2 3.25Å; N98-E155 VanDerWaalsContact OD1-CB 3.29Å; N98-E155 WeakPolarHBondContact OD1-CB 3.48Å; N98-A156 HydrophobicContact CB-CB 3.84Å; N98-A156 VanDerWaalsContact O-CB 3.22Å; N98-A156 WeakPolarHBondContact O-CB 3.22Å; N98-Y185 WeakPolarHBondContact CA-O 3.38Å; N98-Y185 WeakPolarHBondContact CB-O 3.48Å; N98-Y185 PolarHBondContact ND2-O 3.13Å; N98-V186 CarbonylContact O-C 3.6Å; N98-V186 WeakPolarHBondContact O-CA 3.36Å; N98-L187 PolarHBondContact O-N 3.16Å
99	I	98.6	Very high	96.7	Very high	3 Å²	3	44 Å²	44	2%	0.015	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-126.5	131.7	176.6	-68.6	177.2	0	0	0	108.3	L93 H96 R101 A156 R159 L160 F190	L93-I99 HydrophobicContact CB-CD1 3.94Å; L93-I99 HydrophobicContact CB-CG2 4.15Å; L93-I99 HydrophobicContact CD1-CD1 4.29Å; L93-I99 HydrophobicContact CD2-CD1 4.33Å; L93-I99 HydrophobicContact CG-CD1 4.43Å; H96-I99 HydrophobicContact CB-CB 4.29Å; H96-I99 HydrophobicContact CB-CD1 4.15Å; H96-I99 HydrophobicContact CB-CG1 4.35Å; H96-I99 PolarHBondContact O-N 2.96Å; I99-R101 PolarHBondContact O-N 3.17Å; I99-R101 VanDerWaalsContact O-N 3.14Å; I99-A156 HydrophobicContact CG1-CB 4.07Å; I99-R159 HydrophobicContact CD1-CB 4.1Å; I99-R159 HydrophobicContact CD1-CG 3.74Å; I99-L160 HydrophobicContact CD1-CD1 3.7Å; I99-F190 HydrophobicContact CG2-CE2 3.98Å; I99-F190 HydrophobicContact CG2-CZ 3.73Å
100	V	97.9	Very high	96.4	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.024	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-58	120.7	-178.2	69	0	0	0	0	110.5	M90 Y102 M121 E122 V186 L187 C188 F190	M90-V100 HydrophobicContact CE-CG1 3.89Å; V100-Y102 PolarHBondContact O-N 3.44Å; V100-M121 HydrophobicContact CG1-SD 4.44Å; V100-M121 HydrophobicContact CG2-CB 4.34Å; V100-E122 HydrophobicContact CG2-CG 3.99Å; V100-V186 HydrophobicContact CB-CG2 4.25Å; V100-L187 PolarHBondContact N-O 3.01Å; V100-C188 HydrophobicContact CB-CB 4.16Å; V100-C188 HydrophobicContact CG1-CB 3.65Å; V100-F190 HydrophobicContact CG1-CE2 4.31Å
101	R	97.2	Very high	96	Very high	114 Å²	114	50.4 Å²	50.4	43%	0.43	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-69.5	121.6	-170.2	-174.1	170	46.7	101.6	7.6	111.9	I99 M121 E122	I99-R101 PolarHBondContact O-N 3.17Å; I99-R101 VanDerWaalsContact O-N 3.14Å; R101-M121 WeakPolarHBondContact O-CA 3.3Å; R101-E122 HydrophobicContact CB-CB 4.36Å; R101-E122 HydrophobicContact CB-CG 3.99Å; R101-E122 VanDerWaalsContact CB-OE1 3.25Å; R101-E122 WeakPolarHBondContact CB-OE1 3.42Å; R101-E122 WeakPolarHBondContact CB-OE2 3.48Å; R101-E122 IonicContact CZ-OE2 3.79Å; R101-E122 PolarHBondContact N-OE1 2.88Å; R101-E122 IonicContact NE-OE2 3.95Å; R101-E122 PolarHBondContact NE-OE2 3.14Å; R101-E122 IonicContact NH2-OE2 3.65Å; R101-E122 PolarHBondContact NH2-OE2 3.46Å; R101-E122 PolarHBondContact O-N 3.39Å
102	Y	98.2	Very high	95.5	Very high	28 Å²	28	52.4 Å²	52.4	11%	0.11	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	135.5	168	172.3	-84.2	0	0	0	110.8	I87 M90 K91 S94 V100 D104 S105 I119	I87-Y102 HydrophobicContact CG2-CE2 4.41Å; M90-Y102 HydrophobicContact CB-CD2 3.98Å; M90-Y102 HydrophobicContact CB-CG 4.44Å; K91-Y102 WeakPolarHBondContact CE-OH 3.23Å; K91-Y102 HydrophobicContact CG-CD1 4.04Å; K91-Y102 HydrophobicContact CG-CD2 4.36Å; K91-Y102 HydrophobicContact CG-CE1 3.8Å; K91-Y102 HydrophobicContact CG-CE2 4.1Å; K91-Y102 HydrophobicContact CG-CG 4.33Å; S94-Y102 PolarHBondContact OG-N 3.36Å; S94-Y102 PolarHBondContact OG-O 3.05Å; V100-Y102 PolarHBondContact O-N 3.44Å; Y102-D104 VanDerWaalsContact OH-CA 3.27Å; Y102-D104 WeakPolarHBondContact OH-CA 3.33Å; Y102-D104 PolarHBondContact OH-OD1 3.04Å; Y102-S105 PolarHBondContact OH-N 3.44Å; Y102-S105 PolarHBondContact OH-OG 2.59Å; Y102-I119 HydrophobicContact CD2-CG2 4.37Å; Y102-I119 HydrophobicContact CE2-CG2 4.5Å
103	L	97	Very high	95.1	Very high	22 Å²	22	51.4 Å²	51.4	12%	0.115	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-56.5	175.3	-57.1	179.9	0	0	0	111.6	R39 Y40 C67 L120 M121	R39-L103 PolarHBondContact NH2-O 3.04Å; Y40-L103 HydrophobicContact CE2-CB 4.21Å; C67-L103 HydrophobicContact CB-CD1 3.92Å; L103-L120 HydrophobicContact CB-CB 4.35Å; L103-L120 HydrophobicContact CB-CD2 4.25Å; L103-L120 HydrophobicContact CB-CG 4.32Å; L103-L120 WeakPolarHBondContact CB-O 3.47Å; L103-L120 HydrophobicContact CD1-CD2 4.28Å; L103-L120 HydrophobicContact CD1-CG 4.23Å; L103-L120 PolarHBondContact N-O 3.06Å; L103-M121 WeakPolarHBondContact CD1-O 3.44Å
104	D	97.8	Very high	95	Very high	19 Å²	19	53 Å²	53	10%	0.102	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	176.7	174.8	-131.2	-38.6	0	0	0	113	R39 Y40 Y102 L120	R39-D104 IonicContact CZ-OD2 2.81Å; R39-D104 PolarHBondContact N-OD2 3.41Å; R39-D104 VanDerWaalsContact N-OD2 3.1Å; R39-D104 IonicContact NE-OD2 3.82Å; R39-D104 PolarHBondContact NE-OD2 3.44Å; R39-D104 IonicContact NH2-OD2 2.84Å; R39-D104 PolarHBondContact NH2-OD2 2.91Å; R39-D104 VanDerWaalsContact NH2-OD2 3.17Å; Y40-D104 HydrophobicContact CD2-CB 3.66Å; Y40-D104 HydrophobicContact CE2-CB 3.86Å; Y102-D104 VanDerWaalsContact OH-CA 3.27Å; Y102-D104 WeakPolarHBondContact OH-CA 3.33Å; Y102-D104 PolarHBondContact OH-OD1 3.04Å; D104-L120 PolarHBondContact N-O 3.37Å; D104-L120 PolarHBondContact O-N 3.13Å
105	S	98.3	Very high	95.2	Very high	15 Å²	15	53 Å²	53	11%	0.105	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	161.2	177.7	52.6	0	0	0	0	112.8	I87 Y102 L118	I87-S105 VanDerWaalsContact CG2-OG 3.3Å; I87-S105 WeakPolarHBondContact CG2-OG 3.42Å; Y102-S105 PolarHBondContact OH-N 3.44Å; Y102-S105 PolarHBondContact OH-OG 2.59Å; S105-L118 CarbonylContact C-O 3.55Å; S105-L118 WeakPolarHBondContact CA-O 3.17Å; S105-L118 WeakPolarHBondContact CB-O 3.31Å
106	T	97.9	Very high	95.3	Very high	37 Å²	37	51 Å²	51	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	144.1	175.3	-65.9	0	0	0	0	110.4	G38 V117 L118	G38-T106 PolarHBondContact N-OG1 3.2Å; T106-V117 WeakPolarHBondContact O-CA 3.47Å; T106-L118 PolarHBondContact N-O 3.03Å; T106-L118 PolarHBondContact O-N 3.27Å
107	I	97.1	Very high	95.3	Very high	66 Å²	66	48.7 Å²	48.7	34%	0.338	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	111.1	173.1	-61.6	177.3	0	0	0	106.3	L80 K84 I87 W115 E116 V117	L80-I107 HydrophobicContact CD1-CD1 4.4Å; L80-I107 HydrophobicContact CD1-CG2 3.86Å; K84-I107 HydrophobicContact CG-CD1 3.6Å; I87-I107 HydrophobicContact CD1-CD1 4.22Å; I87-I107 HydrophobicContact CD1-CG1 4.28Å; I107-W115 HydrophobicContact CG2-CB 4.44Å; I107-E116 WeakPolarHBondContact CA-O 3.49Å; I107-V117 HydrophobicContact CG1-CG1 4.1Å; I107-V117 HydrophobicContact CG1-CG2 4.18Å; I107-V117 HydrophobicContact CG2-CG2 4.39Å
108	S	95.5	Very high	95.3	Very high	41 Å²	41	45.1 Å²	45.1	29%	0.287	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.4	-177.3	-62.1	0	0	0	0	110.1	W115 E116	S108-W115 CarbonylContact O-C 3.4Å; S108-W115 WeakPolarHBondContact O-CA 3.46Å; S108-E116 PolarHBondContact N-O 3.28Å; S108-E116 PolarHBondContact O-N 3.28Å
109	F	93.5	Very high	95.2	Very high	131 Å²	131	45.1 Å²	45.1	58%	0.575	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	132	166.5	-173	-104	0	0	0	108.8	S111 W115	F109-S111 VanDerWaalsContact CE2-O 3.24Å; F109-S111 WeakPolarHBondContact CE2-O 3.37Å; F109-S111 WeakPolarHBondContact CZ-O 3.39Å; F109-W115 AromaticContact CD2-NE1 3.72Å
110	V	91.3	Very high	95.2	Very high	75 Å²	75	45 Å²	45	46%	0.455	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-41.2	-172	179	0	0	0	0	111.9	Y73 V114 E116	Y73-V110 HydrophobicContact CE1-CG2 4.32Å; V110-V114 PolarHBondContact N-O 3.07Å; V110-E116 HydrophobicContact CG2-CB 3.6Å
111	S	89	Confident	95.2	Very high	62 Å²	62	45.6 Å²	45.6	43%	0.434	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	179.4	175.4	60.4	0	0	0	0	109.6	F109 S113 V114	F109-S111 VanDerWaalsContact CE2-O 3.24Å; F109-S111 WeakPolarHBondContact CE2-O 3.37Å; F109-S111 WeakPolarHBondContact CZ-O 3.39Å; S111-S113 PolarHBondContact O-N 3.49Å; S111-V114 PolarHBondContact O-N 3.19Å
112	D	85.9	Confident	95.2	Very high	149 Å²	149	41.5 Å²	41.5	80%	0.797	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.8	112.9	-175.1	-71.6	-26.4	0	0	0	113.6	V114	D112-V114 PolarHBondContact O-N 2.81Å
113	S	85.6	Confident	95.2	Very high	74 Å²	74	42.9 Å²	42.9	52%	0.517	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	20.6	-175.5	-53.4	0	0	0	0	115.6	N75 S111 W115	N75-S113 CarbonylContact C-O 3.55Å; N75-S113 WeakPolarHBondContact CA-O 3.41Å; S111-S113 PolarHBondContact O-N 3.49Å; S113-W115 WeakPolarHBondContact O-CZ3 3.47Å
114	V	93.9	Very high	95.2	Very high	34 Å²	34	42.1 Å²	42.1	21%	0.206	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.7	175.9	-177.3	0	0	0	0	111	Y73 V74 N75 V110 S111 D112	Y73-V114 HydrophobicContact CD1-CG1 4.19Å; V74-V114 WeakPolarHBondContact O-CA 3.48Å; N75-V114 HydrophobicContact CB-CG2 4.27Å; V110-V114 PolarHBondContact N-O 3.07Å; S111-V114 PolarHBondContact O-N 3.19Å; D112-V114 PolarHBondContact O-N 2.81Å
115	W	95.8	Very high	95	Very high	47 Å²	47	48 Å²	48	18%	0.178	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.6	173.9	-57.2	-92.4	0	0	0	110.8	Y73 V74 V77 L80 I107 S108 F109 S113	Y73-W115 WeakPolarHBondContact CA-O 3.47Å; V74-W115 HydrophobicContact CG1-CB 3.86Å; V74-W115 HydrophobicContact CG1-CE3 4.35Å; V74-W115 PolarHBondContact N-O 3.34Å; V74-W115 PolarHBondContact O-N 3.24Å; V77-W115 HydrophobicContact CG2-CH2 3.77Å; V77-W115 HydrophobicContact CG2-CZ2 4.41Å; V77-W115 HydrophobicContact CG2-CZ3 4.39Å; L80-W115 HydrophobicContact CD1-CB 4.11Å; L80-W115 HydrophobicContact CD1-CG 4.21Å; L80-W115 HydrophobicContact CD2-CD2 3.7Å; L80-W115 HydrophobicContact CD2-CE3 4.12Å; L80-W115 HydrophobicContact CD2-CG 3.94Å; L80-W115 HydrophobicContact CD2-CZ2 4.32Å; I107-W115 HydrophobicContact CG2-CB 4.44Å; S108-W115 CarbonylContact O-C 3.4Å; S108-W115 WeakPolarHBondContact O-CA 3.46Å; F109-W115 AromaticContact CD2-NE1 3.72Å; S113-W115 WeakPolarHBondContact O-CZ3 3.47Å
116	E	96	Very high	94.9	Very high	24 Å²	24	49.1 Å²	49.1	11%	0.112	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	137.1	161	173.3	179.1	-122	0	0	108.6	R71 M72 Y73 I107 S108 V110 L118	R71-E116 IonicContact CZ-OE1 2.71Å; R71-E116 IonicContact NE-OE1 2.72Å; R71-E116 PolarHBondContact NE-OE1 3.36Å; R71-E116 IonicContact NH2-OE1 3.5Å; R71-E116 PolarHBondContact NH2-OE1 3.08Å; M72-E116 WeakPolarHBondContact O-CA 3.16Å; Y73-E116 HydrophobicContact CD1-CB 4.18Å; Y73-E116 HydrophobicContact CE1-CB 3.96Å; Y73-E116 HydrophobicContact CE1-CG 4.46Å; I107-E116 WeakPolarHBondContact CA-O 3.49Å; S108-E116 PolarHBondContact N-O 3.28Å; S108-E116 PolarHBondContact O-N 3.28Å; V110-E116 HydrophobicContact CG2-CB 3.6Å; E116-L118 HydrophobicContact CG-CD2 3.99Å; E116-L118 HydrophobicContact CG-CG 4.1Å
117	V	97.3	Very high	94.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.7	173.9	-175	0	0	0	0	109.3	R71 M72 V74 L80 I87 T106 I107 I119	R71-V117 WeakPolarHBondContact CA-O 3.43Å; M72-V117 HydrophobicContact CB-CB 4.45Å; M72-V117 HydrophobicContact CE-CB 4Å; M72-V117 HydrophobicContact CE-CG1 3.79Å; M72-V117 PolarHBondContact N-O 3.04Å; M72-V117 PolarHBondContact O-N 3.35Å; V74-V117 HydrophobicContact CG1-CG2 4.29Å; L80-V117 HydrophobicContact CD1-CG2 4Å; I87-V117 HydrophobicContact CD1-CG1 3.89Å; T106-V117 WeakPolarHBondContact O-CA 3.47Å; I107-V117 HydrophobicContact CG1-CG1 4.1Å; I107-V117 HydrophobicContact CG1-CG2 4.18Å; I107-V117 HydrophobicContact CG2-CG2 4.39Å; V117-I119 HydrophobicContact CG1-CG1 4.37Å
118	L	97.9	Very high	94.8	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.8	178.3	-57.2	179.2	0	0	0	109	F35 V37 L69 R71 S105 T106 E116	F35-L118 HydrophobicContact CB-CD1 4.28Å; F35-L118 HydrophobicContact CD1-CD1 3.9Å; F35-L118 HydrophobicContact CD1-CD2 4.42Å; F35-L118 HydrophobicContact CG-CD1 4.47Å; V37-L118 HydrophobicContact CG1-CB 4.01Å; V37-L118 HydrophobicContact CG2-CB 4Å; V37-L118 HydrophobicContact CG2-CD1 3.9Å; L69-L118 HydrophobicContact CD1-CB 4.15Å; L69-L118 HydrophobicContact CD1-CD2 4.32Å; R71-L118 HydrophobicContact CB-CD2 3.83Å; R71-L118 HydrophobicContact CG-CD2 3.57Å; S105-L118 CarbonylContact C-O 3.55Å; S105-L118 WeakPolarHBondContact CA-O 3.17Å; S105-L118 WeakPolarHBondContact CB-O 3.31Å; T106-L118 PolarHBondContact N-O 3.03Å; T106-L118 PolarHBondContact O-N 3.27Å; E116-L118 HydrophobicContact CG-CD2 3.99Å; E116-L118 HydrophobicContact CG-CG 4.1Å
119	I	98.1	Very high	94.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.7	173	-51.4	-179.8	0	0	0	107.8	K70 M72 E86 I87 M90 Y102 V117 M121	K70-I119 HydrophobicContact CB-CB 4.42Å; K70-I119 PolarHBondContact N-O 3.03Å; K70-I119 PolarHBondContact O-N 3.45Å; M72-I119 HydrophobicContact CE-CD1 3.81Å; M72-I119 HydrophobicContact CE-CG1 3.93Å; E86-I119 HydrophobicContact CG-CD1 4.15Å; I87-I119 HydrophobicContact CD1-CD1 4.27Å; I87-I119 HydrophobicContact CD1-CG1 4.11Å; I87-I119 HydrophobicContact CG1-CD1 3.63Å; I87-I119 HydrophobicContact CG1-CG1 3.8Å; M90-I119 HydrophobicContact SD-CG2 4.07Å; Y102-I119 HydrophobicContact CD2-CG2 4.37Å; Y102-I119 HydrophobicContact CE2-CG2 4.5Å; V117-I119 HydrophobicContact CG1-CG1 4.37Å; I119-M121 HydrophobicContact CG2-CG 4.09Å
120	L	98.2	Very high	95	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.5	178.5	-161	74.1	0	0	0	110.1	V37 Y40 V42 C67 L69 L103 D104	V37-L120 HydrophobicContact CB-CB 4.36Å; V37-L120 HydrophobicContact CG1-CB 3.93Å; Y40-L120 HydrophobicContact CD1-CD2 4.34Å; Y40-L120 HydrophobicContact CD2-CD2 3.95Å; Y40-L120 HydrophobicContact CG-CD2 3.79Å; V42-L120 HydrophobicContact CG1-CD1 4Å; V42-L120 HydrophobicContact CG1-CD2 3.83Å; V42-L120 HydrophobicContact CG2-CD1 4.12Å; C67-L120 HydrophobicContact CB-CD1 4.04Å; C67-L120 HydrophobicContact CB-CG 4.17Å; L69-L120 HydrophobicContact CB-CD1 4.09Å; L69-L120 HydrophobicContact CD1-CD1 4.1Å; L103-L120 HydrophobicContact CB-CB 4.35Å; L103-L120 HydrophobicContact CB-CD2 4.25Å; L103-L120 HydrophobicContact CB-CG 4.32Å; L103-L120 WeakPolarHBondContact CB-O 3.47Å; L103-L120 HydrophobicContact CD1-CD2 4.28Å; L103-L120 HydrophobicContact CD1-CG 4.23Å; L103-L120 PolarHBondContact N-O 3.06Å; D104-L120 PolarHBondContact N-O 3.37Å; D104-L120 PolarHBondContact O-N 3.13Å
121	M	97.8	Very high	95.2	Very high	17 Å²	17	43.9 Å²	43.9	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	166.2	-173.9	-55.6	169.9	-72.2	0	0	109.5	C67 A68 K70 M90 V100 R101 L103 I119	C67-M121 CarbonylContact C-O 3.59Å; C67-M121 WeakPolarHBondContact CA-O 3.33Å; C67-M121 VanDerWaalsContact CB-O 3.26Å; C67-M121 WeakPolarHBondContact CB-O 3.28Å; A68-M121 HydrophobicContact CB-CB 4.39Å; A68-M121 HydrophobicContact CB-CE 4.18Å; A68-M121 PolarHBondContact N-O 3.25Å; A68-M121 PolarHBondContact O-N 3.27Å; K70-M121 HydrophobicContact CB-CE 3.67Å; M90-M121 HydrophobicContact CE-CG 3.82Å; M90-M121 HydrophobicContact CE-SD 3.75Å; M90-M121 HydrophobicContact SD-SD 4.26Å; V100-M121 HydrophobicContact CG1-SD 4.44Å; V100-M121 HydrophobicContact CG2-CB 4.34Å; R101-M121 WeakPolarHBondContact O-CA 3.3Å; L103-M121 WeakPolarHBondContact CD1-O 3.44Å; I119-M121 HydrophobicContact CG2-CG 4.09Å
122	E	96.9	Very high	95.6	Very high	28 Å²	28	41.8 Å²	41.8	13%	0.131	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	151.2	167	74.7	-167.5	159.6	0	0	112.1	V100 R101	V100-E122 HydrophobicContact CG2-CG 3.99Å; R101-E122 HydrophobicContact CB-CB 4.36Å; R101-E122 HydrophobicContact CB-CG 3.99Å; R101-E122 VanDerWaalsContact CB-OE1 3.25Å; R101-E122 WeakPolarHBondContact CB-OE1 3.42Å; R101-E122 WeakPolarHBondContact CB-OE2 3.48Å; R101-E122 IonicContact CZ-OE2 3.79Å; R101-E122 PolarHBondContact N-OE1 2.88Å; R101-E122 IonicContact NE-OE2 3.95Å; R101-E122 PolarHBondContact NE-OE2 3.14Å; R101-E122 IonicContact NH2-OE2 3.65Å; R101-E122 PolarHBondContact NH2-OE2 3.46Å; R101-E122 PolarHBondContact O-N 3.39Å
123	Y	97.7	Very high	96.1	Very high	56 Å²	56	35 Å²	35	22%	0.22	18%	0.181	C	C	.	.			trans	-95.9	128.3	176	176.6	-105.8	0	0	0	109.9	V48 L58 R66 K125	V48-Y123 HydrophobicContact CG2-CE2 4.04Å; L58-Y123 HydrophobicContact CB-CE2 4.27Å; L58-Y123 HydrophobicContact CD1-CD1 4Å; L58-Y123 HydrophobicContact CD1-CD2 3.7Å; L58-Y123 HydrophobicContact CD1-CE1 4.14Å; L58-Y123 HydrophobicContact CD1-CE2 3.86Å; L58-Y123 HydrophobicContact CD1-CG 3.76Å; L58-Y123 HydrophobicContact CG-CE2 4.44Å; R66-Y123 HydrophobicContact CB-CD1 4.38Å; Y123-K125 HydrophobicContact CD1-CB 4.41Å; Y123-K125 HydrophobicContact CE1-CB 3.99Å; Y123-K125 HydrophobicContact CE1-CG 4.34Å
124	C	97.4	Very high	96.6	Very high	7 Å²	7	36.3 Å²	36.3	5%	0.047	18%	0.182	C	C	.	.			trans	-99.9	101.4	177.1	-67.1	0	0	0	0	109.2	A126 G127 L178 L179	C124-A126 VanDerWaalsContact C-N 3.3Å; C124-A126 PolarHBondContact O-N 3.2Å; C124-G127 PolarHBondContact O-N 3.26Å; C124-L178 HydrophobicContact CB-CB 3.91Å; C124-L178 HydrophobicContact CB-CD1 4.07Å; C124-L179 WeakPolarHBondContact CB-O 3.2Å
125	K	94.9	Very high	96.7	Very high	143 Å²	143	41.1 Å²	41.1	62%	0.622	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-31.8	-168.4	-176.5	-173.9	173.4	-170.6	0	114	Y123 G127 D181	Y123-K125 HydrophobicContact CD1-CB 4.41Å; Y123-K125 HydrophobicContact CE1-CB 3.99Å; Y123-K125 HydrophobicContact CE1-CG 4.34Å; K125-G127 VanDerWaalsContact C-N 3.28Å; K125-G127 PolarHBondContact O-N 2.93Å; K125-D181 WeakPolarHBondContact CB-OD1 3.48Å; K125-D181 PolarHBondContact N-OD1 3.44Å
126	A	95.2	Very high	96.7	Very high	38 Å²	38	41.7 Å²	41.7	31%	0.314	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26	176.1	0	0	0	0	0	112.4	C124 L179	C124-A126 VanDerWaalsContact C-N 3.3Å; C124-A126 PolarHBondContact O-N 3.2Å; A126-L179 HydrophobicContact CB-CB 3.85Å; A126-L179 HydrophobicContact CB-CD2 3.92Å; A126-L179 HydrophobicContact CB-CG 3.92Å
127	G	95.3	Very high	96.6	Very high	19 Å²	19	46 Å²	46	20%	0.196	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.2	-157.2	-179.3	0	0	0	0	0	113.6	C124 K125 L178 L179	C124-G127 PolarHBondContact O-N 3.26Å; K125-G127 VanDerWaalsContact C-N 3.28Å; K125-G127 PolarHBondContact O-N 2.93Å; G127-L178 WeakPolarHBondContact O-CA 3.22Å; G127-L179 PolarHBondContact O-N 3.3Å
128	Q	96.7	Very high	96.3	Very high	83 Å²	83	53.9 Å²	53.9	39%	0.388	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	150.9	-177.2	-66.7	171.6	-16.4	0	0	113.3	V130 K131 E175 I177 L178	Q128-V130 HydrophobicContact CB-CB 4.41Å; Q128-V130 PolarHBondContact O-N 3.47Å; Q128-K131 WeakPolarHBondContact O-CB 3.4Å; Q128-K131 PolarHBondContact O-N 3.34Å; Q128-E175 VanDerWaalsContact CD-O 3.27Å; Q128-E175 WeakPolarHBondContact CG-O 3.41Å; Q128-E175 PolarHBondContact NE2-O 3.14Å; Q128-E175 VanDerWaalsContact NE2-O 3.08Å; Q128-I177 CarbonylContact C-O 3.59Å; Q128-I177 WeakPolarHBondContact CA-O 3.22Å; Q128-L178 HydrophobicContact CB-CD2 4.28Å; Q128-L178 HydrophobicContact CG-CD2 3.55Å
129	V	97.6	Very high	96.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-55.8	-33.9	170	172.2	0	0	0	0	111.8	K131 Q132 M133 F141 I149 I177 Y185 L250	V129-K131 PolarHBondContact O-N 2.86Å; V129-Q132 CarbonylContact O-C 3.49Å; V129-Q132 WeakPolarHBondContact O-CA 3.37Å; V129-Q132 WeakPolarHBondContact O-CB 3.45Å; V129-Q132 PolarHBondContact O-N 2.93Å; V129-M133 HydrophobicContact CG1-CG 4.23Å; V129-M133 HydrophobicContact CG1-SD 4.21Å; V129-M133 WeakPolarHBondContact O-CG 3.34Å; V129-M133 PolarHBondContact O-N 2.96Å; V129-F141 HydrophobicContact CG1-CE2 4.04Å; V129-F141 HydrophobicContact CG1-CZ 4.06Å; V129-I149 HydrophobicContact CG1-CD1 4.22Å; V129-I149 HydrophobicContact CG2-CG2 4.18Å; V129-I177 HydrophobicContact CB-CB 4.48Å; V129-I177 HydrophobicContact CG2-CB 3.81Å; V129-I177 HydrophobicContact CG2-CG2 3.65Å; V129-I177 PolarHBondContact N-O 3.22Å; V129-Y185 HydrophobicContact CG2-CD1 3.71Å; V129-Y185 HydrophobicContact CG2-CE1 3.75Å; V129-L250 HydrophobicContact CG1-CD2 3.75Å
130	V	97.1	Very high	96	Very high	28 Å²	28	59.3 Å²	59.3	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-54.8	-37.4	175	177.3	0	0	0	0	112.8	Q128 Q132 M133 N134 V174 E175	Q128-V130 HydrophobicContact CB-CB 4.41Å; Q128-V130 PolarHBondContact O-N 3.47Å; V130-Q132 VanDerWaalsContact C-N 3.28Å; V130-Q132 PolarHBondContact O-N 3.21Å; V130-M133 WeakPolarHBondContact O-CB 3.43Å; V130-M133 PolarHBondContact O-N 3.28Å; V130-N134 VanDerWaalsContact O-CG 3.24Å; V130-N134 PolarHBondContact O-N 3.44Å; V130-N134 PolarHBondContact O-OD1 3.09Å; V130-V174 HydrophobicContact CG2-CB 4.34Å; V130-V174 HydrophobicContact CG2-CG2 3.69Å; V130-E175 HydrophobicContact CG2-CB 4.44Å; V130-E175 HydrophobicContact CG2-CG 3.99Å
131	K	95.5	Very high	96	Very high	110 Å²	110	59.3 Å²	59.3	48%	0.478	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-37.8	175.6	-174.5	178.4	173.2	-174.3	0	111.5	Q128 V129 Q135	Q128-K131 WeakPolarHBondContact O-CB 3.4Å; Q128-K131 PolarHBondContact O-N 3.34Å; V129-K131 PolarHBondContact O-N 2.86Å; K131-Q135 VanDerWaalsContact O-CG 3.28Å; K131-Q135 WeakPolarHBondContact O-CG 3.43Å; K131-Q135 PolarHBondContact O-N 2.89Å
132	Q	96.3	Very high	96	Very high	17 Å²	17	60.9 Å²	60.9	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-74.8	-28.5	177.8	-55.9	-170.4	51.4	0	0	112.9	V129 V130 R136 F141 Y185	V129-Q132 CarbonylContact O-C 3.49Å; V129-Q132 WeakPolarHBondContact O-CA 3.37Å; V129-Q132 WeakPolarHBondContact O-CB 3.45Å; V129-Q132 PolarHBondContact O-N 2.93Å; V130-Q132 VanDerWaalsContact C-N 3.28Å; V130-Q132 PolarHBondContact O-N 3.21Å; Q132-R136 WeakPolarHBondContact O-CG 3.38Å; Q132-R136 PolarHBondContact O-NH1 3.2Å; Q132-F141 HydrophobicContact CB-CE1 4.1Å; Q132-F141 HydrophobicContact CB-CZ 3.94Å; Q132-Y185 PolarHBondContact OE1-OH 3.3Å
133	M	97.4	Very high	96.1	Very high	8 Å²	8	61.9 Å²	61.9	4%	0.039	32%	0.323	C	S	.	.	H	α-helix	trans	-69.7	-46.7	170.6	-63.7	170.5	73.3	0	0	111.1	V129 V130 Q135 R136 L137 F141 V174 K249 F253	V129-M133 HydrophobicContact CG1-CG 4.23Å; V129-M133 HydrophobicContact CG1-SD 4.21Å; V129-M133 WeakPolarHBondContact O-CG 3.34Å; V129-M133 PolarHBondContact O-N 2.96Å; V130-M133 WeakPolarHBondContact O-CB 3.43Å; V130-M133 PolarHBondContact O-N 3.28Å; M133-Q135 PolarHBondContact O-N 3.42Å; M133-R136 CarbonylContact O-C 3.59Å; M133-R136 WeakPolarHBondContact O-CA 3.5Å; M133-R136 PolarHBondContact O-N 3.07Å; M133-L137 PolarHBondContact O-N 3.26Å; M133-F141 HydrophobicContact CG-CE2 3.51Å; M133-F141 HydrophobicContact CG-CZ 3.84Å; M133-V174 HydrophobicContact SD-CB 4.26Å; M133-V174 HydrophobicContact SD-CG1 4.49Å; M133-V174 HydrophobicContact SD-CG2 4.06Å; M133-K249 HydrophobicContact CE-CG 4.1Å; M133-K249 WeakPolarHBondContact CE-O 3.03Å; M133-F253 HydrophobicContact CB-CD2 4.3Å; M133-F253 HydrophobicContact CB-CE1 4.23Å; M133-F253 HydrophobicContact CB-CE2 3.81Å; M133-F253 HydrophobicContact CB-CZ 3.76Å; M133-F253 HydrophobicContact CE-CB 4.12Å; M133-F253 HydrophobicContact CE-CD1 3.45Å; M133-F253 VanDerWaalsContact CE-CD1 3.45Å; M133-F253 HydrophobicContact CE-CD2 4.37Å; M133-F253 HydrophobicContact CE-CE1 3.87Å; M133-F253 HydrophobicContact CE-CG 3.72Å; M133-F253 HydrophobicContact CE-CZ 4.48Å; M133-F253 HydrophobicContact CG-CD1 4.4Å; M133-F253 HydrophobicContact CG-CE1 3.87Å; M133-F253 HydrophobicContact CG-CE2 4.36Å; M133-F253 HydrophobicContact CG-CZ 3.83Å; M133-F253 VanDerWaalsContact O-CE2 3.28Å; M133-F253 WeakPolarHBondContact O-CE2 3.4Å
134	N	96.3	Very high	96.2	Very high	100 Å²	100	62.6 Å²	62.6	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-28.7	178.5	-67.8	-4.5	0	0	0	112.5	V130 R136	V130-N134 VanDerWaalsContact O-CG 3.24Å; V130-N134 PolarHBondContact O-N 3.44Å; V130-N134 PolarHBondContact O-OD1 3.09Å; N134-R136 VanDerWaalsContact C-N 3.27Å; N134-R136 PolarHBondContact O-N 3.46Å
135	Q	95.8	Very high	96.2	Very high	136 Å²	136	65 Å²	65	64%	0.636	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-8.8	172	-71.6	169.1	-21.1	0	0	114.1	K131 M133	K131-Q135 VanDerWaalsContact O-CG 3.28Å; K131-Q135 WeakPolarHBondContact O-CG 3.43Å; K131-Q135 PolarHBondContact O-N 2.89Å; M133-Q135 PolarHBondContact O-N 3.42Å
136	R	95	Very high	96.4	Very high	58 Å²	58	58.1 Å²	58.1	22%	0.219	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	14.3	-172.6	-72.9	179.8	179.8	74.1	-13.2	113.7	Q132 M133 N134 N138 V139 G140 F141 E145 F253	Q132-R136 WeakPolarHBondContact O-CG 3.38Å; Q132-R136 PolarHBondContact O-NH1 3.2Å; M133-R136 CarbonylContact O-C 3.59Å; M133-R136 WeakPolarHBondContact O-CA 3.5Å; M133-R136 PolarHBondContact O-N 3.07Å; N134-R136 VanDerWaalsContact C-N 3.27Å; N134-R136 PolarHBondContact O-N 3.46Å; R136-N138 PolarHBondContact O-N 3.29Å; R136-V139 HydrophobicContact CB-CG2 3.99Å; R136-V139 HydrophobicContact CG-CG2 4.27Å; R136-V139 WeakPolarHBondContact O-CG2 3.45Å; R136-V139 PolarHBondContact O-N 3.5Å; R136-G140 PolarHBondContact O-N 3.09Å; R136-F141 VanDerWaalsContact CD-CD1 3.48Å; R136-E145 IonicContact CZ-OE1 3.31Å; R136-E145 VanDerWaalsContact CZ-OE1 3.31Å; R136-E145 IonicContact NE-OE1 3.6Å; R136-E145 PolarHBondContact NE-OE1 3.23Å; R136-E145 VanDerWaalsContact NE-OE1 3.13Å; R136-E145 IonicContact NH2-OE1 2.71Å; R136-E145 PolarHBondContact NH2-OE1 3.47Å; R136-F253 HydrophobicContact CB-CE2 4.25Å; R136-F253 HydrophobicContact CB-CZ 4.24Å
137	L	94.5	Very high	96.6	Very high	115 Å²	115	56.6 Å²	56.6	60%	0.602	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-37.5	-171.1	-66.5	174.4	0	0	0	114.6	M133 F253	M133-L137 PolarHBondContact O-N 3.26Å; L137-F253 HydrophobicContact CD2-CD2 4.25Å
138	N	90.8	Very high	96.7	Very high	166 Å²	166	59.3 Å²	59.3	89%	0.888	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-13.3	-178.5	-62.4	-10.3	0	0	0	114.6	R136	R136-N138 PolarHBondContact O-N 3.29Å
139	V	93.9	Very high	96.8	Very high	101 Å²	101	55.4 Å²	55.4	61%	0.612	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	-25.9	-169.9	-65.9	0	0	0	0	114.3	R136 K276	R136-V139 HydrophobicContact CB-CG2 3.99Å; R136-V139 HydrophobicContact CG-CG2 4.27Å; R136-V139 WeakPolarHBondContact O-CG2 3.45Å; R136-V139 PolarHBondContact O-N 3.5Å; V139-K276 PolarHBondContact O-NZ 2.87Å
140	G	96.5	Very high	96.9	Very high	15 Å²	15	55.4 Å²	55.4	16%	0.155	30%	0.297	C	S	.	.			trans	65.7	-178.9	-171	0	0	0	0	0	113.7	R136	R136-G140 PolarHBondContact O-N 3.09Å
141	F	98.2	Very high	97	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.			trans	-76.9	155.1	168.8	-68.2	-58.8	0	0	0	111.7	V129 Q132 M133 R136 E145 V146 I149 L250 F253 K276 F277	V129-F141 HydrophobicContact CG1-CE2 4.04Å; V129-F141 HydrophobicContact CG1-CZ 4.06Å; Q132-F141 HydrophobicContact CB-CE1 4.1Å; Q132-F141 HydrophobicContact CB-CZ 3.94Å; M133-F141 HydrophobicContact CG-CE2 3.51Å; M133-F141 HydrophobicContact CG-CZ 3.84Å; R136-F141 VanDerWaalsContact CD-CD1 3.48Å; F141-E145 HydrophobicContact CB-CB 3.97Å; F141-E145 HydrophobicContact CD1-CB 4.04Å; F141-E145 HydrophobicContact CG-CB 4.29Å; F141-V146 HydrophobicContact CB-CG2 3.64Å; F141-V146 HydrophobicContact CD2-CG2 4.47Å; F141-V146 HydrophobicContact CG-CG2 4.48Å; F141-I149 HydrophobicContact CD2-CD1 4.17Å; F141-I149 HydrophobicContact CE1-CD1 4.33Å; F141-I149 HydrophobicContact CE2-CD1 3.89Å; F141-I149 HydrophobicContact CZ-CD1 3.99Å; F141-L250 HydrophobicContact CD2-CD2 4.47Å; F141-L250 HydrophobicContact CE2-CD2 4.12Å; F141-F253 AromaticContact CD2-CE1 3.68Å; F141-F253 HydrophobicContact CD2-CE1 3.68Å; F141-F253 HydrophobicContact CD2-CZ 4.09Å; F141-F253 AromaticContact CE2-CE1 3.97Å; F141-F253 HydrophobicContact CE2-CE1 3.97Å; F141-F253 HydrophobicContact CE2-CZ 4.21Å; F141-F253 HydrophobicContact CG-CE1 4.41Å; F141-K276 WeakPolarHBondContact O-CE 3.45Å; F141-K276 PolarHBondContact O-NZ 3.3Å; F141-F277 WeakPolarHBondContact O-CZ 3.22Å
142	S	98.1	Very high	97.1	Very high	50 Å²	50	48.9 Å²	48.9	35%	0.35	27%	0.266	S	S	.	.			trans	-72.5	160.4	162.3	62.5	0	0	0	0	111.5	A144 E145 V146	S142-A144 PolarHBondContact O-N 3.09Å; S142-E145 VanDerWaalsContact CB-OE2 3.31Å; S142-E145 WeakPolarHBondContact CB-OE2 3.41Å; S142-E145 PolarHBondContact N-OE2 2.96Å; S142-E145 PolarHBondContact O-N 2.91Å; S142-E145 VanDerWaalsContact O-N 3.16Å; S142-E145 WeakPolarHBondContact OG-CG 3.32Å; S142-E145 PolarHBondContact OG-N 3.05Å; S142-E145 PolarHBondContact OG-OE2 3.32Å; S142-V146 WeakPolarHBondContact O-CG2 3.2Å; S142-V146 PolarHBondContact O-N 3.39Å
143	E	98.5	Very high	97.3	Very high	49 Å²	49	48.2 Å²	48.2	23%	0.229	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-34.7	177.5	-176.5	153.2	161	0	0	112.4	V146 L147 F277 S278 L281	E143-V146 PolarHBondContact O-N 2.92Å; E143-L147 HydrophobicContact CG-CD1 3.77Å; E143-L147 HydrophobicContact CG-CG 4.39Å; E143-L147 VanDerWaalsContact O-CB 3.29Å; E143-L147 WeakPolarHBondContact O-CB 3.24Å; E143-L147 VanDerWaalsContact O-CG 3.3Å; E143-L147 WeakPolarHBondContact O-CG 3.49Å; E143-L147 PolarHBondContact O-N 3.14Å; E143-F277 HydrophobicContact CB-CD1 4.07Å; E143-F277 WeakPolarHBondContact OE2-CA 3.5Å; E143-S278 VanDerWaalsContact OE1-CB 3.29Å; E143-S278 WeakPolarHBondContact OE1-CB 3.42Å; E143-S278 PolarHBondContact OE1-OG 3.48Å; E143-S278 PolarHBondContact OE2-N 3.32Å; E143-L281 HydrophobicContact CG-CD2 4.14Å
144	A	98.5	Very high	97.3	Very high	72 Å²	72	47.9 Å²	47.9	60%	0.595	26%	0.262	S	S	*	.	H	α-helix	trans	-66.9	-40.8	174.7	0	0	0	0	0	112.9	S142 H148	S142-A144 PolarHBondContact O-N 3.09Å; A144-H148 WeakPolarHBondContact O-CB 3.42Å; A144-H148 PolarHBondContact O-N 2.83Å
145	E	98.4	Very high	97.5	Very high	56 Å²	56	44 Å²	44	26%	0.262	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-45.1	173	-76.4	164.4	111.5	0	0	111.4	R136 F141 S142 L147 H148 I149	R136-E145 IonicContact CZ-OE1 3.31Å; R136-E145 VanDerWaalsContact CZ-OE1 3.31Å; R136-E145 IonicContact NE-OE1 3.6Å; R136-E145 PolarHBondContact NE-OE1 3.23Å; R136-E145 VanDerWaalsContact NE-OE1 3.13Å; R136-E145 IonicContact NH2-OE1 2.71Å; R136-E145 PolarHBondContact NH2-OE1 3.47Å; F141-E145 HydrophobicContact CB-CB 3.97Å; F141-E145 HydrophobicContact CD1-CB 4.04Å; F141-E145 HydrophobicContact CG-CB 4.29Å; S142-E145 VanDerWaalsContact CB-OE2 3.31Å; S142-E145 WeakPolarHBondContact CB-OE2 3.41Å; S142-E145 PolarHBondContact N-OE2 2.96Å; S142-E145 PolarHBondContact O-N 2.91Å; S142-E145 VanDerWaalsContact O-N 3.16Å; S142-E145 WeakPolarHBondContact OG-CG 3.32Å; S142-E145 PolarHBondContact OG-N 3.05Å; S142-E145 PolarHBondContact OG-OE2 3.32Å; E145-L147 PolarHBondContact O-N 3.37Å; E145-H148 PolarHBondContact O-N 3.5Å; E145-I149 WeakPolarHBondContact O-CD1 3.24Å; E145-I149 VanDerWaalsContact O-CG1 3.3Å; E145-I149 WeakPolarHBondContact O-CG1 3.3Å; E145-I149 PolarHBondContact O-N 2.87Å
146	V	98.8	Very high	97.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-48.4	176.5	172.8	0	0	0	0	110.9	F141 S142 E143 H148 I149 F150 L247 L250 F277 L281	F141-V146 HydrophobicContact CB-CG2 3.64Å; F141-V146 HydrophobicContact CD2-CG2 4.47Å; F141-V146 HydrophobicContact CG-CG2 4.48Å; S142-V146 WeakPolarHBondContact O-CG2 3.2Å; S142-V146 PolarHBondContact O-N 3.39Å; E143-V146 PolarHBondContact O-N 2.92Å; V146-H148 VanDerWaalsContact C-N 3.33Å; V146-H148 PolarHBondContact O-N 2.94Å; V146-I149 PolarHBondContact O-N 3.04Å; V146-F150 VanDerWaalsContact O-CB 3.23Å; V146-F150 WeakPolarHBondContact O-CB 3.46Å; V146-F150 PolarHBondContact O-N 3.48Å; V146-L247 HydrophobicContact CG1-CD1 3.45Å; V146-L247 VanDerWaalsContact CG1-CD1 3.45Å; V146-L250 HydrophobicContact CG1-CB 3.98Å; V146-L250 HydrophobicContact CG1-CD1 4.4Å; V146-L250 HydrophobicContact CG2-CB 4.23Å; V146-F277 HydrophobicContact CG2-CE1 3.85Å; V146-F277 HydrophobicContact CG2-CZ 4.39Å; V146-L281 HydrophobicContact CG1-CD2 4.28Å
147	L	98.8	Very high	97.8	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-33.3	179.3	-76.9	166.7	0	0	0	112.4	E143 E145 C151 L281 L309 A310	E143-L147 HydrophobicContact CG-CD1 3.77Å; E143-L147 HydrophobicContact CG-CG 4.39Å; E143-L147 VanDerWaalsContact O-CB 3.29Å; E143-L147 WeakPolarHBondContact O-CB 3.24Å; E143-L147 VanDerWaalsContact O-CG 3.3Å; E143-L147 WeakPolarHBondContact O-CG 3.49Å; E143-L147 PolarHBondContact O-N 3.14Å; E145-L147 PolarHBondContact O-N 3.37Å; L147-C151 VanDerWaalsContact O-CB 3.22Å; L147-C151 WeakPolarHBondContact O-CB 3.35Å; L147-C151 PolarHBondContact O-N 3.22Å; L147-C151 PolarHBondContact O-SG 3.22Å; L147-L281 HydrophobicContact CD2-CD1 3.71Å; L147-L281 HydrophobicContact CG-CD1 4.2Å; L147-L309 HydrophobicContact CD1-CB 3.93Å; L147-L309 HydrophobicContact CD2-CB 3.82Å; L147-A310 HydrophobicContact CB-CB 4.16Å
148	H	98.8	Very high	98	Very high	76 Å²	76	29.5 Å²	29.5	35%	0.352	17%	0.173	S	C	.	.	H	α-helix	trans	-63.2	-53.8	173.6	-175.5	-164.2	0	0	0	111.2	A144 E145 V146 F150 C151 D152 Y185	A144-H148 WeakPolarHBondContact O-CB 3.42Å; A144-H148 PolarHBondContact O-N 2.83Å; E145-H148 PolarHBondContact O-N 3.5Å; V146-H148 VanDerWaalsContact C-N 3.33Å; V146-H148 PolarHBondContact O-N 2.94Å; H148-F150 VanDerWaalsContact C-N 3.27Å; H148-F150 PolarHBondContact O-N 2.89Å; H148-C151 PolarHBondContact O-N 2.95Å; H148-D152 IonicContact CD2-OD2 3.6Å; H148-D152 IonicContact NE2-OD2 3.22Å; H148-D152 PolarHBondContact O-N 3.04Å; H148-Y185 AromaticContact CE1-CE2 3.99Å; H148-Y185 AromaticContact ND1-CE2 3.77Å
149	I	98.9	Very high	98.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.3	-45.2	176.7	-60.8	159.8	0	0	0	110.4	V129 F141 E145 V146 T153 I177 Y185 L250	V129-I149 HydrophobicContact CG1-CD1 4.22Å; V129-I149 HydrophobicContact CG2-CG2 4.18Å; F141-I149 HydrophobicContact CD2-CD1 4.17Å; F141-I149 HydrophobicContact CE1-CD1 4.33Å; F141-I149 HydrophobicContact CE2-CD1 3.89Å; F141-I149 HydrophobicContact CZ-CD1 3.99Å; E145-I149 WeakPolarHBondContact O-CD1 3.24Å; E145-I149 VanDerWaalsContact O-CG1 3.3Å; E145-I149 WeakPolarHBondContact O-CG1 3.3Å; E145-I149 PolarHBondContact O-N 2.87Å; V146-I149 PolarHBondContact O-N 3.04Å; I149-T153 WeakPolarHBondContact O-CB 3.33Å; I149-T153 PolarHBondContact O-N 3.11Å; I149-T153 PolarHBondContact O-OG1 3.05Å; I149-I177 HydrophobicContact CG2-CG2 4.37Å; I149-Y185 HydrophobicContact CB-CD2 4.31Å; I149-Y185 HydrophobicContact CB-CE2 4.41Å; I149-Y185 HydrophobicContact CB-CG 4.4Å; I149-Y185 HydrophobicContact CD1-CE1 4.43Å; I149-Y185 HydrophobicContact CG1-CD1 4.06Å; I149-Y185 HydrophobicContact CG1-CD2 3.9Å; I149-Y185 HydrophobicContact CG1-CE1 3.71Å; I149-Y185 HydrophobicContact CG1-CE2 3.53Å; I149-Y185 HydrophobicContact CG1-CG 4.14Å; I149-Y185 VanDerWaalsContact CG1-CZ 3.43Å; I149-Y185 HydrophobicContact CG2-CD1 4.37Å; I149-Y185 HydrophobicContact CG2-CG 4.4Å; I149-L250 HydrophobicContact CB-CD1 4Å; I149-L250 HydrophobicContact CD1-CD2 4.08Å; I149-L250 HydrophobicContact CG2-CD1 3.66Å; I149-L250 HydrophobicContact CG2-CD2 4.09Å
150	F	98.9	Very high	98.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-72.2	-41.7	-174.5	-169	-109.8	0	0	0	113	V146 H148 T153 C154 L243 L246 L247 L284 M288 V302 A306	V146-F150 VanDerWaalsContact O-CB 3.23Å; V146-F150 WeakPolarHBondContact O-CB 3.46Å; V146-F150 PolarHBondContact O-N 3.48Å; H148-F150 VanDerWaalsContact C-N 3.27Å; H148-F150 PolarHBondContact O-N 2.89Å; F150-T153 PolarHBondContact O-N 3.35Å; F150-C154 VanDerWaalsContact CE1-SG 3.52Å; F150-C154 WeakPolarHBondContact O-CB 3.33Å; F150-C154 PolarHBondContact O-N 3.33Å; F150-C154 PolarHBondContact O-SG 3.44Å; F150-C154 VanDerWaalsContact O-SG 3.33Å; F150-L243 HydrophobicContact CE2-CB 4.1Å; F150-L243 HydrophobicContact CE2-CD2 4.08Å; F150-L243 HydrophobicContact CZ-CB 4.36Å; F150-L246 HydrophobicContact CD2-CD2 4.3Å; F150-L247 HydrophobicContact CB-CD1 4.07Å; F150-L247 HydrophobicContact CD1-CD1 4.25Å; F150-L247 HydrophobicContact CD1-CD2 4.19Å; F150-L247 HydrophobicContact CD2-CB 3.92Å; F150-L247 HydrophobicContact CD2-CD1 3.96Å; F150-L247 HydrophobicContact CD2-CD2 4.49Å; F150-L247 HydrophobicContact CD2-CG 4.33Å; F150-L247 HydrophobicContact CE1-CD2 4.02Å; F150-L247 HydrophobicContact CE2-CB 3.81Å; F150-L247 HydrophobicContact CE2-CD2 4.33Å; F150-L247 HydrophobicContact CE2-CG 4.44Å; F150-L247 HydrophobicContact CG-CD1 3.82Å; F150-L247 HydrophobicContact CG-CD2 4.44Å; F150-L247 HydrophobicContact CG-CG 4.5Å; F150-L247 HydrophobicContact CZ-CB 4.36Å; F150-L247 HydrophobicContact CZ-CD2 4.11Å; F150-L284 HydrophobicContact CE1-CD2 4.24Å; F150-M288 HydrophobicContact CE1-CE 4.13Å; F150-M288 HydrophobicContact CE2-CE 4.11Å; F150-M288 HydrophobicContact CE2-SD 4.39Å; F150-M288 HydrophobicContact CZ-CE 3.45Å; F150-M288 VanDerWaalsContact CZ-CE 3.45Å; F150-M288 HydrophobicContact CZ-SD 3.67Å; F150-V302 HydrophobicContact CE1-CG1 3.85Å; F150-V302 HydrophobicContact CZ-CG1 3.78Å; F150-A306 HydrophobicContact CD1-CB 3.8Å; F150-A306 HydrophobicContact CE1-CB 3.88Å
151	C	98.9	Very high	98.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.8	-44.4	176.9	-71.2	0	0	0	0	112	L147 H148 T153 C154 E155 F307	L147-C151 VanDerWaalsContact O-CB 3.22Å; L147-C151 WeakPolarHBondContact O-CB 3.35Å; L147-C151 PolarHBondContact O-N 3.22Å; L147-C151 PolarHBondContact O-SG 3.22Å; H148-C151 PolarHBondContact O-N 2.95Å; C151-T153 VanDerWaalsContact C-N 3.33Å; C151-T153 PolarHBondContact O-N 3.09Å; C151-C154 WeakPolarHBondContact O-CB 3.4Å; C151-C154 PolarHBondContact O-N 3.43Å; C151-E155 PolarHBondContact O-N 3.13Å; C151-F307 HydrophobicContact CB-CD2 4.15Å; C151-F307 HydrophobicContact CB-CE1 4.12Å; C151-F307 HydrophobicContact CB-CE2 3.64Å; C151-F307 HydrophobicContact CB-CZ 3.61Å
152	D	98.9	Very high	98.7	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.011	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-40.2	174.5	-91.6	-12.6	0	0	0	111.8	K97 N98 H148 C154 E155 A156 Y185	K97-D152 IonicContact NZ-OD1 3.65Å; K97-D152 PolarHBondContact NZ-OD1 3.05Å; K97-D152 VanDerWaalsContact NZ-OD1 3.09Å; N98-D152 VanDerWaalsContact CB-O 3.22Å; N98-D152 WeakPolarHBondContact CB-O 3.47Å; N98-D152 VanDerWaalsContact CG-O 3.29Å; N98-D152 WeakPolarHBondContact ND2-CB 3.33Å; N98-D152 PolarHBondContact ND2-OD1 3.36Å; N98-D152 PolarHBondContact ND2-OD2 3.25Å; H148-D152 IonicContact CD2-OD2 3.6Å; H148-D152 IonicContact NE2-OD2 3.22Å; H148-D152 PolarHBondContact O-N 3.04Å; D152-C154 VanDerWaalsContact C-N 3.33Å; D152-C154 PolarHBondContact O-N 3.31Å; D152-E155 PolarHBondContact O-N 3.41Å; D152-A156 PolarHBondContact O-N 3.09Å; D152-A156 VanDerWaalsContact O-N 3.08Å; D152-Y185 PolarHBondContact OD2-N 3.36Å
153	T	98.9	Very high	98.5	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	11%	0.113	C	C	.	.	H	α-helix	trans	-64.9	-37.5	174.4	-53.7	0	0	0	0	111.5	I149 F150 C151 A156 V157 I177 L243 L246	I149-T153 WeakPolarHBondContact O-CB 3.33Å; I149-T153 PolarHBondContact O-N 3.11Å; I149-T153 PolarHBondContact O-OG1 3.05Å; F150-T153 PolarHBondContact O-N 3.35Å; C151-T153 VanDerWaalsContact C-N 3.33Å; C151-T153 PolarHBondContact O-N 3.09Å; T153-A156 WeakPolarHBondContact O-CB 3.28Å; T153-A156 PolarHBondContact O-N 2.98Å; T153-V157 HydrophobicContact CG2-CG2 4.47Å; T153-V157 WeakPolarHBondContact O-CG2 3.45Å; T153-V157 PolarHBondContact O-N 3.04Å; T153-I177 HydrophobicContact CG2-CD1 3.77Å; T153-L243 HydrophobicContact CG2-CD2 3.71Å; T153-L246 HydrophobicContact CG2-CD1 4.38Å
154	C	98.9	Very high	98.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.8	-40.9	174.6	-75.9	0	0	0	0	112.5	F150 C151 D152 A156 V157 A158 I299	F150-C154 VanDerWaalsContact CE1-SG 3.52Å; F150-C154 WeakPolarHBondContact O-CB 3.33Å; F150-C154 PolarHBondContact O-N 3.33Å; F150-C154 PolarHBondContact O-SG 3.44Å; F150-C154 VanDerWaalsContact O-SG 3.33Å; C151-C154 WeakPolarHBondContact O-CB 3.4Å; C151-C154 PolarHBondContact O-N 3.43Å; D152-C154 VanDerWaalsContact C-N 3.33Å; D152-C154 PolarHBondContact O-N 3.31Å; C154-A156 VanDerWaalsContact C-N 3.33Å; C154-A156 PolarHBondContact O-N 2.78Å; C154-V157 PolarHBondContact O-N 3.24Å; C154-A158 WeakPolarHBondContact O-CB 3.5Å; C154-A158 PolarHBondContact O-N 2.98Å; C154-I299 HydrophobicContact CB-CD1 4.37Å
155	E	98.9	Very high	98	Very high	20 Å²	20	30.4 Å²	30.4	9%	0.093	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-41.9	173	-70	-176.4	-113.4	0	0	111.3	H96 K97 N98 C151 D152 A158 R159 F307 R312 P315	H96-E155 PolarHBondContact CE1-O 3.46Å; K97-E155 WeakPolarHBondContact CE-OE2 3.1Å; K97-E155 IonicContact NZ-OE1 3.09Å; K97-E155 PolarHBondContact NZ-OE1 3.36Å; K97-E155 IonicContact NZ-OE2 3.86Å; K97-E155 PolarHBondContact NZ-OE2 2.98Å; N98-E155 VanDerWaalsContact OD1-CB 3.29Å; N98-E155 WeakPolarHBondContact OD1-CB 3.48Å; C151-E155 PolarHBondContact O-N 3.13Å; D152-E155 PolarHBondContact O-N 3.41Å; E155-A158 PolarHBondContact O-N 3.17Å; E155-R159 PolarHBondContact O-N 3.03Å; E155-F307 HydrophobicContact CG-CE2 4.28Å; E155-F307 HydrophobicContact CG-CZ 3.71Å; E155-F307 WeakPolarHBondContact OE1-CZ 3.39Å; E155-R312 IonicContact OE1-NH2 3.13Å; E155-P315 HydrophobicContact CG-CG 3.85Å
156	A	98.9	Very high	98	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.7	-50.8	175.3	0	0	0	0	0	112.4	N98 I99 D152 T153 C154 A158 R159 L160 L187	N98-A156 HydrophobicContact CB-CB 3.84Å; N98-A156 VanDerWaalsContact O-CB 3.22Å; N98-A156 WeakPolarHBondContact O-CB 3.22Å; I99-A156 HydrophobicContact CG1-CB 4.07Å; D152-A156 PolarHBondContact O-N 3.09Å; D152-A156 VanDerWaalsContact O-N 3.08Å; T153-A156 WeakPolarHBondContact O-CB 3.28Å; T153-A156 PolarHBondContact O-N 2.98Å; C154-A156 VanDerWaalsContact C-N 3.33Å; C154-A156 PolarHBondContact O-N 2.78Å; A156-A158 VanDerWaalsContact C-N 3.33Å; A156-A158 PolarHBondContact O-N 3.08Å; A156-R159 WeakPolarHBondContact O-CB 3.36Å; A156-R159 PolarHBondContact O-N 3.05Å; A156-L160 WeakPolarHBondContact O-CD1 3.38Å; A156-L160 PolarHBondContact O-N 2.81Å; A156-L187 HydrophobicContact CB-CB 3.85Å; A156-L187 HydrophobicContact CB-CD2 4.22Å
157	V	98.9	Very high	97.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.1	-33.8	-179.4	176.1	0	0	0	0	111.4	T153 C154 R159 L160 H161 L172 L243 I299	T153-V157 HydrophobicContact CG2-CG2 4.47Å; T153-V157 WeakPolarHBondContact O-CG2 3.45Å; T153-V157 PolarHBondContact O-N 3.04Å; C154-V157 PolarHBondContact O-N 3.24Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.87Å; V157-L160 WeakPolarHBondContact O-CB 3.38Å; V157-L160 PolarHBondContact O-N 3.41Å; V157-H161 VanDerWaalsContact CG1-CE1 3.4Å; V157-H161 WeakPolarHBondContact CG1-CE1 3.33Å; V157-H161 WeakPolarHBondContact CG1-NE2 3.44Å; V157-H161 WeakPolarHBondContact O-CB 3.43Å; V157-H161 PolarHBondContact O-N 3.19Å; V157-L172 HydrophobicContact CG1-CD1 4.34Å; V157-L172 HydrophobicContact CG2-CD1 3.59Å; V157-L172 HydrophobicContact CG2-CD2 3.82Å; V157-L172 HydrophobicContact CG2-CG 4.39Å; V157-L243 HydrophobicContact CB-CD1 4.32Å; V157-L243 HydrophobicContact CG1-CD1 4.11Å; V157-L243 HydrophobicContact CG2-CD1 4.34Å; V157-L243 HydrophobicContact CG2-CD2 4.23Å; V157-I299 HydrophobicContact CB-CD1 3.98Å; V157-I299 HydrophobicContact CB-CG1 4.34Å; V157-I299 HydrophobicContact CG1-CD1 3.81Å; V157-I299 HydrophobicContact CG1-CG1 4.09Å
158	A	98.8	Very high	97.9	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-46	171.7	0	0	0	0	0	110.8	C154 E155 A156 L160 H161 Q162 I299 V316	C154-A158 WeakPolarHBondContact O-CB 3.5Å; C154-A158 PolarHBondContact O-N 2.98Å; E155-A158 PolarHBondContact O-N 3.17Å; A156-A158 VanDerWaalsContact C-N 3.33Å; A156-A158 PolarHBondContact O-N 3.08Å; A158-L160 PolarHBondContact O-N 2.81Å; A158-H161 PolarHBondContact O-N 3.49Å; A158-Q162 WeakPolarHBondContact O-CB 3.46Å; A158-Q162 WeakPolarHBondContact O-CG 3.42Å; A158-Q162 PolarHBondContact O-N 2.95Å; A158-I299 HydrophobicContact CB-CG1 3.9Å; A158-I299 HydrophobicContact CB-CG2 4.24Å; A158-V316 HydrophobicContact CB-CB 4.34Å; A158-V316 HydrophobicContact CB-CG1 3.69Å; A158-V316 HydrophobicContact CB-CG2 3.67Å
159	R	98.6	Very high	97.9	Very high	90 Å²	90	27 Å²	27	34%	0.34	13%	0.133	S	C	.	.	H	α-helix	trans	-59.4	-31.9	176.1	175.2	60	-167.4	143.5	3.2	113	E92 L93 H96 I99 E155 A156 V157 C163	E92-R159 PolarHBondContact O-NH2 2.97Å; L93-R159 HydrophobicContact CD2-CG 3.98Å; H96-R159 HydrophobicContact CB-CG 4.04Å; I99-R159 HydrophobicContact CD1-CB 4.1Å; I99-R159 HydrophobicContact CD1-CG 3.74Å; E155-R159 PolarHBondContact O-N 3.03Å; A156-R159 WeakPolarHBondContact O-CB 3.36Å; A156-R159 PolarHBondContact O-N 3.05Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.87Å; R159-C163 PolarHBondContact NH1-SG 3.2Å; R159-C163 PolarHBondContact O-SG 2.85Å; R159-C163 VanDerWaalsContact O-SG 3.34Å
160	L	98.6	Very high	97.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-73.6	-50.4	172.6	-88.1	74.7	0	0	0	112.7	L93 I99 A156 V157 A158 Q162 I167 H169 L187 F190	L93-L160 HydrophobicContact CD1-CD1 3.68Å; L93-L160 HydrophobicContact CD1-CG 3.86Å; L93-L160 HydrophobicContact CD2-CD1 4.29Å; L93-L160 HydrophobicContact CD2-CG 4.48Å; I99-L160 HydrophobicContact CD1-CD1 3.7Å; A156-L160 WeakPolarHBondContact O-CD1 3.38Å; A156-L160 PolarHBondContact O-N 2.81Å; V157-L160 WeakPolarHBondContact O-CB 3.38Å; V157-L160 PolarHBondContact O-N 3.41Å; A158-L160 PolarHBondContact O-N 2.81Å; L160-Q162 VanDerWaalsContact C-N 3.34Å; L160-Q162 PolarHBondContact O-N 3.48Å; L160-I167 HydrophobicContact CB-CB 4.16Å; L160-I167 HydrophobicContact CD2-CB 4.39Å; L160-I167 HydrophobicContact CD2-CG2 3.9Å; L160-I167 HydrophobicContact CG-CB 4.19Å; L160-I167 HydrophobicContact CG-CG2 4.17Å; L160-I167 PolarHBondContact O-N 2.96Å; L160-H169 HydrophobicContact CD2-CB 3.86Å; L160-L187 HydrophobicContact CD1-CD2 4.24Å; L160-L187 HydrophobicContact CD2-CD2 4.46Å; L160-F190 HydrophobicContact CD1-CE1 4.1Å; L160-F190 HydrophobicContact CD2-CD1 4.45Å; L160-F190 HydrophobicContact CD2-CE1 4.1Å
161	H	98.7	Very high	97.9	Very high	19 Å²	19	28.2 Å²	28.2	9%	0.088	14%	0.138	C	C	.	.	H	α-helix	trans	-72	-28.9	-173.1	-71.2	-169.2	0	0	0	112.8	V157 A158 P166 I167 T236 D239 I299	V157-H161 VanDerWaalsContact CG1-CE1 3.4Å; V157-H161 WeakPolarHBondContact CG1-CE1 3.33Å; V157-H161 WeakPolarHBondContact CG1-NE2 3.44Å; V157-H161 WeakPolarHBondContact O-CB 3.43Å; V157-H161 PolarHBondContact O-N 3.19Å; A158-H161 PolarHBondContact O-N 3.49Å; H161-P166 WeakPolarHBondContact O-CB 3.45Å; H161-I167 PolarHBondContact CD2-O 2.83Å; H161-I167 VanDerWaalsContact CD2-O 3.31Å; H161-T236 HydrophobicContact CB-CG2 4.28Å; H161-T236 PolarHBondContact CE1-O 2.99Å; H161-T236 VanDerWaalsContact CE1-O 3.22Å; H161-D239 IonicContact CD2-OD2 3.26Å; H161-D239 IonicContact CE1-OD2 3.95Å; H161-D239 WeakPolarHBondContact NE2-CB 3.5Å; H161-D239 IonicContact NE2-OD2 2.85Å; H161-D239 PolarHBondContact NE2-OD2 2.78Å; H161-I299 HydrophobicContact CB-CG2 4.06Å
162	Q	97.7	Very high	97.9	Very high	48 Å²	48	28.2 Å²	28.2	22%	0.224	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	9.5	-176.9	-60.8	-173.1	-17.2	0	0	113.4	A158 L160 I299 P317 L319	A158-Q162 WeakPolarHBondContact O-CB 3.46Å; A158-Q162 WeakPolarHBondContact O-CG 3.42Å; A158-Q162 PolarHBondContact O-N 2.95Å; L160-Q162 VanDerWaalsContact C-N 3.34Å; L160-Q162 PolarHBondContact O-N 3.48Å; Q162-I299 HydrophobicContact CG-CG2 4.5Å; Q162-P317 PolarHBondContact NE2-O 3.34Å; Q162-L319 HydrophobicContact CB-CD1 3.7Å; Q162-L319 HydrophobicContact CG-CD1 3.94Å; Q162-L319 HydrophobicContact CG-CG 4.46Å
163	C	93.8	Very high	97.8	Very high	15 Å²	15	29.8 Å²	29.8	10%	0.101	15%	0.145	C	C	.	.	S	Bend	trans	-62.3	148.7	164.6	-92.9	0	0	0	0	111.2	R159 T165 P166	R159-C163 PolarHBondContact NH1-SG 3.2Å; R159-C163 PolarHBondContact O-SG 2.85Å; R159-C163 VanDerWaalsContact O-SG 3.34Å; C163-T165 CarbonylContact O-C 3.59Å; C163-T165 PolarHBondContact O-N 3.43Å; C163-P166 WeakPolarHBondContact O-CD 3.49Å
164	K	91.4	Very high	97.8	Very high	217 Å²	217	29.7 Å²	29.7	94%	0.943	14%	0.144	S	C	*	.	S	Bend	trans	-51.5	-34.5	178.1	179.8	179	176.4	-178.6	0	112.8
165	T	95.1	Very high	97.7	Very high	83 Å²	83	32 Å²	32	51%	0.509	16%	0.155	S	C	.	.	S	Bend	trans	-113.8	102.2	163.4	-50.8	0	0	0	0	106.9	C163 H195	C163-T165 CarbonylContact O-C 3.59Å; C163-T165 PolarHBondContact O-N 3.43Å; T165-H195 HydrophobicContact CG2-CB 3.84Å; T165-H195 PolarHBondContact O-ND1 3.36Å
166	P	97.8	Very high	97.6	Very high	62 Å²	62	31.6 Å²	31.6	40%	0.403	15%	0.153	S	C	.	.			trans	-54.3	144.2	-175.7	-30.4	37	0	0	0	113.1	H161 C163 H195 T236	H161-P166 WeakPolarHBondContact O-CB 3.45Å; C163-P166 WeakPolarHBondContact O-CD 3.49Å; P166-H195 WeakPolarHBondContact O-CA 3.21Å; P166-T236 HydrophobicContact CB-CG2 4.18Å
167	I	98.6	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.			trans	-111.2	126.7	177.4	-62.3	158.4	0	0	0	108.2	I89 L93 L160 H161 H195	I89-I167 HydrophobicContact CD1-CG2 4.14Å; I89-I167 HydrophobicContact CG1-CD1 4.31Å; I89-I167 HydrophobicContact CG2-CD1 4.24Å; I89-I167 HydrophobicContact CG2-CG2 4.5Å; L93-I167 HydrophobicContact CD1-CD1 4.1Å; L93-I167 HydrophobicContact CD2-CD1 4.05Å; L93-I167 HydrophobicContact CG-CD1 4.22Å; L160-I167 HydrophobicContact CB-CB 4.16Å; L160-I167 HydrophobicContact CD2-CB 4.39Å; L160-I167 HydrophobicContact CD2-CG2 3.9Å; L160-I167 HydrophobicContact CG-CB 4.19Å; L160-I167 HydrophobicContact CG-CG2 4.17Å; L160-I167 PolarHBondContact O-N 2.96Å; H161-I167 PolarHBondContact CD2-O 2.83Å; H161-I167 VanDerWaalsContact CD2-O 3.31Å; I167-H195 VanDerWaalsContact CG1-CE1 3.41Å; I167-H195 WeakPolarHBondContact CG1-CE1 3.36Å; I167-H195 WeakPolarHBondContact CG1-ND1 3.38Å
168	I	98.7	Very high	97.6	Very high	4 Å²	4	33 Å²	33	2%	0.021	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-93.4	124.3	168.1	-41.5	172.6	0	0	0	107.1	R170 S193 T194 T236 D239	I168-R170 HydrophobicContact CB-CG 3.99Å; I168-R170 HydrophobicContact CG2-CG 3.54Å; I168-S193 CarbonylContact O-C 3.47Å; I168-S193 VanDerWaalsContact O-CA 3.31Å; I168-S193 WeakPolarHBondContact O-CA 3.43Å; I168-T194 HydrophobicContact CB-CG2 4.18Å; I168-T194 HydrophobicContact CD1-CG2 4.38Å; I168-T194 PolarHBondContact N-O 3.42Å; I168-T194 PolarHBondContact O-N 3.1Å; I168-T236 HydrophobicContact CG1-CG2 4.01Å; I168-D239 WeakPolarHBondContact CA-OD2 3.44Å; I168-D239 WeakPolarHBondContact CG2-OD2 3.36Å
169	H	98.8	Very high	97.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.			trans	-75.2	-40.6	-178.9	-166.8	-96.5	0	0	0	112	L160 D171 L172 D189 F190 S193 D239	L160-H169 HydrophobicContact CD2-CB 3.86Å; H169-D171 PolarHBondContact CE1-O 3.25Å; H169-D171 VanDerWaalsContact ND1-C 3.32Å; H169-D171 PolarHBondContact ND1-O 2.71Å; H169-D171 PolarHBondContact O-N 2.82Å; H169-L172 HydrophobicContact CB-CD2 3.94Å; H169-L172 HydrophobicContact CB-CG 3.9Å; H169-L172 WeakPolarHBondContact ND1-CD2 3.26Å; H169-L172 PolarHBondContact ND1-N 3.5Å; H169-D189 PolarHBondContact NE2-O 2.98Å; H169-F190 AromaticContact CD2-CD1 3.69Å; H169-F190 AromaticContact CD2-CE1 3.76Å; H169-F190 AromaticContact NE2-CD1 3.79Å; H169-F190 AromaticContact NE2-CE1 3.87Å; H169-S193 PolarHBondContact CD2-OG 3.26Å; H169-D239 PolarHBondContact N-OD1 2.83Å; H169-D239 PolarHBondContact N-OD2 3.08Å
170	R	98.4	Very high	97.5	Very high	14 Å²	14	30.5 Å²	30.5	5%	0.053	15%	0.153	C	C	.	.	S	Bend	trans	65.3	-12.6	177.6	-51	-168.8	-64	-178.1	0.6	117.1	I168 S192 T194 E211 T216 M225 D239	I168-R170 HydrophobicContact CB-CG 3.99Å; I168-R170 HydrophobicContact CG2-CG 3.54Å; R170-S192 VanDerWaalsContact CZ-O 3.27Å; R170-S192 PolarHBondContact NE-O 2.92Å; R170-S192 PolarHBondContact NH2-O 3.25Å; R170-T194 HydrophobicContact CG-CG2 4.36Å; R170-E211 IonicContact CZ-OE1 3.64Å; R170-E211 IonicContact NH1-OE1 2.6Å; R170-E211 PolarHBondContact NH1-OE1 2.85Å; R170-E211 IonicContact NH2-OE1 3.67Å; R170-E211 PolarHBondContact NH2-OE1 2.97Å; R170-T216 HydrophobicContact CB-CG2 3.86Å; R170-T216 WeakPolarHBondContact O-CG2 3.36Å; R170-M225 HydrophobicContact CB-CE 4.37Å; R170-M225 HydrophobicContact CG-CE 4.3Å; R170-D239 PolarHBondContact N-OD1 2.95Å
171	D	97.9	Very high	97.4	Very high	11 Å²	11	35.8 Å²	35.8	6%	0.059	18%	0.182	C	C	.	.			trans	-134.4	50.5	176	-157.4	47.6	0	0	0	111.8	H169 K173 N176 T217	H169-D171 PolarHBondContact CE1-O 3.25Å; H169-D171 VanDerWaalsContact ND1-C 3.32Å; H169-D171 PolarHBondContact ND1-O 2.71Å; H169-D171 PolarHBondContact O-N 2.82Å; D171-K173 PolarHBondContact O-N 2.89Å; D171-K173 IonicContact OD1-NZ 2.78Å; D171-K173 VanDerWaalsContact OD2-CE 3.26Å; D171-K173 WeakPolarHBondContact OD2-CE 3.39Å; D171-K173 IonicContact OD2-NZ 3.27Å; D171-K173 PolarHBondContact OD2-NZ 3.23Å; D171-N176 PolarHBondContact O-ND2 3.37Å; D171-N176 PolarHBondContact OD2-ND2 2.96Å; D171-T217 VanDerWaalsContact OD1-CB 3.29Å; D171-T217 WeakPolarHBondContact OD1-CB 3.28Å; D171-T217 PolarHBondContact OD1-N 3.04Å; D171-T217 PolarHBondContact OD1-OG1 3.33Å
172	L	98.9	Very high	97.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.			trans	-74.4	120.6	170.9	-68.5	175.6	0	0	0	110.1	V157 H169 L187 Y220 D239 A242 L243	V157-L172 HydrophobicContact CG1-CD1 4.34Å; V157-L172 HydrophobicContact CG2-CD1 3.59Å; V157-L172 HydrophobicContact CG2-CD2 3.82Å; V157-L172 HydrophobicContact CG2-CG 4.39Å; H169-L172 HydrophobicContact CB-CD2 3.94Å; H169-L172 HydrophobicContact CB-CG 3.9Å; H169-L172 WeakPolarHBondContact ND1-CD2 3.26Å; H169-L172 PolarHBondContact ND1-N 3.5Å; L172-L187 HydrophobicContact CD2-CD1 3.65Å; L172-L187 HydrophobicContact CD2-CD2 3.87Å; L172-L187 HydrophobicContact CD2-CG 4.44Å; L172-Y220 VanDerWaalsContact O-CD1 3.26Å; L172-Y220 WeakPolarHBondContact O-CD1 3.47Å; L172-D239 HydrophobicContact CD1-CB 3.63Å; L172-A242 HydrophobicContact CB-CB 3.96Å; L172-L243 HydrophobicContact CD1-CD2 4.14Å; L172-L243 HydrophobicContact CD1-CG 4.01Å
173	K	98.4	Very high	97.2	Very high	35 Å²	35	41.6 Å²	41.6	15%	0.152	22%	0.219	C	C	.	.			trans	-162	156.9	-175.4	64.1	-172.9	-170.9	-156.3	0	110.7	D171 E175 N176 T217 Y220	D171-K173 PolarHBondContact O-N 2.89Å; D171-K173 IonicContact OD1-NZ 2.78Å; D171-K173 VanDerWaalsContact OD2-CE 3.26Å; D171-K173 WeakPolarHBondContact OD2-CE 3.39Å; D171-K173 IonicContact OD2-NZ 3.27Å; D171-K173 PolarHBondContact OD2-NZ 3.23Å; K173-E175 VanDerWaalsContact CB-OE2 3.27Å; K173-E175 WeakPolarHBondContact CB-OE2 3.44Å; K173-E175 HydrophobicContact CD-CB 4.26Å; K173-E175 HydrophobicContact CG-CB 4.06Å; K173-E175 WeakPolarHBondContact CG-OE2 3.25Å; K173-E175 PolarHBondContact O-N 3.04Å; K173-E175 VanDerWaalsContact O-N 3.16Å; K173-N176 WeakPolarHBondContact CE-ND2 3.29Å; K173-N176 WeakPolarHBondContact CE-OD1 3.33Å; K173-N176 HydrophobicContact CG-CB 4.04Å; K173-N176 PolarHBondContact O-N 2.85Å; K173-T217 PolarHBondContact NZ-OG1 3.47Å; K173-T217 VanDerWaalsContact NZ-OG1 3.11Å; K173-Y220 HydrophobicContact CB-CD1 4.3Å; K173-Y220 HydrophobicContact CB-CD2 4Å; K173-Y220 HydrophobicContact CB-CE1 3.82Å; K173-Y220 HydrophobicContact CB-CE2 3.45Å; K173-Y220 VanDerWaalsContact CB-CE2 3.45Å; K173-Y220 HydrophobicContact CB-CG 4.37Å; K173-Y220 WeakPolarHBondContact CB-OH 3.43Å
174	V	98.1	Very high	97.4	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-62.6	-23	-176.8	-61.6	0	0	0	0	113.5	V130 M133 N176 I177 Y220 L246 K249 L250	V130-V174 HydrophobicContact CG2-CB 4.34Å; V130-V174 HydrophobicContact CG2-CG2 3.69Å; M133-V174 HydrophobicContact SD-CB 4.26Å; M133-V174 HydrophobicContact SD-CG1 4.49Å; M133-V174 HydrophobicContact SD-CG2 4.06Å; V174-N176 PolarHBondContact O-N 3.44Å; V174-I177 PolarHBondContact O-N 2.87Å; V174-Y220 PolarHBondContact N-OH 3.31Å; V174-L246 HydrophobicContact CG1-CD2 4.47Å; V174-L246 HydrophobicContact CG1-CG 3.96Å; V174-K249 HydrophobicContact CG1-CB 4.41Å; V174-K249 HydrophobicContact CG1-CD 4.24Å; V174-K249 HydrophobicContact CG1-CG 4.38Å; V174-K249 HydrophobicContact CG2-CD 3.61Å; V174-K249 HydrophobicContact CG2-CG 4.39Å; V174-L250 HydrophobicContact CG1-CD2 3.86Å; V174-L250 HydrophobicContact CG1-CG 4.21Å
175	E	96.4	Very high	97.7	Very high	49 Å²	49	32.8 Å²	32.8	23%	0.229	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-66.2	-26.4	173.9	-60.3	64.4	-153.1	0	0	112.1	Q128 V130 K173 Y220 K249	Q128-E175 VanDerWaalsContact CD-O 3.27Å; Q128-E175 WeakPolarHBondContact CG-O 3.41Å; Q128-E175 PolarHBondContact NE2-O 3.14Å; Q128-E175 VanDerWaalsContact NE2-O 3.08Å; V130-E175 HydrophobicContact CG2-CB 4.44Å; V130-E175 HydrophobicContact CG2-CG 3.99Å; K173-E175 VanDerWaalsContact CB-OE2 3.27Å; K173-E175 WeakPolarHBondContact CB-OE2 3.44Å; K173-E175 HydrophobicContact CD-CB 4.26Å; K173-E175 HydrophobicContact CG-CB 4.06Å; K173-E175 WeakPolarHBondContact CG-OE2 3.25Å; K173-E175 PolarHBondContact O-N 3.04Å; K173-E175 VanDerWaalsContact O-N 3.16Å; E175-Y220 PolarHBondContact OE2-OH 3.47Å; E175-K249 IonicContact OE1-NZ 3.19Å; E175-K249 PolarHBondContact OE1-NZ 3.39Å; E175-K249 IonicContact OE2-NZ 3.17Å
176	N	98.1	Very high	97.9	Very high	11 Å²	11	28.9 Å²	28.9	6%	0.059	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-100.3	11.3	-177.4	-70.4	-1.4	0	0	0	112.9	D171 K173 V174 C188	D171-N176 PolarHBondContact O-ND2 3.37Å; D171-N176 PolarHBondContact OD2-ND2 2.96Å; K173-N176 WeakPolarHBondContact CE-ND2 3.29Å; K173-N176 WeakPolarHBondContact CE-OD1 3.33Å; K173-N176 HydrophobicContact CG-CB 4.04Å; K173-N176 PolarHBondContact O-N 2.85Å; V174-N176 PolarHBondContact O-N 3.44Å; N176-C188 PolarHBondContact O-N 3.1Å; N176-C188 PolarHBondContact O-SG 3.5Å
177	I	98.8	Very high	97.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.2	172.6	-49.1	-59.2	0	0	0	109	Q128 V129 I149 T153 V174 Y185 V186 L187 L246	Q128-I177 CarbonylContact C-O 3.59Å; Q128-I177 WeakPolarHBondContact CA-O 3.22Å; V129-I177 HydrophobicContact CB-CB 4.48Å; V129-I177 HydrophobicContact CG2-CB 3.81Å; V129-I177 HydrophobicContact CG2-CG2 3.65Å; V129-I177 PolarHBondContact N-O 3.22Å; I149-I177 HydrophobicContact CG2-CG2 4.37Å; T153-I177 HydrophobicContact CG2-CD1 3.77Å; V174-I177 PolarHBondContact O-N 2.87Å; I177-Y185 HydrophobicContact CG2-CD1 4.16Å; I177-V186 WeakPolarHBondContact CA-O 3.45Å; I177-L187 HydrophobicContact CD1-CD1 3.84Å; I177-L246 HydrophobicContact CD1-CD1 4.44Å; I177-L246 HydrophobicContact CG1-CD1 4.22Å
178	L	98.4	Very high	97.9	Very high	28 Å²	28	26.8 Å²	26.8	15%	0.147	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	158.7	176.4	-46.5	178.9	0	0	0	110.4	C124 G127 Q128 Y185 V186 C188	C124-L178 HydrophobicContact CB-CB 3.91Å; C124-L178 HydrophobicContact CB-CD1 4.07Å; G127-L178 WeakPolarHBondContact O-CA 3.22Å; Q128-L178 HydrophobicContact CB-CD2 4.28Å; Q128-L178 HydrophobicContact CG-CD2 3.55Å; L178-Y185 CarbonylContact O-C 3.43Å; L178-Y185 VanDerWaalsContact O-CA 3.3Å; L178-Y185 WeakPolarHBondContact O-CA 3.45Å; L178-V186 HydrophobicContact CB-CG2 3.82Å; L178-V186 PolarHBondContact N-O 3.16Å; L178-V186 PolarHBondContact O-N 3.32Å; L178-C188 HydrophobicContact CD1-CB 4.04Å; L178-C188 HydrophobicContact CG-CB 4.29Å
179	L	98.3	Very high	97.7	Very high	29 Å²	29	29.1 Å²	29.1	15%	0.152	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.8	166.6	174.5	59.5	0	0	0	109.4	C124 A126 G127 G183 Y185	C124-L179 WeakPolarHBondContact CB-O 3.2Å; A126-L179 HydrophobicContact CB-CB 3.85Å; A126-L179 HydrophobicContact CB-CD2 3.92Å; A126-L179 HydrophobicContact CB-CG 3.92Å; G127-L179 PolarHBondContact O-N 3.3Å; L179-G183 WeakPolarHBondContact CD1-O 3.49Å; L179-Y185 HydrophobicContact CB-CD1 4.02Å; L179-Y185 HydrophobicContact CB-CE1 3.78Å; L179-Y185 HydrophobicContact CD1-CD1 4.21Å; L179-Y185 HydrophobicContact CD1-CD2 4.37Å; L179-Y185 HydrophobicContact CD1-CE1 4.02Å; L179-Y185 HydrophobicContact CD1-CE2 4.18Å; L179-Y185 HydrophobicContact CD1-CG 4.39Å; L179-Y185 HydrophobicContact CD2-CE1 4.3Å; L179-Y185 HydrophobicContact CG-CE1 4.25Å
180	N	96.7	Very high	97.6	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.07	16%	0.156	C	C	.	.			trans	-83.6	165.8	-177.9	80.5	11.8	0	0	0	112.6	Q182 G183 N184 V186	N180-Q182 PolarHBondContact O-N 3.36Å; N180-Q182 VanDerWaalsContact O-N 3.08Å; N180-Q182 WeakPolarHBondContact OD1-CA 3.48Å; N180-Q182 WeakPolarHBondContact OD1-CB 3.47Å; N180-Q182 PolarHBondContact OD1-N 3.47Å; N180-G183 PolarHBondContact O-N 2.77Å; N180-G183 PolarHBondContact OD1-N 3.34Å; N180-N184 PolarHBondContact N-O 3.03Å; N180-N184 PolarHBondContact OD1-N 3.49Å; N180-N184 PolarHBondContact OD1-O 2.62Å; N180-V186 HydrophobicContact CB-CG1 4.02Å; N180-V186 HydrophobicContact CB-CG2 4.45Å; N180-V186 WeakPolarHBondContact ND2-CG1 3.46Å
181	D	95.4	Very high	97.4	Very high	112 Å²	112	29.1 Å²	29.1	60%	0.599	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-5.4	-175.7	-69.5	33.5	0	0	0	113.5	K125	K125-D181 WeakPolarHBondContact CB-OD1 3.48Å; K125-D181 PolarHBondContact N-OD1 3.44Å
182	Q	96	Very high	97.4	Very high	152 Å²	152	29.3 Å²	29.3	71%	0.71	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-4	170.5	-58.6	177.9	-7.5	0	0	112.9	N180	N180-Q182 PolarHBondContact O-N 3.36Å; N180-Q182 VanDerWaalsContact O-N 3.08Å; N180-Q182 WeakPolarHBondContact OD1-CA 3.48Å; N180-Q182 WeakPolarHBondContact OD1-CB 3.47Å; N180-Q182 PolarHBondContact OD1-N 3.47Å
183	G	96.6	Very high	97.3	Very high	37 Å²	37	29.3 Å²	29.3	38%	0.381	16%	0.162	S	C	.	.	S	Bend	trans	86.2	4.7	-177.6	0	0	0	0	0	115.4	L179 N180	L179-G183 WeakPolarHBondContact CD1-O 3.49Å; N180-G183 PolarHBondContact O-N 2.77Å; N180-G183 PolarHBondContact OD1-N 3.34Å
184	N	98.1	Very high	97.3	Very high	32 Å²	32	27.7 Å²	27.7	17%	0.171	16%	0.155	C	C	.	.			trans	-88.6	144	174.2	-58.1	-94.6	0	0	0	110.1	N180	N180-N184 PolarHBondContact N-O 3.03Å; N180-N184 PolarHBondContact OD1-N 3.49Å; N180-N184 PolarHBondContact OD1-O 2.62Å
185	Y	98.8	Very high	97.2	Very high	14 Å²	14	30.6 Å²	30.6	6%	0.055	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.7	166.7	-67.2	-84.2	0	0	0	110.3	N98 V129 Q132 H148 I149 D152 I177 L178 L179	N98-Y185 WeakPolarHBondContact CA-O 3.38Å; N98-Y185 WeakPolarHBondContact CB-O 3.48Å; N98-Y185 PolarHBondContact ND2-O 3.13Å; V129-Y185 HydrophobicContact CG2-CD1 3.71Å; V129-Y185 HydrophobicContact CG2-CE1 3.75Å; Q132-Y185 PolarHBondContact OE1-OH 3.3Å; H148-Y185 AromaticContact CE1-CE2 3.99Å; H148-Y185 AromaticContact ND1-CE2 3.77Å; I149-Y185 HydrophobicContact CB-CD2 4.31Å; I149-Y185 HydrophobicContact CB-CE2 4.41Å; I149-Y185 HydrophobicContact CB-CG 4.4Å; I149-Y185 HydrophobicContact CD1-CE1 4.43Å; I149-Y185 HydrophobicContact CG1-CD1 4.06Å; I149-Y185 HydrophobicContact CG1-CD2 3.9Å; I149-Y185 HydrophobicContact CG1-CE1 3.71Å; I149-Y185 HydrophobicContact CG1-CE2 3.53Å; I149-Y185 HydrophobicContact CG1-CG 4.14Å; I149-Y185 VanDerWaalsContact CG1-CZ 3.43Å; I149-Y185 HydrophobicContact CG2-CD1 4.37Å; I149-Y185 HydrophobicContact CG2-CG 4.4Å; D152-Y185 PolarHBondContact OD2-N 3.36Å; I177-Y185 HydrophobicContact CG2-CD1 4.16Å; L178-Y185 CarbonylContact O-C 3.43Å; L178-Y185 VanDerWaalsContact O-CA 3.3Å; L178-Y185 WeakPolarHBondContact O-CA 3.45Å; L179-Y185 HydrophobicContact CB-CD1 4.02Å; L179-Y185 HydrophobicContact CB-CE1 3.78Å; L179-Y185 HydrophobicContact CD1-CD1 4.21Å; L179-Y185 HydrophobicContact CD1-CD2 4.37Å; L179-Y185 HydrophobicContact CD1-CE1 4.02Å; L179-Y185 HydrophobicContact CD1-CE2 4.18Å; L179-Y185 HydrophobicContact CD1-CG 4.39Å; L179-Y185 HydrophobicContact CD2-CE1 4.3Å; L179-Y185 HydrophobicContact CG-CE1 4.25Å
186	V	98.8	Very high	97.1	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.6	-176.5	-54.2	0	0	0	0	112.1	K97 N98 V100 I177 L178 N180	K97-V186 WeakPolarHBondContact O-CG1 2.98Å; N98-V186 CarbonylContact O-C 3.6Å; N98-V186 WeakPolarHBondContact O-CA 3.36Å; V100-V186 HydrophobicContact CB-CG2 4.25Å; I177-V186 WeakPolarHBondContact CA-O 3.45Å; L178-V186 HydrophobicContact CB-CG2 3.82Å; L178-V186 PolarHBondContact N-O 3.16Å; L178-V186 PolarHBondContact O-N 3.32Å; N180-V186 HydrophobicContact CB-CG1 4.02Å; N180-V186 HydrophobicContact CB-CG2 4.45Å; N180-V186 WeakPolarHBondContact ND2-CG1 3.46Å
187	L	98.8	Very high	97.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	137.5	172.5	178.8	61.8	0	0	0	110.7	N98 V100 A156 L160 L172 I177 F190	N98-L187 PolarHBondContact O-N 3.16Å; V100-L187 PolarHBondContact N-O 3.01Å; A156-L187 HydrophobicContact CB-CB 3.85Å; A156-L187 HydrophobicContact CB-CD2 4.22Å; L160-L187 HydrophobicContact CD1-CD2 4.24Å; L160-L187 HydrophobicContact CD2-CD2 4.46Å; L172-L187 HydrophobicContact CD2-CD1 3.65Å; L172-L187 HydrophobicContact CD2-CD2 3.87Å; L172-L187 HydrophobicContact CD2-CG 4.44Å; I177-L187 HydrophobicContact CD1-CD1 3.84Å; L187-F190 HydrophobicContact CD2-CE1 4.1Å; L187-F190 HydrophobicContact CD2-CZ 4.34Å; L187-F190 HydrophobicContact CG-CE1 4.3Å; L187-F190 HydrophobicContact CG-CZ 4.15Å
188	C	97.1	Very high	96.9	Very high	17 Å²	17	37.8 Å²	37.8	12%	0.115	20%	0.204	C	C	.	.			trans	-133.6	173.9	175	72.1	0	0	0	0	113.4	V100 N176 L178	V100-C188 HydrophobicContact CB-CB 4.16Å; V100-C188 HydrophobicContact CG1-CB 3.65Å; N176-C188 PolarHBondContact O-N 3.1Å; N176-C188 PolarHBondContact O-SG 3.5Å; L178-C188 HydrophobicContact CD1-CB 4.04Å; L178-C188 HydrophobicContact CG-CB 4.29Å
189	D	94.7	Very high	96.8	Very high	54 Å²	54	39.5 Å²	39.5	29%	0.289	21%	0.213	S	C	.	.			trans	65.1	74.8	178.1	-160.8	21.5	0	0	0	116.5	K70 H169 G191	K70-D189 IonicContact NZ-OD1 2.7Å; K70-D189 PolarHBondContact NZ-OD1 3.28Å; H169-D189 PolarHBondContact NE2-O 2.98Å; D189-G191 PolarHBondContact O-N 3.17Å
190	F	97.2	Very high	96.6	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-81.9	8.3	179.3	-59.3	-80.2	0	0	0	113.9	E86 I89 M90 L93 I99 V100 L160 H169 L187 S192 S193	E86-F190 HydrophobicContact CG-CB 4.11Å; I89-F190 HydrophobicContact CG2-CB 3.97Å; I89-F190 HydrophobicContact CG2-CD1 3.9Å; I89-F190 HydrophobicContact CG2-CG 4Å; M90-F190 HydrophobicContact CE-CD2 4.31Å; M90-F190 HydrophobicContact CE-CE2 4.49Å; M90-F190 HydrophobicContact CG-CB 4.28Å; M90-F190 HydrophobicContact CG-CD2 3.55Å; M90-F190 HydrophobicContact CG-CE2 4.33Å; M90-F190 HydrophobicContact CG-CG 4.2Å; M90-F190 HydrophobicContact SD-CD2 4.12Å; L93-F190 HydrophobicContact CD1-CD1 4.24Å; L93-F190 HydrophobicContact CD1-CE1 3.94Å; L93-F190 HydrophobicContact CD1-CZ 4.4Å; I99-F190 HydrophobicContact CG2-CE2 3.98Å; I99-F190 HydrophobicContact CG2-CZ 3.73Å; V100-F190 HydrophobicContact CG1-CE2 4.31Å; L160-F190 HydrophobicContact CD1-CE1 4.1Å; L160-F190 HydrophobicContact CD2-CD1 4.45Å; L160-F190 HydrophobicContact CD2-CE1 4.1Å; H169-F190 AromaticContact CD2-CD1 3.69Å; H169-F190 AromaticContact CD2-CE1 3.76Å; H169-F190 AromaticContact NE2-CD1 3.79Å; H169-F190 AromaticContact NE2-CE1 3.87Å; L187-F190 HydrophobicContact CD2-CE1 4.1Å; L187-F190 HydrophobicContact CD2-CZ 4.34Å; L187-F190 HydrophobicContact CG-CE1 4.3Å; L187-F190 HydrophobicContact CG-CZ 4.15Å; F190-S192 PolarHBondContact O-N 3.35Å; F190-S193 VanDerWaalsContact O-CB 3.25Å; F190-S193 WeakPolarHBondContact O-CB 3.37Å; F190-S193 PolarHBondContact O-N 3.05Å; F190-S193 PolarHBondContact O-OG 3.11Å
191	G	94.9	Very high	96.5	Very high	13 Å²	13	43.3 Å²	43.3	13%	0.134	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.4	-31	-178.3	0	0	0	0	0	114.1	I82 E86 D189	I82-G191 WeakPolarHBondContact CG2-O 3.48Å; E86-G191 WeakPolarHBondContact OE2-CA 3.22Å; D189-G191 PolarHBondContact O-N 3.17Å
192	S	96.8	Very high	96.5	Very high	14 Å²	14	45.7 Å²	45.7	10%	0.098	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-83.6	-11.1	175.3	-70.5	0	0	0	0	114.8	R170 F190 Y215	R170-S192 VanDerWaalsContact CZ-O 3.27Å; R170-S192 PolarHBondContact NE-O 2.92Å; R170-S192 PolarHBondContact NH2-O 3.25Å; F190-S192 PolarHBondContact O-N 3.35Å; S192-Y215 WeakPolarHBondContact CB-O 3.44Å; S192-Y215 PolarHBondContact OG-O 3.32Å
193	S	98	Very high	96.4	Very high	1 Å²	1	42 Å²	42	1%	0.007	22%	0.223	C	C	.	.			trans	-70.7	152.7	-167.5	-67.1	0	0	0	0	113.9	R85 I168 H169 F190	R85-S193 VanDerWaalsContact CD-O 3.32Å; R85-S193 WeakPolarHBondContact CD-O 3.34Å; R85-S193 PolarHBondContact NH1-O 3.44Å; I168-S193 CarbonylContact O-C 3.47Å; I168-S193 VanDerWaalsContact O-CA 3.31Å; I168-S193 WeakPolarHBondContact O-CA 3.43Å; H169-S193 PolarHBondContact CD2-OG 3.26Å; F190-S193 VanDerWaalsContact O-CB 3.25Å; F190-S193 WeakPolarHBondContact O-CB 3.37Å; F190-S193 PolarHBondContact O-N 3.05Å; F190-S193 PolarHBondContact O-OG 3.11Å
194	T	96.7	Very high	96.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-151.7	147	-178.9	-168.7	0	0	0	0	112.9	I168 R170 K196	I168-T194 HydrophobicContact CB-CG2 4.18Å; I168-T194 HydrophobicContact CD1-CG2 4.38Å; I168-T194 PolarHBondContact N-O 3.42Å; I168-T194 PolarHBondContact O-N 3.1Å; R170-T194 HydrophobicContact CG-CG2 4.36Å; T194-K196 WeakPolarHBondContact CG2-O 3.28Å; T194-K196 WeakPolarHBondContact OG1-CB 3.34Å; T194-K196 PolarHBondContact OG1-N 3.26Å
195	H	96.4	Very high	96.3	Very high	62 Å²	62	41.4 Å²	41.4	29%	0.287	22%	0.22	S	C	.	.	S	Bend	trans	-88.9	-6.3	164.9	-53.1	-90.6	0	0	0	112.3	E92 T165 P166 I167	E92-H195 IonicContact OE2-CE1 3.79Å; T165-H195 HydrophobicContact CG2-CB 3.84Å; T165-H195 PolarHBondContact O-ND1 3.36Å; P166-H195 WeakPolarHBondContact O-CA 3.21Å; I167-H195 VanDerWaalsContact CG1-CE1 3.41Å; I167-H195 WeakPolarHBondContact CG1-CE1 3.36Å; I167-H195 WeakPolarHBondContact CG1-ND1 3.38Å
196	K	95.6	Very high	96.2	Very high	133 Å²	133	45.2 Å²	45.2	58%	0.578	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-83.5	116.7	179.7	-64.2	-172.6	176	-172.1	0	110.5	T194 L198	T194-K196 WeakPolarHBondContact CG2-O 3.28Å; T194-K196 WeakPolarHBondContact OG1-CB 3.34Å; T194-K196 PolarHBondContact OG1-N 3.26Å; K196-L198 HydrophobicContact CB-CD2 4.17Å
197	V	96.8	Very high	96.1	Very high	71 Å²	71	48 Å²	48	43%	0.43	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64.2	127.8	152.2	173.1	0	0	0	0	107.6	L199 A233 I234 T235	V197-L199 HydrophobicContact CG1-CD2 4.49Å; V197-A233 HydrophobicContact CG1-CB 3.88Å; V197-I234 WeakPolarHBondContact CA-O 3.49Å; V197-T235 HydrophobicContact CG1-CG2 4.05Å; V197-T235 HydrophobicContact CG2-CG2 4.42Å
198	L	95.6	Very high	96	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.042	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-94.8	140	176.4	-55	179.2	0	0	0	110	K196 V208 E211 I234	K196-L198 HydrophobicContact CB-CD2 4.17Å; L198-V208 HydrophobicContact CB-CG1 4.2Å; L198-V208 HydrophobicContact CB-CG2 4.33Å; L198-V208 HydrophobicContact CD1-CG1 4.11Å; L198-E211 HydrophobicContact CD1-CG 4.23Å; L198-I234 HydrophobicContact CB-CB 4.22Å; L198-I234 HydrophobicContact CB-CD1 4.38Å; L198-I234 PolarHBondContact N-O 3.21Å; L198-I234 PolarHBondContact O-N 3Å
199	L	95.5	Very high	96.1	Very high	64 Å²	64	51 Å²	51	34%	0.335	28%	0.281	S	S	.	.			trans	-124.7	89.5	-176.3	-68.4	168	0	0	0	108.9	V197 L201 K202 D203 A233	V197-L199 HydrophobicContact CG1-CD2 4.49Å; L199-L201 VanDerWaalsContact C-N 3.27Å; L199-L201 PolarHBondContact O-N 2.99Å; L199-K202 HydrophobicContact CB-CB 3.9Å; L199-K202 HydrophobicContact CB-CD 4.45Å; L199-K202 HydrophobicContact CD1-CD 3.81Å; L199-K202 PolarHBondContact O-N 3.25Å; L199-D203 PolarHBondContact N-OD2 3.01Å; L199-D203 PolarHBondContact O-N 3.37Å; L199-A233 HydrophobicContact CD2-CB 3.58Å
200	P	94.9	Very high	96.1	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.013	29%	0.288	C	S	.	.	H	α-helix	trans	-53.2	-37.6	-168.6	-26.4	31.5	0	0	0	115.3	K202 G204 V205 V208 L228 K232 I234	P200-K202 VanDerWaalsContact C-N 3.3Å; P200-K202 PolarHBondContact O-N 3.4Å; P200-G204 CarbonylContact O-C 3.57Å; P200-G204 VanDerWaalsContact O-C 3.28Å; P200-G204 WeakPolarHBondContact O-CA 3.44Å; P200-G204 PolarHBondContact O-N 3.44Å; P200-V205 HydrophobicContact CB-CG2 4.25Å; P200-V205 PolarHBondContact O-N 3.29Å; P200-V208 HydrophobicContact CG-CG1 4.13Å; P200-L228 HydrophobicContact CB-CB 4.02Å; P200-L228 WeakPolarHBondContact CB-O 3.17Å; P200-L228 HydrophobicContact CG-CB 4.28Å; P200-L228 HydrophobicContact CG-CD2 4.08Å; P200-K232 WeakPolarHBondContact CD-O 3.16Å; P200-I234 HydrophobicContact CG-CD1 4.5Å
201	L	93.8	Very high	96.1	Very high	119 Å²	119	54.6 Å²	54.6	62%	0.623	30%	0.298	S	S	*	.	H	α-helix	trans	-77	-11.8	179.6	-56.9	-175.7	0	0	0	114.2	L199 V205	L199-L201 VanDerWaalsContact C-N 3.27Å; L199-L201 PolarHBondContact O-N 2.99Å; L201-V205 HydrophobicContact CD2-CG2 4.37Å
202	K	95.4	Very high	96.2	Very high	163 Å²	163	54.1 Å²	54.1	71%	0.709	29%	0.293	S	S	*	.	H	α-helix	trans	-109.2	-44.7	-179.7	-176.6	-165.8	175.9	-170.7	0	111.9	L199 P200 G204	L199-K202 HydrophobicContact CB-CB 3.9Å; L199-K202 HydrophobicContact CB-CD 4.45Å; L199-K202 HydrophobicContact CD1-CD 3.81Å; L199-K202 PolarHBondContact O-N 3.25Å; P200-K202 VanDerWaalsContact C-N 3.3Å; P200-K202 PolarHBondContact O-N 3.4Å; K202-G204 VanDerWaalsContact C-N 3.34Å
203	D	94.6	Very high	96.2	Very high	73 Å²	73	58.3 Å²	58.3	39%	0.39	31%	0.309	S	S	.	.	H	α-helix	trans	-86.4	-10.8	-175.8	-54.8	-29.4	0	0	0	112.1	L199 V208	L199-D203 PolarHBondContact N-OD2 3.01Å; L199-D203 PolarHBondContact O-N 3.37Å; D203-V208 HydrophobicContact CB-CG2 3.92Å
204	G	96.2	Very high	96	Very high	33 Å²	33	63.6 Å²	63.6	34%	0.34	33%	0.332	S	S	.	.			trans	96.7	116.7	178.1	0	0	0	0	0	112.4	P200 K202 T206 A207 V208	P200-G204 CarbonylContact O-C 3.57Å; P200-G204 VanDerWaalsContact O-C 3.28Å; P200-G204 WeakPolarHBondContact O-CA 3.44Å; P200-G204 PolarHBondContact O-N 3.44Å; K202-G204 VanDerWaalsContact C-N 3.34Å; G204-T206 PolarHBondContact O-N 2.67Å; G204-A207 PolarHBondContact O-N 2.96Å; G204-V208 PolarHBondContact O-N 2.76Å
205	V	96.6	Very high	96	Very high	24 Å²	24	65.5 Å²	65.5	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-52.4	-49.4	-172.2	176.6	0	0	0	0	112.3	P200 L201 A207 V208 E209 L228 Y229	P200-V205 HydrophobicContact CB-CG2 4.25Å; P200-V205 PolarHBondContact O-N 3.29Å; L201-V205 HydrophobicContact CD2-CG2 4.37Å; V205-A207 PolarHBondContact O-N 3.16Å; V205-V208 PolarHBondContact O-N 3.42Å; V205-E209 WeakPolarHBondContact O-CB 3.36Å; V205-E209 PolarHBondContact O-N 3.03Å; V205-L228 HydrophobicContact CG1-CB 3.82Å; V205-L228 HydrophobicContact CG1-CD1 3.92Å; V205-Y229 HydrophobicContact CG1-CE1 4.17Å; V205-Y229 HydrophobicContact CG1-CE2 4.21Å; V205-Y229 HydrophobicContact CG2-CE1 4.21Å
206	T	96.8	Very high	96	Very high	94 Å²	94	63 Å²	63	58%	0.577	33%	0.329	S	S	*	.	H	α-helix	trans	-61.9	-39.3	180	-48	0	0	0	0	113.1	G204 E209 D210	G204-T206 PolarHBondContact O-N 2.67Å; T206-E209 PolarHBondContact O-N 3.02Å; T206-D210 PolarHBondContact O-N 3.36Å
207	A	96	Very high	96.1	Very high	61 Å²	61	59 Å²	59	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-68.3	-39.2	179.1	0	0	0	0	0	111.5	G204 V205 E211	G204-A207 PolarHBondContact O-N 2.96Å; V205-A207 PolarHBondContact O-N 3.16Å; A207-E211 WeakPolarHBondContact O-CB 3.43Å; A207-E211 PolarHBondContact O-N 3.1Å
208	V	97.3	Very high	96.1	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-69.8	-38.4	174.1	173.1	0	0	0	0	111.4	L198 P200 D203 G204 V205 E211 I212 L228 I234	L198-V208 HydrophobicContact CB-CG1 4.2Å; L198-V208 HydrophobicContact CB-CG2 4.33Å; L198-V208 HydrophobicContact CD1-CG1 4.11Å; P200-V208 HydrophobicContact CG-CG1 4.13Å; D203-V208 HydrophobicContact CB-CG2 3.92Å; G204-V208 PolarHBondContact O-N 2.76Å; V205-V208 PolarHBondContact O-N 3.42Å; V208-E211 PolarHBondContact O-N 2.84Å; V208-I212 HydrophobicContact CG1-CD1 3.73Å; V208-I212 HydrophobicContact CG1-CG1 4.39Å; V208-I212 WeakPolarHBondContact O-CD1 3.46Å; V208-I212 WeakPolarHBondContact O-CG1 3.26Å; V208-I212 PolarHBondContact O-N 3.2Å; V208-L228 HydrophobicContact CG1-CD1 4.47Å; V208-L228 HydrophobicContact CG1-CD2 4.35Å; V208-I234 HydrophobicContact CG1-CD1 3.86Å
209	E	97.4	Very high	96.3	Very high	76 Å²	76	57.4 Å²	57.4	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-44.6	176.1	-157	-159.8	150.9	0	0	111.7	V205 T206 I212 K213 L228	V205-E209 WeakPolarHBondContact O-CB 3.36Å; V205-E209 PolarHBondContact O-N 3.03Å; T206-E209 PolarHBondContact O-N 3.02Å; E209-I212 PolarHBondContact O-N 3.37Å; E209-K213 WeakPolarHBondContact O-CB 3.43Å; E209-K213 VanDerWaalsContact O-CG 3.25Å; E209-K213 WeakPolarHBondContact O-CG 3.27Å; E209-K213 PolarHBondContact O-N 2.85Å; E209-K213 WeakPolarHBondContact OE1-CE 3.26Å; E209-K213 IonicContact OE1-NZ 2.76Å; E209-K213 PolarHBondContact OE1-NZ 2.92Å; E209-K213 IonicContact OE2-NZ 2.71Å; E209-L228 HydrophobicContact CB-CD1 3.61Å; E209-L228 HydrophobicContact CG-CD1 3.86Å
210	D	96.5	Very high	96.4	Very high	83 Å²	83	54.8 Å²	54.8	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-69.9	-34.3	176.6	-73	-12.7	0	0	0	112.3	T206 K213 K214	T206-D210 PolarHBondContact O-N 3.36Å; D210-K213 IonicContact OD1-NZ 3.3Å; D210-K213 PolarHBondContact OD1-NZ 2.87Å; D210-K214 WeakPolarHBondContact O-CB 3.11Å; D210-K214 PolarHBondContact O-N 2.94Å; D210-K214 VanDerWaalsContact O-N 3.1Å
211	E	95.6	Very high	96.6	Very high	47 Å²	47	56.1 Å²	56.1	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-43.8	170.8	-177	158.8	169.5	0	0	111.6	R170 L198 A207 V208 K214 Y215	R170-E211 IonicContact CZ-OE1 3.64Å; R170-E211 IonicContact NH1-OE1 2.6Å; R170-E211 PolarHBondContact NH1-OE1 2.85Å; R170-E211 IonicContact NH2-OE1 3.67Å; R170-E211 PolarHBondContact NH2-OE1 2.97Å; L198-E211 HydrophobicContact CD1-CG 4.23Å; A207-E211 WeakPolarHBondContact O-CB 3.43Å; A207-E211 PolarHBondContact O-N 3.1Å; V208-E211 PolarHBondContact O-N 2.84Å; E211-K214 PolarHBondContact O-N 3.43Å; E211-Y215 HydrophobicContact CG-CD2 3.63Å; E211-Y215 HydrophobicContact CG-CE2 3.77Å; E211-Y215 WeakPolarHBondContact O-CD2 3.42Å; E211-Y215 PolarHBondContact O-N 3.08Å
212	I	97.4	Very high	96.8	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-47	176	-68.5	159.8	0	0	0	111	V208 E209 K214 Y215 T216 M225 L228 I234	V208-I212 HydrophobicContact CG1-CD1 3.73Å; V208-I212 HydrophobicContact CG1-CG1 4.39Å; V208-I212 WeakPolarHBondContact O-CD1 3.46Å; V208-I212 WeakPolarHBondContact O-CG1 3.26Å; V208-I212 PolarHBondContact O-N 3.2Å; E209-I212 PolarHBondContact O-N 3.37Å; I212-K214 PolarHBondContact O-N 2.91Å; I212-Y215 PolarHBondContact O-N 3.12Å; I212-T216 WeakPolarHBondContact CG2-OG1 3.47Å; I212-T216 PolarHBondContact O-N 3.49Å; I212-T216 VanDerWaalsContact O-N 3.16Å; I212-T216 PolarHBondContact O-OG1 3.35Å; I212-M225 HydrophobicContact CD1-CB 4.23Å; I212-M225 HydrophobicContact CD1-CG 4.48Å; I212-M225 HydrophobicContact CG2-CB 4.14Å; I212-L228 HydrophobicContact CD1-CD1 4.27Å; I212-L228 HydrophobicContact CD1-CD2 3.58Å; I212-I234 HydrophobicContact CD1-CD1 3.54Å; I212-I234 HydrophobicContact CG1-CD1 4.23Å
213	K	96.6	Very high	97	Very high	101 Å²	101	43.3 Å²	43.3	44%	0.439	24%	0.236	S	C	.	.	H	α-helix	trans	-56.1	-37.7	177.9	-76.2	167.1	-168.6	153.7	0	112.2	E209 D210	E209-K213 WeakPolarHBondContact O-CB 3.43Å; E209-K213 VanDerWaalsContact O-CG 3.25Å; E209-K213 WeakPolarHBondContact O-CG 3.27Å; E209-K213 PolarHBondContact O-N 2.85Å; E209-K213 WeakPolarHBondContact OE1-CE 3.26Å; E209-K213 IonicContact OE1-NZ 2.76Å; E209-K213 PolarHBondContact OE1-NZ 2.92Å; E209-K213 IonicContact OE2-NZ 2.71Å; D210-K213 IonicContact OD1-NZ 3.3Å; D210-K213 PolarHBondContact OD1-NZ 2.87Å
214	K	94.6	Very high	97.2	Very high	113 Å²	113	40.2 Å²	40.2	49%	0.491	22%	0.219	S	C	.	.	H	α-helix	trans	-81	-31.8	-175.5	-171.2	173.8	170	-165.2	0	114.3	D79 D210 E211 I212	D79-K214 IonicContact OD1-NZ 3.82Å; D79-K214 PolarHBondContact OD1-NZ 3.45Å; D79-K214 IonicContact OD2-NZ 2.65Å; D210-K214 WeakPolarHBondContact O-CB 3.11Å; D210-K214 PolarHBondContact O-N 2.94Å; D210-K214 VanDerWaalsContact O-N 3.1Å; E211-K214 PolarHBondContact O-N 3.43Å; I212-K214 PolarHBondContact O-N 2.91Å
215	Y	95.6	Very high	97.3	Very high	40 Å²	40	39.2 Å²	39.2	16%	0.157	21%	0.206	C	C	.	.	H	α-helix	trans	-117.8	7.4	-170.7	-52.5	-60.5	0	0	0	115.8	I82 S192 E211 I212	I82-Y215 HydrophobicContact CD1-CE1 3.81Å; I82-Y215 WeakPolarHBondContact CD1-OH 3.43Å; S192-Y215 WeakPolarHBondContact CB-O 3.44Å; S192-Y215 PolarHBondContact OG-O 3.32Å; E211-Y215 HydrophobicContact CG-CD2 3.63Å; E211-Y215 HydrophobicContact CG-CE2 3.77Å; E211-Y215 WeakPolarHBondContact O-CD2 3.42Å; E211-Y215 PolarHBondContact O-N 3.08Å; I212-Y215 PolarHBondContact O-N 3.12Å
216	T	97.6	Very high	97.3	Very high	11 Å²	11	39.7 Å²	39.7	7%	0.067	21%	0.207	C	C	.	.	S	Bend	trans	-137.3	134.8	-176.4	70.3	0	0	0	0	113.3	R170 I212 R221 M225	R170-T216 HydrophobicContact CB-CG2 3.86Å; R170-T216 WeakPolarHBondContact O-CG2 3.36Å; I212-T216 WeakPolarHBondContact CG2-OG1 3.47Å; I212-T216 PolarHBondContact O-N 3.49Å; I212-T216 VanDerWaalsContact O-N 3.16Å; I212-T216 PolarHBondContact O-OG1 3.35Å; T216-R221 PolarHBondContact O-NE 3.03Å; T216-R221 PolarHBondContact O-NH2 3.47Å; T216-R221 PolarHBondContact OG1-NE 2.72Å; T216-M225 HydrophobicContact CG2-CE 4.18Å; T216-M225 HydrophobicContact CG2-SD 4.35Å
217	T	97.1	Very high	97.3	Very high	47 Å²	47	39 Å²	39	29%	0.288	20%	0.2	S	C	.	.			trans	-73.2	124.4	174.1	-55.8	0	0	0	0	111.1	D171 K173 S219 Y220 R221	D171-T217 VanDerWaalsContact OD1-CB 3.29Å; D171-T217 WeakPolarHBondContact OD1-CB 3.28Å; D171-T217 PolarHBondContact OD1-N 3.04Å; D171-T217 PolarHBondContact OD1-OG1 3.33Å; K173-T217 PolarHBondContact NZ-OG1 3.47Å; K173-T217 VanDerWaalsContact NZ-OG1 3.11Å; T217-S219 PolarHBondContact O-N 2.65Å; T217-Y220 HydrophobicContact CG2-CD2 3.79Å; T217-Y220 HydrophobicContact CG2-CE2 4.15Å; T217-Y220 PolarHBondContact O-N 3.29Å; T217-R221 PolarHBondContact O-N 2.97Å
218	L	97.9	Very high	97.4	Very high	35 Å²	35	36.4 Å²	36.4	18%	0.183	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-51.3	-49.3	-169.9	175.4	56	0	0	0	114.2	Y220 R221 I226 E259 Q261	L218-Y220 PolarHBondContact O-N 2.91Å; L218-Y220 VanDerWaalsContact O-N 3.08Å; L218-R221 WeakPolarHBondContact O-CB 3.45Å; L218-R221 PolarHBondContact O-N 2.82Å; L218-I226 HydrophobicContact CD1-CD1 4.1Å; L218-E259 HydrophobicContact CD2-CB 3.84Å; L218-E259 HydrophobicContact CD2-CG 4.13Å; L218-E259 HydrophobicContact CG-CB 4.32Å; L218-E259 HydrophobicContact CG-CG 4.46Å; L218-Q261 HydrophobicContact CD1-CG 4.21Å
219	S	98.2	Very high	97.3	Very high	11 Å²	11	44.6 Å²	44.6	8%	0.077	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-63.5	-12.8	-178.6	-50.9	0	0	0	0	115.9	T217 C245 G258	T217-S219 PolarHBondContact O-N 2.65Å; S219-C245 PolarHBondContact O-SG 3.18Å; S219-G258 WeakPolarHBondContact CA-O 3.47Å; S219-G258 WeakPolarHBondContact CB-O 3.42Å; S219-G258 PolarHBondContact OG-O 2.82Å
220	Y	98.8	Very high	96.9	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.039	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-108.7	-0.6	177.6	-61.3	-94.7	0	0	0	112.4	L172 K173 V174 E175 T217 L218 C245 L246 K249 L255	L172-Y220 VanDerWaalsContact O-CD1 3.26Å; L172-Y220 WeakPolarHBondContact O-CD1 3.47Å; K173-Y220 HydrophobicContact CB-CD1 4.3Å; K173-Y220 HydrophobicContact CB-CD2 4Å; K173-Y220 HydrophobicContact CB-CE1 3.82Å; K173-Y220 HydrophobicContact CB-CE2 3.45Å; K173-Y220 VanDerWaalsContact CB-CE2 3.45Å; K173-Y220 HydrophobicContact CB-CG 4.37Å; K173-Y220 WeakPolarHBondContact CB-OH 3.43Å; V174-Y220 PolarHBondContact N-OH 3.31Å; E175-Y220 PolarHBondContact OE2-OH 3.47Å; T217-Y220 HydrophobicContact CG2-CD2 3.79Å; T217-Y220 HydrophobicContact CG2-CE2 4.15Å; T217-Y220 PolarHBondContact O-N 3.29Å; L218-Y220 PolarHBondContact O-N 2.91Å; L218-Y220 VanDerWaalsContact O-N 3.08Å; Y220-C245 HydrophobicContact CD1-CB 3.55Å; Y220-C245 HydrophobicContact CE1-CB 4.07Å; Y220-C245 HydrophobicContact CG-CB 4.34Å; Y220-L246 HydrophobicContact CE1-CB 4.34Å; Y220-K249 WeakPolarHBondContact OH-CD 3.43Å; Y220-L255 HydrophobicContact CD1-CD2 4.32Å; Y220-L255 HydrophobicContact CD2-CD2 4.45Å; Y220-L255 HydrophobicContact CE1-CD2 3.84Å; Y220-L255 HydrophobicContact CE2-CD1 4.45Å; Y220-L255 HydrophobicContact CE2-CD2 4.03Å
221	R	98.7	Very high	96.5	Very high	30 Å²	30	41.7 Å²	41.7	11%	0.113	21%	0.214	C	C	.	.			trans	-66.2	135.1	177.4	-70.7	-179.5	-169.6	160.2	9.1	110.8	T216 T217 L218 M225 I226 W241 I264	T216-R221 PolarHBondContact O-NE 3.03Å; T216-R221 PolarHBondContact O-NH2 3.47Å; T216-R221 PolarHBondContact OG1-NE 2.72Å; T217-R221 PolarHBondContact O-N 2.97Å; L218-R221 WeakPolarHBondContact O-CB 3.45Å; L218-R221 PolarHBondContact O-N 2.82Å; R221-M225 HydrophobicContact CB-CB 4.1Å; R221-M225 HydrophobicContact CB-SD 4.36Å; R221-M225 HydrophobicContact CG-CB 4.4Å; R221-M225 HydrophobicContact CG-SD 4.32Å; R221-I226 HydrophobicContact CB-CD1 3.87Å; R221-I226 HydrophobicContact CB-CG1 4.33Å; R221-I226 HydrophobicContact CG-CD1 4.48Å; R221-W241 PolarHBondContact O-NE1 3.08Å; R221-I264 VanDerWaalsContact O-CG2 3.32Å; R221-I264 WeakPolarHBondContact O-CG2 3.32Å
222	A	98.7	Very high	96.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.			trans	-76.4	159.7	172.4	0	0	0	0	0	111.8	E224 M225 I226 A238 W241	A222-E224 VanDerWaalsContact C-N 3.25Å; A222-E224 VanDerWaalsContact CB-CD 3.41Å; A222-E224 HydrophobicContact CB-CG 4.4Å; A222-E224 WeakPolarHBondContact CB-OE1 3.4Å; A222-E224 WeakPolarHBondContact CB-OE2 3.35Å; A222-E224 PolarHBondContact O-N 3.18Å; A222-M225 WeakPolarHBondContact O-CA 3.18Å; A222-M225 WeakPolarHBondContact O-CB 3.15Å; A222-M225 PolarHBondContact O-N 2.73Å; A222-I226 PolarHBondContact O-N 2.74Å; A222-A238 HydrophobicContact CB-CB 4.07Å; A222-W241 VanDerWaalsContact CA-CD1 3.45Å; A222-W241 HydrophobicContact CB-CB 3.74Å; A222-W241 HydrophobicContact CB-CD2 4.36Å; A222-W241 HydrophobicContact CB-CG 3.73Å
223	P	98.6	Very high	96.5	Very high	13 Å²	13	43.4 Å²	43.4	8%	0.084	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-54.2	-37.2	178.1	-32.1	40.8	0	0	0	114.1	M225 I226 N227 W241 I264 P291	P223-M225 PolarHBondContact O-N 2.87Å; P223-I226 PolarHBondContact O-N 3.29Å; P223-N227 PolarHBondContact O-N 3.16Å; P223-W241 HydrophobicContact CG-CE3 4.35Å; P223-W241 HydrophobicContact CG-CH2 3.69Å; P223-W241 HydrophobicContact CG-CZ2 4.03Å; P223-W241 HydrophobicContact CG-CZ3 3.89Å; P223-I264 HydrophobicContact CG-CG2 4.23Å; P223-I264 WeakPolarHBondContact CG-O 3.21Å; P223-P291 HydrophobicContact CG-CB 4.12Å
224	E	98.5	Very high	96.5	Very high	8 Å²	8	38.6 Å²	38.6	4%	0.037	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-68.8	-11.9	174.9	68	-83.5	-169.9	0	0	114.5	A222 L228 K232 I234 A238 R296	A222-E224 VanDerWaalsContact C-N 3.25Å; A222-E224 VanDerWaalsContact CB-CD 3.41Å; A222-E224 HydrophobicContact CB-CG 4.4Å; A222-E224 WeakPolarHBondContact CB-OE1 3.4Å; A222-E224 WeakPolarHBondContact CB-OE2 3.35Å; A222-E224 PolarHBondContact O-N 3.18Å; E224-L228 WeakPolarHBondContact O-CD2 3.38Å; E224-K232 HydrophobicContact CB-CB 3.85Å; E224-I234 HydrophobicContact CG-CG1 4.26Å; E224-I234 WeakPolarHBondContact O-CG1 3.46Å; E224-A238 WeakPolarHBondContact OE1-CA 3.18Å; E224-R296 IonicContact OE1-CZ 3.12Å; E224-R296 IonicContact OE1-NH1 2.68Å; E224-R296 PolarHBondContact OE1-NH1 2.77Å; E224-R296 IonicContact OE1-NH2 3.43Å; E224-R296 IonicContact OE2-CZ 2.74Å; E224-R296 IonicContact OE2-NH1 2.77Å; E224-R296 PolarHBondContact OE2-NH1 3.11Å; E224-R296 IonicContact OE2-NH2 3.93Å; E224-R296 PolarHBondContact OE2-NH2 2.59Å
225	M	98.4	Very high	96.7	Very high	11 Å²	11	34.5 Å²	34.5	5%	0.054	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-94	-6.8	169.2	-66.5	176.9	160	0	0	113.1	R170 I212 T216 R221 A222 P223 I234 A238	R170-M225 HydrophobicContact CB-CE 4.37Å; R170-M225 HydrophobicContact CG-CE 4.3Å; I212-M225 HydrophobicContact CD1-CB 4.23Å; I212-M225 HydrophobicContact CD1-CG 4.48Å; I212-M225 HydrophobicContact CG2-CB 4.14Å; T216-M225 HydrophobicContact CG2-CE 4.18Å; T216-M225 HydrophobicContact CG2-SD 4.35Å; R221-M225 HydrophobicContact CB-CB 4.1Å; R221-M225 HydrophobicContact CB-SD 4.36Å; R221-M225 HydrophobicContact CG-CB 4.4Å; R221-M225 HydrophobicContact CG-SD 4.32Å; A222-M225 WeakPolarHBondContact O-CA 3.18Å; A222-M225 WeakPolarHBondContact O-CB 3.15Å; A222-M225 PolarHBondContact O-N 2.73Å; P223-M225 PolarHBondContact O-N 2.87Å; M225-I234 HydrophobicContact CE-CG2 3.62Å; M225-I234 HydrophobicContact CG-CD1 4.17Å; M225-I234 HydrophobicContact CG-CG1 4.47Å; M225-I234 HydrophobicContact CG-CG2 3.97Å; M225-A238 HydrophobicContact CE-CB 3.65Å; M225-A238 HydrophobicContact SD-CB 4.21Å
226	I	98	Very high	96.9	Very high	35 Å²	35	34.4 Å²	34.4	18%	0.179	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-56.1	177.5	-57.7	-57	0	0	0	109.9	L218 R221 A222 P223 L228 Q261 I264 C265	L218-I226 HydrophobicContact CD1-CD1 4.1Å; R221-I226 HydrophobicContact CB-CD1 3.87Å; R221-I226 HydrophobicContact CB-CG1 4.33Å; R221-I226 HydrophobicContact CG-CD1 4.48Å; A222-I226 PolarHBondContact O-N 2.74Å; P223-I226 PolarHBondContact O-N 3.29Å; I226-L228 PolarHBondContact O-N 2.94Å; I226-Q261 HydrophobicContact CD1-CG 4.27Å; I226-Q261 HydrophobicContact CG2-CB 3.89Å; I226-Q261 HydrophobicContact CG2-CG 4.22Å; I226-I264 HydrophobicContact CG1-CG2 3.93Å; I226-C265 VanDerWaalsContact CG2-SG 3.59Å
227	N	96.6	Very high	96.9	Very high	78 Å²	78	35.7 Å²	35.7	42%	0.417	20%	0.196	S	C	.	.			trans	-91.5	73.8	178.8	-172.3	-0.3	0	0	0	111.5	P223 Y229 A230	P223-N227 PolarHBondContact O-N 3.16Å; N227-Y229 PolarHBondContact O-N 3.5Å; N227-Y229 VanDerWaalsContact O-N 3.15Å; N227-Y229 PolarHBondContact OD1-N 3.37Å; N227-A230 HydrophobicContact CB-CB 4.47Å; N227-A230 WeakPolarHBondContact O-CB 3.36Å; N227-A230 PolarHBondContact O-N 2.84Å; N227-A230 VanDerWaalsContact O-N 3.12Å; N227-A230 PolarHBondContact OD1-N 3.39Å
228	L	96.8	Very high	97	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-62.7	-19	179.7	-56.1	-175.5	0	0	0	113.8	P200 V205 V208 E209 I212 E224 I226 A230 I234	P200-L228 HydrophobicContact CB-CB 4.02Å; P200-L228 WeakPolarHBondContact CB-O 3.17Å; P200-L228 HydrophobicContact CG-CB 4.28Å; P200-L228 HydrophobicContact CG-CD2 4.08Å; V205-L228 HydrophobicContact CG1-CB 3.82Å; V205-L228 HydrophobicContact CG1-CD1 3.92Å; V208-L228 HydrophobicContact CG1-CD1 4.47Å; V208-L228 HydrophobicContact CG1-CD2 4.35Å; E209-L228 HydrophobicContact CB-CD1 3.61Å; E209-L228 HydrophobicContact CG-CD1 3.86Å; I212-L228 HydrophobicContact CD1-CD1 4.27Å; I212-L228 HydrophobicContact CD1-CD2 3.58Å; E224-L228 WeakPolarHBondContact O-CD2 3.38Å; I226-L228 PolarHBondContact O-N 2.94Å; L228-A230 VanDerWaalsContact C-N 3.33Å; L228-I234 HydrophobicContact CD2-CD1 4.13Å
229	Y	94.7	Very high	97.1	Very high	177 Å²	177	31.9 Å²	31.9	69%	0.694	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-81.6	-9.7	178.3	-62.2	-80	0	0	0	113.4	V205 N227 G231	V205-Y229 HydrophobicContact CG1-CE1 4.17Å; V205-Y229 HydrophobicContact CG1-CE2 4.21Å; V205-Y229 HydrophobicContact CG2-CE1 4.21Å; N227-Y229 PolarHBondContact O-N 3.5Å; N227-Y229 VanDerWaalsContact O-N 3.15Å; N227-Y229 PolarHBondContact OD1-N 3.37Å; Y229-G231 PolarHBondContact O-N 2.83Å; Y229-G231 VanDerWaalsContact O-N 3.16Å
230	A	90.7	Very high	97.1	Very high	56 Å²	56	31.4 Å²	31.4	46%	0.463	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-70.2	-2.7	175.4	0	0	0	0	0	114.3	N227 L228 K232	N227-A230 HydrophobicContact CB-CB 4.47Å; N227-A230 WeakPolarHBondContact O-CB 3.36Å; N227-A230 PolarHBondContact O-N 2.84Å; N227-A230 VanDerWaalsContact O-N 3.12Å; N227-A230 PolarHBondContact OD1-N 3.39Å; L228-A230 VanDerWaalsContact C-N 3.33Å; A230-K232 HydrophobicContact CB-CG 4.37Å; A230-K232 PolarHBondContact O-N 3.31Å; A230-K232 VanDerWaalsContact O-N 3.14Å
231	G	87.6	Confident	97.1	Very high	42 Å²	42	31 Å²	31	43%	0.433	17%	0.17	S	C	.	.			trans	69.7	6	177.8	0	0	0	0	0	115.5	Y229	Y229-G231 PolarHBondContact O-N 2.83Å; Y229-G231 VanDerWaalsContact O-N 3.16Å
232	K	94.9	Very high	97.1	Very high	64 Å²	64	29.7 Å²	29.7	28%	0.278	17%	0.166	S	C	.	.			trans	-72.5	142.3	177.7	-65.9	-75.9	177	163.6	0	110.9	P200 E224 A230 D292 Q293 E294	P200-K232 WeakPolarHBondContact CD-O 3.16Å; E224-K232 HydrophobicContact CB-CB 3.85Å; A230-K232 HydrophobicContact CB-CG 4.37Å; A230-K232 PolarHBondContact O-N 3.31Å; A230-K232 VanDerWaalsContact O-N 3.14Å; K232-D292 IonicContact NZ-OD1 2.74Å; K232-D292 PolarHBondContact NZ-OD1 2.71Å; K232-Q293 HydrophobicContact CD-CG 4.1Å; K232-E294 IonicContact NZ-OE1 3.53Å; K232-E294 PolarHBondContact NZ-OE1 2.76Å
233	A	97.1	Very high	97.1	Very high	22 Å²	22	29.7 Å²	29.7	18%	0.182	17%	0.166	C	C	.	.			trans	-76.5	143.3	170.7	0	0	0	0	0	110	V197 L199 T235 Q293	V197-A233 HydrophobicContact CG1-CB 3.88Å; L199-A233 HydrophobicContact CD2-CB 3.58Å; A233-T235 HydrophobicContact CB-CG2 3.9Å; A233-T235 PolarHBondContact O-N 3.1Å; A233-Q293 PolarHBondContact O-NE2 2.96Å; A233-Q293 PolarHBondContact O-OE1 3.21Å
234	I	98.3	Very high	97.1	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-91.8	105.7	174.5	-58.4	172.5	0	0	0	107.9	V197 L198 P200 V208 I212 E224 M225 L228 A238	V197-I234 WeakPolarHBondContact CA-O 3.49Å; L198-I234 HydrophobicContact CB-CB 4.22Å; L198-I234 HydrophobicContact CB-CD1 4.38Å; L198-I234 PolarHBondContact N-O 3.21Å; L198-I234 PolarHBondContact O-N 3Å; P200-I234 HydrophobicContact CG-CD1 4.5Å; V208-I234 HydrophobicContact CG1-CD1 3.86Å; I212-I234 HydrophobicContact CD1-CD1 3.54Å; I212-I234 HydrophobicContact CG1-CD1 4.23Å; E224-I234 HydrophobicContact CG-CG1 4.26Å; E224-I234 WeakPolarHBondContact O-CG1 3.46Å; M225-I234 HydrophobicContact CE-CG2 3.62Å; M225-I234 HydrophobicContact CG-CD1 4.17Å; M225-I234 HydrophobicContact CG-CG1 4.47Å; M225-I234 HydrophobicContact CG-CG2 3.97Å; L228-I234 HydrophobicContact CD2-CD1 4.13Å; I234-A238 HydrophobicContact CG2-CB 4.31Å
235	T	98.4	Very high	97.2	Very high	26 Å²	26	28.7 Å²	28.7	16%	0.16	16%	0.16	C	C	.	.			trans	-117.3	-175.3	-169.8	68.6	0	0	0	0	111.9	V197 A233 K237 A238 Q293	V197-T235 HydrophobicContact CG1-CG2 4.05Å; V197-T235 HydrophobicContact CG2-CG2 4.42Å; A233-T235 HydrophobicContact CB-CG2 3.9Å; A233-T235 PolarHBondContact O-N 3.1Å; T235-K237 PolarHBondContact O-N 3.23Å; T235-K237 VanDerWaalsContact O-N 3.11Å; T235-K237 WeakPolarHBondContact OG1-CB 3.47Å; T235-K237 WeakPolarHBondContact OG1-CG 3.44Å; T235-K237 PolarHBondContact OG1-N 2.8Å; T235-K237 VanDerWaalsContact OG1-N 3.15Å; T235-A238 WeakPolarHBondContact O-CB 3.26Å; T235-A238 PolarHBondContact O-N 3.37Å; T235-Q293 PolarHBondContact OG1-OE1 3.49Å
236	T	98.7	Very high	97.2	Very high	38 Å²	38	28.2 Å²	28.2	23%	0.233	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20	167.9	46	0	0	0	0	113.3	H161 P166 I168 A238 D239 I240	H161-T236 HydrophobicContact CB-CG2 4.28Å; H161-T236 PolarHBondContact CE1-O 2.99Å; H161-T236 VanDerWaalsContact CE1-O 3.22Å; P166-T236 HydrophobicContact CB-CG2 4.18Å; I168-T236 HydrophobicContact CG1-CG2 4.01Å; T236-A238 PolarHBondContact O-N 3.13Å; T236-D239 WeakPolarHBondContact O-CB 3.26Å; T236-D239 PolarHBondContact O-N 2.97Å; T236-D239 VanDerWaalsContact O-N 3.14Å; T236-I240 PolarHBondContact O-N 3.32Å
237	K	98.8	Very high	97.2	Very high	38 Å²	38	26.5 Å²	26.5	17%	0.165	15%	0.149	C	C	.	.	H	α-helix	trans	-61.9	-23.3	172.5	-62.3	-65.2	-169.9	79.2	0	113.2	T235 I240 W241 Q293 R296 P297	T235-K237 PolarHBondContact O-N 3.23Å; T235-K237 VanDerWaalsContact O-N 3.11Å; T235-K237 WeakPolarHBondContact OG1-CB 3.47Å; T235-K237 WeakPolarHBondContact OG1-CG 3.44Å; T235-K237 PolarHBondContact OG1-N 2.8Å; T235-K237 VanDerWaalsContact OG1-N 3.15Å; K237-I240 WeakPolarHBondContact O-CB 3.45Å; K237-I240 PolarHBondContact O-N 3.14Å; K237-W241 PolarHBondContact O-N 3.43Å; K237-Q293 HydrophobicContact CB-CB 3.86Å; K237-Q293 HydrophobicContact CG-CB 4.33Å; K237-Q293 WeakPolarHBondContact CG-O 3.39Å; K237-Q293 PolarHBondContact NZ-O 2.88Å; K237-R296 VanDerWaalsContact C-NH1 3.33Å; K237-R296 WeakPolarHBondContact CE-O 3.31Å; K237-R296 PolarHBondContact NZ-O 2.65Å; K237-R296 WeakPolarHBondContact O-CD 3.41Å; K237-R296 PolarHBondContact O-NH1 3.38Å; K237-P297 WeakPolarHBondContact CD-O 3.34Å
238	A	98.8	Very high	97.3	Very high	3 Å²	3	23.6 Å²	23.6	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-67.3	-36.5	174.7	0	0	0	0	0	112.1	A222 E224 M225 I234 T235 T236 I240 W241 A242	A222-A238 HydrophobicContact CB-CB 4.07Å; E224-A238 WeakPolarHBondContact OE1-CA 3.18Å; M225-A238 HydrophobicContact CE-CB 3.65Å; M225-A238 HydrophobicContact SD-CB 4.21Å; I234-A238 HydrophobicContact CG2-CB 4.31Å; T235-A238 WeakPolarHBondContact O-CB 3.26Å; T235-A238 PolarHBondContact O-N 3.37Å; T236-A238 PolarHBondContact O-N 3.13Å; A238-I240 VanDerWaalsContact C-N 3.3Å; A238-I240 PolarHBondContact O-N 3.4Å; A238-W241 WeakPolarHBondContact O-CB 3.36Å; A238-W241 PolarHBondContact O-N 2.95Å; A238-A242 PolarHBondContact O-N 3.05Å; A238-A242 VanDerWaalsContact O-N 3.1Å
239	D	98.9	Very high	97.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-33.5	172.6	-72.2	-23.5	0	0	0	111.5	H161 I168 H169 R170 L172 T236 W241 A242 L243	H161-D239 IonicContact CD2-OD2 3.26Å; H161-D239 IonicContact CE1-OD2 3.95Å; H161-D239 WeakPolarHBondContact NE2-CB 3.5Å; H161-D239 IonicContact NE2-OD2 2.85Å; H161-D239 PolarHBondContact NE2-OD2 2.78Å; I168-D239 WeakPolarHBondContact CA-OD2 3.44Å; I168-D239 WeakPolarHBondContact CG2-OD2 3.36Å; H169-D239 PolarHBondContact N-OD1 2.83Å; H169-D239 PolarHBondContact N-OD2 3.08Å; R170-D239 PolarHBondContact N-OD1 2.95Å; L172-D239 HydrophobicContact CD1-CB 3.63Å; T236-D239 WeakPolarHBondContact O-CB 3.26Å; T236-D239 PolarHBondContact O-N 2.97Å; T236-D239 VanDerWaalsContact O-N 3.14Å; D239-W241 VanDerWaalsContact C-N 3.33Å; D239-W241 PolarHBondContact O-N 2.96Å; D239-A242 CarbonylContact O-C 3.55Å; D239-A242 PolarHBondContact O-N 2.73Å; D239-L243 WeakPolarHBondContact O-CG 3.4Å; D239-L243 PolarHBondContact O-N 3.45Å
240	I	98.9	Very high	97.6	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-38.1	176.3	-54.5	-58.7	0	0	0	111.4	T236 K237 A238 L243 G244 M288 R296 P297 I299 V302	T236-I240 PolarHBondContact O-N 3.32Å; K237-I240 WeakPolarHBondContact O-CB 3.45Å; K237-I240 PolarHBondContact O-N 3.14Å; A238-I240 VanDerWaalsContact C-N 3.3Å; A238-I240 PolarHBondContact O-N 3.4Å; I240-L243 HydrophobicContact CD1-CD1 4.32Å; I240-L243 WeakPolarHBondContact O-CB 3.44Å; I240-L243 PolarHBondContact O-N 3.33Å; I240-G244 PolarHBondContact O-N 2.97Å; I240-G244 VanDerWaalsContact O-N 3.13Å; I240-M288 HydrophobicContact CG2-CB 4.34Å; I240-M288 HydrophobicContact CG2-CG 3.99Å; I240-R296 HydrophobicContact CG2-CG 4.17Å; I240-P297 HydrophobicContact CG2-CG 4.09Å; I240-I299 HydrophobicContact CD1-CB 3.89Å; I240-I299 HydrophobicContact CD1-CD1 4.03Å; I240-V302 HydrophobicContact CG2-CG2 3.9Å
241	W	98.9	Very high	98	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.3	-44.2	171.4	176.9	-84.5	0	0	0	111.6	R221 A222 P223 K237 A238 D239 L243 G244 C245 F257 I264 L289 P291	R221-W241 PolarHBondContact O-NE1 3.08Å; A222-W241 VanDerWaalsContact CA-CD1 3.45Å; A222-W241 HydrophobicContact CB-CB 3.74Å; A222-W241 HydrophobicContact CB-CD2 4.36Å; A222-W241 HydrophobicContact CB-CG 3.73Å; P223-W241 HydrophobicContact CG-CE3 4.35Å; P223-W241 HydrophobicContact CG-CH2 3.69Å; P223-W241 HydrophobicContact CG-CZ2 4.03Å; P223-W241 HydrophobicContact CG-CZ3 3.89Å; K237-W241 PolarHBondContact O-N 3.43Å; A238-W241 WeakPolarHBondContact O-CB 3.36Å; A238-W241 PolarHBondContact O-N 2.95Å; D239-W241 VanDerWaalsContact C-N 3.33Å; D239-W241 PolarHBondContact O-N 2.96Å; W241-L243 VanDerWaalsContact C-N 3.29Å; W241-L243 PolarHBondContact O-N 2.9Å; W241-G244 WeakPolarHBondContact O-CA 3.44Å; W241-G244 PolarHBondContact O-N 3.16Å; W241-C245 PolarHBondContact O-N 3.37Å; W241-F257 AromaticContact CE2-CE2 3.81Å; W241-F257 HydrophobicContact CH2-CE2 4.01Å; W241-F257 AromaticContact CH2-CZ 3.71Å; W241-F257 HydrophobicContact CH2-CZ 3.71Å; W241-F257 HydrophobicContact CZ2-CD2 4.09Å; W241-F257 HydrophobicContact CZ2-CE1 4.42Å; W241-F257 AromaticContact CZ2-CE2 3.26Å; W241-F257 HydrophobicContact CZ2-CE2 3.26Å; W241-F257 AromaticContact CZ2-CZ 3.46Å; W241-F257 HydrophobicContact CZ2-CZ 3.46Å; W241-F257 VanDerWaalsContact CZ2-CZ 3.46Å; W241-I264 VanDerWaalsContact CH2-O 3.26Å; W241-I264 WeakPolarHBondContact CH2-O 3.49Å; W241-I264 HydrophobicContact CZ2-CB 4.47Å; W241-I264 HydrophobicContact CZ2-CG2 3.89Å; W241-L289 HydrophobicContact CD2-CD2 3.78Å; W241-L289 HydrophobicContact CE3-CD2 4Å; W241-L289 HydrophobicContact CG-CD2 4.23Å; W241-L289 HydrophobicContact CZ2-CD2 4.3Å; W241-L289 HydrophobicContact CZ3-CB 4.32Å; W241-L289 HydrophobicContact CZ3-CD2 4.36Å; W241-P291 HydrophobicContact CZ3-CG 4.31Å
242	A	98.9	Very high	98.4	Very high	4 Å²	4	13.7 Å²	13.7	3%	0.033	7%	0.071	C	C	.	.	H	α-helix	trans	-61.5	-35.3	176.1	0	0	0	0	0	112.4	L172 A238 D239 G244 C245 L246	L172-A242 HydrophobicContact CB-CB 3.96Å; A238-A242 PolarHBondContact O-N 3.05Å; A238-A242 VanDerWaalsContact O-N 3.1Å; D239-A242 CarbonylContact O-C 3.55Å; D239-A242 PolarHBondContact O-N 2.73Å; A242-G244 VanDerWaalsContact C-N 3.33Å; A242-C245 PolarHBondContact O-N 3.07Å; A242-L246 VanDerWaalsContact O-CB 3.28Å; A242-L246 WeakPolarHBondContact O-CB 3.43Å; A242-L246 PolarHBondContact O-N 3.11Å
243	L	98.9	Very high	98.5	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.4	-36.4	169.2	-75.3	178.6	0	0	0	112.7	F150 T153 V157 L172 D239 I240 W241 L246 L247 M288 I299	F150-L243 HydrophobicContact CE2-CB 4.1Å; F150-L243 HydrophobicContact CE2-CD2 4.08Å; F150-L243 HydrophobicContact CZ-CB 4.36Å; T153-L243 HydrophobicContact CG2-CD2 3.71Å; V157-L243 HydrophobicContact CB-CD1 4.32Å; V157-L243 HydrophobicContact CG1-CD1 4.11Å; V157-L243 HydrophobicContact CG2-CD1 4.34Å; V157-L243 HydrophobicContact CG2-CD2 4.23Å; L172-L243 HydrophobicContact CD1-CD2 4.14Å; L172-L243 HydrophobicContact CD1-CG 4.01Å; D239-L243 WeakPolarHBondContact O-CG 3.4Å; D239-L243 PolarHBondContact O-N 3.45Å; I240-L243 HydrophobicContact CD1-CD1 4.32Å; I240-L243 WeakPolarHBondContact O-CB 3.44Å; I240-L243 PolarHBondContact O-N 3.33Å; W241-L243 VanDerWaalsContact C-N 3.29Å; W241-L243 PolarHBondContact O-N 2.9Å; L243-L246 PolarHBondContact O-N 3.34Å; L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 PolarHBondContact O-N 3.17Å; L243-M288 HydrophobicContact CB-SD 3.66Å; L243-I299 HydrophobicContact CD1-CD1 3.62Å
244	G	98.9	Very high	98.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.1	-47.9	171.2	0	0	0	0	0	112.7	I240 W241 A242 L246 L247 Y248	I240-G244 PolarHBondContact O-N 2.97Å; I240-G244 VanDerWaalsContact O-N 3.13Å; W241-G244 WeakPolarHBondContact O-CA 3.44Å; W241-G244 PolarHBondContact O-N 3.16Å; A242-G244 VanDerWaalsContact C-N 3.33Å; G244-L246 VanDerWaalsContact C-N 3.35Å; G244-L246 PolarHBondContact O-N 3.09Å; G244-L247 PolarHBondContact O-N 3.3Å; G244-Y248 WeakPolarHBondContact O-CB 3.48Å; G244-Y248 PolarHBondContact O-N 3.04Å
245	C	98.9	Very high	98.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.4	-39.7	173.8	-73.5	0	0	0	0	112.6	S219 Y220 W241 A242 K249 L255 P256	S219-C245 PolarHBondContact O-SG 3.18Å; Y220-C245 HydrophobicContact CD1-CB 3.55Å; Y220-C245 HydrophobicContact CE1-CB 4.07Å; Y220-C245 HydrophobicContact CG-CB 4.34Å; W241-C245 PolarHBondContact O-N 3.37Å; A242-C245 PolarHBondContact O-N 3.07Å; C245-K249 WeakPolarHBondContact O-CB 3.47Å; C245-K249 PolarHBondContact O-N 3.28Å; C245-L255 HydrophobicContact CB-CD2 4.26Å; C245-P256 HydrophobicContact CB-CG 4.26Å
246	L	98.9	Very high	98.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-48.6	177.9	-173.6	157.1	0	0	0	111.1	F150 T153 V174 I177 Y220 A242 L243 G244 Y248 K249 L250	F150-L246 HydrophobicContact CD2-CD2 4.3Å; T153-L246 HydrophobicContact CG2-CD1 4.38Å; V174-L246 HydrophobicContact CG1-CD2 4.47Å; V174-L246 HydrophobicContact CG1-CG 3.96Å; I177-L246 HydrophobicContact CD1-CD1 4.44Å; I177-L246 HydrophobicContact CG1-CD1 4.22Å; Y220-L246 HydrophobicContact CE1-CB 4.34Å; A242-L246 VanDerWaalsContact O-CB 3.28Å; A242-L246 WeakPolarHBondContact O-CB 3.43Å; A242-L246 PolarHBondContact O-N 3.11Å; L243-L246 PolarHBondContact O-N 3.34Å; G244-L246 VanDerWaalsContact C-N 3.35Å; G244-L246 PolarHBondContact O-N 3.09Å; L246-Y248 PolarHBondContact O-N 2.95Å; L246-K249 CarbonylContact O-C 3.53Å; L246-K249 PolarHBondContact O-N 3.04Å; L246-K249 VanDerWaalsContact O-N 3.14Å; L246-L250 HydrophobicContact CD2-CD1 3.66Å; L246-L250 HydrophobicContact CD2-CG 4.05Å; L246-L250 WeakPolarHBondContact O-CG 3.22Å; L246-L250 PolarHBondContact O-N 2.96Å
247	L	98.9	Very high	98.4	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63	-41.9	178.4	-178.4	57.7	0	0	0	111.7	V146 F150 L243 G244 K249 L250 C251 L281 L284 I285 M288	V146-L247 HydrophobicContact CG1-CD1 3.45Å; V146-L247 VanDerWaalsContact CG1-CD1 3.45Å; F150-L247 HydrophobicContact CB-CD1 4.07Å; F150-L247 HydrophobicContact CD1-CD1 4.25Å; F150-L247 HydrophobicContact CD1-CD2 4.19Å; F150-L247 HydrophobicContact CD2-CB 3.92Å; F150-L247 HydrophobicContact CD2-CD1 3.96Å; F150-L247 HydrophobicContact CD2-CD2 4.49Å; F150-L247 HydrophobicContact CD2-CG 4.33Å; F150-L247 HydrophobicContact CE1-CD2 4.02Å; F150-L247 HydrophobicContact CE2-CB 3.81Å; F150-L247 HydrophobicContact CE2-CD2 4.33Å; F150-L247 HydrophobicContact CE2-CG 4.44Å; F150-L247 HydrophobicContact CG-CD1 3.82Å; F150-L247 HydrophobicContact CG-CD2 4.44Å; F150-L247 HydrophobicContact CG-CG 4.5Å; F150-L247 HydrophobicContact CZ-CB 4.36Å; F150-L247 HydrophobicContact CZ-CD2 4.11Å; L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 PolarHBondContact O-N 3.17Å; G244-L247 PolarHBondContact O-N 3.3Å; L247-K249 VanDerWaalsContact C-N 3.33Å; L247-K249 PolarHBondContact O-N 2.98Å; L247-L250 PolarHBondContact O-N 3.41Å; L247-C251 PolarHBondContact O-N 3.49Å; L247-C251 VanDerWaalsContact O-N 3.09Å; L247-C251 PolarHBondContact O-SG 3.42Å; L247-L281 HydrophobicContact CD1-CD1 4.28Å; L247-L281 HydrophobicContact CD2-CD1 4.24Å; L247-L284 HydrophobicContact CD2-CD2 4.29Å; L247-L284 HydrophobicContact CD2-CG 4.15Å; L247-I285 HydrophobicContact CB-CG1 4.17Å; L247-I285 HydrophobicContact CD2-CG1 3.63Å; L247-I285 HydrophobicContact CG-CD1 4.2Å; L247-I285 HydrophobicContact CG-CG1 3.66Å; L247-M288 HydrophobicContact CB-CE 4.1Å; L247-M288 HydrophobicContact CD2-CE 3.58Å; L247-M288 HydrophobicContact CG-CE 4.48Å
248	Y	98.8	Very high	98.2	Very high	17 Å²	17	15.4 Å²	15.4	7%	0.067	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-43.6	172.8	-175.8	-79.7	0	0	0	111.3	G244 L246 L250 C251 F252 T254 P256 F269 I270 I285	G244-Y248 WeakPolarHBondContact O-CB 3.48Å; G244-Y248 PolarHBondContact O-N 3.04Å; L246-Y248 PolarHBondContact O-N 2.95Å; Y248-L250 PolarHBondContact O-N 3.06Å; Y248-C251 PolarHBondContact O-N 2.95Å; Y248-F252 AromaticContact CD1-CD2 3.94Å; Y248-F252 HydrophobicContact CD1-CD2 3.94Å; Y248-F252 AromaticContact CD2-CD2 3.55Å; Y248-F252 HydrophobicContact CD2-CD2 3.55Å; Y248-F252 AromaticContact CD2-CE2 3.72Å; Y248-F252 HydrophobicContact CD2-CE2 3.72Å; Y248-F252 HydrophobicContact CE1-CB 4.09Å; Y248-F252 AromaticContact CE1-CD2 3.86Å; Y248-F252 HydrophobicContact CE1-CD2 3.86Å; Y248-F252 HydrophobicContact CE1-CG 4.39Å; Y248-F252 AromaticContact CE2-CD2 3.45Å; Y248-F252 HydrophobicContact CE2-CD2 3.45Å; Y248-F252 VanDerWaalsContact CE2-CD2 3.45Å; Y248-F252 AromaticContact CE2-CE2 3.72Å; Y248-F252 HydrophobicContact CE2-CE2 3.72Å; Y248-F252 HydrophobicContact CE2-CG 4.44Å; Y248-F252 AromaticContact CG-CD2 3.79Å; Y248-F252 HydrophobicContact CG-CD2 3.79Å; Y248-F252 HydrophobicContact CG-CE2 4.31Å; Y248-F252 AromaticContact CZ-CD2 3.61Å; Y248-F252 WeakPolarHBondContact O-CD2 3.49Å; Y248-F252 PolarHBondContact O-N 3.11Å; Y248-T254 VanDerWaalsContact CD1-O 3.28Å; Y248-T254 WeakPolarHBondContact CD1-O 3.35Å; Y248-T254 HydrophobicContact CE1-CG2 4.02Å; Y248-T254 WeakPolarHBondContact CE1-O 3.26Å; Y248-P256 HydrophobicContact CD1-CB 3.82Å; Y248-P256 VanDerWaalsContact CD1-CD 3.49Å; Y248-P256 HydrophobicContact CD1-CG 4.08Å; Y248-P256 HydrophobicContact CD2-CB 3.97Å; Y248-P256 HydrophobicContact CE1-CB 4.04Å; Y248-P256 HydrophobicContact CE2-CB 4.18Å; Y248-P256 HydrophobicContact CG-CB 3.8Å; Y248-P256 HydrophobicContact CG-CG 4.05Å; Y248-F269 AromaticContact CD2-CD2 4Å; Y248-F269 HydrophobicContact CD2-CD2 4Å; Y248-F269 HydrophobicContact CD2-CE2 4.22Å; Y248-F269 AromaticContact CE2-CD2 3.85Å; Y248-F269 HydrophobicContact CE2-CD2 3.85Å; Y248-F269 HydrophobicContact CE2-CE2 4.36Å; Y248-I270 WeakPolarHBondContact CE2-O 3.49Å; Y248-I270 PolarHBondContact OH-O 3.47Å; Y248-I285 HydrophobicContact CD2-CD1 4.46Å; Y248-I285 HydrophobicContact CD2-CG2 4.18Å
249	K	98.7	Very high	98	Very high	29 Å²	29	21.7 Å²	21.7	13%	0.126	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-33.2	177.5	-169.4	177.3	179.7	178.1	0	113.1	M133 V174 E175 Y220 C245 L246 L247 C251 F253 T254 L255	M133-K249 HydrophobicContact CE-CG 4.1Å; M133-K249 WeakPolarHBondContact CE-O 3.03Å; V174-K249 HydrophobicContact CG1-CB 4.41Å; V174-K249 HydrophobicContact CG1-CD 4.24Å; V174-K249 HydrophobicContact CG1-CG 4.38Å; V174-K249 HydrophobicContact CG2-CD 3.61Å; V174-K249 HydrophobicContact CG2-CG 4.39Å; E175-K249 IonicContact OE1-NZ 3.19Å; E175-K249 PolarHBondContact OE1-NZ 3.39Å; E175-K249 IonicContact OE2-NZ 3.17Å; Y220-K249 WeakPolarHBondContact OH-CD 3.43Å; C245-K249 WeakPolarHBondContact O-CB 3.47Å; C245-K249 PolarHBondContact O-N 3.28Å; L246-K249 CarbonylContact O-C 3.53Å; L246-K249 PolarHBondContact O-N 3.04Å; L246-K249 VanDerWaalsContact O-N 3.14Å; L247-K249 VanDerWaalsContact C-N 3.33Å; L247-K249 PolarHBondContact O-N 2.98Å; K249-C251 VanDerWaalsContact C-N 3.34Å; K249-F253 WeakPolarHBondContact O-CA 3.49Å; K249-F253 PolarHBondContact O-N 3.36Å; K249-T254 VanDerWaalsContact CA-O 3.31Å; K249-T254 WeakPolarHBondContact CA-O 3.48Å; K249-L255 HydrophobicContact CB-CD2 4.36Å; K249-L255 HydrophobicContact CD-CD1 4.31Å; K249-L255 HydrophobicContact CD-CD2 4.09Å; K249-L255 HydrophobicContact CD-CG 3.99Å
250	L	98.7	Very high	97.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-36.7	171.5	-69.1	177.7	0	0	0	112.3	V129 F141 V146 I149 V174 L246 L247 Y248	V129-L250 HydrophobicContact CG1-CD2 3.75Å; F141-L250 HydrophobicContact CD2-CD2 4.47Å; F141-L250 HydrophobicContact CE2-CD2 4.12Å; V146-L250 HydrophobicContact CG1-CB 3.98Å; V146-L250 HydrophobicContact CG1-CD1 4.4Å; V146-L250 HydrophobicContact CG2-CB 4.23Å; I149-L250 HydrophobicContact CB-CD1 4Å; I149-L250 HydrophobicContact CD1-CD2 4.08Å; I149-L250 HydrophobicContact CG2-CD1 3.66Å; I149-L250 HydrophobicContact CG2-CD2 4.09Å; V174-L250 HydrophobicContact CG1-CD2 3.86Å; V174-L250 HydrophobicContact CG1-CG 4.21Å; L246-L250 HydrophobicContact CD2-CD1 3.66Å; L246-L250 HydrophobicContact CD2-CG 4.05Å; L246-L250 WeakPolarHBondContact O-CG 3.22Å; L246-L250 PolarHBondContact O-N 2.96Å; L247-L250 PolarHBondContact O-N 3.41Å; Y248-L250 PolarHBondContact O-N 3.06Å
251	C	98.3	Very high	97.8	Very high	7 Å²	7	29.2 Å²	29.2	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-73.9	-52.9	178	-61.8	0	0	0	0	112.1	L247 Y248 K249 F277	L247-C251 PolarHBondContact O-N 3.49Å; L247-C251 VanDerWaalsContact O-N 3.09Å; L247-C251 PolarHBondContact O-SG 3.42Å; Y248-C251 PolarHBondContact O-N 2.95Å; K249-C251 VanDerWaalsContact C-N 3.34Å; C251-F277 HydrophobicContact CB-CD2 3.91Å; C251-F277 HydrophobicContact CB-CE1 4.47Å; C251-F277 HydrophobicContact CB-CE2 3.73Å; C251-F277 HydrophobicContact CB-CG 4.37Å; C251-F277 HydrophobicContact CB-CZ 4.02Å; C251-F277 WeakPolarHBondContact O-CE2 3.45Å; C251-F277 WeakPolarHBondContact O-CZ 3.35Å
252	F	97	Very high	97.7	Very high	37 Å²	37	34 Å²	34	16%	0.162	19%	0.188	C	C	.	.	H	α-helix	trans	-111.9	1.9	-163.4	-51.9	-64.8	0	0	0	114.4	Y248 T254 V271 P272 F277 I285	Y248-F252 AromaticContact CD1-CD2 3.94Å; Y248-F252 HydrophobicContact CD1-CD2 3.94Å; Y248-F252 AromaticContact CD2-CD2 3.55Å; Y248-F252 HydrophobicContact CD2-CD2 3.55Å; Y248-F252 AromaticContact CD2-CE2 3.72Å; Y248-F252 HydrophobicContact CD2-CE2 3.72Å; Y248-F252 HydrophobicContact CE1-CB 4.09Å; Y248-F252 AromaticContact CE1-CD2 3.86Å; Y248-F252 HydrophobicContact CE1-CD2 3.86Å; Y248-F252 HydrophobicContact CE1-CG 4.39Å; Y248-F252 AromaticContact CE2-CD2 3.45Å; Y248-F252 HydrophobicContact CE2-CD2 3.45Å; Y248-F252 VanDerWaalsContact CE2-CD2 3.45Å; Y248-F252 AromaticContact CE2-CE2 3.72Å; Y248-F252 HydrophobicContact CE2-CE2 3.72Å; Y248-F252 HydrophobicContact CE2-CG 4.44Å; Y248-F252 AromaticContact CG-CD2 3.79Å; Y248-F252 HydrophobicContact CG-CD2 3.79Å; Y248-F252 HydrophobicContact CG-CE2 4.31Å; Y248-F252 AromaticContact CZ-CD2 3.61Å; Y248-F252 WeakPolarHBondContact O-CD2 3.49Å; Y248-F252 PolarHBondContact O-N 3.11Å; F252-T254 HydrophobicContact CB-CG2 4.4Å; F252-T254 PolarHBondContact O-N 3.24Å; F252-V271 HydrophobicContact CE1-CG1 4.47Å; F252-V271 HydrophobicContact CZ-CG1 3.91Å; F252-P272 HydrophobicContact CD1-CG 4Å; F252-P272 HydrophobicContact CE1-CG 4.25Å; F252-F277 AromaticContact CE1-CD2 3.91Å; F252-F277 HydrophobicContact CE1-CD2 3.91Å; F252-F277 HydrophobicContact CE1-CE2 4.29Å; F252-F277 HydrophobicContact CZ-CD2 4.32Å; F252-I285 HydrophobicContact CE2-CD1 4.15Å
253	F	97.1	Very high	97.6	Very high	47 Å²	47	34.8 Å²	34.8	21%	0.206	20%	0.195	C	C	.	.	S	Bend	trans	57.8	3.6	179.6	-72.6	15.9	0	0	0	115.6	M133 R136 L137 F141 K249	M133-F253 HydrophobicContact CB-CD2 4.3Å; M133-F253 HydrophobicContact CB-CE1 4.23Å; M133-F253 HydrophobicContact CB-CE2 3.81Å; M133-F253 HydrophobicContact CB-CZ 3.76Å; M133-F253 HydrophobicContact CE-CB 4.12Å; M133-F253 HydrophobicContact CE-CD1 3.45Å; M133-F253 VanDerWaalsContact CE-CD1 3.45Å; M133-F253 HydrophobicContact CE-CD2 4.37Å; M133-F253 HydrophobicContact CE-CE1 3.87Å; M133-F253 HydrophobicContact CE-CG 3.72Å; M133-F253 HydrophobicContact CE-CZ 4.48Å; M133-F253 HydrophobicContact CG-CD1 4.4Å; M133-F253 HydrophobicContact CG-CE1 3.87Å; M133-F253 HydrophobicContact CG-CE2 4.36Å; M133-F253 HydrophobicContact CG-CZ 3.83Å; M133-F253 VanDerWaalsContact O-CE2 3.28Å; M133-F253 WeakPolarHBondContact O-CE2 3.4Å; R136-F253 HydrophobicContact CB-CE2 4.25Å; R136-F253 HydrophobicContact CB-CZ 4.24Å; L137-F253 HydrophobicContact CD2-CD2 4.25Å; F141-F253 AromaticContact CD2-CE1 3.68Å; F141-F253 HydrophobicContact CD2-CE1 3.68Å; F141-F253 HydrophobicContact CD2-CZ 4.09Å; F141-F253 AromaticContact CE2-CE1 3.97Å; F141-F253 HydrophobicContact CE2-CE1 3.97Å; F141-F253 HydrophobicContact CE2-CZ 4.21Å; F141-F253 HydrophobicContact CG-CE1 4.41Å; K249-F253 WeakPolarHBondContact O-CA 3.49Å; K249-F253 PolarHBondContact O-N 3.36Å
254	T	96.6	Very high	97.5	Very high	83 Å²	83	34.8 Å²	34.8	51%	0.509	20%	0.195	S	C	.	.	S	Bend	trans	-122.9	171.9	172.7	-168.2	0	0	0	0	110.7	Y248 K249 F252	Y248-T254 VanDerWaalsContact CD1-O 3.28Å; Y248-T254 WeakPolarHBondContact CD1-O 3.35Å; Y248-T254 HydrophobicContact CE1-CG2 4.02Å; Y248-T254 WeakPolarHBondContact CE1-O 3.26Å; K249-T254 VanDerWaalsContact CA-O 3.31Å; K249-T254 WeakPolarHBondContact CA-O 3.48Å; F252-T254 HydrophobicContact CB-CG2 4.4Å; F252-T254 PolarHBondContact O-N 3.24Å
255	L	97.7	Very high	97.4	Very high	32 Å²	32	36.7 Å²	36.7	17%	0.168	21%	0.208	C	C	.	.			trans	-101.9	141	-176.7	-78.1	149.1	0	0	0	111.2	Y220 C245 K249 F257 G258	Y220-L255 HydrophobicContact CD1-CD2 4.32Å; Y220-L255 HydrophobicContact CD2-CD2 4.45Å; Y220-L255 HydrophobicContact CE1-CD2 3.84Å; Y220-L255 HydrophobicContact CE2-CD1 4.45Å; Y220-L255 HydrophobicContact CE2-CD2 4.03Å; C245-L255 HydrophobicContact CB-CD2 4.26Å; K249-L255 HydrophobicContact CB-CD2 4.36Å; K249-L255 HydrophobicContact CD-CD1 4.31Å; K249-L255 HydrophobicContact CD-CD2 4.09Å; K249-L255 HydrophobicContact CD-CG 3.99Å; L255-F257 PolarHBondContact O-N 3.1Å; L255-F257 VanDerWaalsContact O-N 3.13Å; L255-G258 PolarHBondContact O-N 3.19Å
256	P	97.8	Very high	97.3	Very high	15 Å²	15	41.5 Å²	41.5	10%	0.097	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.6	-167.2	22.2	-30.3	0	0	0	114.5	C245 Y248 F269 L289	C245-P256 HydrophobicContact CB-CG 4.26Å; Y248-P256 HydrophobicContact CD1-CB 3.82Å; Y248-P256 VanDerWaalsContact CD1-CD 3.49Å; Y248-P256 HydrophobicContact CD1-CG 4.08Å; Y248-P256 HydrophobicContact CD2-CB 3.97Å; Y248-P256 HydrophobicContact CE1-CB 4.04Å; Y248-P256 HydrophobicContact CE2-CB 4.18Å; Y248-P256 HydrophobicContact CG-CB 3.8Å; Y248-P256 HydrophobicContact CG-CG 4.05Å; P256-F269 HydrophobicContact CB-CB 3.65Å; P256-F269 HydrophobicContact CB-CD2 4.36Å; P256-F269 HydrophobicContact CB-CG 4.1Å; P256-L289 HydrophobicContact CB-CD1 4.13Å; P256-L289 HydrophobicContact CG-CD1 3.97Å
257	F	97.6	Very high	97	Very high	13 Å²	13	42 Å²	42	6%	0.057	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-1.1	-177.9	-45.8	-70.1	0	0	0	113.8	W241 L255 E259 S260 A263 I264 F269 L289	W241-F257 AromaticContact CE2-CE2 3.81Å; W241-F257 HydrophobicContact CH2-CE2 4.01Å; W241-F257 AromaticContact CH2-CZ 3.71Å; W241-F257 HydrophobicContact CH2-CZ 3.71Å; W241-F257 HydrophobicContact CZ2-CD2 4.09Å; W241-F257 HydrophobicContact CZ2-CE1 4.42Å; W241-F257 AromaticContact CZ2-CE2 3.26Å; W241-F257 HydrophobicContact CZ2-CE2 3.26Å; W241-F257 AromaticContact CZ2-CZ 3.46Å; W241-F257 HydrophobicContact CZ2-CZ 3.46Å; W241-F257 VanDerWaalsContact CZ2-CZ 3.46Å; L255-F257 PolarHBondContact O-N 3.1Å; L255-F257 VanDerWaalsContact O-N 3.13Å; F257-E259 PolarHBondContact O-N 3.37Å; F257-E259 VanDerWaalsContact O-N 3.16Å; F257-S260 WeakPolarHBondContact O-CB 3.43Å; F257-S260 PolarHBondContact O-N 2.81Å; F257-A263 HydrophobicContact CB-CB 4.32Å; F257-A263 HydrophobicContact CD1-CB 4.08Å; F257-A263 WeakPolarHBondContact CD1-O 3.29Å; F257-A263 WeakPolarHBondContact CE1-O 3.34Å; F257-I264 HydrophobicContact CB-CD1 4.48Å; F257-I264 HydrophobicContact CB-CG1 3.61Å; F257-I264 HydrophobicContact CD2-CG1 3.8Å; F257-I264 HydrophobicContact CG-CG1 3.76Å; F257-F269 HydrophobicContact CD1-CB 4.24Å; F257-F269 HydrophobicContact CE1-CB 3.78Å; F257-F269 HydrophobicContact CE1-CD1 4.28Å; F257-F269 HydrophobicContact CE1-CG 4.49Å; F257-F269 HydrophobicContact CZ-CB 4.34Å; F257-F269 HydrophobicContact CZ-CD1 4.28Å; F257-L289 HydrophobicContact CE2-CD1 4.15Å; F257-L289 HydrophobicContact CE2-CD2 3.96Å; F257-L289 HydrophobicContact CZ-CB 4.49Å; F257-L289 HydrophobicContact CZ-CD1 3.95Å; F257-L289 HydrophobicContact CZ-CD2 4.19Å; F257-L289 HydrophobicContact CZ-CG 4.44Å
258	G	94.2	Very high	96.6	Very high	36 Å²	36	45.6 Å²	45.6	37%	0.371	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	-115.8	-166.4	0	0	0	0	0	111.4	S219 L255	S219-G258 WeakPolarHBondContact CA-O 3.47Å; S219-G258 WeakPolarHBondContact CB-O 3.42Å; S219-G258 PolarHBondContact OG-O 2.82Å; L255-G258 PolarHBondContact O-N 3.19Å
259	E	94.5	Very high	96.3	Very high	134 Å²	134	45.1 Å²	45.1	63%	0.626	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	14	170.6	-64.5	-165.7	133.1	0	0	112.7	L218 F257 Q261	L218-E259 HydrophobicContact CD2-CB 3.84Å; L218-E259 HydrophobicContact CD2-CG 4.13Å; L218-E259 HydrophobicContact CG-CB 4.32Å; L218-E259 HydrophobicContact CG-CG 4.46Å; F257-E259 PolarHBondContact O-N 3.37Å; F257-E259 VanDerWaalsContact O-N 3.16Å; E259-Q261 PolarHBondContact O-N 2.8Å
260	S	97.3	Very high	96	Very high	58 Å²	58	46.7 Å²	46.7	41%	0.406	27%	0.268	S	S	.	.			trans	-74.2	98.9	-176.2	-177.5	0	0	0	0	111.7	F257 V262 A263 I264	F257-S260 WeakPolarHBondContact O-CB 3.43Å; F257-S260 PolarHBondContact O-N 2.81Å; S260-V262 PolarHBondContact O-N 3.33Å; S260-A263 PolarHBondContact O-N 2.71Å; S260-A263 VanDerWaalsContact O-N 3.09Å; S260-A263 PolarHBondContact OG-N 3.39Å; S260-I264 WeakPolarHBondContact O-CG1 3.38Å; S260-I264 PolarHBondContact O-N 2.91Å
261	Q	96.6	Very high	95.8	Very high	102 Å²	102	46.8 Å²	46.8	48%	0.477	27%	0.269	S	S	.	.	H	α-helix	trans	-54.5	-32.9	176	-68.1	-175	0	0	0	113.3	L218 I226 E259 C265	L218-Q261 HydrophobicContact CD1-CG 4.21Å; I226-Q261 HydrophobicContact CD1-CG 4.27Å; I226-Q261 HydrophobicContact CG2-CB 3.89Å; I226-Q261 HydrophobicContact CG2-CG 4.22Å; E259-Q261 PolarHBondContact O-N 2.8Å; Q261-C265 PolarHBondContact O-N 3.46Å; Q261-C265 VanDerWaalsContact O-N 3.09Å; Q261-C265 PolarHBondContact O-SG 2.87Å; Q261-C265 VanDerWaalsContact O-SG 3.39Å
262	V	97.1	Very high	95.5	Very high	99 Å²	99	48.5 Å²	48.5	60%	0.6	28%	0.28	S	S	*	.	H	α-helix	trans	-68.8	-49.3	175.8	-178.4	0	0	0	0	110.6	S260 I264 C265 D266	S260-V262 PolarHBondContact O-N 3.33Å; V262-I264 VanDerWaalsContact C-N 3.28Å; V262-I264 PolarHBondContact O-N 3.07Å; V262-C265 PolarHBondContact O-N 3.26Å; V262-C265 VanDerWaalsContact O-N 3.14Å; V262-D266 WeakPolarHBondContact CG1-OD2 3.43Å; V262-D266 WeakPolarHBondContact O-CB 3.39Å; V262-D266 PolarHBondContact O-N 3Å
263	A	96.4	Very high	95.1	Very high	22 Å²	22	50.9 Å²	50.9	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-32.9	179.4	0	0	0	0	0	112.8	F257 S260 G267 T268	F257-A263 HydrophobicContact CB-CB 4.32Å; F257-A263 HydrophobicContact CD1-CB 4.08Å; F257-A263 WeakPolarHBondContact CD1-O 3.29Å; F257-A263 WeakPolarHBondContact CE1-O 3.34Å; S260-A263 PolarHBondContact O-N 2.71Å; S260-A263 VanDerWaalsContact O-N 3.09Å; S260-A263 PolarHBondContact OG-N 3.39Å; A263-G267 PolarHBondContact O-N 3.29Å; A263-G267 VanDerWaalsContact O-N 3.11Å; A263-T268 PolarHBondContact O-N 3.26Å; A263-T268 VanDerWaalsContact O-N 3.16Å
264	I	97.9	Very high	94.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-57.7	169.3	-69.7	169.7	0	0	0	109.6	R221 P223 I226 W241 F257 S260 V262 D266 G267	R221-I264 VanDerWaalsContact O-CG2 3.32Å; R221-I264 WeakPolarHBondContact O-CG2 3.32Å; P223-I264 HydrophobicContact CG-CG2 4.23Å; P223-I264 WeakPolarHBondContact CG-O 3.21Å; I226-I264 HydrophobicContact CG1-CG2 3.93Å; W241-I264 VanDerWaalsContact CH2-O 3.26Å; W241-I264 WeakPolarHBondContact CH2-O 3.49Å; W241-I264 HydrophobicContact CZ2-CB 4.47Å; W241-I264 HydrophobicContact CZ2-CG2 3.89Å; F257-I264 HydrophobicContact CB-CD1 4.48Å; F257-I264 HydrophobicContact CB-CG1 3.61Å; F257-I264 HydrophobicContact CD2-CG1 3.8Å; F257-I264 HydrophobicContact CG-CG1 3.76Å; S260-I264 WeakPolarHBondContact O-CG1 3.38Å; S260-I264 PolarHBondContact O-N 2.91Å; V262-I264 VanDerWaalsContact C-N 3.28Å; V262-I264 PolarHBondContact O-N 3.07Å; I264-D266 VanDerWaalsContact C-N 3.31Å; I264-D266 PolarHBondContact O-N 3.14Å; I264-G267 PolarHBondContact O-N 2.99Å
265	C	97.2	Very high	94.5	Very high	39 Å²	39	52.9 Å²	52.9	26%	0.264	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-39	-179.1	-75.3	0	0	0	0	113.5	I226 Q261 V262 G267	I226-C265 VanDerWaalsContact CG2-SG 3.59Å; Q261-C265 PolarHBondContact O-N 3.46Å; Q261-C265 VanDerWaalsContact O-N 3.09Å; Q261-C265 PolarHBondContact O-SG 2.87Å; Q261-C265 VanDerWaalsContact O-SG 3.39Å; V262-C265 PolarHBondContact O-N 3.26Å; V262-C265 VanDerWaalsContact O-N 3.14Å; C265-G267 VanDerWaalsContact C-N 3.28Å; C265-G267 PolarHBondContact O-N 3.21Å
266	D	95.3	Very high	94.4	Very high	102 Å²	102	57.1 Å²	57.1	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.1	179.1	-66.3	-19	0	0	0	113.4	V262 I264 T268	V262-D266 WeakPolarHBondContact CG1-OD2 3.43Å; V262-D266 WeakPolarHBondContact O-CB 3.39Å; V262-D266 PolarHBondContact O-N 3Å; I264-D266 VanDerWaalsContact C-N 3.31Å; I264-D266 PolarHBondContact O-N 3.14Å; D266-T268 PolarHBondContact O-N 3.18Å; D266-T268 VanDerWaalsContact O-N 3.1Å; D266-T268 PolarHBondContact O-OG1 3.2Å
267	G	94.3	Very high	94.4	Very high	10 Å²	10	57 Å²	57	10%	0.103	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	16.5	-172.9	0	0	0	0	0	114.9	A263 I264 C265 F269	A263-G267 PolarHBondContact O-N 3.29Å; A263-G267 VanDerWaalsContact O-N 3.11Å; I264-G267 PolarHBondContact O-N 2.99Å; C265-G267 VanDerWaalsContact C-N 3.28Å; C265-G267 PolarHBondContact O-N 3.21Å; G267-F269 PolarHBondContact O-N 3.49Å
268	T	88.6	Confident	94.4	Very high	75 Å²	75	58.2 Å²	58.2	46%	0.46	33%	0.331	S	S	.	.			trans	-91.7	97.4	-170.3	-64.5	0	0	0	0	110.3	A263 D266	A263-T268 PolarHBondContact O-N 3.26Å; A263-T268 VanDerWaalsContact O-N 3.16Å; D266-T268 PolarHBondContact O-N 3.18Å; D266-T268 VanDerWaalsContact O-N 3.1Å; D266-T268 PolarHBondContact O-OG1 3.2Å
269	F	94.4	Very high	94.5	Very high	8 Å²	8	60.5 Å²	60.5	4%	0.035	34%	0.338	C	S	.	.			trans	-116.1	171.8	167.4	72.8	-80.8	0	0	0	110.6	Y248 P256 F257 G267 V271 I285 R286 L289 P331	Y248-F269 AromaticContact CD2-CD2 4Å; Y248-F269 HydrophobicContact CD2-CD2 4Å; Y248-F269 HydrophobicContact CD2-CE2 4.22Å; Y248-F269 AromaticContact CE2-CD2 3.85Å; Y248-F269 HydrophobicContact CE2-CD2 3.85Å; Y248-F269 HydrophobicContact CE2-CE2 4.36Å; P256-F269 HydrophobicContact CB-CB 3.65Å; P256-F269 HydrophobicContact CB-CD2 4.36Å; P256-F269 HydrophobicContact CB-CG 4.1Å; F257-F269 HydrophobicContact CD1-CB 4.24Å; F257-F269 HydrophobicContact CE1-CB 3.78Å; F257-F269 HydrophobicContact CE1-CD1 4.28Å; F257-F269 HydrophobicContact CE1-CG 4.49Å; F257-F269 HydrophobicContact CZ-CB 4.34Å; F257-F269 HydrophobicContact CZ-CD1 4.28Å; G267-F269 PolarHBondContact O-N 3.49Å; F269-V271 HydrophobicContact CE2-CG2 4.04Å; F269-I285 HydrophobicContact CE2-CG2 3.91Å; F269-I285 HydrophobicContact CZ-CG2 3.88Å; F269-R286 HydrophobicContact CE1-CB 4.42Å; F269-R286 HydrophobicContact CZ-CB 3.99Å; F269-L289 HydrophobicContact CD1-CB 4.23Å; F269-L289 HydrophobicContact CD1-CD1 3.73Å; F269-L289 HydrophobicContact CD2-CD1 4.49Å; F269-L289 HydrophobicContact CE1-CB 3.77Å; F269-L289 HydrophobicContact CE1-CD1 3.68Å; F269-L289 HydrophobicContact CE1-CG 4.34Å; F269-L289 HydrophobicContact CE2-CD1 4.44Å; F269-L289 HydrophobicContact CG-CD1 4.15Å; F269-L289 HydrophobicContact CZ-CD1 4.06Å; F269-P331 HydrophobicContact CE2-CB 3.93Å; F269-P331 HydrophobicContact CZ-CB 3.83Å
270	I	92	Very high	94.6	Very high	61 Å²	61	62 Å²	62	31%	0.313	34%	0.338	S	S	.	.			trans	-129.4	137.7	-176.8	-63.3	-179.4	0	0	0	108.8	Y248 L332 A334 V337	Y248-I270 WeakPolarHBondContact CE2-O 3.49Å; Y248-I270 PolarHBondContact OH-O 3.47Å; I270-L332 WeakPolarHBondContact CA-O 3.5Å; I270-A334 VanDerWaalsContact CG2-CA 3.48Å; I270-A334 HydrophobicContact CG2-CB 3.61Å; I270-V337 HydrophobicContact CD1-CB 4.12Å; I270-V337 HydrophobicContact CD1-CG1 4.02Å; I270-V337 HydrophobicContact CD1-CG2 4.08Å; I270-V337 HydrophobicContact CG1-CG2 4.11Å
271	V	93.8	Very high	94.7	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-93.9	134.9	165.9	177.7	0	0	0	0	109.5	F252 F269 D273 Q282 P331 L332 A334	F252-V271 HydrophobicContact CE1-CG1 4.47Å; F252-V271 HydrophobicContact CZ-CG1 3.91Å; F269-V271 HydrophobicContact CE2-CG2 4.04Å; V271-D273 PolarHBondContact O-N 2.9Å; V271-Q282 HydrophobicContact CG1-CG 4.14Å; V271-Q282 HydrophobicContact CG2-CB 4.46Å; V271-P331 HydrophobicContact CG2-CB 3.82Å; V271-P331 HydrophobicContact CG2-CG 3.72Å; V271-L332 PolarHBondContact N-O 2.92Å; V271-A334 PolarHBondContact O-N 3.25Å
272	P	91.9	Very high	94.7	Very high	43 Å²	43	55.6 Å²	55.6	28%	0.279	30%	0.302	S	S	.	.			trans	-60.2	134	174.9	-24.1	34.5	0	0	0	112.5	F252 N274 S275	F252-P272 HydrophobicContact CD1-CG 4Å; F252-P272 HydrophobicContact CE1-CG 4.25Å; P272-N274 PolarHBondContact O-N 2.86Å; P272-N274 VanDerWaalsContact O-N 3.13Å; P272-S275 WeakPolarHBondContact O-CB 3.47Å; P272-S275 PolarHBondContact O-N 2.82Å
273	D	88	Confident	94.8	Very high	87 Å²	87	51.3 Å²	51.3	47%	0.465	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.5	-176.9	-60.1	-16.9	0	0	0	113.1	V271 T333 A334 S335	V271-D273 PolarHBondContact O-N 2.9Å; D273-T333 WeakPolarHBondContact OD1-CB 3.46Å; D273-A334 WeakPolarHBondContact OD1-CA 3.43Å; D273-A334 WeakPolarHBondContact OD1-CB 3.49Å; D273-A334 PolarHBondContact OD1-N 2.86Å; D273-S335 PolarHBondContact OD1-N 2.61Å; D273-S335 VanDerWaalsContact OD1-N 3.08Å; D273-S335 VanDerWaalsContact OD2-CB 3.3Å; D273-S335 WeakPolarHBondContact OD2-CB 3.3Å; D273-S335 PolarHBondContact OD2-N 3.17Å; D273-S335 PolarHBondContact OD2-OG 2.68Å
274	N	88.9	Confident	94.9	Very high	145 Å²	145	50.3 Å²	50.3	78%	0.775	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	23	175.2	68	-25.5	0	0	0	113.5	P272 K276	P272-N274 PolarHBondContact O-N 2.86Å; P272-N274 VanDerWaalsContact O-N 3.13Å; N274-K276 PolarHBondContact O-N 3.21Å
275	S	93.3	Very high	94.9	Very high	28 Å²	28	50.3 Å²	50.3	20%	0.196	27%	0.268	C	S	.	.			trans	-56.9	120.7	177	173.6	0	0	0	0	111.8	P272 F277 Q282	P272-S275 WeakPolarHBondContact O-CB 3.47Å; P272-S275 PolarHBondContact O-N 2.82Å; S275-F277 PolarHBondContact O-N 2.86Å; S275-F277 PolarHBondContact OG-N 2.86Å; S275-Q282 PolarHBondContact OG-NE2 3.23Å
276	K	95.3	Very high	95	Very high	120 Å²	120	51.2 Å²	51.2	52%	0.522	27%	0.266	S	S	.	.			trans	-76	-4.2	175.3	68.7	175.9	-172.4	172.2	0	114.6	V139 F141 N274	V139-K276 PolarHBondContact O-NZ 2.87Å; F141-K276 WeakPolarHBondContact O-CE 3.45Å; F141-K276 PolarHBondContact O-NZ 3.3Å; N274-K276 PolarHBondContact O-N 3.21Å
277	F	97.6	Very high	95.2	Very high	12 Å²	12	47.4 Å²	47.4	5%	0.053	24%	0.244	C	C	.	.	S	Bend	trans	-96.9	146.5	-175.8	-58.6	-84.1	0	0	0	110.9	F141 E143 V146 C251 F252 S275 L281 Q282	F141-F277 WeakPolarHBondContact O-CZ 3.22Å; E143-F277 HydrophobicContact CB-CD1 4.07Å; E143-F277 WeakPolarHBondContact OE2-CA 3.5Å; V146-F277 HydrophobicContact CG2-CE1 3.85Å; V146-F277 HydrophobicContact CG2-CZ 4.39Å; C251-F277 HydrophobicContact CB-CD2 3.91Å; C251-F277 HydrophobicContact CB-CE1 4.47Å; C251-F277 HydrophobicContact CB-CE2 3.73Å; C251-F277 HydrophobicContact CB-CG 4.37Å; C251-F277 HydrophobicContact CB-CZ 4.02Å; C251-F277 WeakPolarHBondContact O-CE2 3.45Å; C251-F277 WeakPolarHBondContact O-CZ 3.35Å; F252-F277 AromaticContact CE1-CD2 3.91Å; F252-F277 HydrophobicContact CE1-CD2 3.91Å; F252-F277 HydrophobicContact CE1-CE2 4.29Å; F252-F277 HydrophobicContact CZ-CD2 4.32Å; S275-F277 PolarHBondContact O-N 2.86Å; S275-F277 PolarHBondContact OG-N 2.86Å; F277-L281 HydrophobicContact CB-CD2 4.04Å; F277-L281 HydrophobicContact CD1-CD2 3.92Å; F277-L281 HydrophobicContact CG-CD2 4.25Å; F277-Q282 PolarHBondContact O-NE2 2.88Å
278	S	97.4	Very high	95.4	Very high	39 Å²	39	46.9 Å²	46.9	27%	0.273	24%	0.239	S	C	.	.			trans	-59.6	144.1	-176.7	77.7	0	0	0	0	112.3	E143 R280 L281 Q282	E143-S278 VanDerWaalsContact OE1-CB 3.29Å; E143-S278 WeakPolarHBondContact OE1-CB 3.42Å; E143-S278 PolarHBondContact OE1-OG 3.48Å; E143-S278 PolarHBondContact OE2-N 3.32Å; S278-R280 PolarHBondContact O-N 3.46Å; S278-L281 WeakPolarHBondContact O-CB 3.43Å; S278-L281 PolarHBondContact O-N 2.81Å; S278-L281 PolarHBondContact OG-N 3.22Å; S278-Q282 WeakPolarHBondContact O-CG 3.23Å; S278-Q282 PolarHBondContact O-N 3.46Å; S278-Q282 VanDerWaalsContact O-N 3.16Å
279	T	96.1	Very high	95.9	Very high	84 Å²	84	43.3 Å²	43.3	52%	0.515	22%	0.217	S	C	.	.	H	α-helix	trans	-51.7	-32.7	174.3	-42.9	0	0	0	0	111.5	L281 Q282 C283	T279-L281 PolarHBondContact O-N 3.31Å; T279-Q282 WeakPolarHBondContact O-CB 3.38Å; T279-Q282 PolarHBondContact O-N 3.14Å; T279-C283 PolarHBondContact O-N 2.95Å; T279-C283 PolarHBondContact O-SG 2.75Å
280	R	97.3	Very high	96	Very high	167 Å²	167	44.7 Å²	44.7	63%	0.63	22%	0.223	S	C	*	.	H	α-helix	trans	-67.1	-37.8	179.9	-46.3	-176.9	79.9	165.3	9.5	112.5	S278 L284 L309	S278-R280 PolarHBondContact O-N 3.46Å; R280-L284 PolarHBondContact O-N 2.84Å; R280-L284 VanDerWaalsContact O-N 3.07Å; R280-L309 HydrophobicContact CB-CD1 4.39Å; R280-L309 HydrophobicContact CB-CD2 3.52Å; R280-L309 HydrophobicContact CG-CD2 4.37Å
281	L	98.4	Very high	96.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-39.9	172.3	-167.8	71.5	0	0	0	111.1	E143 V146 L147 L247 F277 S278 T279 C283 L284 I285 L309	E143-L281 HydrophobicContact CG-CD2 4.14Å; V146-L281 HydrophobicContact CG1-CD2 4.28Å; L147-L281 HydrophobicContact CD2-CD1 3.71Å; L147-L281 HydrophobicContact CG-CD1 4.2Å; L247-L281 HydrophobicContact CD1-CD1 4.28Å; L247-L281 HydrophobicContact CD2-CD1 4.24Å; F277-L281 HydrophobicContact CB-CD2 4.04Å; F277-L281 HydrophobicContact CD1-CD2 3.92Å; F277-L281 HydrophobicContact CG-CD2 4.25Å; S278-L281 WeakPolarHBondContact O-CB 3.43Å; S278-L281 PolarHBondContact O-N 2.81Å; S278-L281 PolarHBondContact OG-N 3.22Å; T279-L281 PolarHBondContact O-N 3.31Å; L281-C283 PolarHBondContact O-N 3.11Å; L281-L284 WeakPolarHBondContact O-CB 3.44Å; L281-L284 PolarHBondContact O-N 3.15Å; L281-L284 VanDerWaalsContact O-N 3.14Å; L281-I285 PolarHBondContact O-N 2.84Å; L281-L309 HydrophobicContact CB-CD1 4.44Å; L281-L309 HydrophobicContact CD1-CD1 4.08Å
282	Q	97.9	Very high	96.5	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.112	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-40.7	176.1	-57	172.7	20.2	0	0	111.6	V271 S275 F277 S278 T279 I285 R286 P331	V271-Q282 HydrophobicContact CG1-CG 4.14Å; V271-Q282 HydrophobicContact CG2-CB 4.46Å; S275-Q282 PolarHBondContact OG-NE2 3.23Å; F277-Q282 PolarHBondContact O-NE2 2.88Å; S278-Q282 WeakPolarHBondContact O-CG 3.23Å; S278-Q282 PolarHBondContact O-N 3.46Å; S278-Q282 VanDerWaalsContact O-N 3.16Å; T279-Q282 WeakPolarHBondContact O-CB 3.38Å; T279-Q282 PolarHBondContact O-N 3.14Å; Q282-I285 WeakPolarHBondContact O-CB 3.46Å; Q282-I285 PolarHBondContact O-N 2.87Å; Q282-R286 PolarHBondContact O-N 2.89Å; Q282-R286 VanDerWaalsContact O-N 3.09Å; Q282-P331 HydrophobicContact CB-CG 3.87Å
283	C	98.4	Very high	96.8	Very high	10 Å²	10	43.7 Å²	43.7	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-32.3	172.7	-57.8	0	0	0	0	113	T279 L281 I285 R286 Y287 L328 P329	T279-C283 PolarHBondContact O-N 2.95Å; T279-C283 PolarHBondContact O-SG 2.75Å; L281-C283 PolarHBondContact O-N 3.11Å; C283-I285 VanDerWaalsContact C-N 3.35Å; C283-R286 PolarHBondContact O-N 3.47Å; C283-Y287 WeakPolarHBondContact O-CB 3.25Å; C283-Y287 PolarHBondContact O-N 2.74Å; C283-L328 HydrophobicContact CB-CB 3.62Å; C283-L328 HydrophobicContact CB-CD1 4.28Å; C283-P329 WeakPolarHBondContact CA-O 3.37Å; C283-P329 WeakPolarHBondContact CB-O 3.41Å
284	L	98.8	Very high	97.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-37.2	173.3	-179.1	55.3	0	0	0	111.8	F150 L247 R280 L281 Y287 M288 V302 F305 A306 L309 L328	F150-L284 HydrophobicContact CE1-CD2 4.24Å; L247-L284 HydrophobicContact CD2-CD2 4.29Å; L247-L284 HydrophobicContact CD2-CG 4.15Å; R280-L284 PolarHBondContact O-N 2.84Å; R280-L284 VanDerWaalsContact O-N 3.07Å; L281-L284 WeakPolarHBondContact O-CB 3.44Å; L281-L284 PolarHBondContact O-N 3.15Å; L281-L284 VanDerWaalsContact O-N 3.14Å; L284-Y287 HydrophobicContact CD1-CD1 4.33Å; L284-Y287 PolarHBondContact O-N 2.94Å; L284-M288 HydrophobicContact CG-CE 4.26Å; L284-M288 WeakPolarHBondContact O-CE 3.39Å; L284-M288 PolarHBondContact O-N 3.25Å; L284-V302 HydrophobicContact CD1-CG1 4.46Å; L284-F305 HydrophobicContact CD1-CB 3.85Å; L284-F305 HydrophobicContact CD2-CB 4.32Å; L284-A306 HydrophobicContact CD2-CB 4.14Å; L284-L309 HydrophobicContact CB-CD1 4.47Å; L284-L309 HydrophobicContact CD2-CD1 4Å; L284-L328 HydrophobicContact CB-CD1 4.29Å
285	I	98.8	Very high	97.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-51.2	169.9	-63.7	166.3	0	0	0	110.2	L247 Y248 F252 F269 L281 Q282 C283 Y287 M288 L289	L247-I285 HydrophobicContact CB-CG1 4.17Å; L247-I285 HydrophobicContact CD2-CG1 3.63Å; L247-I285 HydrophobicContact CG-CD1 4.2Å; L247-I285 HydrophobicContact CG-CG1 3.66Å; Y248-I285 HydrophobicContact CD2-CD1 4.46Å; Y248-I285 HydrophobicContact CD2-CG2 4.18Å; F252-I285 HydrophobicContact CE2-CD1 4.15Å; F269-I285 HydrophobicContact CE2-CG2 3.91Å; F269-I285 HydrophobicContact CZ-CG2 3.88Å; L281-I285 PolarHBondContact O-N 2.84Å; Q282-I285 WeakPolarHBondContact O-CB 3.46Å; Q282-I285 PolarHBondContact O-N 2.87Å; C283-I285 VanDerWaalsContact C-N 3.35Å; I285-Y287 VanDerWaalsContact C-N 3.27Å; I285-Y287 PolarHBondContact O-N 2.85Å; I285-M288 PolarHBondContact O-N 2.92Å; I285-L289 HydrophobicContact CG2-CD1 3.73Å; I285-L289 HydrophobicContact CG2-CG 4.31Å; I285-L289 WeakPolarHBondContact O-CG 3.48Å; I285-L289 PolarHBondContact O-N 3.43Å
286	R	98.5	Very high	97.8	Very high	57 Å²	57	43.7 Å²	43.7	22%	0.215	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-35.3	178.8	176.5	55.7	-170	86.2	-4.8	112.7	F269 Q282 C283 M288 L289 E290 P329 P331	F269-R286 HydrophobicContact CE1-CB 4.42Å; F269-R286 HydrophobicContact CZ-CB 3.99Å; Q282-R286 PolarHBondContact O-N 2.89Å; Q282-R286 VanDerWaalsContact O-N 3.09Å; C283-R286 PolarHBondContact O-N 3.47Å; R286-M288 VanDerWaalsContact C-N 3.33Å; R286-M288 PolarHBondContact O-N 3.36Å; R286-L289 PolarHBondContact NH1-O 3.42Å; R286-L289 CarbonylContact O-C 3.55Å; R286-L289 PolarHBondContact O-N 3Å; R286-E290 IonicContact CZ-OE2 3.46Å; R286-E290 VanDerWaalsContact CZ-OE2 3.27Å; R286-E290 IonicContact NH1-OE2 2.78Å; R286-E290 PolarHBondContact NH1-OE2 3.43Å; R286-E290 IonicContact NH2-OE2 3.46Å; R286-E290 PolarHBondContact NH2-OE2 2.81Å; R286-P329 WeakPolarHBondContact CB-O 3.33Å; R286-P329 HydrophobicContact CG-CB 3.91Å; R286-P329 HydrophobicContact CG-CG 3.94Å; R286-P329 WeakPolarHBondContact CG-O 3.3Å; R286-P331 HydrophobicContact CB-CB 4.1Å
287	Y	98.7	Very high	98	Very high	22 Å²	22	38 Å²	38	9%	0.086	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-39.8	178.5	-174	-145.2	0	0	0	112	C283 L284 I285 P297 Q301 F305 P325 L328 P329	C283-Y287 WeakPolarHBondContact O-CB 3.25Å; C283-Y287 PolarHBondContact O-N 2.74Å; L284-Y287 HydrophobicContact CD1-CD1 4.33Å; L284-Y287 PolarHBondContact O-N 2.94Å; I285-Y287 VanDerWaalsContact C-N 3.27Å; I285-Y287 PolarHBondContact O-N 2.85Å; Y287-P297 HydrophobicContact CD1-CB 4.26Å; Y287-P297 HydrophobicContact CD1-CG 3.87Å; Y287-P297 HydrophobicContact CD2-CG 4.05Å; Y287-P297 HydrophobicContact CE1-CB 3.73Å; Y287-P297 HydrophobicContact CE1-CG 3.86Å; Y287-P297 HydrophobicContact CE2-CB 4.06Å; Y287-P297 HydrophobicContact CE2-CG 4.03Å; Y287-P297 HydrophobicContact CG-CG 3.97Å; Y287-P297 WeakPolarHBondContact O-CD 3.44Å; Y287-Q301 HydrophobicContact CE1-CB 4.24Å; Y287-F305 HydrophobicContact CD1-CD2 4.25Å; Y287-F305 AromaticContact CE1-CD2 3.88Å; Y287-F305 HydrophobicContact CE1-CD2 3.88Å; Y287-F305 AromaticContact CE1-CE2 3.86Å; Y287-F305 HydrophobicContact CE1-CE2 3.86Å; Y287-P325 HydrophobicContact CE2-CG 4.36Å; Y287-P325 WeakPolarHBondContact OH-CD 3.36Å; Y287-L328 HydrophobicContact CD1-CD2 3.46Å; Y287-L328 VanDerWaalsContact CD1-CD2 3.46Å; Y287-L328 HydrophobicContact CD2-CD2 4.13Å; Y287-L328 HydrophobicContact CE1-CD2 3.75Å; Y287-L328 HydrophobicContact CE2-CD2 4.39Å; Y287-L328 HydrophobicContact CG-CD2 3.66Å; Y287-P329 HydrophobicContact CD2-CG 4.39Å
288	M	98.9	Very high	98	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-75.5	-37.6	174.1	-71.6	-175.2	-76.4	0	0	113.5	F150 I240 L243 L247 L284 I285 R286 E290 R296 P297 V302	F150-M288 HydrophobicContact CE1-CE 4.13Å; F150-M288 HydrophobicContact CE2-CE 4.11Å; F150-M288 HydrophobicContact CE2-SD 4.39Å; F150-M288 HydrophobicContact CZ-CE 3.45Å; F150-M288 VanDerWaalsContact CZ-CE 3.45Å; F150-M288 HydrophobicContact CZ-SD 3.67Å; I240-M288 HydrophobicContact CG2-CB 4.34Å; I240-M288 HydrophobicContact CG2-CG 3.99Å; L243-M288 HydrophobicContact CB-SD 3.66Å; L247-M288 HydrophobicContact CB-CE 4.1Å; L247-M288 HydrophobicContact CD2-CE 3.58Å; L247-M288 HydrophobicContact CG-CE 4.48Å; L284-M288 HydrophobicContact CG-CE 4.26Å; L284-M288 WeakPolarHBondContact O-CE 3.39Å; L284-M288 PolarHBondContact O-N 3.25Å; I285-M288 PolarHBondContact O-N 2.92Å; R286-M288 VanDerWaalsContact C-N 3.33Å; R286-M288 PolarHBondContact O-N 3.36Å; M288-E290 PolarHBondContact O-N 2.81Å; M288-R296 WeakPolarHBondContact O-CD 3.01Å; M288-R296 WeakPolarHBondContact O-CG 3.39Å; M288-P297 HydrophobicContact CG-CG 4.48Å; M288-V302 HydrophobicContact CE-CG1 4.46Å; M288-V302 HydrophobicContact CG-CG1 4.28Å; M288-V302 HydrophobicContact CG-CG2 3.6Å; M288-V302 HydrophobicContact SD-CB 4.49Å; M288-V302 HydrophobicContact SD-CG1 3.62Å; M288-V302 HydrophobicContact SD-CG2 3.96Å
289	L	98.8	Very high	98.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.171	C	C	.	.			trans	-81.1	50.4	176.8	-62.1	-177.1	0	0	0	111.7	W241 P256 F257 F269 I285 R286	W241-L289 HydrophobicContact CD2-CD2 3.78Å; W241-L289 HydrophobicContact CE3-CD2 4Å; W241-L289 HydrophobicContact CG-CD2 4.23Å; W241-L289 HydrophobicContact CZ2-CD2 4.3Å; W241-L289 HydrophobicContact CZ3-CB 4.32Å; W241-L289 HydrophobicContact CZ3-CD2 4.36Å; P256-L289 HydrophobicContact CB-CD1 4.13Å; P256-L289 HydrophobicContact CG-CD1 3.97Å; F257-L289 HydrophobicContact CE2-CD1 4.15Å; F257-L289 HydrophobicContact CE2-CD2 3.96Å; F257-L289 HydrophobicContact CZ-CB 4.49Å; F257-L289 HydrophobicContact CZ-CD1 3.95Å; F257-L289 HydrophobicContact CZ-CD2 4.19Å; F257-L289 HydrophobicContact CZ-CG 4.44Å; F269-L289 HydrophobicContact CD1-CB 4.23Å; F269-L289 HydrophobicContact CD1-CD1 3.73Å; F269-L289 HydrophobicContact CD2-CD1 4.49Å; F269-L289 HydrophobicContact CE1-CB 3.77Å; F269-L289 HydrophobicContact CE1-CD1 3.68Å; F269-L289 HydrophobicContact CE1-CG 4.34Å; F269-L289 HydrophobicContact CE2-CD1 4.44Å; F269-L289 HydrophobicContact CG-CD1 4.15Å; F269-L289 HydrophobicContact CZ-CD1 4.06Å; I285-L289 HydrophobicContact CG2-CD1 3.73Å; I285-L289 HydrophobicContact CG2-CG 4.31Å; I285-L289 WeakPolarHBondContact O-CG 3.48Å; I285-L289 PolarHBondContact O-N 3.43Å; R286-L289 PolarHBondContact NH1-O 3.42Å; R286-L289 CarbonylContact O-C 3.55Å; R286-L289 PolarHBondContact O-N 3Å
290	E	98.4	Very high	98.3	Very high	36 Å²	36	34.4 Å²	34.4	17%	0.168	15%	0.153	C	C	.	.			trans	-97.3	117.8	172.5	175.5	51.7	-141.6	0	0	109.8	R286 M288 D292 K295 R296	R286-E290 IonicContact CZ-OE2 3.46Å; R286-E290 VanDerWaalsContact CZ-OE2 3.27Å; R286-E290 IonicContact NH1-OE2 2.78Å; R286-E290 PolarHBondContact NH1-OE2 3.43Å; R286-E290 IonicContact NH2-OE2 3.46Å; R286-E290 PolarHBondContact NH2-OE2 2.81Å; M288-E290 PolarHBondContact O-N 2.81Å; E290-D292 PolarHBondContact O-N 3.47Å; E290-K295 HydrophobicContact CG-CB 3.88Å; E290-R296 HydrophobicContact CB-CB 4.16Å; E290-R296 HydrophobicContact CB-CG 4.28Å; E290-R296 HydrophobicContact CG-CB 4.44Å; E290-R296 PolarHBondContact O-NE 3.25Å; E290-R296 PolarHBondContact O-NH2 3.03Å
291	P	98.1	Very high	98.3	Very high	35 Å²	35	27.5 Å²	27.5	23%	0.227	13%	0.128	C	C	.	.	S	Bend	trans	-62.5	-38.6	-172.6	-29.5	38.1	0	0	0	114.6	P223 W241 Q293 R296	P223-P291 HydrophobicContact CG-CB 4.12Å; W241-P291 HydrophobicContact CZ3-CG 4.31Å; P291-Q293 PolarHBondContact O-N 3.3Å; P291-R296 PolarHBondContact O-NH2 2.97Å
292	D	97.6	Very high	98.4	Very high	42 Å²	42	27.5 Å²	27.5	23%	0.225	13%	0.128	C	C	.	.	S	Bend	trans	-79.3	104.3	179.8	-171	3.2	0	0	0	110.8	K232 E290 E294 K295 R296	K232-D292 IonicContact NZ-OD1 2.74Å; K232-D292 PolarHBondContact NZ-OD1 2.71Å; E290-D292 PolarHBondContact O-N 3.47Å; D292-E294 PolarHBondContact O-N 2.71Å; D292-K295 HydrophobicContact CB-CB 4.42Å; D292-K295 HydrophobicContact CB-CD 4.09Å; D292-K295 HydrophobicContact CB-CG 4.25Å; D292-K295 PolarHBondContact O-N 2.86Å; D292-K295 VanDerWaalsContact OD2-CE 3.28Å; D292-K295 WeakPolarHBondContact OD2-CE 3.47Å; D292-K295 IonicContact OD2-NZ 3.99Å; D292-K295 PolarHBondContact OD2-NZ 3.07Å; D292-R296 PolarHBondContact O-N 2.81Å
293	Q	97.1	Very high	98.4	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.037	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.2	-175.5	64.4	143.5	21.3	0	0	114.8	K232 A233 T235 K237 P291	K232-Q293 HydrophobicContact CD-CG 4.1Å; A233-Q293 PolarHBondContact O-NE2 2.96Å; A233-Q293 PolarHBondContact O-OE1 3.21Å; T235-Q293 PolarHBondContact OG1-OE1 3.49Å; K237-Q293 HydrophobicContact CB-CB 3.86Å; K237-Q293 HydrophobicContact CG-CB 4.33Å; K237-Q293 WeakPolarHBondContact CG-O 3.39Å; K237-Q293 PolarHBondContact NZ-O 2.88Å; P291-Q293 PolarHBondContact O-N 3.3Å
294	E	96.2	Very high	98.4	Very high	118 Å²	118	29 Å²	29	55%	0.551	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-32.8	175.2	-43.6	-48.1	147	0	0	111.7	K232 D292	K232-E294 IonicContact NZ-OE1 3.53Å; K232-E294 PolarHBondContact NZ-OE1 2.76Å; D292-E294 PolarHBondContact O-N 2.71Å
295	K	97.6	Very high	98.4	Very high	140 Å²	140	30.1 Å²	30.1	61%	0.609	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-29.1	177.2	-58.9	177.6	-170.8	124.5	0	112.5	E290 D292	E290-K295 HydrophobicContact CG-CB 3.88Å; D292-K295 HydrophobicContact CB-CB 4.42Å; D292-K295 HydrophobicContact CB-CD 4.09Å; D292-K295 HydrophobicContact CB-CG 4.25Å; D292-K295 PolarHBondContact O-N 2.86Å; D292-K295 VanDerWaalsContact OD2-CE 3.28Å; D292-K295 WeakPolarHBondContact OD2-CE 3.47Å; D292-K295 IonicContact OD2-NZ 3.99Å; D292-K295 PolarHBondContact OD2-NZ 3.07Å
296	R	98.6	Very high	98.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.008	14%	0.136	C	C	.	.	S	Bend	trans	-55	136.2	173.3	-162.8	-176.6	-52.4	148	7	109.8	E224 K237 I240 M288 E290 P291 D292	E224-R296 IonicContact OE1-CZ 3.12Å; E224-R296 IonicContact OE1-NH1 2.68Å; E224-R296 PolarHBondContact OE1-NH1 2.77Å; E224-R296 IonicContact OE1-NH2 3.43Å; E224-R296 IonicContact OE2-CZ 2.74Å; E224-R296 IonicContact OE2-NH1 2.77Å; E224-R296 PolarHBondContact OE2-NH1 3.11Å; E224-R296 IonicContact OE2-NH2 3.93Å; E224-R296 PolarHBondContact OE2-NH2 2.59Å; K237-R296 VanDerWaalsContact C-NH1 3.33Å; K237-R296 WeakPolarHBondContact CE-O 3.31Å; K237-R296 PolarHBondContact NZ-O 2.65Å; K237-R296 WeakPolarHBondContact O-CD 3.41Å; K237-R296 PolarHBondContact O-NH1 3.38Å; I240-R296 HydrophobicContact CG2-CG 4.17Å; M288-R296 WeakPolarHBondContact O-CD 3.01Å; M288-R296 WeakPolarHBondContact O-CG 3.39Å; E290-R296 HydrophobicContact CB-CB 4.16Å; E290-R296 HydrophobicContact CB-CG 4.28Å; E290-R296 HydrophobicContact CG-CB 4.44Å; E290-R296 PolarHBondContact O-NE 3.25Å; E290-R296 PolarHBondContact O-NH2 3.03Å; P291-R296 PolarHBondContact O-NH2 2.97Å; D292-R296 PolarHBondContact O-N 2.81Å
297	P	98.8	Very high	98.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.126	C	C	.	.			trans	-62.2	164.9	-177.2	22.2	-32.9	0	0	0	113.6	K237 I240 Y287 M288 Q301 V302	K237-P297 WeakPolarHBondContact CD-O 3.34Å; I240-P297 HydrophobicContact CG2-CG 4.09Å; Y287-P297 HydrophobicContact CD1-CB 4.26Å; Y287-P297 HydrophobicContact CD1-CG 3.87Å; Y287-P297 HydrophobicContact CD2-CG 4.05Å; Y287-P297 HydrophobicContact CE1-CB 3.73Å; Y287-P297 HydrophobicContact CE1-CG 3.86Å; Y287-P297 HydrophobicContact CE2-CB 4.06Å; Y287-P297 HydrophobicContact CE2-CG 4.03Å; Y287-P297 HydrophobicContact CG-CG 3.97Å; Y287-P297 WeakPolarHBondContact O-CD 3.44Å; M288-P297 HydrophobicContact CG-CG 4.48Å; P297-Q301 HydrophobicContact CB-CB 3.71Å; P297-V302 HydrophobicContact CB-CG2 4.02Å; P297-V302 HydrophobicContact CG-CG2 3.73Å
298	D	98.8	Very high	98.4	Very high	19 Å²	19	31.7 Å²	31.7	10%	0.102	15%	0.145	C	C	.	.			trans	-88.2	174.4	159.1	73.8	21.6	0	0	0	112.2	Y300 Q301 V302 S320 S322	D298-Y300 VanDerWaalsContact C-N 3.26Å; D298-Y300 PolarHBondContact O-N 2.86Å; D298-Y300 WeakPolarHBondContact OD1-CA 3.35Å; D298-Y300 WeakPolarHBondContact OD1-CB 3.5Å; D298-Y300 PolarHBondContact OD1-N 3.42Å; D298-Q301 PolarHBondContact O-N 3.21Å; D298-Q301 PolarHBondContact OD1-N 2.91Å; D298-V302 WeakPolarHBondContact O-CG2 3.18Å; D298-V302 PolarHBondContact O-N 2.75Å; D298-V302 VanDerWaalsContact O-N 3.1Å; D298-S320 WeakPolarHBondContact OD2-CB 3.5Å; D298-S320 PolarHBondContact OD2-OG 3.35Å; D298-S322 WeakPolarHBondContact OD2-CB 3.18Å; D298-S322 PolarHBondContact OD2-OG 3.48Å
299	I	98.9	Very high	98.4	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-27.4	-177.8	-167.3	55.8	0	0	0	113.4	C154 V157 A158 H161 Q162 I240 L243 S303	C154-I299 HydrophobicContact CB-CD1 4.37Å; V157-I299 HydrophobicContact CB-CD1 3.98Å; V157-I299 HydrophobicContact CB-CG1 4.34Å; V157-I299 HydrophobicContact CG1-CD1 3.81Å; V157-I299 HydrophobicContact CG1-CG1 4.09Å; A158-I299 HydrophobicContact CB-CG1 3.9Å; A158-I299 HydrophobicContact CB-CG2 4.24Å; H161-I299 HydrophobicContact CB-CG2 4.06Å; Q162-I299 HydrophobicContact CG-CG2 4.5Å; I240-I299 HydrophobicContact CD1-CB 3.89Å; I240-I299 HydrophobicContact CD1-CD1 4.03Å; L243-I299 HydrophobicContact CD1-CD1 3.62Å; I299-S303 VanDerWaalsContact O-CB 3.24Å; I299-S303 WeakPolarHBondContact O-CB 3.4Å; I299-S303 PolarHBondContact O-N 3.1Å; I299-S303 PolarHBondContact O-OG 3.05Å
300	Y	98.8	Very high	98.4	Very high	37 Å²	37	35.3 Å²	35.3	15%	0.145	17%	0.169	C	C	.	.	H	α-helix	trans	-70.2	-46.9	175.7	164.2	-99.8	0	0	0	110.5	D298 V302 S303 Y304 V316 N318 I324	D298-Y300 VanDerWaalsContact C-N 3.26Å; D298-Y300 PolarHBondContact O-N 2.86Å; D298-Y300 WeakPolarHBondContact OD1-CA 3.35Å; D298-Y300 WeakPolarHBondContact OD1-CB 3.5Å; D298-Y300 PolarHBondContact OD1-N 3.42Å; Y300-V302 VanDerWaalsContact C-N 3.33Å; Y300-V302 PolarHBondContact O-N 3.14Å; Y300-S303 PolarHBondContact O-N 3.03Å; Y300-Y304 WeakPolarHBondContact O-CB 3.44Å; Y300-Y304 PolarHBondContact O-N 3.44Å; Y300-V316 HydrophobicContact CD2-CG1 4.4Å; Y300-V316 WeakPolarHBondContact CD2-O 3.27Å; Y300-V316 WeakPolarHBondContact CE2-O 2.92Å; Y300-N318 HydrophobicContact CD1-CB 3.64Å; Y300-N318 VanDerWaalsContact CD1-OD1 3.28Å; Y300-N318 WeakPolarHBondContact CD1-OD1 3.45Å; Y300-N318 HydrophobicContact CD2-CB 3.88Å; Y300-N318 HydrophobicContact CE1-CB 3.56Å; Y300-N318 VanDerWaalsContact CE1-ND2 3.26Å; Y300-N318 WeakPolarHBondContact CE1-ND2 3.28Å; Y300-N318 HydrophobicContact CE2-CB 3.8Å; Y300-N318 HydrophobicContact CG-CB 3.81Å; Y300-I324 HydrophobicContact CD1-CD1 4.37Å; Y300-I324 HydrophobicContact CE1-CD1 3.63Å; Y300-I324 HydrophobicContact CE1-CG1 4.22Å
301	Q	98.9	Very high	98.4	Very high	22 Å²	22	37.1 Å²	37.1	10%	0.103	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-42.9	177	-70.7	171.4	-53.5	0	0	111.6	Y287 P297 D298 F305 P323 I324	Y287-Q301 HydrophobicContact CE1-CB 4.24Å; P297-Q301 HydrophobicContact CB-CB 3.71Å; D298-Q301 PolarHBondContact O-N 3.21Å; D298-Q301 PolarHBondContact OD1-N 2.91Å; Q301-F305 VanDerWaalsContact O-CD2 3.24Å; Q301-F305 WeakPolarHBondContact O-CD2 3.41Å; Q301-P323 PolarHBondContact NE2-O 2.84Å; Q301-I324 HydrophobicContact CG-CD1 4.27Å
302	V	98.9	Very high	98.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-48.5	173.8	174.2	0	0	0	0	111.3	F150 I240 L284 M288 P297 D298 Y300 Y304 F305 A306	F150-V302 HydrophobicContact CE1-CG1 3.85Å; F150-V302 HydrophobicContact CZ-CG1 3.78Å; I240-V302 HydrophobicContact CG2-CG2 3.9Å; L284-V302 HydrophobicContact CD1-CG1 4.46Å; M288-V302 HydrophobicContact CE-CG1 4.46Å; M288-V302 HydrophobicContact CG-CG1 4.28Å; M288-V302 HydrophobicContact CG-CG2 3.6Å; M288-V302 HydrophobicContact SD-CB 4.49Å; M288-V302 HydrophobicContact SD-CG1 3.62Å; M288-V302 HydrophobicContact SD-CG2 3.96Å; P297-V302 HydrophobicContact CB-CG2 4.02Å; P297-V302 HydrophobicContact CG-CG2 3.73Å; D298-V302 WeakPolarHBondContact O-CG2 3.18Å; D298-V302 PolarHBondContact O-N 2.75Å; D298-V302 VanDerWaalsContact O-N 3.1Å; Y300-V302 VanDerWaalsContact C-N 3.33Å; Y300-V302 PolarHBondContact O-N 3.14Å; V302-Y304 VanDerWaalsContact C-N 3.35Å; V302-Y304 PolarHBondContact O-N 3.26Å; V302-F305 PolarHBondContact O-N 3.39Å; V302-A306 WeakPolarHBondContact O-CB 3.35Å; V302-A306 PolarHBondContact O-N 3.14Å
303	S	98.9	Very high	98.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-41.3	-178.2	-58.9	0	0	0	0	111.9	I299 Y300 F305 A306 F307 C314	I299-S303 VanDerWaalsContact O-CB 3.24Å; I299-S303 WeakPolarHBondContact O-CB 3.4Å; I299-S303 PolarHBondContact O-N 3.1Å; I299-S303 PolarHBondContact O-OG 3.05Å; Y300-S303 PolarHBondContact O-N 3.03Å; S303-F305 VanDerWaalsContact C-N 3.29Å; S303-F305 PolarHBondContact O-N 3.09Å; S303-A306 PolarHBondContact O-N 2.95Å; S303-F307 WeakPolarHBondContact O-CB 3.46Å; S303-F307 VanDerWaalsContact O-CD2 3.32Å; S303-F307 WeakPolarHBondContact O-CD2 3.41Å; S303-F307 PolarHBondContact O-N 3.11Å; S303-C314 VanDerWaalsContact CB-SG 3.56Å
304	Y	98.8	Very high	98.4	Very high	65 Å²	65	47.5 Å²	47.5	26%	0.255	25%	0.246	S	C	.	.	H	α-helix	trans	-52.6	-46.4	176.7	175.8	-89.6	0	0	0	111.9	Y300 V302 K308 I324	Y300-Y304 WeakPolarHBondContact O-CB 3.44Å; Y300-Y304 PolarHBondContact O-N 3.44Å; V302-Y304 VanDerWaalsContact C-N 3.35Å; V302-Y304 PolarHBondContact O-N 3.26Å; Y304-K308 HydrophobicContact CE1-CD 3.78Å; Y304-K308 WeakPolarHBondContact O-CB 3.47Å; Y304-K308 PolarHBondContact O-N 2.97Å; Y304-K308 PolarHBondContact OH-NZ 2.94Å; Y304-I324 HydrophobicContact CD1-CD1 3.85Å; Y304-I324 HydrophobicContact CD1-CG1 4.19Å; Y304-I324 HydrophobicContact CD1-CG2 3.72Å; Y304-I324 HydrophobicContact CD2-CD1 4.21Å; Y304-I324 HydrophobicContact CD2-CG1 4.27Å; Y304-I324 HydrophobicContact CE1-CG1 4.48Å; Y304-I324 HydrophobicContact CE1-CG2 3.52Å; Y304-I324 HydrophobicContact CG-CD1 3.64Å; Y304-I324 HydrophobicContact CG-CG1 4.1Å; Y304-I324 HydrophobicContact CG-CG2 4.47Å
305	F	98.8	Very high	98.5	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.105	24%	0.242	C	C	.	.	H	α-helix	trans	-76.6	-39.5	178.1	-70	-72.5	0	0	0	112.8	L284 Y287 Q301 V302 S303 K308 L309 I324 P325 L328	L284-F305 HydrophobicContact CD1-CB 3.85Å; L284-F305 HydrophobicContact CD2-CB 4.32Å; Y287-F305 HydrophobicContact CD1-CD2 4.25Å; Y287-F305 AromaticContact CE1-CD2 3.88Å; Y287-F305 HydrophobicContact CE1-CD2 3.88Å; Y287-F305 AromaticContact CE1-CE2 3.86Å; Y287-F305 HydrophobicContact CE1-CE2 3.86Å; Q301-F305 VanDerWaalsContact O-CD2 3.24Å; Q301-F305 WeakPolarHBondContact O-CD2 3.41Å; V302-F305 PolarHBondContact O-N 3.39Å; S303-F305 VanDerWaalsContact C-N 3.29Å; S303-F305 PolarHBondContact O-N 3.09Å; F305-K308 PolarHBondContact O-N 3.41Å; F305-L309 VanDerWaalsContact O-CG 3.3Å; F305-L309 WeakPolarHBondContact O-CG 3.43Å; F305-L309 PolarHBondContact O-N 3.28Å; F305-I324 HydrophobicContact CE2-CG2 4.16Å; F305-I324 HydrophobicContact CZ-CG2 3.75Å; F305-P325 HydrophobicContact CE2-CG 3.99Å; F305-P325 HydrophobicContact CZ-CG 3.99Å; F305-L328 HydrophobicContact CB-CD1 4.37Å; F305-L328 HydrophobicContact CD1-CD1 3.96Å; F305-L328 HydrophobicContact CD1-CD2 4.45Å; F305-L328 HydrophobicContact CD1-CG 4.26Å; F305-L328 HydrophobicContact CD2-CD1 4.28Å; F305-L328 HydrophobicContact CD2-CD2 3.9Å; F305-L328 HydrophobicContact CE1-CD1 4.32Å; F305-L328 HydrophobicContact CE1-CD2 4.16Å; F305-L328 HydrophobicContact CE1-CG 4.11Å; F305-L328 HydrophobicContact CE2-CD2 3.59Å; F305-L328 HydrophobicContact CE2-CG 4.38Å; F305-L328 HydrophobicContact CG-CD1 3.94Å; F305-L328 HydrophobicContact CG-CD2 4.34Å; F305-L328 HydrophobicContact CG-CG 4.46Å; F305-L328 HydrophobicContact CZ-CD2 3.72Å; F305-L328 HydrophobicContact CZ-CG 4.18Å
306	A	98.8	Very high	98.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-51.8	178.1	0	0	0	0	0	112.1	F150 L284 V302 S303 L309 A310	F150-A306 HydrophobicContact CD1-CB 3.8Å; F150-A306 HydrophobicContact CE1-CB 3.88Å; L284-A306 HydrophobicContact CD2-CB 4.14Å; V302-A306 WeakPolarHBondContact O-CB 3.35Å; V302-A306 PolarHBondContact O-N 3.14Å; S303-A306 PolarHBondContact O-N 2.95Å; A306-L309 PolarHBondContact O-N 3.31Å; A306-A310 PolarHBondContact O-N 3.42Å
307	F	98.8	Very high	98.6	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-66.9	-39.4	-179.9	-81.1	-100.7	0	0	0	111.9	C151 E155 S303 L309 A310 G311 R312 D313 C314 P315	C151-F307 HydrophobicContact CB-CD2 4.15Å; C151-F307 HydrophobicContact CB-CE1 4.12Å; C151-F307 HydrophobicContact CB-CE2 3.64Å; C151-F307 HydrophobicContact CB-CZ 3.61Å; E155-F307 HydrophobicContact CG-CE2 4.28Å; E155-F307 HydrophobicContact CG-CZ 3.71Å; E155-F307 WeakPolarHBondContact OE1-CZ 3.39Å; S303-F307 WeakPolarHBondContact O-CB 3.46Å; S303-F307 VanDerWaalsContact O-CD2 3.32Å; S303-F307 WeakPolarHBondContact O-CD2 3.41Å; S303-F307 PolarHBondContact O-N 3.11Å; F307-L309 VanDerWaalsContact C-N 3.3Å; F307-L309 PolarHBondContact O-N 3.44Å; F307-A310 CarbonylContact O-C 3.25Å; F307-A310 WeakPolarHBondContact O-CA 3.42Å; F307-A310 WeakPolarHBondContact O-CB 3.45Å; F307-A310 PolarHBondContact O-N 3.26Å; F307-G311 PolarHBondContact O-N 3.46Å; F307-G311 VanDerWaalsContact O-N 3.08Å; F307-R312 CarbonylContact C-O 3.44Å; F307-R312 VanDerWaalsContact C-O 3.25Å; F307-R312 HydrophobicContact CD1-CB 3.88Å; F307-R312 PolarHBondContact O-N 2.77Å; F307-R312 VanDerWaalsContact O-O 3.05Å; F307-D313 WeakPolarHBondContact CD1-O 3.46Å; F307-C314 HydrophobicContact CB-CB 4.05Å; F307-C314 HydrophobicContact CG-CB 4.37Å; F307-P315 VanDerWaalsContact CD1-CD 3.49Å; F307-P315 HydrophobicContact CD1-CG 4.47Å; F307-P315 HydrophobicContact CE1-CG 3.75Å; F307-P315 HydrophobicContact CE2-CG 4.45Å; F307-P315 HydrophobicContact CZ-CG 3.75Å
308	K	98.3	Very high	98.5	Very high	112 Å²	112	44.3 Å²	44.3	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-63.4	-31.2	174.9	-173.2	173.9	-169.9	173.6	0	113.5	Y304 F305	Y304-K308 HydrophobicContact CE1-CD 3.78Å; Y304-K308 WeakPolarHBondContact O-CB 3.47Å; Y304-K308 PolarHBondContact O-N 2.97Å; Y304-K308 PolarHBondContact OH-NZ 2.94Å; F305-K308 PolarHBondContact O-N 3.41Å
309	L	98.3	Very high	98.4	Very high	39 Å²	39	48.7 Å²	48.7	20%	0.204	27%	0.271	C	S	.	.	H	α-helix	trans	-75.5	-35.3	170.5	-68.1	176.5	0	0	0	111.9	L147 R280 L281 L284 F305 A306 F307 G311	L147-L309 HydrophobicContact CD1-CB 3.93Å; L147-L309 HydrophobicContact CD2-CB 3.82Å; R280-L309 HydrophobicContact CB-CD1 4.39Å; R280-L309 HydrophobicContact CB-CD2 3.52Å; R280-L309 HydrophobicContact CG-CD2 4.37Å; L281-L309 HydrophobicContact CB-CD1 4.44Å; L281-L309 HydrophobicContact CD1-CD1 4.08Å; L284-L309 HydrophobicContact CB-CD1 4.47Å; L284-L309 HydrophobicContact CD2-CD1 4Å; F305-L309 VanDerWaalsContact O-CG 3.3Å; F305-L309 WeakPolarHBondContact O-CG 3.43Å; F305-L309 PolarHBondContact O-N 3.28Å; A306-L309 PolarHBondContact O-N 3.31Å; F307-L309 VanDerWaalsContact C-N 3.3Å; F307-L309 PolarHBondContact O-N 3.44Å; L309-G311 PolarHBondContact O-N 3.13Å
310	A	98.4	Very high	98.2	Very high	36 Å²	36	51.8 Å²	51.8	30%	0.298	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-0.8	174.2	0	0	0	0	0	114.4	L147 A306 F307 R312	L147-A310 HydrophobicContact CB-CB 4.16Å; A306-A310 PolarHBondContact O-N 3.42Å; F307-A310 CarbonylContact O-C 3.25Å; F307-A310 WeakPolarHBondContact O-CA 3.42Å; F307-A310 WeakPolarHBondContact O-CB 3.45Å; F307-A310 PolarHBondContact O-N 3.26Å; A310-R312 VanDerWaalsContact C-N 3.28Å; A310-R312 HydrophobicContact CB-CG 4.46Å; A310-R312 PolarHBondContact O-N 3.49Å
311	G	98.3	Very high	98.1	Very high	75 Å²	75	56.8 Å²	56.8	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	25.1	-176.1	0	0	0	0	0	114	F307 L309	F307-G311 PolarHBondContact O-N 3.46Å; F307-G311 VanDerWaalsContact O-N 3.08Å; L309-G311 PolarHBondContact O-N 3.13Å
312	R	98.1	Very high	98	Very high	106 Å²	106	56.8 Å²	56.8	40%	0.4	33%	0.325	S	S	.	.	S	Bend	trans	-118.7	152.4	-176.4	-70.1	170.2	61.7	-174.3	-4	111	E155 F307 A310	E155-R312 IonicContact OE1-NH2 3.13Å; F307-R312 CarbonylContact C-O 3.44Å; F307-R312 VanDerWaalsContact C-O 3.25Å; F307-R312 HydrophobicContact CD1-CB 3.88Å; F307-R312 PolarHBondContact O-N 2.77Å; F307-R312 VanDerWaalsContact O-O 3.05Å; A310-R312 VanDerWaalsContact C-N 3.28Å; A310-R312 HydrophobicContact CB-CG 4.46Å; A310-R312 PolarHBondContact O-N 3.49Å
313	D	98	Very high	97.9	Very high	155 Å²	155	61.7 Å²	61.7	83%	0.829	36%	0.356	S	S	*	.			trans	-66.9	143.8	164.8	-66.8	-55.5	0	0	0	110.9	F307 P315	F307-D313 WeakPolarHBondContact CD1-O 3.46Å; D313-P315 WeakPolarHBondContact O-CD 3.3Å
314	C	98.5	Very high	97.8	Very high	41 Å²	41	64.3 Å²	64.3	28%	0.277	37%	0.37	S	S	.	.			trans	-81.7	118.9	179.2	-174	0	0	0	0	110.7	S303 F307 V316	S303-C314 VanDerWaalsContact CB-SG 3.56Å; F307-C314 HydrophobicContact CB-CB 4.05Å; F307-C314 HydrophobicContact CG-CB 4.37Å; C314-V316 VanDerWaalsContact C-N 3.34Å
315	P	98.4	Very high	97.7	Very high	72 Å²	72	63.4 Å²	63.4	47%	0.468	37%	0.372	S	S	.	.			trans	-82.4	-11.1	178.9	34.2	-36.4	0	0	0	113.2	E155 F307 D313	E155-P315 HydrophobicContact CG-CG 3.85Å; F307-P315 VanDerWaalsContact CD1-CD 3.49Å; F307-P315 HydrophobicContact CD1-CG 4.47Å; F307-P315 HydrophobicContact CE1-CG 3.75Å; F307-P315 HydrophobicContact CE2-CG 4.45Å; F307-P315 HydrophobicContact CZ-CG 3.75Å; D313-P315 WeakPolarHBondContact O-CD 3.3Å
316	V	98.5	Very high	97.4	Very high	10 Å²	10	69.6 Å²	69.6	6%	0.061	41%	0.412	C	S	.	.	S	Bend	trans	-80.2	125.7	-176.1	177.6	0	0	0	0	109.9	A158 Y300 C314	A158-V316 HydrophobicContact CB-CB 4.34Å; A158-V316 HydrophobicContact CB-CG1 3.69Å; A158-V316 HydrophobicContact CB-CG2 3.67Å; Y300-V316 HydrophobicContact CD2-CG1 4.4Å; Y300-V316 WeakPolarHBondContact CD2-O 3.27Å; Y300-V316 WeakPolarHBondContact CE2-O 2.92Å; C314-V316 VanDerWaalsContact C-N 3.34Å
317	P	98	Very high	97.1	Very high	65 Å²	65	73.8 Å²	73.8	42%	0.422	44%	0.441	S	S	.	.			trans	-79.7	150.5	179.7	31.5	-35.6	0	0	0	112.9	Q162 L319	Q162-P317 PolarHBondContact NE2-O 3.34Å; P317-L319 HydrophobicContact CB-CD2 4.04Å; P317-L319 HydrophobicContact CG-CD2 4.02Å; P317-L319 HydrophobicContact CG-CG 4.2Å; P317-L319 PolarHBondContact O-N 3.06Å; P317-L319 VanDerWaalsContact O-N 3.1Å
318	N	98.1	Very high	97	Very high	46 Å²	46	75.1 Å²	75.1	25%	0.246	45%	0.448	C	S	.	.			trans	-85.4	65.6	178.6	-166.8	1.9	0	0	0	112.8	Y300 S320 N321 S322	Y300-N318 HydrophobicContact CD1-CB 3.64Å; Y300-N318 VanDerWaalsContact CD1-OD1 3.28Å; Y300-N318 WeakPolarHBondContact CD1-OD1 3.45Å; Y300-N318 HydrophobicContact CD2-CB 3.88Å; Y300-N318 HydrophobicContact CE1-CB 3.56Å; Y300-N318 VanDerWaalsContact CE1-ND2 3.26Å; Y300-N318 WeakPolarHBondContact CE1-ND2 3.28Å; Y300-N318 HydrophobicContact CE2-CB 3.8Å; Y300-N318 HydrophobicContact CG-CB 3.81Å; N318-S320 PolarHBondContact O-N 3.38Å; N318-N321 PolarHBondContact O-N 3.28Å; N318-N321 VanDerWaalsContact O-N 3.1Å; N318-N321 WeakPolarHBondContact OD1-CA 3.31Å; N318-N321 PolarHBondContact OD1-N 3.4Å; N318-S322 PolarHBondContact ND2-N 2.87Å; N318-S322 PolarHBondContact ND2-O 2.98Å; N318-S322 PolarHBondContact OD1-N 2.86Å
319	L	96.8	Very high	96.8	Very high	111 Å²	111	72.2 Å²	72.2	58%	0.581	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-24.9	-177	-56.4	-170.3	0	0	0	113.7	Q162 P317	Q162-L319 HydrophobicContact CB-CD1 3.7Å; Q162-L319 HydrophobicContact CG-CD1 3.94Å; Q162-L319 HydrophobicContact CG-CG 4.46Å; P317-L319 HydrophobicContact CB-CD2 4.04Å; P317-L319 HydrophobicContact CG-CD2 4.02Å; P317-L319 HydrophobicContact CG-CG 4.2Å; P317-L319 PolarHBondContact O-N 3.06Å; P317-L319 VanDerWaalsContact O-N 3.1Å
320	S	93.7	Very high	96.5	Very high	71 Å²	71	77.6 Å²	77.6	50%	0.497	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-14	177.9	-46.1	0	0	0	0	113.9	D298 N318 S322	D298-S320 WeakPolarHBondContact OD2-CB 3.5Å; D298-S320 PolarHBondContact OD2-OG 3.35Å; N318-S320 PolarHBondContact O-N 3.38Å; S320-S322 WeakPolarHBondContact CB-OG 3.33Å; S320-S322 PolarHBondContact O-N 2.99Å
321	N	96.8	Very high	96.1	Very high	142 Å²	142	76.5 Å²	76.5	76%	0.759	46%	0.455	S	S	*	.			trans	52.3	31.9	-160.2	-61.8	-63.1	0	0	0	113.6	N318	N318-N321 PolarHBondContact O-N 3.28Å; N318-N321 VanDerWaalsContact O-N 3.1Å; N318-N321 WeakPolarHBondContact OD1-CA 3.31Å; N318-N321 PolarHBondContact OD1-N 3.4Å
322	S	96.6	Very high	95.7	Very high	22 Å²	22	75.7 Å²	75.7	15%	0.154	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-64	133.3	-178.8	-74.1	0	0	0	0	111.5	D298 N318 S320	D298-S322 WeakPolarHBondContact OD2-CB 3.18Å; D298-S322 PolarHBondContact OD2-OG 3.48Å; N318-S322 PolarHBondContact ND2-N 2.87Å; N318-S322 PolarHBondContact ND2-O 2.98Å; N318-S322 PolarHBondContact OD1-N 2.86Å; S320-S322 WeakPolarHBondContact CB-OG 3.33Å; S320-S322 PolarHBondContact O-N 2.99Å
323	P	97.2	Very high	95.2	Very high	102 Å²	102	72.8 Å²	72.8	66%	0.662	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-73.1	143.8	179.4	29.8	-34.7	0	0	0	111.4	Q301	Q301-P323 PolarHBondContact NE2-O 2.84Å
324	I	97.6	Very high	94.5	Very high	55 Å²	55	67.2 Å²	67.2	28%	0.282	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-88	123.6	171	-62.6	-56.7	0	0	0	108.8	Y300 Q301 Y304 F305	Y300-I324 HydrophobicContact CD1-CD1 4.37Å; Y300-I324 HydrophobicContact CE1-CD1 3.63Å; Y300-I324 HydrophobicContact CE1-CG1 4.22Å; Q301-I324 HydrophobicContact CG-CD1 4.27Å; Y304-I324 HydrophobicContact CD1-CD1 3.85Å; Y304-I324 HydrophobicContact CD1-CG1 4.19Å; Y304-I324 HydrophobicContact CD1-CG2 3.72Å; Y304-I324 HydrophobicContact CD2-CD1 4.21Å; Y304-I324 HydrophobicContact CD2-CG1 4.27Å; Y304-I324 HydrophobicContact CE1-CG1 4.48Å; Y304-I324 HydrophobicContact CE1-CG2 3.52Å; Y304-I324 HydrophobicContact CG-CD1 3.64Å; Y304-I324 HydrophobicContact CG-CG1 4.1Å; Y304-I324 HydrophobicContact CG-CG2 4.47Å; F305-I324 HydrophobicContact CE2-CG2 4.16Å; F305-I324 HydrophobicContact CZ-CG2 3.75Å
325	P	96.2	Very high	93.8	Very high	47 Å²	47	68.7 Å²	68.7	31%	0.305	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-71	151.3	175.5	31.4	-36.5	0	0	0	111.7	Y287 F305 L328	Y287-P325 HydrophobicContact CE2-CG 4.36Å; Y287-P325 WeakPolarHBondContact OH-CD 3.36Å; F305-P325 HydrophobicContact CE2-CG 3.99Å; F305-P325 HydrophobicContact CZ-CG 3.99Å; P325-L328 HydrophobicContact CG-CD2 4.12Å
326	T	92	Very high	93.3	Very high	153 Å²	153	68.7 Å²	68.7	94%	0.939	41%	0.407	S	S	*	.	S	Bend	trans	-72.6	-31.5	179.6	46.3	0	0	0	0	113.1
327	S	92.8	Very high	92.5	Very high	89 Å²	89	69.3 Å²	69.3	62%	0.622	41%	0.41	S	S	*	.	S	Bend	trans	-133.2	157.6	174.1	55.6	0	0	0	0	110.8
328	L	96	Very high	91.6	Very high	29 Å²	29	69 Å²	69	15%	0.152	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-101.4	150.1	174.1	-68.4	-174.2	0	0	0	110.4	C283 L284 Y287 F305 P325	C283-L328 HydrophobicContact CB-CB 3.62Å; C283-L328 HydrophobicContact CB-CD1 4.28Å; L284-L328 HydrophobicContact CB-CD1 4.29Å; Y287-L328 HydrophobicContact CD1-CD2 3.46Å; Y287-L328 VanDerWaalsContact CD1-CD2 3.46Å; Y287-L328 HydrophobicContact CD2-CD2 4.13Å; Y287-L328 HydrophobicContact CE1-CD2 3.75Å; Y287-L328 HydrophobicContact CE2-CD2 4.39Å; Y287-L328 HydrophobicContact CG-CD2 3.66Å; F305-L328 HydrophobicContact CB-CD1 4.37Å; F305-L328 HydrophobicContact CD1-CD1 3.96Å; F305-L328 HydrophobicContact CD1-CD2 4.45Å; F305-L328 HydrophobicContact CD1-CG 4.26Å; F305-L328 HydrophobicContact CD2-CD1 4.28Å; F305-L328 HydrophobicContact CD2-CD2 3.9Å; F305-L328 HydrophobicContact CE1-CD1 4.32Å; F305-L328 HydrophobicContact CE1-CD2 4.16Å; F305-L328 HydrophobicContact CE1-CG 4.11Å; F305-L328 HydrophobicContact CE2-CD2 3.59Å; F305-L328 HydrophobicContact CE2-CG 4.38Å; F305-L328 HydrophobicContact CG-CD1 3.94Å; F305-L328 HydrophobicContact CG-CD2 4.34Å; F305-L328 HydrophobicContact CG-CG 4.46Å; F305-L328 HydrophobicContact CZ-CD2 3.72Å; F305-L328 HydrophobicContact CZ-CG 4.18Å; P325-L328 HydrophobicContact CG-CD2 4.12Å
329	P	94.3	Very high	90.7	Very high	51 Å²	51	69.1 Å²	69.1	33%	0.331	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-66.3	137	175.4	28.4	-35.5	0	0	0	111.4	C283 R286 Y287	C283-P329 WeakPolarHBondContact CA-O 3.37Å; C283-P329 WeakPolarHBondContact CB-O 3.41Å; R286-P329 WeakPolarHBondContact CB-O 3.33Å; R286-P329 HydrophobicContact CG-CB 3.91Å; R286-P329 HydrophobicContact CG-CG 3.94Å; R286-P329 WeakPolarHBondContact CG-O 3.3Å; Y287-P329 HydrophobicContact CD2-CG 4.39Å
330	E	92.6	Very high	89.9	Confident	151 Å²	151	68.6 Å²	68.6	71%	0.706	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-84.1	138.9	178.9	-59.4	-176.2	161.3	0	0	111.1
331	P	90.8	Very high	89	Confident	13 Å²	13	72.5 Å²	72.5	8%	0.084	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-76.8	166.3	172.4	30.5	-31.4	0	0	0	111.9	F269 V271 Q282 R286	F269-P331 HydrophobicContact CE2-CB 3.93Å; F269-P331 HydrophobicContact CZ-CB 3.83Å; V271-P331 HydrophobicContact CG2-CB 3.82Å; V271-P331 HydrophobicContact CG2-CG 3.72Å; Q282-P331 HydrophobicContact CB-CG 3.87Å; R286-P331 HydrophobicContact CB-CB 4.1Å
332	L	88	Confident	87.6	Confident	59 Å²	59	69.7 Å²	69.7	31%	0.309	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-82.8	134.1	172.2	-63.1	179.9	0	0	0	111.5	I270 V271 V337	I270-L332 WeakPolarHBondContact CA-O 3.5Å; V271-L332 PolarHBondContact N-O 2.92Å; L332-V337 HydrophobicContact CB-CG2 4.01Å; L332-V337 HydrophobicContact CD1-CG2 4.08Å
333	T	88.4	Confident	86	Confident	45 Å²	45	75.2 Å²	75.2	28%	0.276	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-79.8	162	169.1	61.8	0	0	0	0	111.7	D273 E336 V337	D273-T333 WeakPolarHBondContact OD1-CB 3.46Å; T333-E336 PolarHBondContact N-OE2 2.91Å; T333-E336 PolarHBondContact O-N 3.44Å; T333-E336 WeakPolarHBondContact OG1-CB 3.42Å; T333-E336 WeakPolarHBondContact OG1-CG 3.39Å; T333-E336 PolarHBondContact OG1-N 2.83Å; T333-E336 PolarHBondContact OG1-OE2 3.29Å; T333-V337 PolarHBondContact O-N 3.3Å
334	A	83.9	Confident	84.4	Confident	37 Å²	37	74.7 Å²	74.7	31%	0.306	43%	0.433	S	S	.	.	H	α-helix	trans	-67.2	-41.1	178.7	0	0	0	0	0	111.2	I270 V271 D273 E336 V337 A338	I270-A334 VanDerWaalsContact CG2-CA 3.48Å; I270-A334 HydrophobicContact CG2-CB 3.61Å; V271-A334 PolarHBondContact O-N 3.25Å; D273-A334 WeakPolarHBondContact OD1-CA 3.43Å; D273-A334 WeakPolarHBondContact OD1-CB 3.49Å; D273-A334 PolarHBondContact OD1-N 2.86Å; A334-E336 PolarHBondContact O-N 2.91Å; A334-V337 PolarHBondContact O-N 2.94Å; A334-A338 PolarHBondContact O-N 3.24Å
335	S	83.7	Confident	82.4	Confident	73 Å²	73	79.9 Å²	79.9	51%	0.51	45%	0.454	S	S	.	.	H	α-helix	trans	-59.3	-41.9	174.8	-79.8	0	0	0	0	113.1	D273 A338 A339	D273-S335 PolarHBondContact OD1-N 2.61Å; D273-S335 VanDerWaalsContact OD1-N 3.08Å; D273-S335 VanDerWaalsContact OD2-CB 3.3Å; D273-S335 WeakPolarHBondContact OD2-CB 3.3Å; D273-S335 PolarHBondContact OD2-N 3.17Å; D273-S335 PolarHBondContact OD2-OG 2.68Å; S335-A338 PolarHBondContact O-N 2.8Å; S335-A339 WeakPolarHBondContact O-CB 3.4Å; S335-A339 PolarHBondContact O-N 2.67Å
336	E	86.4	Confident	80.4	Confident	72 Å²	72	80 Å²	80	34%	0.336	46%	0.458	S	S	.	.	H	α-helix	trans	-65.4	-39.5	175.4	-77.8	174.3	86.8	0	0	113.3	T333 A334 A338 A339 K340	T333-E336 PolarHBondContact N-OE2 2.91Å; T333-E336 PolarHBondContact O-N 3.44Å; T333-E336 WeakPolarHBondContact OG1-CB 3.42Å; T333-E336 WeakPolarHBondContact OG1-CG 3.39Å; T333-E336 PolarHBondContact OG1-N 2.83Å; T333-E336 PolarHBondContact OG1-OE2 3.29Å; A334-E336 PolarHBondContact O-N 2.91Å; E336-A338 VanDerWaalsContact C-N 3.32Å; E336-A339 PolarHBondContact O-N 2.99Å; E336-K340 WeakPolarHBondContact O-CB 3.32Å; E336-K340 VanDerWaalsContact O-CG 3.28Å; E336-K340 WeakPolarHBondContact O-CG 3.46Å; E336-K340 PolarHBondContact O-N 3.29Å; E336-K340 IonicContact OE1-NZ 2.75Å; E336-K340 PolarHBondContact OE1-NZ 3.2Å
337	V	82.9	Confident	78.5	Confident	22 Å²	22	82.5 Å²	82.5	13%	0.133	45%	0.451	C	S	.	.	H	α-helix	trans	-67.5	-36.8	177.5	174	0	0	0	0	110.6	I270 L332 T333 A334 K341	I270-V337 HydrophobicContact CD1-CB 4.12Å; I270-V337 HydrophobicContact CD1-CG1 4.02Å; I270-V337 HydrophobicContact CD1-CG2 4.08Å; I270-V337 HydrophobicContact CG1-CG2 4.11Å; L332-V337 HydrophobicContact CB-CG2 4.01Å; L332-V337 HydrophobicContact CD1-CG2 4.08Å; T333-V337 PolarHBondContact O-N 3.3Å; A334-V337 PolarHBondContact O-N 2.94Å; V337-K341 HydrophobicContact CG1-CD 4.28Å; V337-K341 WeakPolarHBondContact O-CB 3.27Å; V337-K341 WeakPolarHBondContact O-CG 3.2Å; V337-K341 PolarHBondContact O-N 2.95Å
338	A	79.1	Confident	76.6	Confident	60 Å²	60	84.3 Å²	84.3	50%	0.496	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-46.4	171.7	0	0	0	0	0	111.8	A334 S335 E336 K341 S342	A334-A338 PolarHBondContact O-N 3.24Å; S335-A338 PolarHBondContact O-N 2.8Å; E336-A338 VanDerWaalsContact C-N 3.32Å; A338-K341 PolarHBondContact O-N 2.93Å; A338-S342 PolarHBondContact O-N 3.46Å
339	A	79.8	Confident	74.6	Confident	47 Å²	47	88 Å²	88	39%	0.388	48%	0.476	S	S	.	.	H	α-helix	trans	-60.1	-47.6	177	0	0	0	0	0	112.2	S335 E336 K341 S342 M343	S335-A339 WeakPolarHBondContact O-CB 3.4Å; S335-A339 PolarHBondContact O-N 2.67Å; E336-A339 PolarHBondContact O-N 2.99Å; A339-K341 PolarHBondContact O-N 3.46Å; A339-S342 WeakPolarHBondContact O-CB 3.45Å; A339-S342 PolarHBondContact O-N 2.89Å; A339-S342 VanDerWaalsContact O-N 3.17Å; A339-M343 WeakPolarHBondContact O-CG 3.4Å; A339-M343 PolarHBondContact O-N 3.26Å
340	K	78.3	Confident	72.4	Confident	101 Å²	101	92.2 Å²	92.2	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-59.3	-45.4	177.2	-73.4	163.9	-174.7	160.3	0	111.4	E336 S342 M343 T344	E336-K340 WeakPolarHBondContact O-CB 3.32Å; E336-K340 VanDerWaalsContact O-CG 3.28Å; E336-K340 WeakPolarHBondContact O-CG 3.46Å; E336-K340 PolarHBondContact O-N 3.29Å; E336-K340 IonicContact OE1-NZ 2.75Å; E336-K340 PolarHBondContact OE1-NZ 3.2Å; K340-S342 VanDerWaalsContact C-N 3.35Å; K340-S342 PolarHBondContact O-N 2.91Å; K340-M343 PolarHBondContact O-N 3.11Å; K340-T344 PolarHBondContact O-N 2.78Å; K340-T344 PolarHBondContact O-OG1 3.31Å; K340-T344 VanDerWaalsContact O-OG1 3.13Å
341	K	75.5	Confident	70.1	Confident	152 Å²	152	89.2 Å²	89.2	66%	0.661	49%	0.491	S	S	*	.	H	α-helix	trans	-61.7	-38.9	174.9	-75.8	175.8	179.2	177.2	0	112.9	V337 A338 A339 K345	V337-K341 HydrophobicContact CG1-CD 4.28Å; V337-K341 WeakPolarHBondContact O-CB 3.27Å; V337-K341 WeakPolarHBondContact O-CG 3.2Å; V337-K341 PolarHBondContact O-N 2.95Å; A338-K341 PolarHBondContact O-N 2.93Å; A339-K341 PolarHBondContact O-N 3.46Å; K341-K345 PolarHBondContact O-N 2.71Å; K341-K345 VanDerWaalsContact O-N 3.14Å
342	S	68.2	Low	68.1	Low	83 Å²	83	95.7 Å²	95.7	58%	0.58	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-47.1	176.6	-166	0	0	0	0	111.7	A338 A339 K340 T344 K345 A346	A338-S342 PolarHBondContact O-N 3.46Å; A339-S342 WeakPolarHBondContact O-CB 3.45Å; A339-S342 PolarHBondContact O-N 2.89Å; A339-S342 VanDerWaalsContact O-N 3.17Å; K340-S342 VanDerWaalsContact C-N 3.35Å; K340-S342 PolarHBondContact O-N 2.91Å; S342-T344 PolarHBondContact O-N 2.67Å; S342-K345 PolarHBondContact O-N 3.16Å; S342-K345 VanDerWaalsContact O-N 3.16Å; S342-A346 PolarHBondContact O-N 2.8Å
343	M	63.2	Low	65.8	Low	139 Å²	139	95.4 Å²	95.4	69%	0.685	54%	0.542	S	S	*	.	H	α-helix	trans	-62.1	-41.6	177.7	-70.2	-179.3	174.9	0	0	112.7	A339 K340 K345 A346 R347	A339-M343 WeakPolarHBondContact O-CG 3.4Å; A339-M343 PolarHBondContact O-N 3.26Å; K340-M343 PolarHBondContact O-N 3.11Å; M343-K345 VanDerWaalsContact C-N 3.31Å; M343-K345 PolarHBondContact O-N 2.83Å; M343-A346 PolarHBondContact O-N 2.79Å; M343-R347 PolarHBondContact O-N 3.44Å
344	T	61.9	Low	63.6	Low	91 Å²	91	99.6 Å²	99.6	56%	0.558	57%	0.57	S	S	*	*	H	α-helix	trans	-62.2	-38.7	174.8	-54.7	0	0	0	0	111.9	K340 S342 R347 I348	K340-T344 PolarHBondContact O-N 2.78Å; K340-T344 PolarHBondContact O-OG1 3.31Å; K340-T344 VanDerWaalsContact O-OG1 3.13Å; S342-T344 PolarHBondContact O-N 2.67Å; T344-R347 PolarHBondContact O-N 2.83Å; T344-I348 HydrophobicContact CG2-CD1 4.43Å; T344-I348 WeakPolarHBondContact O-CG1 3.41Å; T344-I348 PolarHBondContact O-N 3.21Å
345	K	57.5	Low	61.8	Low	164 Å²	164	104.1 Å²	104.1	71%	0.713	59%	0.594	S	S	*	*	H	α-helix	trans	-68	-41.5	178.3	-167.2	175.7	-179.3	-178	0	112.2	K341 S342 M343 I348	K341-K345 PolarHBondContact O-N 2.71Å; K341-K345 VanDerWaalsContact O-N 3.14Å; S342-K345 PolarHBondContact O-N 3.16Å; S342-K345 VanDerWaalsContact O-N 3.16Å; M343-K345 VanDerWaalsContact C-N 3.31Å; M343-K345 PolarHBondContact O-N 2.83Å; K345-I348 PolarHBondContact O-N 3.42Å
346	A	54	Low	60.3	Low	48 Å²	48	109.4 Å²	109.4	40%	0.397	61%	0.61	S	S	.	*	H	α-helix	trans	-64.1	-39.7	175.7	0	0	0	0	0	112.6	S342 M343 I348 T349 D350	S342-A346 PolarHBondContact O-N 2.8Å; M343-A346 PolarHBondContact O-N 2.79Å; A346-I348 PolarHBondContact O-N 3.27Å; A346-T349 PolarHBondContact O-N 3Å; A346-T349 PolarHBondContact O-OG1 3.15Å; A346-D350 PolarHBondContact O-N 3.12Å
347	R	51.8	Low	58	Low	207 Å²	207	112.2 Å²	112.2	78%	0.781	63%	0.633	S	S	*	*	H	α-helix	trans	-65.3	-21.3	178.7	-163.7	172.5	-172.7	172	3.6	113.9	M343 T344	M343-R347 PolarHBondContact O-N 3.44Å; T344-R347 PolarHBondContact O-N 2.83Å
348	I	53.3	Low	56.2	Low	126 Å²	126	116.8 Å²	116.8	65%	0.646	67%	0.665	S	S	*	*	H	α-helix	trans	-82	-26	175.5	-67.2	166.7	0	0	0	111.4	T344 K345 A346	T344-I348 HydrophobicContact CG2-CD1 4.43Å; T344-I348 WeakPolarHBondContact O-CG1 3.41Å; T344-I348 PolarHBondContact O-N 3.21Å; K345-I348 PolarHBondContact O-N 3.42Å; A346-I348 PolarHBondContact O-N 3.27Å
349	T	54.2	Low	54.4	Low	106 Å²	106	121.5 Å²	121.5	65%	0.65	68%	0.68	S	S	*	*	H	α-helix	trans	-81.4	-29.9	176.1	45.7	0	0	0	0	113.4	A346 S351	A346-T349 PolarHBondContact O-N 3Å; A346-T349 PolarHBondContact O-OG1 3.15Å; T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.39Å
350	D	46.8	Very low	52.3	Low	141 Å²	141	123.4 Å²	123.4	75%	0.754	70%	0.697	S	S	*	*	S	Bend	trans	-93	47.2	177.6	-66.2	-41.8	0	0	0	113.1	A346	A346-D350 PolarHBondContact O-N 3.12Å
351	S	43.6	Very low	50.4	Low	88 Å²	88	124.6 Å²	124.6	62%	0.615	71%	0.714	S	S	*	*			trans	-110.7	116.4	168.6	-70.1	0	0	0	0	110.1	T349	T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.39Å
352	V	48.8	Very low	48.6	Very low	149 Å²	149	129.3 Å²	129.3	90%	0.903	73%	0.728	S	S	*	*			trans	-56.1	145	179.2	177	0	0	0	0	110.8
353	G	41.3	Very low	47	Very low	53 Å²	53	134.2 Å²	134.2	55%	0.546	74%	0.742	S	S	.	*			trans	-56.5	154.1	-170.9	0	0	0	0	0	114.9	T355	G353-T355 PolarHBondContact O-N 3.45Å; G353-T355 VanDerWaalsContact O-N 3.17Å
354	P	42.5	Very low	45.9	Very low	133 Å²	133	138.4 Å²	138.4	86%	0.864	75%	0.75	S	S	*	*			trans	-68.6	113.1	-171	27.9	-35	0	0	0	112
355	T	45.6	Very low	44.6	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	76%	0.761	S	S	*	*			trans	-69.5	140.7	159.6	44	0	0	0	0	109.9	G353	G353-T355 PolarHBondContact O-N 3.45Å; G353-T355 VanDerWaalsContact O-N 3.17Å
356	E	51	Low	43.4	Very low	184 Å²	184	142 Å²	142	86%	0.86	77%	0.77	S	S	*	*			trans	-68.9	137.3	-167.7	-56	179.4	126.6	0	0	113.3
357	T	37.8	Very low	42.3	Very low	131 Å²	131	144.4 Å²	144.4	80%	0.804	79%	0.791	S	S	*	*			trans	-129.9	96.7	159.2	51.7	0	0	0	0	110	I359	T357-I359 PolarHBondContact O-N 2.99Å
358	S	45.1	Very low	41.3	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	79%	0.791	S	S	*	*			trans	-68	112.8	-178.1	-67.9	0	0	0	0	112.8
359	I	41.3	Very low	40.2	Very low	159 Å²	159	141.4 Å²	141.4	82%	0.815	81%	0.805	S	S	*	*			trans	-126.1	114.3	162.4	-59.6	-177.8	0	0	0	108	T357	T357-I359 PolarHBondContact O-N 2.99Å
360	A	36.6	Very low	39.2	Very low	88 Å²	88	141.1 Å²	141.1	73%	0.727	81%	0.807	S	S	*	*			trans	-73.6	142.8	-172	0	0	0	0	0	112.9	R362	A360-R362 PolarHBondContact O-N 3.44Å
361	P	37.6	Very low	38.5	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	81%	0.808	S	S	*	*			trans	-73.3	110	-179.1	29	-34.3	0	0	0	111.7	Q363	P361-Q363 PolarHBondContact O-N 3.47Å
362	R	38.3	Very low	37.9	Very low	252 Å²	252	143.3 Å²	143.3	95%	0.951	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.1	121.6	175.1	-132.2	179.6	-165.9	-170.5	4.9	110.2	A360	A360-R362 PolarHBondContact O-N 3.44Å
363	Q	34.3	Very low	36.9	Very low	186 Å²	186	143.6 Å²	143.6	87%	0.869	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-69.9	141.3	-175.2	-64.1	-178.6	1.3	0	0	112.7	P361	P361-Q363 PolarHBondContact O-N 3.47Å
364	R	39.9	Very low	37.1	Very low	226 Å²	226	146.4 Å²	146.4	85%	0.853	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-77	141.8	162.3	176.5	-179.4	-81.6	-175.4	-5.7	109
365	P	34.7	Very low	37.7	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-58.1	140	178.3	-24.9	34.6	0	0	0	112.9
366	K	32.7	Very low	37	Very low	207 Å²	207	145.9 Å²	145.9	90%	0.9	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.4	133.6	170.2	-77.2	-176.6	173.9	-179.7	0	110.3
367	A	30.2	Very low	36	Very low	100 Å²	100	142.2 Å²	142.2	83%	0.826	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.2	155.4	151.7	0	0	0	0	0	109.4
368	A	30.9	Very low	35.6	Very low	96 Å²	96	142.6 Å²	142.6	79%	0.793	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.3	154.9	-172.6	0	0	0	0	0	113.6
369	N	31.5	Very low	34.8	Very low	173 Å²	173	142.6 Å²	142.6	93%	0.925	79%	0.793	S	S	*	*			trans	-149.9	146.8	145	-106.4	-11.6	0	0	0	107.9
370	S	33.3	Very low	34.3	Very low	101 Å²	101	141.3 Å²	141.3	71%	0.706	79%	0.793	S	S	*	*			trans	-115	158.3	-165.4	47.4	0	0	0	0	113.8
371	N	32	Very low	34	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	80%	0.795	S	S	*	*			trans	81.2	117.1	154.2	-65.6	-3.6	0	0	0	122
372	V	30.6	Very low	34.2	Very low	128 Å²	128	142.2 Å²	142.2	78%	0.776	79%	0.789	S	S	*	*				81.6	86.3	122.3	179.5	0	0	0	0	119.7
373	L	28.8	Very low	33.9	Very low	155 Å²	155	136.4 Å²	136.4	81%	0.812	78%	0.781	S	S	*	*				16	162.7	103.3	-75.6	171.4	0	0	0	120.2
374	P	45.3	Very low	33.8	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	78%	0.779	S	S	*	*			cis	-134.2	-131.6	-12.2	35.1	-8.9	0	0	0	113.7
375	P	54.6	Low	33.2	Very low	106 Å²	106	134.9 Å²	134.9	69%	0.688	78%	0.783	S	S	*	*				-140	-144.6	-123.4	45.4	-20.6	0	0	0	116.3
376	L	30.4	Very low	32.9	Very low	148 Å²	148	133.5 Å²	133.5	78%	0.775	78%	0.782	S	S	*	*			trans	96.8	144.3	166.7	-57.1	178.5	0	0	0	117.4
377	T	29.9	Very low	32.9	Very low	107 Å²	107	130.1 Å²	130.1	66%	0.656	78%	0.778	S	S	*	*			cis	-176.4	142.7	-40.4	24.5	0	0	0	0	109.8
378	N	29.6	Very low	33.3	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	78%	0.779	S	S	*	*			trans	137.4	111.5	138.3	-72.6	-31	0	0	0	118.1
379	T	28.6	Very low	33.3	Very low	118 Å²	118	132.2 Å²	132.2	72%	0.724	78%	0.778	S	S	*	*				42.9	120	118.6	-33.9	0	0	0	0	121.8
380	V	31.3	Very low	33.3	Very low	132 Å²	132	128.5 Å²	128.5	80%	0.8	77%	0.772	S	S	*	*				-176.2	160.7	112.6	150.8	0	0	0	0	110.8
381	T	29.3	Very low	33.9	Very low	126 Å²	126	129.3 Å²	129.3	77%	0.773	77%	0.774	S	S	*	*			trans	-95.1	-171.8	-169.7	48.2	0	0	0	0	112.2
382	P	42.3	Very low	33.8	Very low	106 Å²	106	128.9 Å²	128.9	69%	0.688	78%	0.777	S	S	*	*			cis	-147.7	169.9	14.4	44.8	-24	0	0	0	121
383	V	31.5	Very low	33.8	Very low	129 Å²	129	127.2 Å²	127.2	78%	0.782	77%	0.771	S	S	*	*			trans	50.8	119.1	140.2	172.1	0	0	0	0	119.4
384	K	31.5	Very low	33.9	Very low	190 Å²	190	127.8 Å²	127.8	83%	0.826	78%	0.775	S	S	*	*			cis	80.9	116.2	43.6	-176.3	-168.2	172	-177	0	115.5
385	M	28.6	Very low	33.2	Very low	190 Å²	190	126.3 Å²	126.3	94%	0.936	78%	0.78	S	S	*	*			trans	-156.8	154	135.7	-86.5	-130.2	-177.7	0	0	111
386	A	27.9	Very low	32	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	79%	0.785	S	S	*	*			trans	-159.7	153.8	178.5	0	0	0	0	0	109.9
387	V	31.8	Very low	32.1	Very low	137 Å²	137	131 Å²	131	83%	0.83	79%	0.786	S	S	*	*			trans	-142	139.1	175.8	-174.1	0	0	0	0	110
388	P	39.6	Very low	32	Very low	128 Å²	128	130.4 Å²	130.4	83%	0.831	79%	0.792	S	S	*	*			trans	-101.1	-154.7	-174.7	41.2	-37.1	0	0	0	114.2
389	S	31.1	Very low	32.8	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	79%	0.794	S	S	*	*			trans	-118.5	145.9	-151.9	53	0	0	0	0	118.3
390	A	31.5	Very low	33	Very low	96 Å²	96	130.1 Å²	130.1	79%	0.793	80%	0.797	S	S	*	*			trans	67.8	177.9	152.4	0	0	0	0	0	117.6
391	P	44.9	Very low	33.6	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	80%	0.8	S	S	*	*			cis	-134.1	-159.8	-10.6	27.1	-1.6	0	0	0	114.7
392	V	31.2	Very low	33.6	Very low	138 Å²	138	128 Å²	128	84%	0.836	80%	0.803	S	S	*	*			trans	96	159.6	158.2	-166	0	0	0	0	117.7
393	S	29.8	Very low	33.1	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	81%	0.813	S	S	*	*			trans	-137.5	-179	-149.9	61.2	0	0	0	0	116.1
394	N	30.7	Very low	33	Very low	167 Å²	167	126.7 Å²	126.7	89%	0.893	82%	0.815	S	S	*	*			trans	81.5	131.1	169	-68.4	-15.1	0	0	0	119.7
395	G	30.3	Very low	32.9	Very low	81 Å²	81	126.7 Å²	126.7	84%	0.835	82%	0.817	S	S	*	*			trans	169.1	135.8	170.6	0	0	0	0	0	111.6
396	Q	31.2	Very low	34.4	Very low	172 Å²	172	122.5 Å²	122.5	80%	0.804	81%	0.805	S	S	*	*			trans	-112.8	155.6	-171.1	-71.1	-172	0.6	0	0	114.8
397	K	30.6	Very low	34.5	Very low	180 Å²	180	124.1 Å²	124.1	78%	0.783	81%	0.81	S	S	*	*			trans	68.3	110.6	148.3	-77.9	171.2	175.6	175	0	121.5
398	A	29.5	Very low	34.5	Very low	95 Å²	95	121 Å²	121	79%	0.785	81%	0.806	S	S	*	*				64.1	167	121.8	0	0	0	0	0	120.2
399	P	45.3	Very low	33.9	Very low	123 Å²	123	124 Å²	124	80%	0.799	81%	0.809	S	S	*	*			cis	-129.1	-179.9	-0.5	42.5	-26.5	0	0	0	116.5
400	T	33.3	Very low	34.8	Very low	128 Å²	128	123.7 Å²	123.7	79%	0.785	80%	0.804	S	S	*	*			trans	-68.1	169.1	159.9	40.7	0	0	0	0	112.4
401	P	44.5	Very low	34.8	Very low	132 Å²	132	124.1 Å²	124.1	86%	0.857	80%	0.801	S	S	*	*			cis	-150.1	-167.5	37.1	44.5	-22.9	0	0	0	117.5
402	G	29.3	Very low	34.2	Very low	81 Å²	81	124 Å²	124	84%	0.835	80%	0.798	S	S	*	*			trans	151.7	116.9	158.4	0	0	0	0	0	116.7
403	S	31.8	Very low	34.1	Very low	129 Å²	129	125.5 Å²	125.5	90%	0.902	80%	0.796	S	S	*	*			trans	-97.3	153.4	179.2	52.6	0	0	0	0	114.2
404	G	29	Very low	34.2	Very low	79 Å²	79	127.8 Å²	127.8	81%	0.814	81%	0.806	S	S	*	*			trans	-164.1	142.8	170.7	0	0	0	0	0	115.8
405	Q	29.4	Very low	34.1	Very low	189 Å²	189	124.3 Å²	124.3	88%	0.883	80%	0.801	S	S	*	*			trans	-148.8	-174.9	-179.8	-110.2	-164.2	-5.8	0	0	107.2
406	P	59.6	Low	34.8	Very low	103 Å²	103	126.8 Å²	126.8	67%	0.669	80%	0.802	S	S	*	*			cis	-134.2	-179.1	-48.6	39.5	-23.4	0	0	0	112.4
407	S	29.9	Very low	34.7	Very low	128 Å²	128	122.1 Å²	122.1	90%	0.895	80%	0.801	S	S	*	*			trans	170.7	157.5	150.4	36.7	0	0	0	0	110.3
408	G	31.6	Very low	34.8	Very low	72 Å²	72	119 Å²	119	74%	0.742	80%	0.801	S	S	*	*			cis	-160	-179.5	-1.6	0	0	0	0	0	112.2
409	Q	27.5	Very low	35.1	Very low	191 Å²	191	123 Å²	123	89%	0.893	80%	0.804	S	S	*	*			trans	-101.3	-163.7	-174.9	-55	-176.1	-45.3	0	0	111.3
410	P	50	Low	34.6	Very low	103 Å²	103	125.2 Å²	125.2	67%	0.669	80%	0.803	S	S	*	*			cis	-146.6	175.8	-1.7	42.4	-22.1	0	0	0	119.6
411	S	31.9	Very low	34.8	Very low	106 Å²	106	127.4 Å²	127.4	74%	0.741	80%	0.804	S	S	*	*			trans	72.3	151.1	140.8	73.6	0	0	0	0	120.9
412	V	32.1	Very low	34.6	Very low	114 Å²	114	132.3 Å²	132.3	69%	0.691	81%	0.806	S	S	*	*			cis	-163.6	149.2	-8.7	117	0	0	0	0	112.1
413	Q	29.6	Very low	34.9	Very low	169 Å²	169	134.3 Å²	134.3	79%	0.79	80%	0.801	S	S	*	*			trans	44.9	136.3	158	-61.2	163.5	7.4	0	0	120.2
414	T	30.7	Very low	35.2	Very low	141 Å²	141	135.2 Å²	135.2	87%	0.865	80%	0.795	S	S	*	*				-156.7	175.9	58.8	38.9	0	0	0	0	113.3
415	A	29.2	Very low	35.9	Very low	94 Å²	94	140.2 Å²	140.2	78%	0.777	80%	0.798	S	S	*	*			trans	-142.6	173.1	179.6	0	0	0	0	0	108.9
416	P	45.7	Very low	36.5	Very low	133 Å²	133	139.4 Å²	139.4	86%	0.864	79%	0.794	S	S	*	*			cis	-131.9	171.7	9.6	41.9	-25.7	0	0	0	116.2
417	G	28.7	Very low	35.8	Very low	75 Å²	75	141.3 Å²	141.3	77%	0.773	80%	0.798	S	S	*	*			trans	-171.3	128.9	171.9	0	0	0	0	0	112.5	Q419	G417-Q419 PolarHBondContact O-N 2.95Å
418	S	31.8	Very low	36.8	Very low	113 Å²	113	142.5 Å²	142.5	79%	0.79	79%	0.789	S	S	*	*			trans	-47	120.7	-172	47.4	0	0	0	0	118.1
419	Q	35.7	Very low	37.7	Very low	181 Å²	181	145.2 Å²	145.2	85%	0.846	79%	0.794	S	S	*	*			trans	27.3	117.1	131.4	-59.7	178.2	-3.6	0	0	119.5	G417	G417-Q419 PolarHBondContact O-N 2.95Å
420	Q	34.7	Very low	38.8	Very low	169 Å²	169	138 Å²	138	79%	0.79	77%	0.771	S	S	*	*				-171.1	164.7	108.9	-102.4	-179.1	20.4	0	0	112.3
421	H	38.9	Very low	39	Very low	173 Å²	173	137 Å²	137	80%	0.801	76%	0.76	S	S	*	*			trans	50.9	85.9	170.2	-69.8	97.8	0	0	0	119.4
422	R	39.6	Very low	40.3	Very low	236 Å²	236	138.6 Å²	138.6	89%	0.891	76%	0.759	S	S	*	*			trans	-83.3	130.8	146.1	169.7	-160.6	-85.7	-163.3	-5	108.4
423	V	35.8	Very low	41.7	Very low	122 Å²	122	142.1 Å²	142.1	74%	0.739	76%	0.76	S	S	*	*			trans	176.5	129.7	134	145.1	0	0	0	0	111.5
424	L	37.1	Very low	43.2	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	75%	0.751	S	S	*	*			trans	36.1	110.4	161.3	-81.7	145.2	0	0	0	120.9
425	Q	44.3	Very low	45.1	Very low	184 Å²	184	138.9 Å²	138.9	86%	0.86	74%	0.738	S	S	*	*			trans	-125.7	98	143	-173.7	174.9	87.3	0	0	109.4
426	Q	42.9	Very low	47.1	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	73%	0.733	S	S	*	*			trans	-141.2	91.5	165.8	-83.8	-169.8	-22.7	0	0	108.1
427	L	44.8	Very low	48.3	Very low	143 Å²	143	139.7 Å²	139.7	75%	0.749	72%	0.717	S	S	*	*			trans	-76.4	139.9	172.7	-77.1	160.5	0	0	0	109.8
428	Q	50.3	Low	50.6	Low	152 Å²	152	143 Å²	143	71%	0.71	71%	0.712	S	S	*	*			trans	-86.1	154.3	176.8	-67.5	-167.8	17.7	0	0	110.5	G430 D431	Q428-G430 PolarHBondContact O-N 3.47Å; Q428-D431 PolarHBondContact O-N 2.92Å
429	P	51.3	Low	52.6	Low	130 Å²	130	142.7 Å²	142.7	84%	0.844	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	8.5	179.2	27.3	-35.6	0	0	0	115.3
430	G	50.7	Low	54.5	Low	40 Å²	40	140.2 Å²	140.2	41%	0.412	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	-39.7	172.9	0	0	0	0	0	113.7	Q428 L432 R433 L434	Q428-G430 PolarHBondContact O-N 3.47Å; G430-L432 PolarHBondContact O-N 3.03Å; G430-R433 WeakPolarHBondContact O-CB 3.5Å; G430-R433 PolarHBondContact O-N 3.39Å; G430-R433 VanDerWaalsContact O-N 3.09Å; G430-L434 PolarHBondContact O-N 3.4Å
431	D	54.3	Low	56.4	Low	82 Å²	82	138.4 Å²	138.4	44%	0.439	68%	0.681	S	S	.	*	H	α-helix	trans	-66.5	-41.4	-168.2	-63.6	-54.1	0	0	0	112.8	Q428 R433 L434 Q435	Q428-D431 PolarHBondContact O-N 2.92Å; D431-R433 PolarHBondContact O-N 3.31Å; D431-L434 PolarHBondContact O-N 3.17Å; D431-Q435 PolarHBondContact O-N 2.94Å
432	L	58.3	Low	58.2	Low	138 Å²	138	136.3 Å²	136.3	72%	0.723	67%	0.672	S	S	*	*	H	α-helix	trans	-56.9	-34.8	174.7	-110	76.4	0	0	0	112.4	G430 Q436	G430-L432 PolarHBondContact O-N 3.03Å; L432-Q436 VanDerWaalsContact O-CB 3.31Å; L432-Q436 WeakPolarHBondContact O-CB 3.13Å; L432-Q436 PolarHBondContact O-N 3.2Å
433	R	61.2	Low	60	Low	188 Å²	188	131.3 Å²	131.3	71%	0.709	66%	0.658	S	S	*	*	H	α-helix	trans	-76.5	-35.7	-178.2	-167.6	174.7	-176.2	170.2	1.7	111.9	G430 D431 L437	G430-R433 WeakPolarHBondContact O-CB 3.5Å; G430-R433 PolarHBondContact O-N 3.39Å; G430-R433 VanDerWaalsContact O-N 3.09Å; D431-R433 PolarHBondContact O-N 3.31Å; R433-L437 WeakPolarHBondContact O-CB 3.46Å; R433-L437 PolarHBondContact O-N 3Å; R433-L437 VanDerWaalsContact O-N 3.08Å
434	L	62.1	Low	62	Low	117 Å²	117	132.1 Å²	132.1	61%	0.613	65%	0.654	S	S	*	*	H	α-helix	trans	-65.7	-46.6	171.5	-79	164.5	0	0	0	111.2	G430 D431 Q436 L437 Q438	G430-L434 PolarHBondContact O-N 3.4Å; D431-L434 PolarHBondContact O-N 3.17Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; L434-Q436 PolarHBondContact O-N 3.34Å; L434-L437 WeakPolarHBondContact O-CB 3.2Å; L434-L437 PolarHBondContact O-N 2.85Å; L434-Q438 PolarHBondContact O-N 3.39Å
435	Q	70.8	Confident	64.1	Low	126 Å²	126	131 Å²	131	59%	0.589	65%	0.645	S	S	*	*	H	α-helix	trans	-62	-40.2	178.4	-165.8	174	38.2	0	0	112.1	D431 Q438 L439	D431-Q435 PolarHBondContact O-N 2.94Å; Q435-Q438 PolarHBondContact O-N 3.13Å; Q435-L439 PolarHBondContact O-N 3.25Å
436	Q	70.7	Confident	65.8	Low	145 Å²	145	128.8 Å²	128.8	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-66.8	-37.4	175.5	-171.6	171.3	95	0	0	112.8	L432 L434 Q440	L432-Q436 VanDerWaalsContact O-CB 3.31Å; L432-Q436 WeakPolarHBondContact O-CB 3.13Å; L432-Q436 PolarHBondContact O-N 3.2Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; L434-Q436 PolarHBondContact O-N 3.34Å; Q436-Q440 WeakPolarHBondContact O-CB 3.4Å; Q436-Q440 PolarHBondContact O-N 2.83Å
437	L	71.1	Confident	67.7	Low	99 Å²	99	126 Å²	126	52%	0.518	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-39.5	171.9	-96.9	160.2	0	0	0	112.4	R433 L434 Q440 Q441	R433-L437 WeakPolarHBondContact O-CB 3.46Å; R433-L437 PolarHBondContact O-N 3Å; R433-L437 VanDerWaalsContact O-N 3.08Å; L434-L437 WeakPolarHBondContact O-CB 3.2Å; L434-L437 PolarHBondContact O-N 2.85Å; L437-Q440 PolarHBondContact O-N 3.1Å; L437-Q441 WeakPolarHBondContact O-CB 3.25Å; L437-Q441 PolarHBondContact O-N 3Å
438	Q	75.8	Confident	69.7	Low	143 Å²	143	125.5 Å²	125.5	67%	0.668	62%	0.619	S	S	*	*	H	α-helix	trans	-67.1	-43.7	179.6	-163.8	171.7	14.5	0	0	111.7	L434 Q435 Q441 Q442	L434-Q438 PolarHBondContact O-N 3.39Å; Q435-Q438 PolarHBondContact O-N 3.13Å; Q438-Q441 PolarHBondContact O-N 2.82Å; Q438-Q442 WeakPolarHBondContact O-CB 3.39Å; Q438-Q442 PolarHBondContact O-N 2.83Å
439	L	73.4	Confident	71.2	Confident	108 Å²	108	125.2 Å²	125.2	57%	0.565	61%	0.612	S	S	*	*	H	α-helix	trans	-60	-42.8	171.6	-85.9	160	0	0	0	112.5	Q435 Q442 Q443	Q435-L439 PolarHBondContact O-N 3.25Å; L439-Q442 PolarHBondContact O-N 3.38Å; L439-Q443 PolarHBondContact O-N 2.72Å
440	Q	76.5	Confident	72.9	Confident	128 Å²	128	124 Å²	124	60%	0.598	60%	0.598	S	S	*	*	H	α-helix	trans	-65.4	-39.5	177.4	-176.4	169.3	85	0	0	112.2	Q436 L437 Q444	Q436-Q440 WeakPolarHBondContact O-CB 3.4Å; Q436-Q440 PolarHBondContact O-N 2.83Å; L437-Q440 PolarHBondContact O-N 3.1Å; Q440-Q444 WeakPolarHBondContact O-CB 3.46Å; Q440-Q444 PolarHBondContact O-N 2.85Å
441	Q	74.6	Confident	74.7	Confident	131 Å²	131	128.7 Å²	128.7	61%	0.612	61%	0.609	S	S	*	*	H	α-helix	trans	-64.5	-44.3	175.3	-167.7	-174.9	114.8	0	0	111.5	L437 Q438 Q443 Q444 Q445	L437-Q441 WeakPolarHBondContact O-CB 3.25Å; L437-Q441 PolarHBondContact O-N 3Å; Q438-Q441 PolarHBondContact O-N 2.82Å; Q441-Q443 PolarHBondContact O-N 3.08Å; Q441-Q444 PolarHBondContact O-N 3.08Å; Q441-Q445 WeakPolarHBondContact O-CB 3.35Å; Q441-Q445 PolarHBondContact O-N 3.03Å
442	Q	76.4	Confident	76.1	Confident	130 Å²	130	132.3 Å²	132.3	61%	0.607	62%	0.618	S	S	*	*	H	α-helix	trans	-62.4	-43.4	178.8	-167.8	177.9	43.6	0	0	111.9	Q438 L439 Q445 Q446	Q438-Q442 WeakPolarHBondContact O-CB 3.39Å; Q438-Q442 PolarHBondContact O-N 2.83Å; L439-Q442 PolarHBondContact O-N 3.38Å; Q442-Q445 PolarHBondContact O-N 3.19Å; Q442-Q446 PolarHBondContact O-N 3.31Å
443	Q	78.3	Confident	77.5	Confident	130 Å²	130	130.8 Å²	130.8	61%	0.607	61%	0.607	S	S	*	*	H	α-helix	trans	-63.5	-41.4	175.3	-174.9	177	95.1	0	0	112.2	L439 Q441 Q446 L447	L439-Q443 PolarHBondContact O-N 2.72Å; Q441-Q443 PolarHBondContact O-N 3.08Å; Q443-Q446 PolarHBondContact O-N 2.88Å; Q443-L447 HydrophobicContact CG-CD1 4.44Å; Q443-L447 WeakPolarHBondContact O-CG 3.35Å; Q443-L447 PolarHBondContact O-N 2.99Å
444	Q	77.2	Confident	78.7	Confident	140 Å²	140	128 Å²	128	65%	0.654	60%	0.602	S	S	*	*	H	α-helix	trans	-64.8	-39.4	177.3	-173.8	169.9	90.8	0	0	112.1	Q440 Q441 L447 Q448	Q440-Q444 WeakPolarHBondContact O-CB 3.46Å; Q440-Q444 PolarHBondContact O-N 2.85Å; Q441-Q444 PolarHBondContact O-N 3.08Å; Q444-L447 PolarHBondContact O-N 3.36Å; Q444-Q448 PolarHBondContact O-N 3.49Å
445	Q	80.7	Confident	79.8	Confident	126 Å²	126	125 Å²	125	59%	0.589	59%	0.594	S	S	*	*	H	α-helix	trans	-66.7	-38.8	176	-168.2	173.5	76.7	0	0	112	Q441 Q442 Q448 Y449	Q441-Q445 WeakPolarHBondContact O-CB 3.35Å; Q441-Q445 PolarHBondContact O-N 3.03Å; Q442-Q445 PolarHBondContact O-N 3.19Å; Q445-Q448 PolarHBondContact O-N 3.47Å; Q445-Y449 PolarHBondContact O-N 2.88Å
446	Q	81.4	Confident	80.6	Confident	137 Å²	137	121.9 Å²	121.9	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-66.3	-40.1	175.5	-169.3	175.3	66	0	0	112.5	Q442 Q443 Y449 L450	Q442-Q446 PolarHBondContact O-N 3.31Å; Q443-Q446 PolarHBondContact O-N 2.88Å; Q446-Y449 PolarHBondContact O-N 3.03Å; Q446-L450 PolarHBondContact O-N 2.87Å; Q446-L450 VanDerWaalsContact O-N 3.11Å
447	L	82.4	Confident	81.3	Confident	112 Å²	112	121.7 Å²	121.7	59%	0.586	58%	0.582	S	S	*	*	H	α-helix	trans	-62.7	-41.9	172.8	-75.1	167.1	0	0	0	112.1	Q443 Q444 Y449 L450 Q451	Q443-L447 HydrophobicContact CG-CD1 4.44Å; Q443-L447 WeakPolarHBondContact O-CG 3.35Å; Q443-L447 PolarHBondContact O-N 2.99Å; Q444-L447 PolarHBondContact O-N 3.36Å; L447-Y449 VanDerWaalsContact C-N 3.29Å; L447-Y449 PolarHBondContact O-N 2.9Å; L447-L450 PolarHBondContact O-N 3.26Å; L447-Q451 PolarHBondContact O-N 3.29Å
448	Q	85.9	Confident	82.1	Confident	134 Å²	134	122.6 Å²	122.6	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-62.7	-36.8	176.2	-169.1	174.9	24.9	0	0	111.9	Q444 Q445 Q451 Y452	Q444-Q448 PolarHBondContact O-N 3.49Å; Q445-Q448 PolarHBondContact O-N 3.47Å; Q448-Q451 PolarHBondContact O-N 3.44Å; Q448-Y452 PolarHBondContact O-N 2.85Å
449	Y	82.4	Confident	82.6	Confident	145 Å²	145	119.3 Å²	119.3	57%	0.569	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-41.6	176.6	-165.8	-101.8	0	0	0	112.7	Q445 Q446 L447 Y452 Q453	Q445-Y449 PolarHBondContact O-N 2.88Å; Q446-Y449 PolarHBondContact O-N 3.03Å; L447-Y449 VanDerWaalsContact C-N 3.29Å; L447-Y449 PolarHBondContact O-N 2.9Å; Y449-Y452 PolarHBondContact O-N 2.86Å; Y449-Q453 HydrophobicContact CE1-CG 4.31Å; Y449-Q453 VanDerWaalsContact CE1-NE2 3.31Å; Y449-Q453 PolarHBondContact O-N 2.85Å
450	L	86.7	Confident	83.2	Confident	105 Å²	105	119.1 Å²	119.1	55%	0.55	58%	0.576	S	S	.	*	H	α-helix	trans	-60.3	-45.2	171.7	-102.5	79.3	0	0	0	111.8	Q446 L447 Y452 Q453 Q454	Q446-L450 PolarHBondContact O-N 2.87Å; Q446-L450 VanDerWaalsContact O-N 3.11Å; L447-L450 PolarHBondContact O-N 3.26Å; L450-Y452 VanDerWaalsContact C-N 3.29Å; L450-Y452 PolarHBondContact O-N 3.06Å; L450-Q453 PolarHBondContact O-N 2.74Å; L450-Q454 PolarHBondContact O-N 3.14Å
451	Q	87.9	Confident	83.9	Confident	139 Å²	139	119.8 Å²	119.8	65%	0.65	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-38.4	179	-168.4	176.7	34.5	0	0	111.7	L447 Q448 Q454 A455	L447-Q451 PolarHBondContact O-N 3.29Å; Q448-Q451 PolarHBondContact O-N 3.44Å; Q451-Q454 PolarHBondContact O-N 3.16Å; Q451-A455 WeakPolarHBondContact O-CB 2.91Å; Q451-A455 PolarHBondContact O-N 2.86Å
452	Y	85.2	Confident	84.5	Confident	158 Å²	158	119 Å²	119	62%	0.62	58%	0.578	S	S	*	*	H	α-helix	trans	-63	-48.3	174.3	179.7	-101.2	0	0	0	112.2	Q448 Y449 L450 Q454 A455 V456	Q448-Y452 PolarHBondContact O-N 2.85Å; Y449-Y452 PolarHBondContact O-N 2.86Å; L450-Y452 VanDerWaalsContact C-N 3.29Å; L450-Y452 PolarHBondContact O-N 3.06Å; Y452-Q454 VanDerWaalsContact C-N 3.3Å; Y452-Q454 PolarHBondContact O-N 3.19Å; Y452-A455 PolarHBondContact O-N 2.8Å; Y452-V456 HydrophobicContact CD1-CG2 4.37Å; Y452-V456 HydrophobicContact CE1-CG2 3.94Å; Y452-V456 HydrophobicContact CE2-CG2 4.22Å; Y452-V456 WeakPolarHBondContact O-CG2 3.42Å; Y452-V456 PolarHBondContact O-N 2.68Å
453	Q	86.2	Confident	85	Confident	106 Å²	106	119 Å²	119	50%	0.495	58%	0.578	S	S	.	*	H	α-helix	trans	-59	-41.4	176.3	-72.6	-168.9	-12.9	0	0	112.2	Y449 L450 V456 Q457	Y449-Q453 HydrophobicContact CE1-CG 4.31Å; Y449-Q453 VanDerWaalsContact CE1-NE2 3.31Å; Y449-Q453 PolarHBondContact O-N 2.85Å; L450-Q453 PolarHBondContact O-N 2.74Å; Q453-V456 PolarHBondContact O-N 2.7Å; Q453-Q457 PolarHBondContact O-N 3.36Å
454	Q	87.7	Confident	85.4	Confident	128 Å²	128	118.7 Å²	118.7	60%	0.598	58%	0.577	S	S	*	*	H	α-helix	trans	-67.2	-37.2	179.4	-162.8	171.3	63.7	0	0	112.3	L450 Q451 Y452 Q457 Q458	L450-Q454 PolarHBondContact O-N 3.14Å; Q451-Q454 PolarHBondContact O-N 3.16Å; Y452-Q454 VanDerWaalsContact C-N 3.3Å; Y452-Q454 PolarHBondContact O-N 3.19Å; Q454-Q457 PolarHBondContact O-N 2.89Å; Q454-Q458 PolarHBondContact O-N 3.03Å
455	A	84.9	Confident	85.8	Confident	55 Å²	55	118.3 Å²	118.3	46%	0.455	58%	0.575	S	S	.	*	H	α-helix	trans	-66.5	-41.3	173.6	0	0	0	0	0	112.6	Q451 Y452 Q457 Q458 S459	Q451-A455 WeakPolarHBondContact O-CB 2.91Å; Q451-A455 PolarHBondContact O-N 2.86Å; Y452-A455 PolarHBondContact O-N 2.8Å; A455-Q457 VanDerWaalsContact C-N 3.33Å; A455-Q457 PolarHBondContact O-N 3.32Å; A455-Q458 PolarHBondContact O-N 2.97Å; A455-S459 WeakPolarHBondContact O-CB 3.37Å; A455-S459 PolarHBondContact O-N 3.37Å
456	V	86.5	Confident	86	Confident	60 Å²	60	118.6 Å²	118.6	36%	0.364	58%	0.576	S	S	.	*	H	α-helix	trans	-62.4	-40.8	174.2	171.5	0	0	0	0	111	Y452 Q453 S459 L460	Y452-V456 HydrophobicContact CD1-CG2 4.37Å; Y452-V456 HydrophobicContact CE1-CG2 3.94Å; Y452-V456 HydrophobicContact CE2-CG2 4.22Å; Y452-V456 WeakPolarHBondContact O-CG2 3.42Å; Y452-V456 PolarHBondContact O-N 2.68Å; Q453-V456 PolarHBondContact O-N 2.7Å; V456-S459 WeakPolarHBondContact O-CB 3.26Å; V456-S459 PolarHBondContact O-N 3.1Å; V456-L460 HydrophobicContact CG1-CD1 4.15Å; V456-L460 WeakPolarHBondContact O-CG 3.5Å; V456-L460 PolarHBondContact O-N 2.88Å
457	Q	85.9	Confident	86.2	Confident	141 Å²	141	114.8 Å²	114.8	66%	0.659	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-41.4	177.7	-169.5	171.4	82.6	0	0	112.4	Q453 Q454 A455 Q461	Q453-Q457 PolarHBondContact O-N 3.36Å; Q454-Q457 PolarHBondContact O-N 2.89Å; A455-Q457 VanDerWaalsContact C-N 3.33Å; A455-Q457 PolarHBondContact O-N 3.32Å; Q457-Q461 WeakPolarHBondContact O-CB 3.5Å; Q457-Q461 PolarHBondContact O-N 3.28Å; Q457-Q461 VanDerWaalsContact O-N 3.11Å
458	Q	87.2	Confident	86.4	Confident	119 Å²	119	114 Å²	114	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-64.7	-39	172.5	-73.4	-174.3	-0.5	0	0	112.5	Q454 A455 Q461 L462	Q454-Q458 PolarHBondContact O-N 3.03Å; A455-Q458 PolarHBondContact O-N 2.97Å; Q458-Q461 PolarHBondContact O-N 3Å; Q458-L462 WeakPolarHBondContact O-CB 3.4Å; Q458-L462 WeakPolarHBondContact O-CG 3.29Å; Q458-L462 PolarHBondContact O-N 2.81Å
459	S	87.1	Confident	86.6	Confident	73 Å²	73	113 Å²	113	51%	0.51	56%	0.562	S	S	.	*	H	α-helix	trans	-59	-48.1	176.4	-179	0	0	0	0	111.9	A455 V456 Q461 L462 Q463	A455-S459 WeakPolarHBondContact O-CB 3.37Å; A455-S459 PolarHBondContact O-N 3.37Å; V456-S459 WeakPolarHBondContact O-CB 3.26Å; V456-S459 PolarHBondContact O-N 3.1Å; S459-Q461 VanDerWaalsContact C-N 3.34Å; S459-Q461 PolarHBondContact O-N 3.3Å; S459-L462 PolarHBondContact O-N 3.37Å; S459-Q463 WeakPolarHBondContact O-CB 3.32Å; S459-Q463 PolarHBondContact O-N 3.06Å
460	L	86.8	Confident	86.7	Confident	104 Å²	104	110.9 Å²	110.9	55%	0.545	56%	0.561	S	S	.	*	H	α-helix	trans	-61	-40.6	175.6	-73.8	164	0	0	0	112.3	V456 Q463 H464	V456-L460 HydrophobicContact CG1-CD1 4.15Å; V456-L460 WeakPolarHBondContact O-CG 3.5Å; V456-L460 PolarHBondContact O-N 2.88Å; L460-Q463 PolarHBondContact O-N 2.72Å; L460-H464 WeakPolarHBondContact O-CB 3.3Å; L460-H464 PolarHBondContact O-N 3.18Å
461	Q	89.5	Confident	86.6	Confident	142 Å²	142	110.4 Å²	110.4	66%	0.664	56%	0.556	S	S	*	*	H	α-helix	trans	-68.5	-40.7	-179.5	-162	173	42.3	0	0	112.2	Q457 Q458 S459 H464 Q465	Q457-Q461 WeakPolarHBondContact O-CB 3.5Å; Q457-Q461 PolarHBondContact O-N 3.28Å; Q457-Q461 VanDerWaalsContact O-N 3.11Å; Q458-Q461 PolarHBondContact O-N 3Å; S459-Q461 VanDerWaalsContact C-N 3.34Å; S459-Q461 PolarHBondContact O-N 3.3Å; Q461-H464 PolarHBondContact O-N 2.88Å; Q461-Q465 PolarHBondContact O-N 3.07Å
462	L	88	Confident	86.3	Confident	115 Å²	115	108.9 Å²	108.9	60%	0.602	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-44.1	172	-77.8	165.3	0	0	0	111.8	Q458 S459 H464 Q465 Q466	Q458-L462 WeakPolarHBondContact O-CB 3.4Å; Q458-L462 WeakPolarHBondContact O-CG 3.29Å; Q458-L462 PolarHBondContact O-N 2.81Å; S459-L462 PolarHBondContact O-N 3.37Å; L462-H464 VanDerWaalsContact C-N 3.34Å; L462-H464 PolarHBondContact O-N 2.9Å; L462-Q465 PolarHBondContact O-N 3.38Å; L462-Q466 WeakPolarHBondContact O-CB 3.47Å; L462-Q466 PolarHBondContact O-N 3.47Å
463	Q	86.5	Confident	86	Confident	129 Å²	129	106.4 Å²	106.4	60%	0.603	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-40.1	178.6	-165.5	177.7	45.4	0	0	111.7	S459 L460 Q466 A467	S459-Q463 WeakPolarHBondContact O-CB 3.32Å; S459-Q463 PolarHBondContact O-N 3.06Å; L460-Q463 PolarHBondContact O-N 2.72Å; Q463-Q466 PolarHBondContact O-N 3.11Å; Q463-A467 WeakPolarHBondContact O-CB 3.39Å; Q463-A467 PolarHBondContact O-N 3.42Å
464	H	88	Confident	85.6	Confident	125 Å²	125	105.6 Å²	105.6	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-64.5	-44.1	174.4	-172.2	85.6	0	0	0	112.5	L460 Q461 L462 Q466 A467 L468	L460-H464 WeakPolarHBondContact O-CB 3.3Å; L460-H464 PolarHBondContact O-N 3.18Å; Q461-H464 PolarHBondContact O-N 2.88Å; L462-H464 VanDerWaalsContact C-N 3.34Å; L462-H464 PolarHBondContact O-N 2.9Å; H464-Q466 VanDerWaalsContact C-N 3.34Å; H464-Q466 PolarHBondContact O-N 3.32Å; H464-A467 PolarHBondContact O-N 3.31Å; H464-L468 PolarHBondContact O-N 3.35Å
465	Q	85.9	Confident	85.1	Confident	131 Å²	131	104.9 Å²	104.9	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-40.2	176.5	-172.4	175.9	92	0	0	111.8	Q461 L462 L468 L469	Q461-Q465 PolarHBondContact O-N 3.07Å; L462-Q465 PolarHBondContact O-N 3.38Å; Q465-L468 PolarHBondContact O-N 3.42Å; Q465-L469 PolarHBondContact O-N 2.87Å; Q465-L469 VanDerWaalsContact O-N 3.11Å
466	Q	84.3	Confident	84.5	Confident	132 Å²	132	107.8 Å²	107.8	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-66.1	-37.3	176.1	-167.9	173.4	86.7	0	0	112.1	L462 Q463 H464 L469 L470	L462-Q466 WeakPolarHBondContact O-CB 3.47Å; L462-Q466 PolarHBondContact O-N 3.47Å; Q463-Q466 PolarHBondContact O-N 3.11Å; H464-Q466 VanDerWaalsContact C-N 3.34Å; H464-Q466 PolarHBondContact O-N 3.32Å; Q466-L469 PolarHBondContact O-N 2.86Å; Q466-L470 HydrophobicContact CG-CD1 4.32Å; Q466-L470 PolarHBondContact O-N 3Å
467	A	85.3	Confident	83.6	Confident	58 Å²	58	110.5 Å²	110.5	48%	0.479	55%	0.548	S	S	.	.	H	α-helix	trans	-65.3	-39.3	174.7	0	0	0	0	0	113	Q463 H464 L469 L470 Q471	Q463-A467 WeakPolarHBondContact O-CB 3.39Å; Q463-A467 PolarHBondContact O-N 3.42Å; H464-A467 PolarHBondContact O-N 3.31Å; A467-L469 VanDerWaalsContact C-N 3.35Å; A467-L470 PolarHBondContact O-N 3.38Å; A467-Q471 WeakPolarHBondContact O-CB 3.08Å; A467-Q471 PolarHBondContact O-N 3.08Å
468	L	87.5	Confident	82.7	Confident	94 Å²	94	109.2 Å²	109.2	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-41.2	172.4	-76.9	166.1	0	0	0	111.9	H464 Q465 Q471 Q472	H464-L468 PolarHBondContact O-N 3.35Å; Q465-L468 PolarHBondContact O-N 3.42Å; L468-Q471 WeakPolarHBondContact O-CB 3.45Å; L468-Q471 PolarHBondContact O-N 2.6Å; L468-Q472 PolarHBondContact O-N 3.48Å
469	L	88.4	Confident	81.6	Confident	113 Å²	113	111 Å²	111	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-66.6	-41.2	179.2	-138.5	163.9	0	0	0	111.6	Q465 Q466 A467 Q472 Q473	Q465-L469 PolarHBondContact O-N 2.87Å; Q465-L469 VanDerWaalsContact O-N 3.11Å; Q466-L469 PolarHBondContact O-N 2.86Å; A467-L469 VanDerWaalsContact C-N 3.35Å; L469-Q472 PolarHBondContact O-N 2.95Å; L469-Q473 PolarHBondContact O-N 2.81Å
470	L	85.1	Confident	80.4	Confident	102 Å²	102	113 Å²	113	53%	0.534	56%	0.557	S	S	.	*	H	α-helix	trans	-62.1	-40.1	170.2	-102.3	112.4	0	0	0	112.7	Q466 A467 Q473 Q474	Q466-L470 HydrophobicContact CG-CD1 4.32Å; Q466-L470 PolarHBondContact O-N 3Å; A467-L470 PolarHBondContact O-N 3.38Å; L470-Q473 PolarHBondContact O-N 2.93Å; L470-Q474 WeakPolarHBondContact O-CB 3.45Å; L470-Q474 PolarHBondContact O-N 3.2Å
471	Q	84.8	Confident	79.1	Confident	95 Å²	95	114.2 Å²	114.2	44%	0.444	56%	0.559	S	S	.	*	H	α-helix	trans	-63.3	-42.1	177.7	-169.5	-178.6	114.9	0	0	111.6	A467 L468 Q474 Q475	A467-Q471 WeakPolarHBondContact O-CB 3.08Å; A467-Q471 PolarHBondContact O-N 3.08Å; L468-Q471 WeakPolarHBondContact O-CB 3.45Å; L468-Q471 PolarHBondContact O-N 2.6Å; Q471-Q474 PolarHBondContact O-N 3.44Å; Q471-Q475 PolarHBondContact O-N 3.28Å
472	Q	81.4	Confident	77.6	Confident	107 Å²	107	111.5 Å²	111.5	50%	0.5	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-43.1	176.1	-161.1	-143.4	101.8	0	0	111.7	L468 L469 Q474 Q475 Q476	L468-Q472 PolarHBondContact O-N 3.48Å; L469-Q472 PolarHBondContact O-N 2.95Å; Q472-Q474 VanDerWaalsContact C-N 3.3Å; Q472-Q474 PolarHBondContact O-N 2.84Å; Q472-Q475 PolarHBondContact O-N 3.05Å; Q472-Q476 PolarHBondContact O-N 2.86Å
473	Q	79.6	Confident	76.2	Confident	106 Å²	106	111.6 Å²	111.6	50%	0.495	55%	0.553	S	S	.	*	H	α-helix	trans	-59.5	-41.6	174.7	-169.3	-165.2	101.7	0	0	111.6	L469 L470 Q475 Q476 Q477	L469-Q473 PolarHBondContact O-N 2.81Å; L470-Q473 PolarHBondContact O-N 2.93Å; Q473-Q475 VanDerWaalsContact C-N 3.33Å; Q473-Q475 PolarHBondContact O-N 3.4Å; Q473-Q476 PolarHBondContact O-N 3.07Å; Q473-Q477 PolarHBondContact O-N 3.06Å
474	Q	78.4	Confident	74.9	Confident	89 Å²	89	113 Å²	113	42%	0.416	55%	0.554	S	S	.	*	H	α-helix	trans	-67.3	-31.6	179	-163.2	169.1	116.7	0	0	112.4	L470 Q471 Q472 M478	L470-Q474 WeakPolarHBondContact O-CB 3.45Å; L470-Q474 PolarHBondContact O-N 3.2Å; Q471-Q474 PolarHBondContact O-N 3.44Å; Q472-Q474 VanDerWaalsContact C-N 3.3Å; Q472-Q474 PolarHBondContact O-N 2.84Å; Q474-M478 PolarHBondContact O-N 2.8Å; Q474-M478 VanDerWaalsContact O-N 3.16Å
475	Q	76	Confident	73.5	Confident	113 Å²	113	113.9 Å²	113.9	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-68.3	-43.6	169.8	-74	-174.5	-2.6	0	0	112.3	Q471 Q472 Q473 Q477 M478 M479	Q471-Q475 PolarHBondContact O-N 3.28Å; Q472-Q475 PolarHBondContact O-N 3.05Å; Q473-Q475 VanDerWaalsContact C-N 3.33Å; Q473-Q475 PolarHBondContact O-N 3.4Å; Q475-Q477 VanDerWaalsContact C-N 3.32Å; Q475-Q477 PolarHBondContact O-N 3.05Å; Q475-M478 PolarHBondContact O-N 3.25Å; Q475-M479 PolarHBondContact O-N 2.97Å
476	Q	72.3	Confident	72.3	Confident	116 Å²	116	114 Å²	114	54%	0.542	56%	0.559	S	S	.	*	H	α-helix	trans	-60.5	-41.4	175.5	-67.9	-168	31	0	0	111.8	Q472 Q473 M478 M479 M480	Q472-Q476 PolarHBondContact O-N 2.86Å; Q473-Q476 PolarHBondContact O-N 3.07Å; Q476-M478 PolarHBondContact O-N 2.99Å; Q476-M479 PolarHBondContact O-N 3.23Å; Q476-M480 PolarHBondContact O-N 3.48Å; Q476-M480 VanDerWaalsContact O-N 3.15Å
477	Q	68.3	Low	71	Confident	116 Å²	116	113.5 Å²	113.5	54%	0.542	56%	0.556	S	S	.	*	H	α-helix	trans	-62.2	-40.3	175.2	-76.1	-176.3	-5	0	0	112.8	Q473 Q475 M479 M480 Q481	Q473-Q477 PolarHBondContact O-N 3.06Å; Q475-Q477 VanDerWaalsContact C-N 3.32Å; Q475-Q477 PolarHBondContact O-N 3.05Å; Q477-M479 VanDerWaalsContact C-N 3.33Å; Q477-M479 PolarHBondContact O-N 3.05Å; Q477-M480 PolarHBondContact O-N 3.4Å; Q477-Q481 PolarHBondContact O-N 3.3Å
478	M	65.7	Low	69.8	Low	114 Å²	114	113.7 Å²	113.7	56%	0.562	55%	0.552	S	S	*	*	H	α-helix	trans	-65.9	-30.8	176.6	-75.6	-168.7	-62	0	0	113.2	Q474 Q475 Q476 P482	Q474-M478 PolarHBondContact O-N 2.8Å; Q474-M478 VanDerWaalsContact O-N 3.16Å; Q475-M478 PolarHBondContact O-N 3.25Å; Q476-M478 PolarHBondContact O-N 2.99Å; M478-P482 VanDerWaalsContact O-CD 3.31Å; M478-P482 WeakPolarHBondContact O-CD 3.48Å
479	M	64.9	Low	68.5	Low	156 Å²	156	111.9 Å²	111.9	77%	0.768	55%	0.55	S	S	*	*	H	α-helix	trans	-73.2	-31.3	171.9	-74	-146.4	-64.2	0	0	113.4	Q475 Q476 Q477	Q475-M479 PolarHBondContact O-N 2.97Å; Q476-M479 PolarHBondContact O-N 3.23Å; Q477-M479 VanDerWaalsContact C-N 3.33Å; Q477-M479 PolarHBondContact O-N 3.05Å
480	M	61.4	Low	67.4	Low	116 Å²	116	112.8 Å²	112.8	57%	0.571	55%	0.551	S	S	*	*	H	α-helix	trans	-75.3	-29.3	177.2	-76	-68.5	-68.7	0	0	113.6	Q476 Q477 M483 Y484	Q476-M480 PolarHBondContact O-N 3.48Å; Q476-M480 VanDerWaalsContact O-N 3.15Å; Q477-M480 PolarHBondContact O-N 3.4Å; M480-M483 PolarHBondContact O-N 3.38Å; M480-Y484 PolarHBondContact O-N 2.87Å
481	Q	60.8	Low	66.4	Low	129 Å²	129	110.9 Å²	110.9	60%	0.603	55%	0.55	S	S	*	*	H	α-helix	trans	-57.9	-48.9	-172	-165.8	164.4	54.4	0	0	115.6	Q477 M483 Q485	Q477-Q481 PolarHBondContact O-N 3.3Å; Q481-M483 VanDerWaalsContact C-N 3.32Å; Q481-M483 PolarHBondContact O-N 3.03Å; Q481-Q485 PolarHBondContact O-N 3.34Å
482	P	57.9	Low	65.6	Low	86 Å²	86	112.6 Å²	112.6	56%	0.558	56%	0.558	S	S	*	*	H	α-helix	trans	-67.1	-32.6	-179.8	26	-34.7	0	0	0	112.9	M478 Q485 Q486	M478-P482 VanDerWaalsContact O-CD 3.31Å; M478-P482 WeakPolarHBondContact O-CD 3.48Å; P482-Q485 PolarHBondContact O-N 2.95Å; P482-Q486 PolarHBondContact O-N 3.27Å; P482-Q486 VanDerWaalsContact O-N 3.09Å
483	M	57.8	Low	65	Low	117 Å²	117	114.5 Å²	114.5	58%	0.576	56%	0.562	S	S	*	*	H	α-helix	trans	-67.3	-44.7	-177.9	-137.7	-81.7	-80	0	0	110.9	M480 Q481 Q485 Q487	M480-M483 PolarHBondContact O-N 3.38Å; Q481-M483 VanDerWaalsContact C-N 3.32Å; Q481-M483 PolarHBondContact O-N 3.03Å; M483-Q485 PolarHBondContact O-N 2.86Å; M483-Q487 PolarHBondContact O-N 3.23Å
484	Y	59.5	Low	64.8	Low	159 Å²	159	112.3 Å²	112.3	62%	0.624	56%	0.562	S	S	*	*	H	α-helix	trans	-65.7	-38.4	176.1	-144.9	-96.8	0	0	0	112.3	M480 Q487 V488	M480-Y484 PolarHBondContact O-N 2.87Å; Y484-Q487 PolarHBondContact O-N 3.25Å; Y484-V488 HydrophobicContact CD1-CG2 4.24Å; Y484-V488 HydrophobicContact CE1-CG2 4.39Å; Y484-V488 WeakPolarHBondContact O-CG2 3.49Å; Y484-V488 PolarHBondContact O-N 3.47Å; Y484-V488 VanDerWaalsContact O-N 3.12Å
485	Q	58.8	Low	64.5	Low	143 Å²	143	111 Å²	111	67%	0.668	57%	0.566	S	S	*	*	H	α-helix	trans	-72.4	-32.8	-177	-164.7	153.9	18.6	0	0	113	Q481 P482 M483 A489	Q481-Q485 PolarHBondContact O-N 3.34Å; P482-Q485 PolarHBondContact O-N 2.95Å; M483-Q485 PolarHBondContact O-N 2.86Å; Q485-A489 PolarHBondContact O-N 3.06Å
486	Q	59.3	Low	64.5	Low	132 Å²	132	110.7 Å²	110.7	62%	0.617	57%	0.566	S	S	*	*	H	α-helix	trans	-65.8	-39.5	171.8	-171.2	171.2	49.7	0	0	112	P482 A489 Q490	P482-Q486 PolarHBondContact O-N 3.27Å; P482-Q486 VanDerWaalsContact O-N 3.09Å; Q486-A489 PolarHBondContact O-N 3.21Å; Q486-Q490 PolarHBondContact O-N 3.45Å
487	Q	58.8	Low	64.6	Low	122 Å²	122	109.6 Å²	109.6	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-68.9	-39.3	-179.3	-161	170.2	40.2	0	0	112.5	M483 Y484 Q490 A491	M483-Q487 PolarHBondContact O-N 3.23Å; Y484-Q487 PolarHBondContact O-N 3.25Å; Q487-Q490 PolarHBondContact O-N 3.31Å; Q487-A491 PolarHBondContact O-N 3.4Å
488	V	59.8	Low	65.2	Low	63 Å²	63	109.3 Å²	109.3	38%	0.382	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-40.4	174.3	173.1	0	0	0	0	111.8	Y484 Q490 A491 Q492	Y484-V488 HydrophobicContact CD1-CG2 4.24Å; Y484-V488 HydrophobicContact CE1-CG2 4.39Å; Y484-V488 WeakPolarHBondContact O-CG2 3.49Å; Y484-V488 PolarHBondContact O-N 3.47Å; Y484-V488 VanDerWaalsContact O-N 3.12Å; V488-Q490 PolarHBondContact O-N 2.83Å; V488-A491 PolarHBondContact O-N 2.92Å; V488-Q492 HydrophobicContact CG1-CG 4.39Å; V488-Q492 WeakPolarHBondContact O-CG 3.48Å; V488-Q492 PolarHBondContact O-N 3.38Å
489	A	60.5	Low	65.6	Low	56 Å²	56	110.6 Å²	110.6	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-62.4	-40.8	178.3	0	0	0	0	0	112.5	Q485 Q486 Q492 Y493	Q485-A489 PolarHBondContact O-N 3.06Å; Q486-A489 PolarHBondContact O-N 3.21Å; A489-Q492 PolarHBondContact O-N 3.24Å; A489-Y493 PolarHBondContact O-N 3.04Å
490	Q	64	Low	66.1	Low	131 Å²	131	111.4 Å²	111.4	61%	0.612	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-42.1	175.2	-71.9	179.3	-14.9	0	0	112.2	Q486 Q487 V488 Y493 A494	Q486-Q490 PolarHBondContact O-N 3.45Å; Q487-Q490 PolarHBondContact O-N 3.31Å; V488-Q490 PolarHBondContact O-N 2.83Å; Q490-Y493 PolarHBondContact O-N 3.17Å; Q490-A494 PolarHBondContact O-N 2.96Å; Q490-A494 VanDerWaalsContact O-N 3.08Å
491	A	65.3	Low	66.9	Low	62 Å²	62	112.1 Å²	112.1	51%	0.512	56%	0.564	S	S	.	*	H	α-helix	trans	-63.5	-40.7	176.7	0	0	0	0	0	112.6	Q487 V488 A494 A495	Q487-A491 PolarHBondContact O-N 3.4Å; V488-A491 PolarHBondContact O-N 2.92Å; A491-A494 PolarHBondContact O-N 2.95Å; A491-A495 PolarHBondContact O-N 3.22Å
492	Q	66.6	Low	67.6	Low	132 Å²	132	111.5 Å²	111.5	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-65.5	-39.9	176.2	-73.8	177.9	-19.6	0	0	112.4	V488 A489 A495 M496	V488-Q492 HydrophobicContact CG1-CG 4.39Å; V488-Q492 WeakPolarHBondContact O-CG 3.48Å; V488-Q492 PolarHBondContact O-N 3.38Å; A489-Q492 PolarHBondContact O-N 3.24Å; Q492-A495 PolarHBondContact O-N 3.37Å; Q492-M496 WeakPolarHBondContact O-CB 3.21Å; Q492-M496 PolarHBondContact O-N 3.03Å
493	Y	70.4	Confident	68.4	Low	147 Å²	147	110.1 Å²	110.1	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-41.7	176.7	-168.5	-100.6	0	0	0	112.3	A489 Q490 M496 L497	A489-Y493 PolarHBondContact O-N 3.04Å; Q490-Y493 PolarHBondContact O-N 3.17Å; Y493-M496 HydrophobicContact CD2-CE 3.81Å; Y493-M496 HydrophobicContact CE2-CE 3.97Å; Y493-M496 PolarHBondContact O-N 3.42Å; Y493-L497 HydrophobicContact CD1-CD1 3.96Å; Y493-L497 HydrophobicContact CE1-CD1 3.6Å; Y493-L497 HydrophobicContact CE1-CG 4.36Å; Y493-L497 PolarHBondContact O-N 3.48Å; Y493-L497 VanDerWaalsContact O-N 3.17Å
494	A	73.6	Confident	69.4	Low	59 Å²	59	110.2 Å²	110.2	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-63.3	-42.3	175.1	0	0	0	0	0	112.6	Q490 A491 M496 L497 H498	Q490-A494 PolarHBondContact O-N 2.96Å; Q490-A494 VanDerWaalsContact O-N 3.08Å; A491-A494 PolarHBondContact O-N 2.95Å; A494-M496 PolarHBondContact O-N 3.16Å; A494-L497 PolarHBondContact O-N 3.15Å; A494-H498 PolarHBondContact O-N 3.27Å; A494-H498 VanDerWaalsContact O-N 3.15Å
495	A	72	Confident	70.2	Confident	62 Å²	62	106.3 Å²	106.3	51%	0.512	55%	0.547	S	S	.	.	H	α-helix	trans	-63.4	-40.8	177.1	0	0	0	0	0	112.4	A491 Q492 H498 Q499	A491-A495 PolarHBondContact O-N 3.22Å; Q492-A495 PolarHBondContact O-N 3.37Å; A495-H498 PolarHBondContact O-N 3.43Å; A495-Q499 PolarHBondContact O-N 3.24Å
496	M	75.9	Confident	70.9	Confident	106 Å²	106	105.9 Å²	105.9	52%	0.522	55%	0.545	S	S	.	.	H	α-helix	trans	-63.1	-44.6	178	-177	-113.5	-68.1	0	0	112.3	Q492 Y493 A494 H498 Q499 Y500	Q492-M496 WeakPolarHBondContact O-CB 3.21Å; Q492-M496 PolarHBondContact O-N 3.03Å; Y493-M496 HydrophobicContact CD2-CE 3.81Å; Y493-M496 HydrophobicContact CE2-CE 3.97Å; Y493-M496 PolarHBondContact O-N 3.42Å; A494-M496 PolarHBondContact O-N 3.16Å; M496-H498 VanDerWaalsContact C-N 3.35Å; M496-H498 PolarHBondContact O-N 3.05Å; M496-Q499 PolarHBondContact O-N 3.33Å; M496-Y500 PolarHBondContact O-N 3.09Å
497	L	76.3	Confident	71.4	Confident	93 Å²	93	105.3 Å²	105.3	49%	0.487	54%	0.542	S	S	.	.	H	α-helix	trans	-60.2	-43	174.5	-79	169.7	0	0	0	112.3	Y493 A494 Q499 Y500 Q501	Y493-L497 HydrophobicContact CD1-CD1 3.96Å; Y493-L497 HydrophobicContact CE1-CD1 3.6Å; Y493-L497 HydrophobicContact CE1-CG 4.36Å; Y493-L497 PolarHBondContact O-N 3.48Å; Y493-L497 VanDerWaalsContact O-N 3.17Å; A494-L497 PolarHBondContact O-N 3.15Å; L497-Q499 PolarHBondContact O-N 3.21Å; L497-Y500 PolarHBondContact O-N 3.41Å; L497-Q501 PolarHBondContact O-N 3.34Å
498	H	80.5	Confident	71.9	Confident	110 Å²	110	105.7 Å²	105.7	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-38.9	179.4	-162.9	-98.8	0	0	0	112.1	A494 A495 M496 Q501 Q502	A494-H498 PolarHBondContact O-N 3.27Å; A494-H498 VanDerWaalsContact O-N 3.15Å; A495-H498 PolarHBondContact O-N 3.43Å; M496-H498 VanDerWaalsContact C-N 3.35Å; M496-H498 PolarHBondContact O-N 3.05Å; H498-Q501 PolarHBondContact O-N 3.42Å; H498-Q502 WeakPolarHBondContact O-CG 3.43Å; H498-Q502 PolarHBondContact O-N 2.98Å; H498-Q502 VanDerWaalsContact O-N 3.16Å
499	Q	74.5	Confident	72.3	Confident	141 Å²	141	108.9 Å²	108.9	66%	0.659	56%	0.555	S	S	*	*	H	α-helix	trans	-66.7	-40.2	175	-170.8	175.5	3.4	0	0	112.2	A495 M496 L497 Q501 Q502 A503	A495-Q499 PolarHBondContact O-N 3.24Å; M496-Q499 PolarHBondContact O-N 3.33Å; L497-Q499 PolarHBondContact O-N 3.21Å; Q499-Q501 VanDerWaalsContact C-N 3.34Å; Q499-Q501 PolarHBondContact O-N 3.4Å; Q499-Q502 PolarHBondContact O-N 3.25Å; Q499-A503 PolarHBondContact O-N 3.49Å; Q499-A503 VanDerWaalsContact O-N 3.11Å
500	Y	74.4	Confident	72.3	Confident	173 Å²	173	113.1 Å²	113.1	68%	0.678	57%	0.565	S	S	*	*	H	α-helix	trans	-63.5	-40.2	176.4	-161.6	-89.8	0	0	0	111.8	M496 L497 A503 F504	M496-Y500 PolarHBondContact O-N 3.09Å; L497-Y500 PolarHBondContact O-N 3.41Å; Y500-A503 PolarHBondContact O-N 3.12Å; Y500-F504 PolarHBondContact O-N 3.4Å; Y500-F504 VanDerWaalsContact O-N 3.11Å
501	Q	78.6	Confident	72.1	Confident	132 Å²	132	113.5 Å²	113.5	62%	0.617	57%	0.566	S	S	*	*	H	α-helix	trans	-64.8	-38.6	176.8	-166.4	170.7	29.1	0	0	112.4	L497 H498 Q499 F504 V505	L497-Q501 PolarHBondContact O-N 3.34Å; H498-Q501 PolarHBondContact O-N 3.42Å; Q499-Q501 VanDerWaalsContact C-N 3.34Å; Q499-Q501 PolarHBondContact O-N 3.4Å; Q501-F504 PolarHBondContact O-N 3.36Å; Q501-V505 WeakPolarHBondContact O-CG2 3.05Å; Q501-V505 PolarHBondContact O-N 3.23Å
502	Q	75.1	Confident	71.8	Confident	116 Å²	116	118.2 Å²	118.2	54%	0.542	58%	0.578	S	S	.	*	H	α-helix	trans	-65.5	-41	174.7	-73	-176.7	-11.8	0	0	112.7	H498 Q499 F504 V505 Q506	H498-Q502 WeakPolarHBondContact O-CG 3.43Å; H498-Q502 PolarHBondContact O-N 2.98Å; H498-Q502 VanDerWaalsContact O-N 3.16Å; Q499-Q502 PolarHBondContact O-N 3.25Å; Q502-F504 VanDerWaalsContact C-N 3.35Å; Q502-F504 PolarHBondContact O-N 3.07Å; Q502-V505 PolarHBondContact O-N 3.28Å; Q502-Q506 PolarHBondContact O-N 3.45Å; Q502-Q506 VanDerWaalsContact O-N 3.15Å
503	A	74.3	Confident	71.3	Confident	56 Å²	56	120.1 Å²	120.1	46%	0.463	59%	0.586	S	S	.	*	H	α-helix	trans	-62	-41.5	176.5	0	0	0	0	0	112.1	Q499 Y500 V505 Q506 Q507	Q499-A503 PolarHBondContact O-N 3.49Å; Q499-A503 VanDerWaalsContact O-N 3.11Å; Y500-A503 PolarHBondContact O-N 3.12Å; A503-V505 VanDerWaalsContact C-N 3.34Å; A503-V505 PolarHBondContact O-N 3.46Å; A503-Q506 PolarHBondContact O-N 3.36Å; A503-Q507 PolarHBondContact O-N 3.05Å
504	F	78.8	Confident	70.5	Confident	119 Å²	119	121.1 Å²	121.1	52%	0.522	60%	0.596	S	S	.	*	H	α-helix	trans	-61.4	-39.8	177	-169.4	-100.1	0	0	0	112.6	Y500 Q501 Q502 Q507 Q508	Y500-F504 PolarHBondContact O-N 3.4Å; Y500-F504 VanDerWaalsContact O-N 3.11Å; Q501-F504 PolarHBondContact O-N 3.36Å; Q502-F504 VanDerWaalsContact C-N 3.35Å; Q502-F504 PolarHBondContact O-N 3.07Å; F504-Q507 PolarHBondContact O-N 3.17Å; F504-Q508 PolarHBondContact O-N 3.08Å; F504-Q508 VanDerWaalsContact O-N 3.17Å
505	V	77.1	Confident	69.5	Low	77 Å²	77	125.7 Å²	125.7	47%	0.467	61%	0.607	S	S	.	*	H	α-helix	trans	-66.6	-41.3	176.5	173.6	0	0	0	0	111.8	Q501 Q502 A503 Q508 Q509	Q501-V505 WeakPolarHBondContact O-CG2 3.05Å; Q501-V505 PolarHBondContact O-N 3.23Å; Q502-V505 PolarHBondContact O-N 3.28Å; A503-V505 VanDerWaalsContact C-N 3.34Å; A503-V505 PolarHBondContact O-N 3.46Å; V505-Q508 PolarHBondContact O-N 3.47Å; V505-Q509 WeakPolarHBondContact O-CG 3.14Å; V505-Q509 PolarHBondContact O-N 3.06Å; V505-Q509 VanDerWaalsContact O-N 3.16Å
506	Q	73.1	Confident	68.4	Low	134 Å²	134	131 Å²	131	63%	0.626	62%	0.621	S	S	*	*	H	α-helix	trans	-62.7	-43.3	175.5	-77.3	-171.6	-15.6	0	0	112.5	Q502 A503 Q508 Q509 Q510	Q502-Q506 PolarHBondContact O-N 3.45Å; Q502-Q506 VanDerWaalsContact O-N 3.15Å; A503-Q506 PolarHBondContact O-N 3.36Å; Q506-Q508 VanDerWaalsContact C-N 3.28Å; Q506-Q508 PolarHBondContact O-N 3.23Å; Q506-Q509 PolarHBondContact O-N 3.46Å; Q506-Q510 PolarHBondContact O-N 3.3Å
507	Q	70.3	Confident	66.9	Low	121 Å²	121	134.3 Å²	134.3	57%	0.565	64%	0.636	S	S	*	*	H	α-helix	trans	-63.3	-36	179.7	-167.2	171.6	56.8	0	0	111.9	A503 F504 Q510 H511	A503-Q507 PolarHBondContact O-N 3.05Å; F504-Q507 PolarHBondContact O-N 3.17Å; Q507-Q510 PolarHBondContact O-N 3.02Å; Q507-H511 PolarHBondContact O-N 3.49Å
508	Q	69.9	Low	65.2	Low	129 Å²	129	138 Å²	138	60%	0.603	65%	0.65	S	S	*	*	H	α-helix	trans	-69	-35.7	175.8	-154.3	175.8	110.2	0	0	112.6	F504 V505 Q506 H512	F504-Q508 PolarHBondContact O-N 3.08Å; F504-Q508 VanDerWaalsContact O-N 3.17Å; V505-Q508 PolarHBondContact O-N 3.47Å; Q506-Q508 VanDerWaalsContact C-N 3.28Å; Q506-Q508 PolarHBondContact O-N 3.23Å; Q508-H512 PolarHBondContact O-N 3.34Å
509	Q	67.3	Low	63.9	Low	130 Å²	130	138 Å²	138	61%	0.607	66%	0.66	S	S	*	*	H	α-helix	trans	-68.3	-39.4	174.6	-70.6	178.1	6.7	0	0	112.6	V505 Q506 H511 H512 H513	V505-Q509 WeakPolarHBondContact O-CG 3.14Å; V505-Q509 PolarHBondContact O-N 3.06Å; V505-Q509 VanDerWaalsContact O-N 3.16Å; Q506-Q509 PolarHBondContact O-N 3.46Å; Q509-H511 PolarHBondContact O-N 3.11Å; Q509-H512 PolarHBondContact O-N 3.17Å; Q509-H513 PolarHBondContact O-N 3.34Å
510	Q	60.5	Low	62	Low	146 Å²	146	135.8 Å²	135.8	68%	0.682	67%	0.665	S	S	*	*	H	α-helix	trans	-62.3	-41.8	176.1	-74.9	-176	-25.4	0	0	112.2	Q506 Q507 H512 H513	Q506-Q510 PolarHBondContact O-N 3.3Å; Q507-Q510 PolarHBondContact O-N 3.02Å; Q510-H512 PolarHBondContact O-N 3.47Å; Q510-H513 PolarHBondContact O-N 3.02Å; Q510-H513 VanDerWaalsContact O-N 3.1Å
511	H	59.4	Low	60.2	Low	138 Å²	138	136 Å²	136	64%	0.639	67%	0.673	S	S	*	*	H	α-helix	trans	-60.4	-32.3	176	-99.3	-68.7	0	0	0	113.6	Q507 Q509 H513	Q507-H511 PolarHBondContact O-N 3.49Å; Q509-H511 PolarHBondContact O-N 3.11Å; H511-H513 VanDerWaalsContact C-N 3.32Å
512	H	59.3	Low	58.5	Low	161 Å²	161	138.5 Å²	138.5	75%	0.745	68%	0.684	S	S	*	*	H	α-helix	trans	-72.6	-25	177.7	-130.7	69	0	0	0	113	Q508 Q509 Q510	Q508-H512 PolarHBondContact O-N 3.34Å; Q509-H512 PolarHBondContact O-N 3.17Å; Q510-H512 PolarHBondContact O-N 3.47Å
513	H	55.9	Low	57.3	Low	172 Å²	172	137.6 Å²	137.6	80%	0.796	69%	0.688	S	S	*	*	H	α-helix	trans	-83.6	-20.1	-177.1	-137.9	75.1	0	0	0	113.6	Q509 Q510 H511	Q509-H513 PolarHBondContact O-N 3.34Å; Q510-H513 PolarHBondContact O-N 3.02Å; Q510-H513 VanDerWaalsContact O-N 3.1Å; H511-H513 VanDerWaalsContact C-N 3.32Å
514	Q	53.8	Low	55.3	Low	168 Å²	168	142.6 Å²	142.6	79%	0.785	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-0.1	-173.3	-155	167.6	35.3	0	0	114.4
515	Q	52.7	Low	54	Low	156 Å²	156	141.1 Å²	141.1	73%	0.729	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-0.3	-169.2	-154.1	167	75.7	0	0	115.1
516	Q	49.8	Very low	51.8	Low	172 Å²	172	147.5 Å²	147.5	80%	0.804	73%	0.726	S	S	*	*	S	Bend	trans	-91.3	-4.6	-171.8	-84.3	-165.4	-2.8	0	0	117.5
517	H	44.1	Very low	49.8	Very low	177 Å²	177	147.9 Å²	147.9	82%	0.819	73%	0.732	S	S	*	*			trans	-125.9	121.2	179.4	-70.8	-62.6	0	0	0	114.3
518	H	39.3	Very low	47.9	Very low	169 Å²	169	147.2 Å²	147.2	78%	0.782	74%	0.74	S	S	*	*			trans	-110.1	-178.9	171.7	-81.9	60.9	0	0	0	108.7
519	P	53.4	Low	46.1	Very low	112 Å²	112	146.4 Å²	146.4	73%	0.727	75%	0.749	S	S	*	*			cis	-135.3	171.5	2.1	30.6	-8	0	0	0	117.6
520	A	34.8	Very low	45.2	Very low	93 Å²	93	145 Å²	145	77%	0.769	75%	0.751	S	S	*	*			trans	47.6	136.4	144.6	0	0	0	0	0	121.6
521	Q	37	Very low	43.9	Very low	179 Å²	179	145.1 Å²	145.1	84%	0.836	76%	0.756	S	S	*	*				-159.5	135.9	59.2	-74.9	176.8	-3.6	0	0	114.4
522	Q	41.8	Very low	42.4	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	77%	0.767	S	S	*	*			trans	30.4	157.8	138.9	-60	-165.4	10.2	0	0	124
523	P	51.4	Low	41.3	Very low	97 Å²	97	148 Å²	148	63%	0.63	77%	0.767	S	S	*	*			cis	-146.7	142.4	-43.1	40.3	-22.1	0	0	0	117.1
524	L	32.6	Very low	40	Very low	161 Å²	161	149 Å²	149	84%	0.843	77%	0.773	S	S	*	*			trans	61.8	165.1	133.2	-66.6	177.4	0	0	0	122.6
525	P	49.7	Very low	38.9	Very low	87 Å²	87	147.9 Å²	147.9	57%	0.565	77%	0.77	S	S	*	*			cis	-142.7	173.6	-26.9	37.6	-19.5	0	0	0	117.6
526	Y	32.4	Very low	38.5	Very low	211 Å²	211	145.3 Å²	145.3	83%	0.827	77%	0.767	S	S	*	*			trans	67.6	151.2	150.4	-68.2	-44.7	0	0	0	119.8
527	L	30.4	Very low	37.5	Very low	143 Å²	143	145.2 Å²	145.2	75%	0.749	77%	0.771	S	S	*	*			cis	-153.1	161.2	7.5	-125	158.9	0	0	0	112.3
528	S	31.2	Very low	36.8	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	76%	0.764	S	S	*	*			trans	74.2	120.3	155.9	-62.8	0	0	0	0	123.2
529	S	31.2	Very low	36.4	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	77%	0.767	S	S	*	*			trans	-92.2	-172.4	153.8	-140.9	0	0	0	0	108.6
530	P	48.8	Very low	35.3	Very low	101 Å²	101	143.2 Å²	143.2	66%	0.656	78%	0.775	S	S	*	*			cis	-140.6	-179.7	8.1	43.9	-24.4	0	0	0	117.9
531	L	33	Very low	35.1	Very low	148 Å²	148	144.8 Å²	144.8	78%	0.775	78%	0.781	S	S	*	*			trans	34.2	140.2	144.2	-71.3	155.5	0	0	0	120
532	E	28.3	Very low	34.7	Very low	186 Å²	186	140.8 Å²	140.8	87%	0.869	78%	0.778	S	S	*	*				-156.2	-173.1	51.6	-148.4	166.7	-161.8	0	0	114.4
533	F	35.8	Very low	34.2	Very low	172 Å²	172	136 Å²	136	75%	0.754	77%	0.77	S	S	*	*			trans	-88.5	146.2	-170.6	-98.7	-105.1	0	0	0	115.1
534	Q	28.3	Very low	33.2	Very low	195 Å²	195	137.9 Å²	137.9	91%	0.911	78%	0.78	S	S	*	*			trans	-160.6	155.1	136	-113.4	164.4	31.4	0	0	114.3
535	I	30.9	Very low	33.8	Very low	144 Å²	144	136.1 Å²	136.1	74%	0.738	78%	0.778	S	S	*	*			trans	-128.2	156.6	174.1	-15	170.6	0	0	0	104.4
536	P	44.6	Very low	33	Very low	101 Å²	101	138.6 Å²	138.6	66%	0.656	79%	0.792	S	S	*	*			cis	-152.1	-173.6	41	44	-22.8	0	0	0	117.7
537	L	29.5	Very low	33	Very low	170 Å²	170	133.4 Å²	133.4	89%	0.89	79%	0.792	S	S	*	*			trans	59.7	138.9	155	-75.6	148.2	0	0	0	118.7
538	G	29.2	Very low	32.9	Very low	65 Å²	65	130 Å²	130	67%	0.67	79%	0.792	S	S	*	*			cis	144.1	108.7	-7.4	0	0	0	0	0	113.5
539	S	30.3	Very low	34.2	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	79%	0.794	S	S	*	*			trans	-178.7	152.6	155.7	41.3	0	0	0	0	110.1
540	Y	30.6	Very low	34.2	Very low	230 Å²	230	133.1 Å²	133.1	90%	0.902	80%	0.796	S	S	*	*			trans	-128.9	140.6	-178.9	-68.9	-91.2	0	0	0	110.8
541	S	29.6	Very low	33.3	Very low	126 Å²	126	133 Å²	133	88%	0.881	80%	0.804	S	S	*	*			trans	-164	141.6	158.2	-86	0	0	0	0	114
542	A	29.8	Very low	32.9	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	80%	0.802	S	S	*	*			trans	65.7	100	151.8	0	0	0	0	0	122.2
543	A	30.9	Very low	33.9	Very low	83 Å²	83	126.2 Å²	126.2	69%	0.686	80%	0.798	S	S	*	*				79.6	134.2	112.9	0	0	0	0	0	123.5
544	T	30.8	Very low	33.6	Very low	137 Å²	137	123.4 Å²	123.4	84%	0.84	80%	0.799	S	S	*	*			trans	67.8	171	155	58.7	0	0	0	0	116.9
545	P	44.3	Very low	34.7	Very low	123 Å²	123	119.7 Å²	119.7	80%	0.799	79%	0.792	S	S	*	*			cis	-135.3	-171.8	5.3	43.1	-24.1	0	0	0	117.9
546	T	33	Very low	34.8	Very low	140 Å²	140	119 Å²	119	86%	0.859	79%	0.794	S	S	*	*			trans	-68.6	149.1	179.8	-37.3	0	0	0	0	116.8
547	A	33.2	Very low	34.1	Very low	101 Å²	101	122.2 Å²	122.2	84%	0.835	80%	0.801	S	S	*	*			trans	-173.5	160.4	141.7	0	0	0	0	0	113.4
548	G	27.3	Very low	34.2	Very low	71 Å²	71	119.6 Å²	119.6	73%	0.732	79%	0.792	S	S	*	*			trans	-129.8	-147.9	166.3	0	0	0	0	0	109.9
549	P	58.8	Low	34.3	Very low	122 Å²	122	120.3 Å²	120.3	79%	0.792	79%	0.787	S	S	*	*			cis	-129.4	-157.1	-13.5	41.4	-22.8	0	0	0	112
550	I	31.5	Very low	34.5	Very low	163 Å²	163	125.1 Å²	125.1	84%	0.836	79%	0.788	S	S	*	*			trans	157.8	137.3	138	-82.8	160.6	0	0	0	115.7
551	A	29.7	Very low	34.5	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	78%	0.782	S	S	*	*			trans	59.6	151.6	155.7	0	0	0	0	0	124.9
552	G	24.2	Very low	34.7	Very low	71 Å²	71	121.2 Å²	121.2	73%	0.732	78%	0.778	S	S	*	*			trans	-117.3	-141.2	165.9	0	0	0	0	0	111.2
553	P	49.8	Very low	35.6	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	77%	0.772	S	S	*	*			cis	-141.7	170.3	10.3	43.9	-26.5	0	0	0	118.1
554	S	29.3	Very low	35.8	Very low	113 Å²	113	123.1 Å²	123.1	79%	0.79	78%	0.778	S	S	*	*			trans	49.7	165.8	141.1	-66.9	0	0	0	0	123.2
555	P	52	Low	35.8	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	78%	0.783	S	S	*	*			cis	-103.9	-145.6	1.2	9.9	16.6	0	0	0	112.2
556	V	33.4	Very low	35.2	Very low	130 Å²	130	129.7 Å²	129.7	79%	0.788	78%	0.782	S	S	*	*			cis	-143.6	-130.7	12.2	-153	0	0	0	0	112.4
557	E	29.5	Very low	35.9	Very low	168 Å²	168	129 Å²	129	79%	0.785	78%	0.78	S	S	*	*			trans	-130.8	174.6	-163.7	-65	-177.5	124.9	0	0	111.8
558	T	31.4	Very low	35.8	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	78%	0.777	S	S	*	*			cis	-154.6	151	22.6	-25.8	0	0	0	0	113.6
559	S	31.6	Very low	36.2	Very low	81 Å²	81	135.5 Å²	135.5	57%	0.566	78%	0.782	S	S	*	*			trans	31.6	141.9	150.3	60.3	0	0	0	0	122.4
560	Y	33.5	Very low	34.8	Very low	222 Å²	222	134.3 Å²	134.3	87%	0.871	78%	0.783	S	S	*	*			cis	-151.4	177.4	45.9	-83.1	-87.3	0	0	0	114.6
561	T	31.6	Very low	34.8	Very low	127 Å²	127	132.6 Å²	132.6	78%	0.779	78%	0.78	S	S	*	*			trans	-114.9	-169.4	-178.2	61.8	0	0	0	0	112
562	N	33.5	Very low	34.8	Very low	148 Å²	148	135 Å²	135	79%	0.791	78%	0.779	S	S	*	*			cis	-159.5	167.4	18.1	-139.2	16.5	0	0	0	111.6
563	P	48.3	Very low	34.9	Very low	103 Å²	103	134.3 Å²	134.3	67%	0.669	77%	0.771	S	S	*	*			trans	-113.6	164.1	-163.8	42	-36.5	0	0	0	119.2
564	S	34.8	Very low	34	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	78%	0.776	S	S	*	*			trans	46.5	127.1	143.5	-58.6	0	0	0	0	124.2
565	R	30.3	Very low	33.9	Very low	252 Å²	252	137.3 Å²	137.3	95%	0.951	78%	0.775	S	S	*	*			trans	-168.9	159.8	136	-115.4	172.8	-179.3	178.6	-0.4	116.5
566	N	33.2	Very low	33.7	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	77%	0.771	S	S	*	*			trans	-109.7	163.2	170.3	-112.7	11.3	0	0	0	109.6
567	P	47.6	Very low	33.3	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	77%	0.77	S	S	*	*				-152.9	-143.2	97.2	41.2	-19.7	0	0	0	116.1
568	L	31.2	Very low	33.3	Very low	149 Å²	149	132.5 Å²	132.5	78%	0.78	76%	0.761	S	S	*	*			trans	-133.2	164.7	-146.4	-75.9	162.8	0	0	0	117.3
569	L	34	Very low	33.2	Very low	160 Å²	160	135 Å²	135	84%	0.838	76%	0.764	S	S	*	*			trans	73.5	130.1	142.2	-86	163	0	0	0	123.7
570	A	30.9	Very low	32.9	Very low	97 Å²	97	135.9 Å²	135.9	80%	0.802	77%	0.771	S	S	*	*			trans	-169.7	174.6	132.8	0	0	0	0	0	112.6
571	T	30.8	Very low	32.5	Very low	126 Å²	126	130 Å²	130	77%	0.773	76%	0.762	S	S	*	*			trans	-79	-178.8	-170	64.8	0	0	0	0	114.7
572	D	30	Very low	32.3	Very low	151 Å²	151	129.2 Å²	129.2	81%	0.807	76%	0.762	S	S	*	*			cis	-154.9	-172.6	18	-120.5	-65.3	0	0	0	109.5
573	G	25.8	Very low	32	Very low	55 Å²	55	126.7 Å²	126.7	57%	0.567	76%	0.756	S	S	*	*			cis	165.4	179.8	1.4	0	0	0	0	0	113.4
574	I	30.9	Very low	31	Very low	172 Å²	172	126.9 Å²	126.9	88%	0.882	76%	0.76	S	S	*	*			trans	75.2	149.2	163.3	-59.4	174.9	0	0	0	119.7
575	T	28	Very low	30.7	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	76%	0.755	S	S	*	*			trans	-141	-166.2	-179.9	60.4	0	0	0	0	109.1
576	P	48.2	Very low	30.5	Very low	103 Å²	103	119.6 Å²	119.6	67%	0.669	75%	0.747	S	S	*	*			cis	-143.5	-153.7	1.9	34.8	-8	0	0	0	115.5
577	T	24.8	Very low	30.2	Very low	128 Å²	128	118.2 Å²	118.2	79%	0.785	75%	0.749	S	S	*	*			trans	84	151.7	163.3	72	0	0	0	0	119.5
578	S	28.3	Very low	29.3	Very low	83 Å²	83	117.3 Å²	117.3	58%	0.58	75%	0.745	S	S	*	*			cis	-169.7	173.5	-28.5	62.3	0	0	0	0	111.3
579	Q	28.9	Very low	29.2	Very low	168 Å²	168	115.9 Å²	115.9	79%	0.785	74%	0.743	S	S	*	*			trans	73	137.3	166.8	-63.5	165.8	64	0	0	115.5
580	S	26.1	Very low	28.9	Very low	100 Å²	100	113.7 Å²	113.7	70%	0.699	74%	0.741	S	S	*	*			cis	74.5	136.2	36.9	79.1	0	0	0	0	114.2
581	S	25.6	Very low	29	Very low	97 Å²	97	117.4 Å²	117.4	68%	0.678	74%	0.741	S	S	*	*			cis	-177.2	160.9	-7.1	43.6	0	0	0	0	109.8
582	S	26.3	Very low	29.1	Very low	111 Å²	111	116.9 Å²	116.9	78%	0.776	74%	0.74	S	S	*	*			trans	60.4	157.7	159.4	42.6	0	0	0	0	118.5
583	S	28.2	Very low	29.5	Very low	96 Å²	96	115.3 Å²	115.3	67%	0.671	74%	0.738	S	S	*	*			cis	-170.6	174.4	-15.8	51.5	0	0	0	0	109.8
584	S	26.3	Very low	30.2	Very low	107 Å²	107	119.1 Å²	119.1	75%	0.748	75%	0.746	S	S	*	*			trans	67	153	156.4	29.3	0	0	0	0	118.3
585	S	28.1	Very low	30.3	Very low	101 Å²	101	118.2 Å²	118.2	71%	0.706	74%	0.739	S	S	*	*			cis	-166.9	155.2	-4.5	42.1	0	0	0	0	111.8
586	S	27.3	Very low	31	Very low	112 Å²	112	117.4 Å²	117.4	78%	0.783	74%	0.738	S	S	*	*			trans	45.5	136.7	147.9	62.7	0	0	0	0	120.5
587	S	27.3	Very low	30.7	Very low	117 Å²	117	115.7 Å²	115.7	82%	0.818	74%	0.74	S	S	*	*			cis	-151	-156.5	20.5	54.5	0	0	0	0	108.8
588	S	28.3	Very low	31.1	Very low	106 Å²	106	120.3 Å²	120.3	74%	0.741	74%	0.743	S	S	*	*			cis	-154.2	-177.6	11.7	55	0	0	0	0	111.1
589	V	29.8	Very low	31.6	Very low	120 Å²	120	121.5 Å²	121.5	73%	0.727	74%	0.743	S	S	*	*			trans	-127.7	143	179.9	176.3	0	0	0	0	111.9
590	S	27.3	Very low	32	Very low	114 Å²	114	118.5 Å²	118.5	80%	0.797	74%	0.738	S	S	*	*			trans	-153	131.4	161.8	53.7	0	0	0	0	110.4
591	H	31.8	Very low	32.6	Very low	174 Å²	174	121.6 Å²	121.6	81%	0.806	74%	0.739	S	S	*	*			trans	-107.1	139.5	-178.9	-71.8	-93	0	0	0	112.2
592	P	33.3	Very low	32.9	Very low	115 Å²	115	119.8 Å²	119.8	75%	0.747	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-81.8	165.3	158.9	35	-32.3	0	0	0	111.4
593	P	39	Very low	33.5	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-82.4	164	-165.4	33	-37.4	0	0	0	115.5
594	D	39.5	Very low	34.2	Very low	135 Å²	135	125.7 Å²	125.7	72%	0.722	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-64	144.8	172.2	-164.9	-11.5	0	0	0	112.2	S596	D594-S596 WeakPolarHBondContact OD1-CB 3.33Å; D594-S596 PolarHBondContact OD1-N 3.48Å
595	M	32.8	Very low	35	Very low	153 Å²	153	127 Å²	127	75%	0.754	74%	0.743	S	S	*	*			trans	-132.6	36.2	174.9	-65	-136.4	78.9	0	0	112.4	G597	M595-G597 PolarHBondContact O-N 3.46Å
596	S	42.6	Very low	35.5	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	69.8	169.5	69.8	0	0	0	0	113	D594	D594-S596 WeakPolarHBondContact OD1-CB 3.33Å; D594-S596 PolarHBondContact OD1-N 3.48Å
597	G	42	Very low	36.3	Very low	67 Å²	67	130.7 Å²	130.7	69%	0.691	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.9	-1.3	-176.5	0	0	0	0	0	119.2	M595	M595-G597 PolarHBondContact O-N 3.46Å
598	W	33.1	Very low	37	Very low	226 Å²	226	133.2 Å²	133.2	86%	0.856	74%	0.743	S	S	*	*			trans	-118.6	102.3	179.9	-91.3	77.3	0	0	0	113.2
599	N	39.7	Very low	37.5	Very low	108 Å²	108	131.9 Å²	131.9	58%	0.578	73%	0.728	S	S	*	*			trans	-108.9	112.6	165.3	174.2	22.2	0	0	0	109.1	F601	N599-F601 VanDerWaalsContact ND2-C 3.31Å; N599-F601 PolarHBondContact ND2-O 3.32Å; N599-F601 PolarHBondContact O-N 3.15Å; N599-F601 WeakPolarHBondContact OD1-CA 3.44Å; N599-F601 PolarHBondContact OD1-N 3.5Å
600	P	37.8	Very low	38.6	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	72%	0.715	S	S	*	*	S	Bend	trans	-77.1	-3.6	176.5	31.7	-34.1	0	0	0	113.9
601	F	39.3	Very low	39.6	Very low	166 Å²	166	131.8 Å²	131.8	73%	0.728	71%	0.712	S	S	*	*			trans	-116.2	60	176	-59.5	-73.9	0	0	0	110.5	N599	N599-F601 VanDerWaalsContact ND2-C 3.31Å; N599-F601 PolarHBondContact ND2-O 3.32Å; N599-F601 PolarHBondContact O-N 3.15Å; N599-F601 WeakPolarHBondContact OD1-CA 3.44Å; N599-F601 PolarHBondContact OD1-N 3.5Å
602	G	31.7	Very low	40.6	Very low	58 Å²	58	129.3 Å²	129.3	60%	0.598	70%	0.701	S	S	*	*			trans	-79.5	126	167.6	0	0	0	0	0	110.8
603	E	39.2	Very low	41.2	Very low	198 Å²	198	128.8 Å²	128.8	93%	0.925	69%	0.689	S	S	*	*			trans	70.5	47.9	168.1	-54.5	-166.6	-161.9	0	0	118.4
604	D	41.5	Very low	41.4	Very low	134 Å²	134	127.6 Å²	127.6	72%	0.717	68%	0.675	S	S	*	*			trans	-91.5	120	149	-102.5	-47.5	0	0	0	110.2	F606	D604-F606 PolarHBondContact O-N 3.41Å
605	N	43.8	Very low	42.2	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	40	-165.8	-163.3	20.9	0	0	0	114.1
606	F	38.7	Very low	43	Very low	173 Å²	173	122.8 Å²	122.8	76%	0.759	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-12.7	-175.8	-109.2	-85.5	0	0	0	114.6	D604 K608	D604-F606 PolarHBondContact O-N 3.41Å; F606-K608 VanDerWaalsContact C-N 3.3Å; F606-K608 PolarHBondContact O-N 3.06Å
607	S	43.3	Very low	43.2	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	22.7	-174.8	-47.7	0	0	0	0	114.6
608	K	41.8	Very low	43.4	Very low	169 Å²	169	129.2 Å²	129.2	74%	0.735	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	11.2	-169.4	-84.4	-168.1	175.8	-179.7	0	116.5	F606	F606-K608 VanDerWaalsContact C-N 3.3Å; F606-K608 PolarHBondContact O-N 3.06Å
609	L	39.6	Very low	44.2	Very low	78 Å²	78	124 Å²	124	41%	0.408	63%	0.628	S	S	.	*			trans	-107.4	133.1	164.5	-64.2	173.3	0	0	0	107.6	E613 L614	L609-E613 WeakPolarHBondContact CD2-OE2 3.46Å; L609-L614 HydrophobicContact CB-CG 4.46Å; L609-L614 HydrophobicContact CD1-CD2 4.35Å
610	T	53.7	Low	44.7	Very low	77 Å²	77	123.1 Å²	123.1	47%	0.472	62%	0.623	S	S	.	*			trans	-81.5	167.5	172.8	67	0	0	0	0	110.6	E612 E613	T610-E612 WeakPolarHBondContact CB-OE2 3.31Å; T610-E612 PolarHBondContact O-N 3.29Å; T610-E612 PolarHBondContact OG1-OE2 3.48Å; T610-E613 PolarHBondContact O-N 3.43Å
611	E	47.7	Very low	45.1	Very low	155 Å²	155	123.5 Å²	123.5	72%	0.724	62%	0.617	S	S	*	*	H	α-helix	trans	-63.7	-29.1	-175.7	-163.1	168.1	175.8	0	0	111.7	I615	E611-I615 HydrophobicContact CG-CD1 4.39Å; E611-I615 WeakPolarHBondContact O-CD1 3.24Å; E611-I615 WeakPolarHBondContact O-CG1 3.13Å; E611-I615 PolarHBondContact O-N 3.11Å
612	E	51.9	Low	45.3	Very low	123 Å²	123	120.9 Å²	120.9	58%	0.575	61%	0.61	S	S	*	*	H	α-helix	trans	-65.5	-46.4	175	-53.4	87.4	172.8	0	0	112.7	T610 L614 I615 D616	T610-E612 WeakPolarHBondContact CB-OE2 3.31Å; T610-E612 PolarHBondContact O-N 3.29Å; T610-E612 PolarHBondContact OG1-OE2 3.48Å; E612-L614 PolarHBondContact O-N 3.46Å; E612-I615 PolarHBondContact O-N 3.45Å; E612-I615 VanDerWaalsContact O-N 3.13Å; E612-D616 PolarHBondContact O-N 3.26Å; E612-D616 VanDerWaalsContact O-N 3.09Å
613	E	45.8	Very low	46.2	Very low	104 Å²	104	126.3 Å²	126.3	49%	0.486	61%	0.612	S	S	.	*	H	α-helix	trans	-66.7	-24.5	-175.4	-66.8	-172.7	128.3	0	0	113.5	L609 T610	L609-E613 WeakPolarHBondContact CD2-OE2 3.46Å; T610-E613 PolarHBondContact O-N 3.43Å
614	L	43.7	Very low	46.4	Very low	93 Å²	93	120.8 Å²	120.8	49%	0.487	60%	0.601	S	S	.	*	H	α-helix	trans	-76.3	-38.9	173.8	-80.4	162.1	0	0	0	111.9	L609 E612 E618	L609-L614 HydrophobicContact CB-CG 4.46Å; L609-L614 HydrophobicContact CD1-CD2 4.35Å; E612-L614 PolarHBondContact O-N 3.46Å; L614-E618 PolarHBondContact O-N 3.02Å
615	I	55.9	Low	46.4	Very low	86 Å²	86	122.3 Å²	122.3	44%	0.441	60%	0.601	S	S	.	*	H	α-helix	trans	-70.5	-45.2	-178.6	-66.8	166.9	0	0	0	110.9	E611 E612 R617 E618 F619	E611-I615 HydrophobicContact CG-CD1 4.39Å; E611-I615 WeakPolarHBondContact O-CD1 3.24Å; E611-I615 WeakPolarHBondContact O-CG1 3.13Å; E611-I615 PolarHBondContact O-N 3.11Å; E612-I615 PolarHBondContact O-N 3.45Å; E612-I615 VanDerWaalsContact O-N 3.13Å; I615-R617 VanDerWaalsContact C-N 3.28Å; I615-R617 PolarHBondContact O-N 3.35Å; I615-E618 PolarHBondContact O-N 3.31Å; I615-F619 HydrophobicContact CG2-CD2 4.04Å; I615-F619 HydrophobicContact CG2-CE2 4.32Å; I615-F619 PolarHBondContact O-N 3.16Å
616	D	50.9	Low	45.9	Very low	101 Å²	101	124.8 Å²	124.8	54%	0.54	61%	0.606	S	S	.	*	H	α-helix	trans	-61.7	-37.5	178.8	-86	-24.2	0	0	0	112	E612 E618 F619 D620	E612-D616 PolarHBondContact O-N 3.26Å; E612-D616 VanDerWaalsContact O-N 3.09Å; D616-E618 VanDerWaalsContact C-N 3.34Å; D616-E618 PolarHBondContact O-N 3.05Å; D616-F619 PolarHBondContact O-N 3.38Å; D616-D620 PolarHBondContact O-N 3.47Å
617	R	45.6	Very low	45.8	Very low	182 Å²	182	122.2 Å²	122.2	69%	0.687	61%	0.606	S	S	*	*	H	α-helix	trans	-63.3	-36.8	175.9	-115.9	178.4	177.3	169.4	1.8	113.3	I615 M621	I615-R617 VanDerWaalsContact C-N 3.28Å; I615-R617 PolarHBondContact O-N 3.35Å; R617-M621 WeakPolarHBondContact O-CB 3.47Å; R617-M621 PolarHBondContact O-N 3.48Å
618	E	47.6	Very low	45.3	Very low	127 Å²	127	126.1 Å²	126.1	59%	0.593	61%	0.611	S	S	*	*	H	α-helix	trans	-72.7	-37	175.9	-168.6	166.6	-143.3	0	0	111.3	L614 I615 D616 M621 L622	L614-E618 PolarHBondContact O-N 3.02Å; I615-E618 PolarHBondContact O-N 3.31Å; D616-E618 VanDerWaalsContact C-N 3.34Å; D616-E618 PolarHBondContact O-N 3.05Å; E618-M621 PolarHBondContact O-N 3.19Å; E618-L622 WeakPolarHBondContact O-CG 3.42Å; E618-L622 PolarHBondContact O-N 3.16Å; E618-L622 VanDerWaalsContact O-N 3.11Å
619	F	48.8	Very low	44.8	Very low	116 Å²	116	127.4 Å²	127.4	51%	0.509	62%	0.62	S	S	.	*	H	α-helix	trans	-68.2	-39.3	175.7	-96.4	-85.3	0	0	0	114	I615 D616 M621 L622 R623	I615-F619 HydrophobicContact CG2-CD2 4.04Å; I615-F619 HydrophobicContact CG2-CE2 4.32Å; I615-F619 PolarHBondContact O-N 3.16Å; D616-F619 PolarHBondContact O-N 3.38Å; F619-M621 VanDerWaalsContact C-N 3.32Å; F619-L622 WeakPolarHBondContact O-CB 3.47Å; F619-L622 PolarHBondContact O-N 3.38Å; F619-R623 PolarHBondContact O-N 3.17Å
620	D	49.8	Very low	44.3	Very low	90 Å²	90	135 Å²	135	48%	0.481	64%	0.643	S	S	.	*	H	α-helix	trans	-66.2	-35.5	172.8	-89.3	-22.9	0	0	0	112.1	D616 L622 R623 A624	D616-D620 PolarHBondContact O-N 3.47Å; D620-L622 PolarHBondContact O-N 3.49Å; D620-R623 PolarHBondContact O-N 3.15Å; D620-R623 VanDerWaalsContact O-N 3.16Å; D620-R623 WeakPolarHBondContact OD1-CD 3.5Å; D620-R623 IonicContact OD1-CZ 2.77Å; D620-R623 IonicContact OD1-NE 2.67Å; D620-R623 IonicContact OD1-NH1 2.62Å; D620-R623 PolarHBondContact OD1-NH1 3.29Å; D620-A624 WeakPolarHBondContact O-CB 3.49Å; D620-A624 PolarHBondContact O-N 3.25Å
621	M	47.2	Very low	43.2	Very low	112 Å²	112	137.6 Å²	137.6	55%	0.552	66%	0.659	S	S	*	*	H	α-helix	trans	-67.4	-21.7	174.1	-164.1	170.9	56.6	0	0	112.9	R617 E618 F619	R617-M621 WeakPolarHBondContact O-CB 3.47Å; R617-M621 PolarHBondContact O-N 3.48Å; E618-M621 PolarHBondContact O-N 3.19Å; F619-M621 VanDerWaalsContact C-N 3.32Å
622	L	42.5	Very low	42.3	Very low	111 Å²	111	137.2 Å²	137.2	58%	0.581	67%	0.667	S	S	*	*	H	α-helix	trans	-81.6	-37.7	168.9	-73.9	163.9	0	0	0	112.6	E618 F619 D620 A624 K625	E618-L622 WeakPolarHBondContact O-CG 3.42Å; E618-L622 PolarHBondContact O-N 3.16Å; E618-L622 VanDerWaalsContact O-N 3.11Å; F619-L622 WeakPolarHBondContact O-CB 3.47Å; F619-L622 PolarHBondContact O-N 3.38Å; D620-L622 PolarHBondContact O-N 3.49Å; L622-A624 VanDerWaalsContact C-N 3.27Å; L622-A624 PolarHBondContact O-N 3.23Å; L622-K625 PolarHBondContact O-N 3.1Å
623	R	50.5	Low	41.3	Very low	171 Å²	171	134.6 Å²	134.6	65%	0.645	67%	0.673	S	S	*	*	H	α-helix	trans	-60.1	-38.2	171.5	-69	177.6	-174.8	134.3	2.2	111.7	F619 D620 K625	F619-R623 PolarHBondContact O-N 3.17Å; D620-R623 PolarHBondContact O-N 3.15Å; D620-R623 VanDerWaalsContact O-N 3.16Å; D620-R623 WeakPolarHBondContact OD1-CD 3.5Å; D620-R623 IonicContact OD1-CZ 2.77Å; D620-R623 IonicContact OD1-NE 2.67Å; D620-R623 IonicContact OD1-NH1 2.62Å; D620-R623 PolarHBondContact OD1-NH1 3.29Å; R623-K625 PolarHBondContact O-N 3.42Å; R623-K625 VanDerWaalsContact O-N 3.11Å
624	A	44	Very low	40.6	Very low	82 Å²	82	136.5 Å²	136.5	68%	0.678	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	0.4	178.3	0	0	0	0	0	115.4	D620 L622	D620-A624 WeakPolarHBondContact O-CB 3.49Å; D620-A624 PolarHBondContact O-N 3.25Å; L622-A624 VanDerWaalsContact C-N 3.27Å; L622-A624 PolarHBondContact O-N 3.23Å
625	K	40.9	Very low	40.1	Very low	167 Å²	167	140.7 Å²	140.7	73%	0.726	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	50.1	-177.6	-74.8	-177.7	177.1	170.2	0	113.5	L622 R623	L622-K625 PolarHBondContact O-N 3.1Å; R623-K625 PolarHBondContact O-N 3.42Å; R623-K625 VanDerWaalsContact O-N 3.11Å
626	K	34.8	Very low	38.9	Very low	185 Å²	185	143.7 Å²	143.7	80%	0.804	73%	0.731	S	S	*	*			trans	-116	132.5	164.6	-157.6	178.1	-175.8	-172	0	109.8
627	P	35	Very low	38	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	74%	0.744	S	S	*	*			trans	-63.8	143	174.2	-19.2	31.8	0	0	0	111.2
628	E	33.7	Very low	38.2	Very low	201 Å²	201	142.5 Å²	142.5	94%	0.939	74%	0.744	S	S	*	*			trans	-67.8	127.6	162.3	-62.6	-177.5	133.1	0	0	108.9
629	E	30.9	Very low	37.4	Very low	196 Å²	196	140.7 Å²	140.7	92%	0.916	75%	0.751	S	S	*	*			trans	-107.1	132.9	169	-160.7	159.5	-133.9	0	0	109.1
630	R	30.4	Very low	37.4	Very low	237 Å²	237	140.9 Å²	140.9	89%	0.894	76%	0.764	S	S	*	*			trans	-87.5	137.7	-155.2	-151.5	175	-169.2	169.1	2.6	111.8	V632	R630-V632 PolarHBondContact O-N 3.43Å
631	T	29.7	Very low	36.5	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	78%	0.782	S	S	*	*			trans	-52.6	126.7	178.7	51.5	0	0	0	0	114
632	V	29.4	Very low	35.6	Very low	146 Å²	146	141 Å²	141	89%	0.885	80%	0.795	S	S	*	*			trans	-133.1	120.7	143.9	-177.1	0	0	0	0	106.2	R630	R630-V632 PolarHBondContact O-N 3.43Å
633	G	29.5	Very low	35.2	Very low	69 Å²	69	140.2 Å²	140.2	71%	0.711	81%	0.805	S	S	*	*			trans	-106.6	153.6	-178.4	0	0	0	0	0	112.5
634	V	31.6	Very low	34.1	Very low	144 Å²	144	140.1 Å²	140.1	87%	0.873	82%	0.816	S	S	*	*			trans	-136.6	133.7	155.3	178.8	0	0	0	0	106.5
635	E	32.4	Very low	33.5	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	82%	0.824	S	S	*	*			trans	-80.7	144.5	-178.6	-59.1	163.5	117.5	0	0	111.4
636	T	31.7	Very low	33.8	Very low	149 Å²	149	140.8 Å²	140.8	91%	0.914	82%	0.821	S	S	*	*			trans	-164.5	148.7	132.9	3.4	0	0	0	0	110.6
637	D	32.3	Very low	33.7	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	82%	0.818	S	S	*	*			trans	-118	-167.4	-168.6	-148.4	17.2	0	0	0	110
638	P	49.2	Very low	33.6	Very low	106 Å²	106	141.1 Å²	141.1	69%	0.688	82%	0.82	S	S	*	*				-128	-158.8	-110.7	42.4	-25	0	0	0	115.2
639	A	31.8	Very low	33.7	Very low	90 Å²	90	137.8 Å²	137.8	74%	0.744	81%	0.808	S	S	*	*			trans	97.7	172	156.5	0	0	0	0	0	117.4
640	P	49	Very low	33.9	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	81%	0.805	S	S	*	*				-143.7	-167.1	-105	40.4	-17.7	0	0	0	116.7
641	A	29.5	Very low	33.9	Very low	104 Å²	104	129.7 Å²	129.7	86%	0.86	80%	0.796	S	S	*	*			trans	72.5	164.7	167.7	0	0	0	0	0	115.8
642	A	29.5	Very low	34.1	Very low	99 Å²	99	128.6 Å²	128.6	82%	0.818	79%	0.794	S	S	*	*			cis	-138.9	175.7	6.9	0	0	0	0	0	112.7
643	A	32.8	Very low	34.7	Very low	95 Å²	95	128.4 Å²	128.4	79%	0.785	79%	0.793	S	S	*	*			trans	-86	163.1	175	0	0	0	0	0	112.5
644	L	29	Very low	35.6	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	79%	0.793	S	S	*	*			trans	-162.5	124.6	150	-105.5	167.1	0	0	0	111.8
645	L	30.4	Very low	35.5	Very low	160 Å²	160	133.3 Å²	133.3	84%	0.838	80%	0.795	S	S	*	*			trans	-110.5	170	151.3	-78.1	174.3	0	0	0	106
646	P	47.5	Very low	35.6	Very low	102 Å²	102	129.9 Å²	129.9	66%	0.662	79%	0.786	S	S	*	*			cis	-131.1	-166.8	10.5	42.8	-25.6	0	0	0	113
647	E	32.3	Very low	35.8	Very low	159 Å²	159	127 Å²	127	74%	0.743	78%	0.777	S	S	*	*				-169	149.7	114.4	-95.9	-66.3	95.8	0	0	108.5
648	D	33.8	Very low	35.8	Very low	151 Å²	151	127.7 Å²	127.7	81%	0.807	78%	0.781	S	S	*	*			trans	-132.8	133.4	-176.2	-173.8	16.2	0	0	0	110
649	L	34.2	Very low	35.6	Very low	131 Å²	131	127.1 Å²	127.1	69%	0.686	79%	0.785	S	S	*	*			trans	-147.3	113.6	-175	-105	112.5	0	0	0	112.8
650	F	35.1	Very low	35.9	Very low	194 Å²	194	126.7 Å²	126.7	85%	0.851	79%	0.789	S	S	*	*			trans	24.9	127.4	151.2	-62.3	-96.2	0	0	0	119.2
651	G	30.9	Very low	35.9	Very low	70 Å²	70	130.8 Å²	130.8	72%	0.722	80%	0.795	S	S	*	*			cis	140.6	168.1	2.2	0	0	0	0	0	112.9
652	S	34.9	Very low	36.9	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	82%	0.82	S	S	*	*			trans	74	87.5	156.4	-60.6	0	0	0	0	121.7
653	V	41.4	Very low	37.2	Very low	143 Å²	143	137.2 Å²	137.2	87%	0.867	82%	0.821	S	S	*	*				64.9	158.2	128.5	-70.9	0	0	0	0	122
654	P	48.2	Very low	37.5	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	82%	0.822	S	S	*	*			trans	-110.7	-178.4	-155.1	43.1	-36.2	0	0	0	115.4
655	F	29.7	Very low	38	Very low	205 Å²	205	137.7 Å²	137.7	90%	0.899	82%	0.819	S	S	*	*			trans	-118.3	153.8	164.3	-151.2	-93.3	0	0	0	111.7
656	V	35.6	Very low	38.4	Very low	109 Å²	109	136.4 Å²	136.4	66%	0.661	82%	0.818	S	S	*	*			trans	-130	134.8	-167.2	171.4	0	0	0	0	111.6
657	A	34.7	Very low	37.8	Very low	89 Å²	89	138.6 Å²	138.6	74%	0.736	83%	0.827	S	S	*	*			trans	47.5	137.4	157.8	0	0	0	0	0	120.7
658	N	33.5	Very low	38.2	Very low	165 Å²	165	137.2 Å²	137.2	88%	0.882	83%	0.833	S	S	*	*				-153.2	164.7	100.6	-143.3	-18.2	0	0	0	112.3
659	A	42.9	Very low	38.5	Very low	94 Å²	94	136.2 Å²	136.2	78%	0.777	84%	0.835	S	S	*	*			trans	-98.8	153.1	173.7	0	0	0	0	0	111.6
660	G	39	Very low	38.8	Very low	80 Å²	80	136.6 Å²	136.6	83%	0.825	85%	0.846	S	S	*	*			trans	-144.3	126.3	171.8	0	0	0	0	0	110.6
661	K	49.8	Very low	39.2	Very low	207 Å²	207	131.8 Å²	131.8	90%	0.9	85%	0.846	S	S	*	*			trans	-108.9	129.5	168.4	-73.7	-177.7	176.9	179.9	0	109
662	S	49.3	Very low	39.9	Very low	200 Å²	200	137.5 Å²	137.5	100%	1.399	86%	0.857	S	S	*	*			trans	-165.4	0	145.7	-76	0	0	0	0	107.6

Retrieved 662 of 662 residues in 580.7 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).