X6R8H3_HUMAN Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X6R8H3, Species HUMAN (Homo sapiens, Human), Gene SGK2, Length 358 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.1	Very low	38	Very low	240 Å²	240	128.2 Å²	128.2	100%	1.182	84%	0.835	S	S	*	*				0	111.5	0	-61.7	172.2	178.4	0	0	105.5
2	N	34.7	Very low	37.6	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	84%	0.835	S	S	*	*			cis	-143	133	24.8	-83.2	-19.2	0	0	0	109.6
3	S	33.9	Very low	37.4	Very low	123 Å²	123	131.5 Å²	131.5	86%	0.86	83%	0.831	S	S	*	*			trans	-91.8	111.2	160.3	35.6	0	0	0	0	108.1
4	S	39.8	Very low	37.2	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-82.8	136.5	170.6	-64.2	0	0	0	0	109.7
5	P	42.3	Very low	37	Very low	123 Å²	123	136.9 Å²	136.9	80%	0.799	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-79.2	142.1	-178.9	19.6	-11.3	0	0	0	111.7	G7	P5-G7 PolarHBondContact O-N 3.32Å
6	A	41.8	Very low	37.2	Very low	101 Å²	101	134.7 Å²	134.7	84%	0.835	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-58.8	123.2	170.2	0	0	0	0	0	110.1	T8	A6-T8 PolarHBondContact O-N 2.9Å
7	G	35.8	Very low	37.4	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-63.7	125.8	175.8	0	0	0	0	0	111.3	P5	P5-G7 PolarHBondContact O-N 3.32Å
8	T	42.1	Very low	38	Very low	130 Å²	130	131.2 Å²	131.2	80%	0.798	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-55.8	132.3	164.7	35.5	0	0	0	0	110.5	A6 S10	A6-T8 PolarHBondContact O-N 2.9Å; T8-S10 PolarHBondContact O-N 3.48Å
9	P	37.7	Very low	39	Very low	123 Å²	123	130.4 Å²	130.4	80%	0.799	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.2	128.7	175.8	26.8	-30.7	0	0	0	110
10	S	35.6	Very low	39.9	Very low	104 Å²	104	124.4 Å²	124.4	73%	0.727	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-53.9	141.1	172.6	-40.6	0	0	0	0	110.8	T8 Q12	T8-S10 PolarHBondContact O-N 3.48Å; S10-Q12 PolarHBondContact O-N 2.67Å; S10-Q12 VanDerWaalsContact O-N 3.08Å
11	P	36.4	Very low	41.1	Very low	130 Å²	130	122.9 Å²	122.9	84%	0.844	76%	0.756	S	S	*	*			trans	-65	115.9	175.6	16	-14.5	0	0	0	109.1
12	Q	33.2	Very low	42	Very low	178 Å²	178	111.7 Å²	111.7	83%	0.832	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59.4	140.8	170	-75.3	-173.4	-25.2	0	0	109.6	S10 S14	S10-Q12 PolarHBondContact O-N 2.67Å; S10-Q12 VanDerWaalsContact O-N 3.08Å; Q12-S14 PolarHBondContact O-N 2.78Å
13	P	34.8	Very low	43.2	Very low	122 Å²	122	105.9 Å²	105.9	79%	0.792	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.5	124	173.2	24.1	-31.3	0	0	0	109	R15	P13-R15 PolarHBondContact O-N 2.87Å; P13-R15 VanDerWaalsContact O-N 3.09Å
14	S	35	Very low	44.1	Very low	113 Å²	113	105.6 Å²	105.6	79%	0.79	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-50.6	117.1	176.8	53.3	0	0	0	0	109.9	Q12 A16	Q12-S14 PolarHBondContact O-N 2.78Å; S14-A16 PolarHBondContact O-N 3.05Å; S14-A16 VanDerWaalsContact O-N 3.1Å
15	R	33.2	Very low	44.8	Very low	231 Å²	231	102.3 Å²	102.3	87%	0.872	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-51.8	119.9	165.2	-75.3	178.9	173.7	179.2	-1.9	107.6	P13 N17	P13-R15 PolarHBondContact O-N 2.87Å; P13-R15 VanDerWaalsContact O-N 3.09Å; R15-N17 VanDerWaalsContact C-N 3.33Å; R15-N17 PolarHBondContact O-N 3.01Å
16	A	40.3	Very low	45.2	Very low	101 Å²	101	98.1 Å²	98.1	84%	0.835	63%	0.625	S	S	*	*			trans	-61.4	96.2	174.2	0	0	0	0	0	108.7	S14 G18	S14-A16 PolarHBondContact O-N 3.05Å; S14-A16 VanDerWaalsContact O-N 3.1Å; A16-G18 PolarHBondContact O-N 3.02Å
17	N	41.9	Very low	45.9	Very low	147 Å²	147	97.4 Å²	97.4	79%	0.786	61%	0.607	S	S	*	*			trans	-60	127.6	171	-89.8	-15.3	0	0	0	107.9	R15 N19	R15-N17 VanDerWaalsContact C-N 3.33Å; R15-N17 PolarHBondContact O-N 3.01Å; N17-N19 PolarHBondContact O-N 3.36Å
18	G	48.2	Very low	46.9	Very low	59 Å²	59	98.5 Å²	98.5	61%	0.608	60%	0.601	S	S	*	*	S	Bend	trans	-67.2	40.9	-176.5	0	0	0	0	0	115.3	A16 L72	A16-G18 PolarHBondContact O-N 3.02Å; G18-L72 WeakPolarHBondContact O-CD1 3.4Å
19	N	55.8	Low	48	Very low	116 Å²	116	98.2 Å²	98.2	62%	0.62	59%	0.594	S	S	*	*			trans	-102.5	113.6	177.6	-160.1	11.6	0	0	0	109.5	N17 N21	N17-N19 PolarHBondContact O-N 3.36Å; N19-N21 PolarHBondContact O-N 2.86Å
20	I	58.4	Low	49.8	Very low	11 Å²	11	92.9 Å²	92.9	6%	0.056	56%	0.561	C	S	.	*			trans	-77.7	106.8	170.9	-59.2	171.4	0	0	0	107.1	K68 I71 L72 Q77 L109	I20-K68 HydrophobicContact CB-CD 4.31Å; I20-K68 HydrophobicContact CB-CG 4.23Å; I20-K68 HydrophobicContact CD1-CB 4.34Å; I20-K68 WeakPolarHBondContact O-CE 3.17Å; I20-K68 PolarHBondContact O-NZ 3.33Å; I20-I71 HydrophobicContact CD1-CB 3.65Å; I20-I71 HydrophobicContact CD1-CD1 4.31Å; I20-I71 HydrophobicContact CD1-CG2 3.52Å; I20-L72 HydrophobicContact CD1-CD2 3.78Å; I20-L72 HydrophobicContact CD1-CG 3.71Å; I20-L72 HydrophobicContact CG1-CD2 3.69Å; I20-L72 HydrophobicContact CG1-CG 4.05Å; I20-Q77 HydrophobicContact CD1-CG 3.84Å; I20-Q77 HydrophobicContact CG1-CG 3.83Å; I20-L109 HydrophobicContact CG2-CD1 4Å; I20-L109 HydrophobicContact CG2-CD2 4.4Å
21	N	63.9	Low	52.1	Low	93 Å²	93	93.4 Å²	93.4	50%	0.497	55%	0.552	S	S	.	*			trans	-118.3	123.3	173.7	-172	-17.4	0	0	0	108	N19 G23 Q104	N19-N21 PolarHBondContact O-N 2.86Å; N21-G23 PolarHBondContact O-N 2.98Å; N21-G23 VanDerWaalsContact O-N 3.12Å; N21-G23 PolarHBondContact OD1-N 2.88Å; N21-Q104 PolarHBondContact OD1-NE2 3.44Å
22	L	58.1	Low	54.4	Low	4 Å²	4	88.8 Å²	88.8	2%	0.021	52%	0.522	C	S	.	.			trans	-64.1	-10.6	175.1	-61.2	-179.3	0	0	0	112.6	M81 R84 Q104 L109	L22-M81 HydrophobicContact CD2-SD 4.26Å; L22-R84 PolarHBondContact O-NE 3.38Å; L22-R84 PolarHBondContact O-NH1 3.3Å; L22-R84 PolarHBondContact O-NH2 3.28Å; L22-Q104 HydrophobicContact CD1-CB 3.97Å; L22-Q104 HydrophobicContact CD1-CG 4.41Å; L22-Q104 HydrophobicContact CG-CB 4.3Å; L22-Q104 HydrophobicContact CG-CG 4.5Å; L22-L109 HydrophobicContact CD1-CB 4.49Å; L22-L109 HydrophobicContact CD1-CD2 3.82Å; L22-L109 HydrophobicContact CD2-CD1 3.78Å; L22-L109 HydrophobicContact CD2-CD2 3.62Å; L22-L109 HydrophobicContact CD2-CG 4.21Å; L22-L109 HydrophobicContact CG-CD2 3.51Å
23	G	59.5	Low	57.1	Low	31 Å²	31	84.7 Å²	84.7	32%	0.32	51%	0.509	S	S	.	.			trans	73.6	-166	-164.8	0	0	0	0	0	110.9	N21 S25	N21-G23 PolarHBondContact O-N 2.98Å; N21-G23 VanDerWaalsContact O-N 3.12Å; N21-G23 PolarHBondContact OD1-N 2.88Å; G23-S25 PolarHBondContact O-N 2.8Å
24	P	52.8	Low	59.8	Low	118 Å²	118	81.5 Å²	81.5	77%	0.766	49%	0.485	S	S	*	.	S	Bend	trans	-58.8	132.3	-178.6	19.8	-28.2	0	0	0	111	R84	P24-R84 PolarHBondContact O-NH2 2.85Å
25	S	53	Low	62.5	Low	40 Å²	40	76.4 Å²	76.4	28%	0.28	45%	0.449	S	S	.	.			trans	-60.4	136	179.8	-43.7	0	0	0	0	110.6	G23 N27 S102	G23-S25 PolarHBondContact O-N 2.8Å; S25-N27 PolarHBondContact O-N 3.3Å; S25-S102 WeakPolarHBondContact CB-O 3.35Å
26	A	52.1	Low	65.3	Low	36 Å²	36	68.8 Å²	68.8	30%	0.298	43%	0.426	S	S	.	.	S	Bend	trans	-67.6	106.1	156	0	0	0	0	0	107.8	L88 S102	A26-L88 HydrophobicContact CB-CD2 3.28Å; A26-S102 PolarHBondContact N-OG 2.84Å; A26-S102 PolarHBondContact O-N 2.81Å
27	N	55.6	Low	67.8	Low	85 Å²	85	68 Å²	68	46%	0.455	40%	0.403	S	S	.	.	S	Bend	trans	69.8	87.5	-168.3	-144.3	-20.2	0	0	0	113.4	S25 N29 A30 Y101	S25-N27 PolarHBondContact O-N 3.3Å; N27-N29 PolarHBondContact O-N 3.31Å; N27-A30 PolarHBondContact O-N 3.38Å; N27-Y101 HydrophobicContact CB-CD1 4.12Å
28	P	56.4	Low	70.1	Confident	96 Å²	96	65.4 Å²	65.4	62%	0.623	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-7.8	-174.5	26	-33.8	0	0	0	115.7
29	N	65.9	Low	72	Confident	124 Å²	124	67.8 Å²	67.8	66%	0.663	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-8.3	-174.8	-62.2	-21	0	0	0	114.2	N27	N27-N29 PolarHBondContact O-N 3.31Å
30	A	76.3	Confident	73.5	Confident	11 Å²	11	65.2 Å²	65.2	9%	0.091	37%	0.371	C	S	.	.			trans	-82.6	130.4	179.3	0	0	0	0	0	111.5	N27 D34 Y101 F103	N27-A30 PolarHBondContact O-N 3.38Å; A30-D34 WeakPolarHBondContact CA-OD2 3.47Å; A30-Y101 HydrophobicContact CB-CD1 3.93Å; A30-Y101 HydrophobicContact CB-CG 4.15Å; A30-F103 HydrophobicContact CB-CD1 3.79Å; A30-F103 HydrophobicContact CB-CE1 4.08Å; A30-F103 WeakPolarHBondContact O-CB 3.18Å; A30-F103 WeakPolarHBondContact O-CD1 3.43Å; A30-F103 WeakPolarHBondContact O-CG 3.45Å
31	Q	84.3	Confident	74.6	Confident	116 Å²	116	68 Å²	68	54%	0.542	39%	0.385	S	S	.	.			trans	-130.2	158.2	-179.3	-65	-174.4	65.1	0	0	111.1	T33 D34 F35	Q31-T33 PolarHBondContact O-N 3.01Å; Q31-D34 PolarHBondContact N-OD2 3.34Å; Q31-D34 WeakPolarHBondContact O-CB 3.49Å; Q31-D34 PolarHBondContact O-N 3.07Å; Q31-F35 WeakPolarHBondContact O-CD2 3.33Å
32	P	84.5	Confident	75.3	Confident	32 Å²	32	64.8 Å²	64.8	21%	0.208	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-53.4	-32.2	177.2	-22	28	0	0	0	113.8	D34 F35 F37 F103 T105 Y110	P32-D34 PolarHBondContact O-N 2.78Å; P32-F35 PolarHBondContact O-N 3.25Å; P32-F37 HydrophobicContact CB-CE2 4.43Å; P32-F37 WeakPolarHBondContact O-CE2 3.48Å; P32-F103 HydrophobicContact CB-CE2 4.33Å; P32-F103 HydrophobicContact CG-CD2 4.28Å; P32-F103 HydrophobicContact CG-CE2 3.72Å; P32-T105 HydrophobicContact CG-CG2 4.06Å; P32-Y110 HydrophobicContact CB-CE1 4.43Å; P32-Y110 HydrophobicContact CG-CE1 4.3Å; P32-Y110 HydrophobicContact CG-CE2 4.14Å
33	T	89.2	Confident	76.1	Confident	92 Å²	92	71 Å²	71	56%	0.564	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-68.7	-16.4	-179.3	46.3	0	0	0	0	114.2	Q31 F35 K55	Q31-T33 PolarHBondContact O-N 3.01Å; T33-F35 PolarHBondContact O-N 3.02Å; T33-K55 WeakPolarHBondContact O-CE 3.37Å; T33-K55 PolarHBondContact O-NZ 2.78Å
34	D	90.5	Very high	76.5	Confident	55 Å²	55	71.9 Å²	71.9	29%	0.294	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-77.8	-7.4	178.2	-56	-28.6	0	0	0	112.4	A30 Q31 P32 K55	A30-D34 WeakPolarHBondContact CA-OD2 3.47Å; Q31-D34 PolarHBondContact N-OD2 3.34Å; Q31-D34 WeakPolarHBondContact O-CB 3.49Å; Q31-D34 PolarHBondContact O-N 3.07Å; P32-D34 PolarHBondContact O-N 2.78Å; D34-K55 WeakPolarHBondContact O-CG 3.39Å; D34-K55 PolarHBondContact O-N 3.18Å
35	F	92.4	Very high	77.2	Confident	7 Å²	7	72.1 Å²	72.1	3%	0.031	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.3	-174.5	-60.1	-90.5	0	0	0	111.2	Q31 P32 T33 F37 A52 K53 R54 Y61 Y101 F103 V112	Q31-F35 WeakPolarHBondContact O-CD2 3.33Å; P32-F35 PolarHBondContact O-N 3.25Å; T33-F35 PolarHBondContact O-N 3.02Å; F35-F37 HydrophobicContact CB-CE1 4.45Å; F35-F37 HydrophobicContact CB-CZ 4.24Å; F35-A52 HydrophobicContact CB-CB 4.09Å; F35-A52 HydrophobicContact CD1-CB 4.39Å; F35-K53 CarbonylContact C-O 3.59Å; F35-K53 WeakPolarHBondContact CA-O 3.42Å; F35-R54 HydrophobicContact CD1-CB 3.92Å; F35-R54 HydrophobicContact CD1-CG 4.47Å; F35-R54 HydrophobicContact CE1-CB 3.82Å; F35-R54 HydrophobicContact CE1-CG 4.12Å; F35-Y61 HydrophobicContact CD1-CD2 4.36Å; F35-Y61 AromaticContact CE1-CD2 3.93Å; F35-Y61 HydrophobicContact CE1-CD2 3.93Å; F35-Y61 HydrophobicContact CE1-CE2 4.33Å; F35-Y101 AromaticContact CZ-CD2 4Å; F35-Y101 HydrophobicContact CZ-CD2 4Å; F35-Y101 HydrophobicContact CZ-CE2 4.43Å; F35-F103 HydrophobicContact CD2-CE1 4.48Å; F35-F103 HydrophobicContact CD2-CZ 4.21Å; F35-F103 AromaticContact CE2-CE1 3.76Å; F35-F103 HydrophobicContact CE2-CE1 3.76Å; F35-F103 AromaticContact CE2-CZ 3.94Å; F35-F103 HydrophobicContact CE2-CZ 3.94Å; F35-F103 HydrophobicContact CZ-CE1 4.42Å; F35-V112 HydrophobicContact CE1-CG1 3.84Å; F35-V112 HydrophobicContact CE1-CG2 4.35Å; F35-V112 HydrophobicContact CE2-CG2 4.33Å; F35-V112 HydrophobicContact CZ-CG1 4.09Å; F35-V112 HydrophobicContact CZ-CG2 3.94Å
36	D	92.9	Very high	78	Confident	71 Å²	71	72.5 Å²	72.5	38%	0.38	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	108	166.4	-65.2	-42.6	0	0	0	108.7	L38 A52 K53 K55	D36-L38 HydrophobicContact CB-CD2 4.22Å; D36-L38 WeakPolarHBondContact O-CG 3.41Å; D36-L38 PolarHBondContact O-N 2.86Å; D36-A52 CarbonylContact O-C 3.55Å; D36-A52 WeakPolarHBondContact O-CA 3.48Å; D36-K53 PolarHBondContact N-O 2.76Å; D36-K53 PolarHBondContact O-N 2.66Å; D36-K55 WeakPolarHBondContact OD1-CE 3.38Å; D36-K55 IonicContact OD1-NZ 3.91Å
37	F	92.3	Very high	79.4	Confident	83 Å²	83	71.8 Å²	71.8	36%	0.364	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111.5	178.2	-62.5	-74.4	0	0	0	110.4	P32 F35 L50 A52 V63 Y110	P32-F37 HydrophobicContact CB-CE2 4.43Å; P32-F37 WeakPolarHBondContact O-CE2 3.48Å; F35-F37 HydrophobicContact CB-CE1 4.45Å; F35-F37 HydrophobicContact CB-CZ 4.24Å; F37-L50 HydrophobicContact CB-CD1 4.37Å; F37-L50 HydrophobicContact CD1-CB 3.92Å; F37-L50 HydrophobicContact CD1-CD1 3.43Å; F37-L50 VanDerWaalsContact CD1-CD1 3.43Å; F37-L50 HydrophobicContact CD1-CG 4.31Å; F37-L50 HydrophobicContact CE1-CD1 3.91Å; F37-L50 HydrophobicContact CG-CD1 4.02Å; F37-A52 HydrophobicContact CD1-CB 3.84Å; F37-A52 HydrophobicContact CE1-CB 4.2Å; F37-V63 HydrophobicContact CE1-CB 4.11Å; F37-V63 HydrophobicContact CE1-CG1 4.04Å; F37-V63 HydrophobicContact CE1-CG2 4.18Å; F37-Y110 HydrophobicContact CZ-CE1 4.46Å
38	L	89.3	Confident	80.9	Confident	94 Å²	94	72.5 Å²	72.5	49%	0.492	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-48.3	-169.1	-55	180	0	0	0	112.8	D36 L51 K53 F60	D36-L38 HydrophobicContact CB-CD2 4.22Å; D36-L38 WeakPolarHBondContact O-CG 3.41Å; D36-L38 PolarHBondContact O-N 2.86Å; L38-L51 HydrophobicContact CB-CD2 4.46Å; L38-L51 HydrophobicContact CB-CG 4.43Å; L38-L51 HydrophobicContact CD1-CD2 4.26Å; L38-L51 HydrophobicContact CD1-CG 4.28Å; L38-L51 PolarHBondContact N-O 3.42Å; L38-K53 HydrophobicContact CD1-CB 4.16Å; L38-F60 HydrophobicContact CD1-CD1 4.04Å; L38-F60 HydrophobicContact CD1-CE1 3.56Å
39	K	89	Confident	82.4	Confident	109 Å²	109	69.7 Å²	69.7	47%	0.474	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	145.5	-171.1	-175.1	178.8	173	-171.8	0	111.8	I41 L50 L51	K39-I41 PolarHBondContact O-N 3.32Å; K39-L50 CarbonylContact O-C 3.28Å; K39-L50 WeakPolarHBondContact O-CA 3.45Å; K39-L51 HydrophobicContact CB-CB 4.48Å; K39-L51 PolarHBondContact N-O 3.04Å; K39-L51 PolarHBondContact O-N 2.83Å
40	V	86.5	Confident	83.5	Confident	62 Å²	62	64.5 Å²	64.5	38%	0.376	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.5	165.9	-175.7	0	0	0	0	109	G42 K43 K48 L50	V40-G42 WeakPolarHBondContact CG1-O 3.13Å; V40-K43 HydrophobicContact CG1-CG 4.09Å; V40-K48 HydrophobicContact CG1-CB 4.4Å; V40-K48 HydrophobicContact CG2-CD 4.4Å; V40-L50 HydrophobicContact CB-CD2 4.28Å; V40-L50 HydrophobicContact CG2-CD2 3.65Å
41	I	82	Confident	84.3	Confident	69 Å²	69	64.3 Å²	64.3	35%	0.354	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-14.5	179.7	60	174.5	0	0	0	113.1	K39 V49 L51 A62 Y115	K39-I41 PolarHBondContact O-N 3.32Å; I41-V49 HydrophobicContact CD1-CG1 3.91Å; I41-V49 HydrophobicContact CG1-CB 4.11Å; I41-V49 HydrophobicContact CG1-CG1 3.75Å; I41-V49 WeakPolarHBondContact CG1-O 3.37Å; I41-V49 PolarHBondContact N-O 2.91Å; I41-L51 HydrophobicContact CD1-CB 4.3Å; I41-L51 HydrophobicContact CG2-CB 3.74Å; I41-A62 HydrophobicContact CD1-CB 4.05Å; I41-Y115 HydrophobicContact CD1-CD2 4.2Å; I41-Y115 HydrophobicContact CD1-CE2 4.04Å
42	G	79.3	Confident	84.7	Confident	25 Å²	25	58.8 Å²	58.8	26%	0.258	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.9	173.1	0	0	0	0	0	111.7	V40 K48 V49	V40-G42 WeakPolarHBondContact CG1-O 3.13Å; G42-K48 CarbonylContact O-C 3.58Å; G42-K48 WeakPolarHBondContact O-CA 3.47Å; G42-V49 PolarHBondContact N-O 3.44Å; G42-V49 VanDerWaalsContact N-O 3.16Å; G42-V49 PolarHBondContact O-N 3.06Å
43	K	75.2	Confident	85.1	Confident	136 Å²	136	61.2 Å²	61.2	59%	0.591	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.8	172.1	-68.9	179.3	-177.2	170.8	0	107.7	V40 W355	V40-K43 HydrophobicContact CG1-CG 4.09Å; K43-W355 VanDerWaalsContact NZ-NE1 3.19Å
44	G	67.9	Low	85.3	Confident	49 Å²	49	59.9 Å²	59.9	51%	0.505	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	174.9	178	0	0	0	0	0	111.4	Y46 G47	G44-Y46 PolarHBondContact O-N 2.9Å; G44-G47 PolarHBondContact N-O 2.72Å; G44-G47 PolarHBondContact O-N 2.93Å
45	N	67.3	Low	85.4	Confident	122 Å²	122	63 Å²	63	65%	0.652	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-21.5	-175.5	-76.1	-23.6	0	0	0	115.3	K74	N45-K74 PolarHBondContact O-NZ 2.91Å
46	Y	69.5	Low	85.3	Confident	48 Å²	48	66.9 Å²	66.9	19%	0.188	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	4	-172.7	-42.9	-80	0	0	0	113.2	G44 L66 Q67 K74 E76	G44-Y46 PolarHBondContact O-N 2.9Å; Y46-L66 WeakPolarHBondContact O-CA 3.35Å; Y46-Q67 PolarHBondContact O-N 2.82Å; Y46-K74 HydrophobicContact CD1-CD 3.72Å; Y46-K74 HydrophobicContact CE1-CB 3.89Å; Y46-K74 HydrophobicContact CE1-CD 3.29Å; Y46-K74 HydrophobicContact CE1-CG 4.2Å; Y46-E76 HydrophobicContact CE1-CB 3.93Å; Y46-E76 HydrophobicContact CE1-CG 3.58Å; Y46-E76 WeakPolarHBondContact OH-CG 3.44Å; Y46-E76 PolarHBondContact OH-OE1 3.11Å
47	G	80.9	Confident	85	Confident	21 Å²	21	67.3 Å²	67.3	22%	0.216	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-167	-167.6	0	0	0	0	0	114.9	G44 V65	G44-G47 PolarHBondContact N-O 2.72Å; G44-G47 PolarHBondContact O-N 2.93Å; G47-V65 CarbonylContact C-O 3.55Å; G47-V65 WeakPolarHBondContact CA-O 3.46Å
48	K	87	Confident	84.8	Confident	100 Å²	100	64.5 Å²	64.5	44%	0.435	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.7	179.1	60	-175.5	178.5	177.4	0	110.4	V40 G42 L50 V65	V40-K48 HydrophobicContact CG1-CB 4.4Å; V40-K48 HydrophobicContact CG2-CD 4.4Å; G42-K48 CarbonylContact O-C 3.58Å; G42-K48 WeakPolarHBondContact O-CA 3.47Å; K48-L50 HydrophobicContact CD-CD2 3.93Å; K48-L50 HydrophobicContact CG-CD2 4.14Å; K48-L50 HydrophobicContact CG-CG 4.27Å; K48-V65 PolarHBondContact N-O 2.81Å; K48-V65 PolarHBondContact O-N 2.92Å
49	V	87.6	Confident	84.8	Confident	37 Å²	37	61.6 Å²	61.6	22%	0.224	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.6	172.1	-170.7	0	0	0	0	107.7	I41 G42 A62 V63 K64	I41-V49 HydrophobicContact CD1-CG1 3.91Å; I41-V49 HydrophobicContact CG1-CB 4.11Å; I41-V49 HydrophobicContact CG1-CG1 3.75Å; I41-V49 WeakPolarHBondContact CG1-O 3.37Å; I41-V49 PolarHBondContact N-O 2.91Å; G42-V49 PolarHBondContact N-O 3.44Å; G42-V49 VanDerWaalsContact N-O 3.16Å; G42-V49 PolarHBondContact O-N 3.06Å; V49-A62 HydrophobicContact CG1-CB 4.06Å; V49-V63 CarbonylContact C-O 3.56Å; V49-V63 WeakPolarHBondContact CA-O 3.32Å; V49-K64 HydrophobicContact CG2-CB 4.37Å; V49-K64 HydrophobicContact CG2-CG 4.25Å
50	L	90.5	Very high	85	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.084	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.3	-178	-58.8	173	0	0	0	109.4	F37 K39 V40 K48 A52 V63 V65	F37-L50 HydrophobicContact CB-CD1 4.37Å; F37-L50 HydrophobicContact CD1-CB 3.92Å; F37-L50 HydrophobicContact CD1-CD1 3.43Å; F37-L50 VanDerWaalsContact CD1-CD1 3.43Å; F37-L50 HydrophobicContact CD1-CG 4.31Å; F37-L50 HydrophobicContact CE1-CD1 3.91Å; F37-L50 HydrophobicContact CG-CD1 4.02Å; K39-L50 CarbonylContact O-C 3.28Å; K39-L50 WeakPolarHBondContact O-CA 3.45Å; V40-L50 HydrophobicContact CB-CD2 4.28Å; V40-L50 HydrophobicContact CG2-CD2 3.65Å; K48-L50 HydrophobicContact CD-CD2 3.93Å; K48-L50 HydrophobicContact CG-CD2 4.14Å; K48-L50 HydrophobicContact CG-CG 4.27Å; L50-A52 PolarHBondContact O-N 2.67Å; L50-V63 PolarHBondContact N-O 3.14Å; L50-V63 PolarHBondContact O-N 3.36Å; L50-V65 HydrophobicContact CD1-CG2 3.8Å; L50-V65 HydrophobicContact CG-CG2 4.4Å
51	L	91.8	Very high	85.2	Confident	7 Å²	7	56.8 Å²	56.8	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125.2	159.2	175.9	64.9	0	0	0	107.7	L38 K39 I41 F60 Y115 P318	L38-L51 HydrophobicContact CB-CD2 4.46Å; L38-L51 HydrophobicContact CB-CG 4.43Å; L38-L51 HydrophobicContact CD1-CD2 4.26Å; L38-L51 HydrophobicContact CD1-CG 4.28Å; L38-L51 PolarHBondContact N-O 3.42Å; K39-L51 HydrophobicContact CB-CB 4.48Å; K39-L51 PolarHBondContact N-O 3.04Å; K39-L51 PolarHBondContact O-N 2.83Å; I41-L51 HydrophobicContact CD1-CB 4.3Å; I41-L51 HydrophobicContact CG2-CB 3.74Å; L51-F60 HydrophobicContact CD1-CB 4.23Å; L51-F60 HydrophobicContact CD1-CD1 3.98Å; L51-F60 HydrophobicContact CG-CD1 4.4Å; L51-Y115 HydrophobicContact CD1-CD1 3.81Å; L51-Y115 HydrophobicContact CD1-CD2 3.81Å; L51-Y115 HydrophobicContact CD1-CE1 3.82Å; L51-Y115 HydrophobicContact CD1-CE2 3.86Å; L51-Y115 HydrophobicContact CD1-CG 3.81Å; L51-P318 HydrophobicContact CD2-CG 3.63Å
52	A	93.1	Very high	85.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.2	176.7	0	0	0	0	0	111.3	F35 D36 F37 L50 F60 Y61 V63	F35-A52 HydrophobicContact CB-CB 4.09Å; F35-A52 HydrophobicContact CD1-CB 4.39Å; D36-A52 CarbonylContact O-C 3.55Å; D36-A52 WeakPolarHBondContact O-CA 3.48Å; F37-A52 HydrophobicContact CD1-CB 3.84Å; F37-A52 HydrophobicContact CE1-CB 4.2Å; L50-A52 PolarHBondContact O-N 2.67Å; A52-F60 CarbonylContact O-C 3.59Å; A52-F60 WeakPolarHBondContact O-CA 3.47Å; A52-Y61 PolarHBondContact N-O 3.01Å; A52-Y61 PolarHBondContact O-N 3.43Å; A52-V63 HydrophobicContact CB-CG2 3.6Å
53	K	93.1	Very high	86.2	Confident	83 Å²	83	52.9 Å²	52.9	36%	0.361	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.2	171.9	-172.9	179.1	-177.5	-179.4	0	108.7	F35 D36 L38 G58 A59 F60	F35-K53 CarbonylContact C-O 3.59Å; F35-K53 WeakPolarHBondContact CA-O 3.42Å; D36-K53 PolarHBondContact N-O 2.76Å; D36-K53 PolarHBondContact O-N 2.66Å; L38-K53 HydrophobicContact CD1-CB 4.16Å; K53-G58 VanDerWaalsContact CE-CA 3.43Å; K53-G58 WeakPolarHBondContact CE-O 2.82Å; K53-G58 WeakPolarHBondContact CG-O 3.29Å; K53-A59 CarbonylContact C-O 3.56Å; K53-A59 WeakPolarHBondContact CA-O 3.4Å; K53-F60 HydrophobicContact CB-CD1 4.22Å; K53-F60 HydrophobicContact CB-CE1 4.19Å; K53-F60 HydrophobicContact CD-CE1 4.3Å; K53-F60 HydrophobicContact CD-CZ 4.11Å; K53-F60 HydrophobicContact CG-CE1 4.38Å
54	R	92.9	Very high	86.9	Confident	64 Å²	64	48 Å²	48	24%	0.242	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.9	175.8	178.7	178.1	167.6	-147.5	-2.4	109.4	F35 S56 D57 G58 A59 Y61 Y101	F35-R54 HydrophobicContact CD1-CB 3.92Å; F35-R54 HydrophobicContact CD1-CG 4.47Å; F35-R54 HydrophobicContact CE1-CB 3.82Å; F35-R54 HydrophobicContact CE1-CG 4.12Å; R54-S56 PolarHBondContact NE-OG 2.96Å; R54-S56 PolarHBondContact NH2-OG 3.24Å; R54-S56 PolarHBondContact O-N 3.22Å; R54-D57 WeakPolarHBondContact CB-OD1 3.5Å; R54-D57 WeakPolarHBondContact CD-OD1 3.42Å; R54-D57 WeakPolarHBondContact CG-OD1 3.47Å; R54-D57 IonicContact CZ-OD2 2.7Å; R54-D57 IonicContact NE-OD2 3.79Å; R54-D57 IonicContact NH1-OD2 3.94Å; R54-D57 PolarHBondContact NH1-OD2 2.81Å; R54-G58 WeakPolarHBondContact O-CA 3.46Å; R54-G58 PolarHBondContact O-N 3.47Å; R54-A59 PolarHBondContact N-O 2.68Å; R54-Y61 HydrophobicContact CB-CD2 3.98Å; R54-Y61 HydrophobicContact CB-CE2 3.52Å; R54-Y61 HydrophobicContact CG-CE2 4.42Å; R54-Y101 PolarHBondContact NH1-OH 2.89Å
55	K	92.4	Very high	88	Confident	121 Å²	121	46.1 Å²	46.1	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-36.2	-172.4	-70.5	174.8	178.8	172.2	0	113.5	T33 D34 D36	T33-K55 WeakPolarHBondContact O-CE 3.37Å; T33-K55 PolarHBondContact O-NZ 2.78Å; D34-K55 WeakPolarHBondContact O-CG 3.39Å; D34-K55 PolarHBondContact O-N 3.18Å; D36-K55 WeakPolarHBondContact OD1-CE 3.38Å; D36-K55 IonicContact OD1-NZ 3.91Å
56	S	89.9	Confident	89	Confident	87 Å²	87	40.6 Å²	40.6	61%	0.608	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-33.5	-171.7	59.3	0	0	0	0	114.3	R54	R54-S56 PolarHBondContact NE-OG 2.96Å; R54-S56 PolarHBondContact NH2-OG 3.24Å; R54-S56 PolarHBondContact O-N 3.22Å
57	D	88.1	Confident	89.9	Confident	80 Å²	80	43 Å²	43	43%	0.428	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-9.2	-176.4	58.9	10.9	0	0	0	113.3	R54 A59	R54-D57 WeakPolarHBondContact CB-OD1 3.5Å; R54-D57 WeakPolarHBondContact CD-OD1 3.42Å; R54-D57 WeakPolarHBondContact CG-OD1 3.47Å; R54-D57 IonicContact CZ-OD2 2.7Å; R54-D57 IonicContact NE-OD2 3.79Å; R54-D57 IonicContact NH1-OD2 3.94Å; R54-D57 PolarHBondContact NH1-OD2 2.81Å; D57-A59 PolarHBondContact O-N 3.34Å; D57-A59 WeakPolarHBondContact OD1-CB 3.48Å; D57-A59 PolarHBondContact OD1-N 2.96Å
58	G	88.3	Confident	90.3	Very high	25 Å²	25	42.7 Å²	42.7	26%	0.258	22%	0.221	S	C	.	.			trans	71.3	9.4	-177.5	0	0	0	0	0	114.6	K53 R54	K53-G58 VanDerWaalsContact CE-CA 3.43Å; K53-G58 WeakPolarHBondContact CE-O 2.82Å; K53-G58 WeakPolarHBondContact CG-O 3.29Å; R54-G58 WeakPolarHBondContact O-CA 3.46Å; R54-G58 PolarHBondContact O-N 3.47Å
59	A	89.6	Confident	90.3	Very high	33 Å²	33	46 Å²	46	27%	0.273	24%	0.235	S	C	.	.			trans	-74.3	147.5	-179.2	0	0	0	0	0	111.8	K53 R54 D57 Y61	K53-A59 CarbonylContact C-O 3.56Å; K53-A59 WeakPolarHBondContact CA-O 3.4Å; R54-A59 PolarHBondContact N-O 2.68Å; D57-A59 PolarHBondContact O-N 3.34Å; D57-A59 WeakPolarHBondContact OD1-CB 3.48Å; D57-A59 PolarHBondContact OD1-N 2.96Å; A59-Y61 HydrophobicContact CB-CE2 3.67Å; A59-Y61 WeakPolarHBondContact O-CD2 3.19Å; A59-Y61 WeakPolarHBondContact O-CE2 3.41Å
60	F	91.2	Very high	90.2	Very high	51 Å²	51	46 Å²	46	22%	0.224	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	140.2	178.3	-68.8	-90.2	0	0	0	111.4	L38 L51 A52 K53 Y115 L316 P318	L38-F60 HydrophobicContact CD1-CD1 4.04Å; L38-F60 HydrophobicContact CD1-CE1 3.56Å; L51-F60 HydrophobicContact CD1-CB 4.23Å; L51-F60 HydrophobicContact CD1-CD1 3.98Å; L51-F60 HydrophobicContact CG-CD1 4.4Å; A52-F60 CarbonylContact O-C 3.59Å; A52-F60 WeakPolarHBondContact O-CA 3.47Å; K53-F60 HydrophobicContact CB-CD1 4.22Å; K53-F60 HydrophobicContact CB-CE1 4.19Å; K53-F60 HydrophobicContact CD-CE1 4.3Å; K53-F60 HydrophobicContact CD-CZ 4.11Å; K53-F60 HydrophobicContact CG-CE1 4.38Å; F60-Y115 HydrophobicContact CB-CD1 4.01Å; F60-L316 WeakPolarHBondContact CE2-O 3.35Å; F60-P318 HydrophobicContact CE1-CG 4.47Å
61	Y	91.8	Very high	89.8	Confident	19 Å²	19	45.2 Å²	45.2	8%	0.075	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.7	-177.7	-61.4	-79.3	0	0	0	111.7	F35 A52 R54 A59 R100 Y101 V112	F35-Y61 HydrophobicContact CD1-CD2 4.36Å; F35-Y61 AromaticContact CE1-CD2 3.93Å; F35-Y61 HydrophobicContact CE1-CD2 3.93Å; F35-Y61 HydrophobicContact CE1-CE2 4.33Å; A52-Y61 PolarHBondContact N-O 3.01Å; A52-Y61 PolarHBondContact O-N 3.43Å; R54-Y61 HydrophobicContact CB-CD2 3.98Å; R54-Y61 HydrophobicContact CB-CE2 3.52Å; R54-Y61 HydrophobicContact CG-CE2 4.42Å; A59-Y61 HydrophobicContact CB-CE2 3.67Å; A59-Y61 WeakPolarHBondContact O-CD2 3.19Å; A59-Y61 WeakPolarHBondContact O-CE2 3.41Å; Y61-R100 HydrophobicContact CD1-CB 4.48Å; Y61-R100 HydrophobicContact CD1-CG 4.25Å; Y61-R100 HydrophobicContact CE1-CB 4.12Å; Y61-R100 HydrophobicContact CE1-CG 3.88Å; Y61-Y101 HydrophobicContact CE1-CE2 4.25Å; Y61-V112 HydrophobicContact CD1-CG1 3.77Å; Y61-V112 HydrophobicContact CD2-CG1 4.27Å; Y61-V112 HydrophobicContact CG-CG1 3.58Å
62	A	91.6	Very high	89.5	Confident	12 Å²	12	47.6 Å²	47.6	10%	0.099	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	112.1	165.3	0	0	0	0	0	109.1	I41 V49 L113 Y115	I41-A62 HydrophobicContact CD1-CB 4.05Å; V49-A62 HydrophobicContact CG1-CB 4.06Å; A62-L113 HydrophobicContact CB-CB 4.42Å; A62-L113 PolarHBondContact N-O 3.2Å; A62-L113 WeakPolarHBondContact O-CB 3.48Å; A62-L113 PolarHBondContact O-N 2.97Å; A62-Y115 HydrophobicContact CB-CD2 4.49Å
63	V	91.4	Very high	89.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	106.1	-179.2	-171	0	0	0	0	110	F37 V49 L50 A52 V65 Y110 F111 V112	F37-V63 HydrophobicContact CE1-CB 4.11Å; F37-V63 HydrophobicContact CE1-CG1 4.04Å; F37-V63 HydrophobicContact CE1-CG2 4.18Å; V49-V63 CarbonylContact C-O 3.56Å; V49-V63 WeakPolarHBondContact CA-O 3.32Å; L50-V63 PolarHBondContact N-O 3.14Å; L50-V63 PolarHBondContact O-N 3.36Å; A52-V63 HydrophobicContact CB-CG2 3.6Å; V63-V65 HydrophobicContact CG1-CG2 3.92Å; V63-V65 PolarHBondContact O-N 3.27Å; V63-Y110 HydrophobicContact CG1-CD1 4.05Å; V63-F111 CarbonylContact C-O 3.49Å; V63-F111 WeakPolarHBondContact CA-O 3.29Å; V63-V112 HydrophobicContact CG1-CG2 4.24Å; V63-V112 HydrophobicContact CG2-CG1 4.24Å; V63-V112 HydrophobicContact CG2-CG2 4.22Å
64	K	89.8	Confident	88.4	Confident	32 Å²	32	57.6 Å²	57.6	14%	0.139	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	110.7	172.1	-170	174.3	-173	178.8	0	108.3	V49 L66 E83 Y110 F111 D177	V49-K64 HydrophobicContact CG2-CB 4.37Å; V49-K64 HydrophobicContact CG2-CG 4.25Å; K64-L66 HydrophobicContact CG-CD2 4.18Å; K64-L66 HydrophobicContact CG-CG 4.34Å; K64-E83 IonicContact NZ-OE1 2.81Å; K64-E83 PolarHBondContact NZ-OE1 3.49Å; K64-E83 IonicContact NZ-OE2 3.47Å; K64-E83 PolarHBondContact NZ-OE2 2.84Å; K64-Y110 WeakPolarHBondContact O-CA 3.25Å; K64-F111 HydrophobicContact CB-CB 4.26Å; K64-F111 HydrophobicContact CB-CD2 4.5Å; K64-F111 HydrophobicContact CD-CD2 4.45Å; K64-F111 PolarHBondContact N-O 3.43Å; K64-F111 PolarHBondContact O-N 2.89Å; K64-D177 IonicContact NZ-OD1 3.25Å; K64-D177 PolarHBondContact NZ-OD1 3.05Å
65	V	90.4	Very high	87.9	Confident	11 Å²	11	62.8 Å²	62.8	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.7	-179.8	-173.4	0	0	0	0	109.5	G47 K48 L50 V63 K108 L109 Y110	G47-V65 CarbonylContact C-O 3.55Å; G47-V65 WeakPolarHBondContact CA-O 3.46Å; K48-V65 PolarHBondContact N-O 2.81Å; K48-V65 PolarHBondContact O-N 2.92Å; L50-V65 HydrophobicContact CD1-CG2 3.8Å; L50-V65 HydrophobicContact CG-CG2 4.4Å; V63-V65 HydrophobicContact CG1-CG2 3.92Å; V63-V65 PolarHBondContact O-N 3.27Å; V65-K108 HydrophobicContact CG1-CB 4.39Å; V65-K108 HydrophobicContact CG1-CD 3.95Å; V65-K108 HydrophobicContact CG1-CG 4.44Å; V65-L109 WeakPolarHBondContact CA-O 3.39Å; V65-Y110 HydrophobicContact CB-CD1 4.44Å; V65-Y110 HydrophobicContact CB-CE1 4.4Å; V65-Y110 HydrophobicContact CG1-CD1 4.16Å; V65-Y110 HydrophobicContact CG1-CE1 3.75Å; V65-Y110 HydrophobicContact CG2-CD1 3.72Å; V65-Y110 HydrophobicContact CG2-CE1 3.79Å
66	L	87.9	Confident	87.2	Confident	5 Å²	5	59 Å²	59	3%	0.026	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.1	-177.7	-52.8	164.3	0	0	0	111.1	Y46 K64 I71 I80 K108 L109 F111	Y46-L66 WeakPolarHBondContact O-CA 3.35Å; K64-L66 HydrophobicContact CG-CD2 4.18Å; K64-L66 HydrophobicContact CG-CG 4.34Å; L66-I71 HydrophobicContact CB-CD1 3.94Å; L66-I80 HydrophobicContact CD1-CD1 3.75Å; L66-I80 HydrophobicContact CD1-CG1 4.42Å; L66-I80 HydrophobicContact CD1-CG2 3.99Å; L66-K108 CarbonylContact O-C 3.53Å; L66-K108 VanDerWaalsContact O-CA 3.23Å; L66-K108 WeakPolarHBondContact O-CA 3.39Å; L66-L109 HydrophobicContact CB-CB 4.24Å; L66-L109 PolarHBondContact N-O 2.63Å; L66-L109 PolarHBondContact O-N 3.32Å; L66-F111 HydrophobicContact CD1-CD2 4.01Å; L66-F111 HydrophobicContact CD1-CE2 3.52Å
67	Q	89	Confident	86.8	Confident	98 Å²	98	58.1 Å²	58.1	46%	0.458	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.6	179.5	-63.8	-177.4	3.6	0	0	111.2	Y46 K69 S70 I71	Y46-Q67 PolarHBondContact O-N 2.82Å; Q67-K69 VanDerWaalsContact C-N 3.32Å; Q67-K69 PolarHBondContact O-N 3.28Å; Q67-S70 PolarHBondContact O-N 2.85Å; Q67-S70 VanDerWaalsContact O-N 3.11Å; Q67-S70 PolarHBondContact OE1-OG 2.83Å; Q67-I71 WeakPolarHBondContact O-CG1 3.36Å; Q67-I71 PolarHBondContact O-N 2.97Å; Q67-I71 VanDerWaalsContact O-N 3.08Å
68	K	88.6	Confident	86.1	Confident	16 Å²	16	58 Å²	58	7%	0.07	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-42.1	-178.7	-69.6	-179.4	177.5	-176	0	112.3	I20 S70 I71 L72 T105 P106 E107 L109	I20-K68 HydrophobicContact CB-CD 4.31Å; I20-K68 HydrophobicContact CB-CG 4.23Å; I20-K68 HydrophobicContact CD1-CB 4.34Å; I20-K68 WeakPolarHBondContact O-CE 3.17Å; I20-K68 PolarHBondContact O-NZ 3.33Å; K68-S70 VanDerWaalsContact C-N 3.32Å; K68-S70 PolarHBondContact O-N 2.9Å; K68-I71 PolarHBondContact O-N 3.36Å; K68-L72 WeakPolarHBondContact O-CG 3.37Å; K68-L72 PolarHBondContact O-N 3.15Å; K68-T105 WeakPolarHBondContact CE-O 3.45Å; K68-T105 PolarHBondContact NZ-O 2.92Å; K68-P106 WeakPolarHBondContact CD-O 3.32Å; K68-E107 WeakPolarHBondContact CB-O 3.45Å; K68-E107 PolarHBondContact N-O 2.88Å; K68-L109 HydrophobicContact CD-CD2 4.33Å; K68-L109 HydrophobicContact CG-CD2 4.15Å; K68-L109 HydrophobicContact CG-CG 4.1Å
69	K	87.1	Confident	85.4	Confident	169 Å²	169	59.6 Å²	59.6	74%	0.735	29%	0.289	S	S	*	.	H	α-helix	trans	-57.3	-43.6	176.5	-69.9	-174.6	177.4	-179.3	0	112.2	Q67 L72 K73	Q67-K69 VanDerWaalsContact C-N 3.32Å; Q67-K69 PolarHBondContact O-N 3.28Å; K69-L72 PolarHBondContact O-N 3.1Å; K69-K73 WeakPolarHBondContact O-CB 3.24Å; K69-K73 PolarHBondContact O-N 2.87Å
70	S	84.8	Confident	84.8	Confident	36 Å²	36	58.5 Å²	58.5	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-69.3	-38	-179.9	-58.4	0	0	0	0	112.4	Q67 K68 K74	Q67-S70 PolarHBondContact O-N 2.85Å; Q67-S70 VanDerWaalsContact O-N 3.11Å; Q67-S70 PolarHBondContact OE1-OG 2.83Å; K68-S70 VanDerWaalsContact C-N 3.32Å; K68-S70 PolarHBondContact O-N 2.9Å; S70-K74 PolarHBondContact O-N 3.06Å
71	I	83.6	Confident	84.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-48.3	174.6	-61.6	161.5	0	0	0	110.4	I20 L66 Q67 K68 K73 K74 K75 E76 Q77 I80 L109	I20-I71 HydrophobicContact CD1-CB 3.65Å; I20-I71 HydrophobicContact CD1-CD1 4.31Å; I20-I71 HydrophobicContact CD1-CG2 3.52Å; L66-I71 HydrophobicContact CB-CD1 3.94Å; Q67-I71 WeakPolarHBondContact O-CG1 3.36Å; Q67-I71 PolarHBondContact O-N 2.97Å; Q67-I71 VanDerWaalsContact O-N 3.08Å; K68-I71 PolarHBondContact O-N 3.36Å; I71-K73 PolarHBondContact O-N 2.77Å; I71-K74 PolarHBondContact O-N 3.1Å; I71-K75 PolarHBondContact O-N 2.93Å; I71-E76 HydrophobicContact CG2-CB 4.22Å; I71-E76 PolarHBondContact O-N 2.86Å; I71-E76 VanDerWaalsContact O-N 3.15Å; I71-Q77 HydrophobicContact CG2-CG 4.16Å; I71-I80 HydrophobicContact CD1-CG1 3.99Å; I71-I80 HydrophobicContact CD1-CG2 4.39Å; I71-I80 HydrophobicContact CG1-CG1 4.17Å; I71-I80 HydrophobicContact CG2-CG1 4.11Å; I71-L109 HydrophobicContact CD1-CD1 3.86Å
72	L	84.4	Confident	83.1	Confident	57 Å²	57	59.6 Å²	59.6	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-45.7	178.3	-72.1	174.7	0	0	0	111.8	G18 I20 K68 K69 K74 K75 Q77	G18-L72 WeakPolarHBondContact O-CD1 3.4Å; I20-L72 HydrophobicContact CD1-CD2 3.78Å; I20-L72 HydrophobicContact CD1-CG 3.71Å; I20-L72 HydrophobicContact CG1-CD2 3.69Å; I20-L72 HydrophobicContact CG1-CG 4.05Å; K68-L72 WeakPolarHBondContact O-CG 3.37Å; K68-L72 PolarHBondContact O-N 3.15Å; K69-L72 PolarHBondContact O-N 3.1Å; L72-K74 VanDerWaalsContact C-N 3.25Å; L72-K74 PolarHBondContact O-N 3.18Å; L72-K75 PolarHBondContact O-N 3.01Å; L72-Q77 HydrophobicContact CD2-CG 4.05Å; L72-Q77 VanDerWaalsContact CD2-NE2 3.27Å
73	K	84.4	Confident	82.5	Confident	186 Å²	186	59.2 Å²	59.2	81%	0.809	29%	0.286	S	S	*	.	H	α-helix	trans	-59.4	-37.4	180	-174.7	178.8	179.4	-178.1	0	112.1	K69 I71	K69-K73 WeakPolarHBondContact O-CB 3.24Å; K69-K73 PolarHBondContact O-N 2.87Å; I71-K73 PolarHBondContact O-N 2.77Å
74	K	78.8	Confident	81.8	Confident	108 Å²	108	60.7 Å²	60.7	47%	0.47	29%	0.292	S	S	.	.	H	α-helix	trans	-90.5	-5.2	-178.8	-67.7	-179	173.4	-175	0	113.7	N45 Y46 S70 I71 L72 E76	N45-K74 PolarHBondContact O-NZ 2.91Å; Y46-K74 HydrophobicContact CD1-CD 3.72Å; Y46-K74 HydrophobicContact CE1-CB 3.89Å; Y46-K74 HydrophobicContact CE1-CD 3.29Å; Y46-K74 HydrophobicContact CE1-CG 4.2Å; S70-K74 PolarHBondContact O-N 3.06Å; I71-K74 PolarHBondContact O-N 3.1Å; L72-K74 VanDerWaalsContact C-N 3.25Å; L72-K74 PolarHBondContact O-N 3.18Å; K74-E76 HydrophobicContact CB-CG 3.82Å
75	K	82.3	Confident	81.3	Confident	172 Å²	172	61.4 Å²	61.4	75%	0.748	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	40.6	-177.9	-55.9	-178	-179.8	178.6	0	114.2	I71 L72 Q77	I71-K75 PolarHBondContact O-N 2.93Å; L72-K75 PolarHBondContact O-N 3.01Å; K75-Q77 PolarHBondContact O-OE1 2.92Å
76	E	77.9	Confident	80.7	Confident	43 Å²	43	60.9 Å²	60.9	20%	0.201	30%	0.298	C	S	.	.			trans	-107.3	19.2	-170.8	-67.6	-81.2	-169.6	0	0	113.2	Y46 I71 K74 S78 H79 I80	Y46-E76 HydrophobicContact CE1-CB 3.93Å; Y46-E76 HydrophobicContact CE1-CG 3.58Å; Y46-E76 WeakPolarHBondContact OH-CG 3.44Å; Y46-E76 PolarHBondContact OH-OE1 3.11Å; I71-E76 HydrophobicContact CG2-CB 4.22Å; I71-E76 PolarHBondContact O-N 2.86Å; I71-E76 VanDerWaalsContact O-N 3.15Å; K74-E76 HydrophobicContact CB-CG 3.82Å; E76-S78 VanDerWaalsContact C-N 3.26Å; E76-S78 PolarHBondContact O-N 3.26Å; E76-H79 PolarHBondContact O-N 2.84Å; E76-H79 IonicContact OE2-CE1 3.72Å; E76-H79 PolarHBondContact OE2-CE1 3.41Å; E76-H79 IonicContact OE2-CG 2.68Å; E76-H79 IonicContact OE2-ND1 2.68Å; E76-H79 PolarHBondContact OE2-ND1 3.49Å; E76-I80 PolarHBondContact O-N 3.45Å
77	Q	81.7	Confident	80.2	Confident	67 Å²	67	61.2 Å²	61.2	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-60	-38.3	-175.9	-58.9	91.4	-41.1	0	0	111.8	I20 I71 L72 K75 I80 M81	I20-Q77 HydrophobicContact CD1-CG 3.84Å; I20-Q77 HydrophobicContact CG1-CG 3.83Å; I71-Q77 HydrophobicContact CG2-CG 4.16Å; L72-Q77 HydrophobicContact CD2-CG 4.05Å; L72-Q77 VanDerWaalsContact CD2-NE2 3.27Å; K75-Q77 PolarHBondContact O-OE1 2.92Å; Q77-I80 PolarHBondContact O-N 2.68Å; Q77-M81 WeakPolarHBondContact O-CB 3.47Å; Q77-M81 VanDerWaalsContact O-CG 3.25Å; Q77-M81 WeakPolarHBondContact O-CG 3.39Å; Q77-M81 PolarHBondContact O-N 2.97Å
78	S	73.9	Confident	79.5	Confident	79 Å²	79	59.2 Å²	59.2	55%	0.552	29%	0.292	S	S	*	.	H	α-helix	trans	-62	-46.4	-179.1	47.9	0	0	0	0	112.3	E76 M81 A82	E76-S78 VanDerWaalsContact C-N 3.26Å; E76-S78 PolarHBondContact O-N 3.26Å; S78-M81 PolarHBondContact O-N 2.85Å; S78-A82 WeakPolarHBondContact O-CB 3.37Å; S78-A82 PolarHBondContact O-N 2.78Å
79	H	73.9	Confident	78.8	Confident	58 Å²	58	63.3 Å²	63.3	27%	0.269	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-42.5	179.8	-65.3	157.1	0	0	0	112	E76 M81 A82 E83	E76-H79 PolarHBondContact O-N 2.84Å; E76-H79 IonicContact OE2-CE1 3.72Å; E76-H79 PolarHBondContact OE2-CE1 3.41Å; E76-H79 IonicContact OE2-CG 2.68Å; E76-H79 IonicContact OE2-ND1 2.68Å; E76-H79 PolarHBondContact OE2-ND1 3.49Å; H79-M81 VanDerWaalsContact C-N 3.32Å; H79-M81 PolarHBondContact O-N 2.82Å; H79-A82 PolarHBondContact O-N 2.76Å; H79-E83 PolarHBondContact O-N 3.45Å
80	I	77.4	Confident	77.8	Confident	9 Å²	9	59.5 Å²	59.5	5%	0.046	30%	0.297	C	S	.	.	H	α-helix	trans	-65.2	-36.6	177.1	-61.4	-52.1	0	0	0	112.1	L66 I71 E76 Q77 R84 L109 F111	L66-I80 HydrophobicContact CD1-CD1 3.75Å; L66-I80 HydrophobicContact CD1-CG1 4.42Å; L66-I80 HydrophobicContact CD1-CG2 3.99Å; I71-I80 HydrophobicContact CD1-CG1 3.99Å; I71-I80 HydrophobicContact CD1-CG2 4.39Å; I71-I80 HydrophobicContact CG1-CG1 4.17Å; I71-I80 HydrophobicContact CG2-CG1 4.11Å; E76-I80 PolarHBondContact O-N 3.45Å; Q77-I80 PolarHBondContact O-N 2.68Å; I80-R84 PolarHBondContact O-N 3.3Å; I80-R84 VanDerWaalsContact O-N 3.1Å; I80-L109 HydrophobicContact CG2-CD1 3.64Å; I80-F111 HydrophobicContact CG2-CE2 4.34Å; I80-F111 HydrophobicContact CG2-CZ 4.31Å
81	M	75.6	Confident	77.2	Confident	68 Å²	68	58.7 Å²	58.7	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-72.8	-34	176.8	-68.1	-59.1	-70.9	0	0	112.2	L22 Q77 S78 H79 S85	L22-M81 HydrophobicContact CD2-SD 4.26Å; Q77-M81 WeakPolarHBondContact O-CB 3.47Å; Q77-M81 VanDerWaalsContact O-CG 3.25Å; Q77-M81 WeakPolarHBondContact O-CG 3.39Å; Q77-M81 PolarHBondContact O-N 2.97Å; S78-M81 PolarHBondContact O-N 2.85Å; H79-M81 VanDerWaalsContact C-N 3.32Å; H79-M81 PolarHBondContact O-N 2.82Å; M81-S85 VanDerWaalsContact O-CB 3.28Å; M81-S85 WeakPolarHBondContact O-CB 3.43Å; M81-S85 PolarHBondContact O-N 2.85Å
82	A	71.6	Confident	77.2	Confident	25 Å²	25	67 Å²	67	21%	0.207	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-48.7	171.7	0	0	0	0	0	111.3	S78 H79 R84 S85 V86	S78-A82 WeakPolarHBondContact O-CB 3.37Å; S78-A82 PolarHBondContact O-N 2.78Å; H79-A82 PolarHBondContact O-N 2.76Å; A82-R84 VanDerWaalsContact C-N 3.29Å; A82-R84 PolarHBondContact O-N 3.25Å; A82-S85 PolarHBondContact O-N 3.41Å; A82-S85 VanDerWaalsContact O-N 3.08Å; A82-V86 WeakPolarHBondContact O-CG2 3.4Å; A82-V86 PolarHBondContact O-N 3.01Å
83	E	77.8	Confident	77.6	Confident	4 Å²	4	65 Å²	65	2%	0.019	31%	0.311	C	S	.	.	H	α-helix	trans	-53.9	-48.3	175.7	-169.4	-179.3	179.1	0	0	111.1	K64 H79 S85 L87 F178	K64-E83 IonicContact NZ-OE1 2.81Å; K64-E83 PolarHBondContact NZ-OE1 3.49Å; K64-E83 IonicContact NZ-OE2 3.47Å; K64-E83 PolarHBondContact NZ-OE2 2.84Å; H79-E83 PolarHBondContact O-N 3.45Å; E83-S85 PolarHBondContact O-N 2.88Å; E83-L87 HydrophobicContact CG-CD1 3.96Å; E83-L87 WeakPolarHBondContact O-CB 3.48Å; E83-L87 VanDerWaalsContact O-CG 3.25Å; E83-L87 WeakPolarHBondContact O-CG 3.47Å; E83-L87 PolarHBondContact O-N 3.35Å; E83-F178 HydrophobicContact CG-CB 4.25Å
84	R	77.2	Confident	78.1	Confident	32 Å²	32	58 Å²	58	12%	0.121	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-47.5	176.7	176.3	173.9	175.1	-86	0.8	111.6	L22 P24 I80 A82 L87 L88 F111	L22-R84 PolarHBondContact O-NE 3.38Å; L22-R84 PolarHBondContact O-NH1 3.3Å; L22-R84 PolarHBondContact O-NH2 3.28Å; P24-R84 PolarHBondContact O-NH2 2.85Å; I80-R84 PolarHBondContact O-N 3.3Å; I80-R84 VanDerWaalsContact O-N 3.1Å; A82-R84 VanDerWaalsContact C-N 3.29Å; A82-R84 PolarHBondContact O-N 3.25Å; R84-L87 PolarHBondContact O-N 3.06Å; R84-L88 HydrophobicContact CG-CD1 3.55Å; R84-L88 HydrophobicContact CG-CG 3.99Å; R84-L88 VanDerWaalsContact NH2-CD1 3.3Å; R84-L88 VanDerWaalsContact O-CB 3.24Å; R84-L88 WeakPolarHBondContact O-CB 3.37Å; R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.38Å; R84-F111 HydrophobicContact CB-CE1 3.77Å; R84-F111 HydrophobicContact CB-CZ 3.88Å; R84-F111 HydrophobicContact CG-CE1 3.96Å
85	S	78.6	Confident	79	Confident	46 Å²	46	52.8 Å²	52.8	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-45.5	-175.5	173.5	0	0	0	0	111.3	M81 A82 E83 L88 K89 E183	M81-S85 VanDerWaalsContact O-CB 3.28Å; M81-S85 WeakPolarHBondContact O-CB 3.43Å; M81-S85 PolarHBondContact O-N 2.85Å; A82-S85 PolarHBondContact O-N 3.41Å; A82-S85 VanDerWaalsContact O-N 3.08Å; E83-S85 PolarHBondContact O-N 2.88Å; S85-L88 PolarHBondContact O-N 3.44Å; S85-K89 WeakPolarHBondContact O-CG 3.31Å; S85-K89 PolarHBondContact O-N 3.15Å; S85-K89 VanDerWaalsContact O-N 3.09Å; S85-E183 WeakPolarHBondContact CB-OE1 3.43Å; S85-E183 VanDerWaalsContact OG-CD 3.31Å; S85-E183 PolarHBondContact OG-OE1 2.84Å; S85-E183 PolarHBondContact OG-OE2 2.98Å
86	V	77.6	Confident	79.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-51.2	172.4	174.1	0	0	0	0	111.3	A82 L88 K89 V91 I155 F178 C181 E183	A82-V86 WeakPolarHBondContact O-CG2 3.4Å; A82-V86 PolarHBondContact O-N 3.01Å; V86-L88 PolarHBondContact O-N 3.37Å; V86-K89 PolarHBondContact O-N 2.93Å; V86-V91 HydrophobicContact CG1-CG2 4.47Å; V86-V91 VanDerWaalsContact O-CG2 3.3Å; V86-V91 WeakPolarHBondContact O-CG2 3.42Å; V86-I155 HydrophobicContact CG1-CD1 4.19Å; V86-I155 HydrophobicContact CG1-CG2 4.45Å; V86-I155 HydrophobicContact CG2-CD1 4.29Å; V86-I155 HydrophobicContact CG2-CG2 4.05Å; V86-F178 HydrophobicContact CB-CB 4.42Å; V86-F178 HydrophobicContact CG1-CB 4.09Å; V86-F178 HydrophobicContact CG1-CD1 3.95Å; V86-F178 HydrophobicContact CG1-CG 4.03Å; V86-C181 HydrophobicContact CG2-CB 3.85Å; V86-E183 HydrophobicContact CG2-CG 3.47Å; V86-E183 VanDerWaalsContact CG2-CG 3.47Å; V86-E183 PolarHBondContact N-OE1 3.19Å
87	L	78.1	Confident	80.3	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-30.1	179.9	-75.4	174.1	0	0	0	113	E83 R84 L99 L113 F178	E83-L87 HydrophobicContact CG-CD1 3.96Å; E83-L87 WeakPolarHBondContact O-CB 3.48Å; E83-L87 VanDerWaalsContact O-CG 3.25Å; E83-L87 WeakPolarHBondContact O-CG 3.47Å; E83-L87 PolarHBondContact O-N 3.35Å; R84-L87 PolarHBondContact O-N 3.06Å; L87-L99 HydrophobicContact CB-CB 3.86Å; L87-L99 HydrophobicContact CB-CD2 3.69Å; L87-L99 HydrophobicContact CB-CG 4.29Å; L87-L99 HydrophobicContact CD1-CD1 4.49Å; L87-L99 HydrophobicContact CD2-CB 4.16Å; L87-L99 HydrophobicContact CG-CB 4.45Å; L87-L113 HydrophobicContact CD1-CD2 4.02Å; L87-L113 HydrophobicContact CD2-CD2 4.02Å; L87-F178 HydrophobicContact CD2-CD2 3.44Å; L87-F178 VanDerWaalsContact CD2-CD2 3.44Å; L87-F178 HydrophobicContact CD2-CE2 3.61Å; L87-F178 HydrophobicContact CG-CD2 4.01Å
88	L	75.1	Confident	80.5	Confident	57 Å²	57	40.9 Å²	40.9	30%	0.298	21%	0.214	S	C	.	.	H	α-helix	trans	-82.9	-17	179.5	-76.8	-177.7	0	0	0	114.8	A26 R84 S85 V86 N90 L99	A26-L88 HydrophobicContact CB-CD2 3.28Å; R84-L88 HydrophobicContact CG-CD1 3.55Å; R84-L88 HydrophobicContact CG-CG 3.99Å; R84-L88 VanDerWaalsContact NH2-CD1 3.3Å; R84-L88 VanDerWaalsContact O-CB 3.24Å; R84-L88 WeakPolarHBondContact O-CB 3.37Å; R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.38Å; S85-L88 PolarHBondContact O-N 3.44Å; V86-L88 PolarHBondContact O-N 3.37Å; L88-N90 PolarHBondContact O-N 2.88Å; L88-L99 HydrophobicContact CD2-CD2 3.68Å; L88-L99 HydrophobicContact CG-CD2 4.11Å
89	K	73.4	Confident	81.1	Confident	101 Å²	101	38.6 Å²	38.6	44%	0.439	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	3.5	173.8	-81.3	179.4	165.5	177.6	0	113.5	S85 V86 V91 I155 E183	S85-K89 WeakPolarHBondContact O-CG 3.31Å; S85-K89 PolarHBondContact O-N 3.15Å; S85-K89 VanDerWaalsContact O-N 3.09Å; V86-K89 PolarHBondContact O-N 2.93Å; K89-V91 HydrophobicContact CB-CG2 4.24Å; K89-V91 PolarHBondContact O-N 2.91Å; K89-I155 HydrophobicContact CD-CD1 4.15Å; K89-E183 VanDerWaalsContact CD-OE2 3.27Å; K89-E183 WeakPolarHBondContact CD-OE2 3.18Å; K89-E183 WeakPolarHBondContact CE-OE2 3.33Å; K89-E183 IonicContact NZ-OE2 2.81Å; K89-E183 PolarHBondContact NZ-OE2 2.98Å
90	N	64.9	Low	81.7	Confident	89 Å²	89	42.2 Å²	42.2	48%	0.476	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	45.9	-179.9	177.7	60.2	0	0	0	109.6	L88 R92	L88-N90 PolarHBondContact O-N 2.88Å; N90-R92 VanDerWaalsContact CG-NE 3.32Å; N90-R92 VanDerWaalsContact ND2-CZ 3.34Å; N90-R92 PolarHBondContact ND2-NE 3.19Å; N90-R92 PolarHBondContact ND2-NH2 3.46Å; N90-R92 WeakPolarHBondContact O-CG 3.26Å; N90-R92 PolarHBondContact O-N 3Å; N90-R92 PolarHBondContact OD1-NE 3.28Å; N90-R92 PolarHBondContact OD1-NH2 2.93Å
91	V	73	Confident	82	Confident	19 Å²	19	43.2 Å²	43.2	12%	0.115	21%	0.21	C	C	.	.			trans	-52.6	105.3	171	172.4	0	0	0	0	107	V86 K89 L96 Y149 L150 L153	V86-V91 HydrophobicContact CG1-CG2 4.47Å; V86-V91 VanDerWaalsContact O-CG2 3.3Å; V86-V91 WeakPolarHBondContact O-CG2 3.42Å; K89-V91 HydrophobicContact CB-CG2 4.24Å; K89-V91 PolarHBondContact O-N 2.91Å; V91-L96 HydrophobicContact CG1-CB 4.16Å; V91-L96 HydrophobicContact CG1-CD1 3.23Å; V91-L96 HydrophobicContact CG1-CG 4.3Å; V91-Y149 HydrophobicContact CB-CE1 4.35Å; V91-Y149 HydrophobicContact CG1-CD1 4.2Å; V91-Y149 HydrophobicContact CG1-CE1 3.63Å; V91-L150 HydrophobicContact CG1-CD2 4.21Å; V91-L153 HydrophobicContact CG2-CD1 4.33Å
92	R	83.3	Confident	82.5	Confident	175 Å²	175	40 Å²	40	66%	0.66	19%	0.194	S	C	*	.			trans	-111.3	86.3	-176.8	-79.9	179.6	-171.8	-175.5	6.2	108.5	N90 Y149	N90-R92 VanDerWaalsContact CG-NE 3.32Å; N90-R92 VanDerWaalsContact ND2-CZ 3.34Å; N90-R92 PolarHBondContact ND2-NE 3.19Å; N90-R92 PolarHBondContact ND2-NH2 3.46Å; N90-R92 WeakPolarHBondContact O-CG 3.26Å; N90-R92 PolarHBondContact O-N 3Å; N90-R92 PolarHBondContact OD1-NE 3.28Å; N90-R92 PolarHBondContact OD1-NH2 2.93Å; R92-Y149 PolarHBondContact N-OH 3.32Å; R92-Y149 VanDerWaalsContact N-OH 3.15Å
93	H	93.7	Very high	83.2	Confident	14 Å²	14	39.1 Å²	39.1	7%	0.065	19%	0.185	C	C	.	.			trans	-133.5	136.5	174.7	-164.2	-88.4	0	0	0	109.7	F95 L96 S145 Y149 Y301	H93-F95 AromaticContact CE1-CD2 3.52Å; H93-F95 AromaticContact ND1-CD2 3.99Å; H93-F95 PolarHBondContact ND1-N 3.22Å; H93-F95 PolarHBondContact O-N 2.64Å; H93-L96 HydrophobicContact CB-CB 4.1Å; H93-L96 HydrophobicContact CB-CD1 3.66Å; H93-L96 HydrophobicContact CB-CG 3.81Å; H93-L96 PolarHBondContact O-N 3.09Å; H93-L96 VanDerWaalsContact O-N 3.15Å; H93-S145 PolarHBondContact CE1-OG 2.92Å; H93-S145 PolarHBondContact NE2-O 3.15Å; H93-S145 PolarHBondContact NE2-OG 3.27Å; H93-Y149 HydrophobicContact CB-CD1 3.65Å; H93-Y149 HydrophobicContact CB-CE1 3.9Å; H93-Y149 HydrophobicContact CB-CG 4.15Å; H93-Y149 VanDerWaalsContact CD2-CB 3.44Å; H93-Y149 WeakPolarHBondContact CD2-CB 3.35Å; H93-Y149 AromaticContact CD2-CD1 3.97Å; H93-Y149 AromaticContact CD2-CG 3.55Å; H93-Y301 AromaticContact CD2-CE2 3.59Å; H93-Y301 AromaticContact NE2-CD2 3.65Å; H93-Y301 AromaticContact NE2-CE2 3.54Å
94	P	95.2	Very high	83.6	Confident	39 Å²	39	41.2 Å²	41.2	25%	0.253	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.2	-177	24.6	-39.1	0	0	0	114.8	Y301 K303	P94-Y301 HydrophobicContact CG-CD2 4.11Å; P94-Y301 HydrophobicContact CG-CE2 4.2Å; P94-Y301 VanDerWaalsContact CG-O 3.29Å; P94-Y301 WeakPolarHBondContact CG-O 3.41Å; P94-K303 HydrophobicContact CB-CD 4.43Å; P94-K303 HydrophobicContact CB-CG 4.29Å; P94-K303 VanDerWaalsContact O-CE 3.29Å; P94-K303 WeakPolarHBondContact O-CE 3.42Å; P94-K303 PolarHBondContact O-NZ 3.45Å
95	F	97.2	Very high	84.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	16.5	-176.5	-47.7	-47.2	0	0	0	113.6	H93 E142 A146 H172 V173 V174 L175 L300 K303	H93-F95 AromaticContact CE1-CD2 3.52Å; H93-F95 AromaticContact ND1-CD2 3.99Å; H93-F95 PolarHBondContact ND1-N 3.22Å; H93-F95 PolarHBondContact O-N 2.64Å; F95-E142 HydrophobicContact CD1-CB 4.25Å; F95-E142 HydrophobicContact CD1-CG 4.35Å; F95-E142 HydrophobicContact CD2-CB 3.76Å; F95-E142 HydrophobicContact CD2-CG 4.19Å; F95-E142 WeakPolarHBondContact CD2-O 3.41Å; F95-E142 HydrophobicContact CE1-CB 4.28Å; F95-E142 HydrophobicContact CE1-CG 3.89Å; F95-E142 WeakPolarHBondContact CE1-OE1 3.28Å; F95-E142 HydrophobicContact CE2-CB 3.85Å; F95-E142 HydrophobicContact CE2-CG 3.78Å; F95-E142 HydrophobicContact CG-CB 4Å; F95-E142 HydrophobicContact CG-CG 4.49Å; F95-E142 HydrophobicContact CZ-CB 4.1Å; F95-E142 HydrophobicContact CZ-CG 3.6Å; F95-E142 WeakPolarHBondContact CZ-OE1 3.42Å; F95-A146 HydrophobicContact CB-CB 4.06Å; F95-H172 HydrophobicContact CD1-CB 4.44Å; F95-H172 HydrophobicContact CE1-CB 4.21Å; F95-V173 WeakPolarHBondContact CA-O 3.27Å; F95-V173 WeakPolarHBondContact CB-O 3.15Å; F95-V173 WeakPolarHBondContact CD1-O 3.29Å; F95-V174 WeakPolarHBondContact O-CA 3.26Å; F95-L175 PolarHBondContact O-N 2.9Å; F95-L300 HydrophobicContact CE2-CD2 4.4Å; F95-L300 HydrophobicContact CE2-CG 4.11Å; F95-L300 HydrophobicContact CZ-CG 4.18Å; F95-L300 VanDerWaalsContact CZ-O 3.26Å; F95-L300 WeakPolarHBondContact CZ-O 3.15Å; F95-K303 HydrophobicContact CE1-CD 4.43Å; F95-K303 HydrophobicContact CE1-CG 3.95Å; F95-K303 HydrophobicContact CZ-CG 4.4Å
96	L	94.6	Very high	84.5	Confident	11 Å²	11	44.2 Å²	44.2	6%	0.058	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-119	138.6	173.9	-65	179.3	0	0	0	109.3	V91 H93 G98 A146 Y149 L150 L175 F178	V91-L96 HydrophobicContact CG1-CB 4.16Å; V91-L96 HydrophobicContact CG1-CD1 3.23Å; V91-L96 HydrophobicContact CG1-CG 4.3Å; H93-L96 HydrophobicContact CB-CB 4.1Å; H93-L96 HydrophobicContact CB-CD1 3.66Å; H93-L96 HydrophobicContact CB-CG 3.81Å; H93-L96 PolarHBondContact O-N 3.09Å; H93-L96 VanDerWaalsContact O-N 3.15Å; L96-G98 PolarHBondContact O-N 3.26Å; L96-A146 HydrophobicContact CD2-CB 3.62Å; L96-A146 HydrophobicContact CG-CB 3.98Å; L96-Y149 HydrophobicContact CD1-CD1 3.73Å; L96-Y149 HydrophobicContact CD1-CE1 4.25Å; L96-L150 HydrophobicContact CD1-CD1 4.46Å; L96-L150 HydrophobicContact CD1-CD2 3.83Å; L96-L150 HydrophobicContact CD1-CG 3.93Å; L96-L150 HydrophobicContact CD2-CD1 4.28Å; L96-L175 HydrophobicContact CD2-CB 3.74Å; L96-L175 HydrophobicContact CD2-CD1 3.86Å; L96-L175 HydrophobicContact CD2-CG 4.06Å; L96-F178 HydrophobicContact CB-CZ 4.26Å; L96-F178 HydrophobicContact CD2-CE1 4.09Å; L96-F178 HydrophobicContact CD2-CZ 4.08Å
97	V	91.6	Very high	85	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.042	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-66.7	131.3	177.2	69.1	0	0	0	0	110.7	L113 D114 V174 L175 F178	V97-L113 HydrophobicContact CG2-CB 4.04Å; V97-D114 HydrophobicContact CG2-CB 4.11Å; V97-V174 HydrophobicContact CB-CG1 3.88Å; V97-L175 WeakPolarHBondContact CB-O 3.18Å; V97-L175 WeakPolarHBondContact CG1-O 3.33Å; V97-L175 PolarHBondContact N-O 3.23Å; V97-F178 HydrophobicContact CG1-CD2 4.39Å; V97-F178 HydrophobicContact CG1-CE2 3.53Å; V97-F178 HydrophobicContact CG1-CZ 4.27Å
98	G	86.2	Confident	85.5	Confident	14 Å²	14	52.5 Å²	52.5	14%	0.144	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-87.1	138.1	179.2	0	0	0	0	0	113	L96 L113 D114	L96-G98 PolarHBondContact O-N 3.26Å; G98-L113 WeakPolarHBondContact O-CA 3.36Å; G98-D114 WeakPolarHBondContact CA-OD2 3.44Å; G98-D114 PolarHBondContact N-OD2 2.78Å; G98-D114 PolarHBondContact O-N 3.16Å
99	L	86.8	Confident	86.2	Confident	31 Å²	31	49.8 Å²	49.8	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125	163.8	179.9	71.4	0	0	0	110.1	L87 L88 Y101 F111 L113	L87-L99 HydrophobicContact CB-CB 3.86Å; L87-L99 HydrophobicContact CB-CD2 3.69Å; L87-L99 HydrophobicContact CB-CG 4.29Å; L87-L99 HydrophobicContact CD1-CD1 4.49Å; L87-L99 HydrophobicContact CD2-CB 4.16Å; L87-L99 HydrophobicContact CG-CB 4.45Å; L88-L99 HydrophobicContact CD2-CD2 3.68Å; L88-L99 HydrophobicContact CG-CD2 4.11Å; L99-Y101 VanDerWaalsContact CD1-O 3.25Å; L99-Y101 WeakPolarHBondContact CD1-O 3.43Å; L99-F111 HydrophobicContact CD1-CB 3.96Å; L99-F111 HydrophobicContact CD1-CD1 4.2Å; L99-L113 HydrophobicContact CB-CD2 4.18Å; L99-L113 HydrophobicContact CD1-CD2 3.89Å
100	R	85.9	Confident	86.9	Confident	134 Å²	134	45.8 Å²	45.8	51%	0.506	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-41.7	-178.7	-59.5	-64.6	-176.2	-173.1	-6.9	112.3	Y61 V112 D114	Y61-R100 HydrophobicContact CD1-CB 4.48Å; Y61-R100 HydrophobicContact CD1-CG 4.25Å; Y61-R100 HydrophobicContact CE1-CB 4.12Å; Y61-R100 HydrophobicContact CE1-CG 3.88Å; R100-V112 PolarHBondContact N-O 2.8Å; R100-D114 IonicContact CZ-OD1 4Å; R100-D114 VanDerWaalsContact CZ-OD1 3.25Å; R100-D114 IonicContact CZ-OD2 2.78Å; R100-D114 IonicContact NE-OD1 3.68Å; R100-D114 PolarHBondContact NE-OD1 2.75Å; R100-D114 IonicContact NE-OD2 3.1Å; R100-D114 PolarHBondContact NE-OD2 2.87Å; R100-D114 VanDerWaalsContact NH2-CG 3.27Å; R100-D114 IonicContact NH2-OD1 3.29Å; R100-D114 PolarHBondContact NH2-OD1 3.46Å; R100-D114 IonicContact NH2-OD2 4Å; R100-D114 PolarHBondContact NH2-OD2 2.78Å
101	Y	85.6	Confident	88	Confident	30 Å²	30	41.6 Å²	41.6	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147.1	178	-45.8	-84.3	0	0	0	110.1	N27 A30 F35 R54 Y61 L99 V112	N27-Y101 HydrophobicContact CB-CD1 4.12Å; A30-Y101 HydrophobicContact CB-CD1 3.93Å; A30-Y101 HydrophobicContact CB-CG 4.15Å; F35-Y101 AromaticContact CZ-CD2 4Å; F35-Y101 HydrophobicContact CZ-CD2 4Å; F35-Y101 HydrophobicContact CZ-CE2 4.43Å; R54-Y101 PolarHBondContact NH1-OH 2.89Å; Y61-Y101 HydrophobicContact CE1-CE2 4.25Å; L99-Y101 VanDerWaalsContact CD1-O 3.25Å; L99-Y101 WeakPolarHBondContact CD1-O 3.43Å; Y101-V112 HydrophobicContact CD2-CB 3.82Å; Y101-V112 HydrophobicContact CD2-CG1 3.69Å; Y101-V112 HydrophobicContact CD2-CG2 4.33Å; Y101-V112 HydrophobicContact CE2-CG1 4.44Å; Y101-V112 HydrophobicContact CG-CB 4.36Å; Y101-V112 PolarHBondContact N-O 3.43Å; Y101-V112 PolarHBondContact O-N 3.12Å
102	S	85.6	Confident	88.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	127.1	168	70.4	0	0	0	0	109.8	S25 A26 Y110	S25-S102 WeakPolarHBondContact CB-O 3.35Å; A26-S102 PolarHBondContact N-OG 2.84Å; A26-S102 PolarHBondContact O-N 2.81Å; S102-Y110 WeakPolarHBondContact CA-O 3.39Å
103	F	86.3	Confident	89.1	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	173.3	178.4	53.8	-94.9	0	0	0	110.9	A30 P32 F35 Y110 V112	A30-F103 HydrophobicContact CB-CD1 3.79Å; A30-F103 HydrophobicContact CB-CE1 4.08Å; A30-F103 WeakPolarHBondContact O-CB 3.18Å; A30-F103 WeakPolarHBondContact O-CD1 3.43Å; A30-F103 WeakPolarHBondContact O-CG 3.45Å; P32-F103 HydrophobicContact CB-CE2 4.33Å; P32-F103 HydrophobicContact CG-CD2 4.28Å; P32-F103 HydrophobicContact CG-CE2 3.72Å; F35-F103 HydrophobicContact CD2-CE1 4.48Å; F35-F103 HydrophobicContact CD2-CZ 4.21Å; F35-F103 AromaticContact CE2-CE1 3.76Å; F35-F103 HydrophobicContact CE2-CE1 3.76Å; F35-F103 AromaticContact CE2-CZ 3.94Å; F35-F103 HydrophobicContact CE2-CZ 3.94Å; F35-F103 HydrophobicContact CZ-CE1 4.42Å; F103-Y110 HydrophobicContact CD2-CD1 4.49Å; F103-Y110 AromaticContact CD2-CD2 3.62Å; F103-Y110 HydrophobicContact CD2-CD2 3.62Å; F103-Y110 HydrophobicContact CD2-CE2 4.44Å; F103-Y110 AromaticContact CD2-CG 3.67Å; F103-Y110 HydrophobicContact CD2-CG 3.67Å; F103-Y110 AromaticContact CE2-CD1 3.64Å; F103-Y110 HydrophobicContact CE2-CD1 3.64Å; F103-Y110 AromaticContact CE2-CD2 3.56Å; F103-Y110 HydrophobicContact CE2-CD2 3.56Å; F103-Y110 HydrophobicContact CE2-CE1 4.32Å; F103-Y110 HydrophobicContact CE2-CE2 4.26Å; F103-Y110 AromaticContact CE2-CG 3.22Å; F103-Y110 HydrophobicContact CE2-CG 3.22Å; F103-Y110 HydrophobicContact CZ-CD1 4.14Å; F103-Y110 AromaticContact CZ-CG 3.94Å; F103-Y110 HydrophobicContact CZ-CG 3.94Å; F103-Y110 PolarHBondContact N-O 2.96Å; F103-Y110 VanDerWaalsContact N-O 3.1Å; F103-Y110 PolarHBondContact O-N 3.24Å; F103-V112 HydrophobicContact CD1-CG2 4.49Å; F103-V112 HydrophobicContact CE1-CG2 3.58Å; F103-V112 HydrophobicContact CZ-CG2 4.11Å
104	Q	86.9	Confident	88.9	Confident	49 Å²	49	34.4 Å²	34.4	23%	0.229	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	153.8	-176.7	57.8	-179.8	-42.3	0	0	111.5	N21 L22 K108 L109	N21-Q104 PolarHBondContact OD1-NE2 3.44Å; L22-Q104 HydrophobicContact CD1-CB 3.97Å; L22-Q104 HydrophobicContact CD1-CG 4.41Å; L22-Q104 HydrophobicContact CG-CB 4.3Å; L22-Q104 HydrophobicContact CG-CG 4.5Å; Q104-K108 CarbonylContact C-O 3.51Å; Q104-K108 VanDerWaalsContact CA-O 3.32Å; Q104-K108 WeakPolarHBondContact CA-O 3.33Å; Q104-K108 WeakPolarHBondContact CB-O 3.38Å; Q104-L109 HydrophobicContact CB-CD2 3.79Å
105	T	86.8	Confident	88.7	Confident	34 Å²	34	35.8 Å²	35.8	21%	0.209	18%	0.175	C	C	.	.			trans	-111.4	176.7	164.1	71.1	0	0	0	0	108.7	P32 K68 E107 K108 Y110	P32-T105 HydrophobicContact CG-CG2 4.06Å; K68-T105 WeakPolarHBondContact CE-O 3.45Å; K68-T105 PolarHBondContact NZ-O 2.92Å; T105-E107 PolarHBondContact O-N 2.93Å; T105-E107 VanDerWaalsContact O-N 3.15Å; T105-E107 PolarHBondContact OG1-N 3.32Å; T105-E107 PolarHBondContact OG1-OE2 3.23Å; T105-K108 PolarHBondContact N-O 3.08Å; T105-K108 PolarHBondContact OG1-N 2.65Å; T105-Y110 HydrophobicContact CG2-CE2 3.84Å
106	P	86.9	Confident	88.4	Confident	106 Å²	106	36.8 Å²	36.8	69%	0.688	18%	0.181	S	C	*	.	S	Bend	trans	-57.2	-27.9	174.9	-24	34.5	0	0	0	113.2	K68	K68-P106 WeakPolarHBondContact CD-O 3.32Å
107	E	88.1	Confident	88	Confident	105 Å²	105	37.5 Å²	37.5	49%	0.491	19%	0.185	S	C	.	.	S	Bend	trans	-104.4	-23.7	-176	-53.1	72.4	-156.7	0	0	114.6	K68 T105	K68-E107 WeakPolarHBondContact CB-O 3.45Å; K68-E107 PolarHBondContact N-O 2.88Å; T105-E107 PolarHBondContact O-N 2.93Å; T105-E107 VanDerWaalsContact O-N 3.15Å; T105-E107 PolarHBondContact OG1-N 3.32Å; T105-E107 PolarHBondContact OG1-OE2 3.23Å
108	K	89.4	Confident	87.9	Confident	82 Å²	82	37.2 Å²	37.2	36%	0.357	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.9	-165.6	-65	172.8	-173.3	169.9	0	113.4	V65 L66 Q104 T105 Y110	V65-K108 HydrophobicContact CG1-CB 4.39Å; V65-K108 HydrophobicContact CG1-CD 3.95Å; V65-K108 HydrophobicContact CG1-CG 4.44Å; L66-K108 CarbonylContact O-C 3.53Å; L66-K108 VanDerWaalsContact O-CA 3.23Å; L66-K108 WeakPolarHBondContact O-CA 3.39Å; Q104-K108 CarbonylContact C-O 3.51Å; Q104-K108 VanDerWaalsContact CA-O 3.32Å; Q104-K108 WeakPolarHBondContact CA-O 3.33Å; Q104-K108 WeakPolarHBondContact CB-O 3.38Å; T105-K108 PolarHBondContact N-O 3.08Å; T105-K108 PolarHBondContact OG1-N 2.65Å; K108-Y110 HydrophobicContact CB-CD2 4.39Å; K108-Y110 HydrophobicContact CB-CE2 3.57Å; K108-Y110 WeakPolarHBondContact CD-OH 3.33Å
109	L	87.9	Confident	88	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145.2	169.2	-53	180	0	0	0	109.5	I20 L22 V65 L66 K68 I71 I80 Q104	I20-L109 HydrophobicContact CG2-CD1 4Å; I20-L109 HydrophobicContact CG2-CD2 4.4Å; L22-L109 HydrophobicContact CD1-CB 4.49Å; L22-L109 HydrophobicContact CD1-CD2 3.82Å; L22-L109 HydrophobicContact CD2-CD1 3.78Å; L22-L109 HydrophobicContact CD2-CD2 3.62Å; L22-L109 HydrophobicContact CD2-CG 4.21Å; L22-L109 HydrophobicContact CG-CD2 3.51Å; V65-L109 WeakPolarHBondContact CA-O 3.39Å; L66-L109 HydrophobicContact CB-CB 4.24Å; L66-L109 PolarHBondContact N-O 2.63Å; L66-L109 PolarHBondContact O-N 3.32Å; K68-L109 HydrophobicContact CD-CD2 4.33Å; K68-L109 HydrophobicContact CG-CD2 4.15Å; K68-L109 HydrophobicContact CG-CG 4.1Å; I71-L109 HydrophobicContact CD1-CD1 3.86Å; I80-L109 HydrophobicContact CG2-CD1 3.64Å; Q104-L109 HydrophobicContact CB-CD2 3.79Å
110	Y	88.8	Confident	88.3	Confident	17 Å²	17	39.1 Å²	39.1	7%	0.067	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.2	-179.5	-60.4	-102.2	0	0	0	109.8	P32 F37 V63 K64 V65 S102 F103 T105 K108	P32-Y110 HydrophobicContact CB-CE1 4.43Å; P32-Y110 HydrophobicContact CG-CE1 4.3Å; P32-Y110 HydrophobicContact CG-CE2 4.14Å; F37-Y110 HydrophobicContact CZ-CE1 4.46Å; V63-Y110 HydrophobicContact CG1-CD1 4.05Å; K64-Y110 WeakPolarHBondContact O-CA 3.25Å; V65-Y110 HydrophobicContact CB-CD1 4.44Å; V65-Y110 HydrophobicContact CB-CE1 4.4Å; V65-Y110 HydrophobicContact CG1-CD1 4.16Å; V65-Y110 HydrophobicContact CG1-CE1 3.75Å; V65-Y110 HydrophobicContact CG2-CD1 3.72Å; V65-Y110 HydrophobicContact CG2-CE1 3.79Å; S102-Y110 WeakPolarHBondContact CA-O 3.39Å; F103-Y110 HydrophobicContact CD2-CD1 4.49Å; F103-Y110 AromaticContact CD2-CD2 3.62Å; F103-Y110 HydrophobicContact CD2-CD2 3.62Å; F103-Y110 HydrophobicContact CD2-CE2 4.44Å; F103-Y110 AromaticContact CD2-CG 3.67Å; F103-Y110 HydrophobicContact CD2-CG 3.67Å; F103-Y110 AromaticContact CE2-CD1 3.64Å; F103-Y110 HydrophobicContact CE2-CD1 3.64Å; F103-Y110 AromaticContact CE2-CD2 3.56Å; F103-Y110 HydrophobicContact CE2-CD2 3.56Å; F103-Y110 HydrophobicContact CE2-CE1 4.32Å; F103-Y110 HydrophobicContact CE2-CE2 4.26Å; F103-Y110 AromaticContact CE2-CG 3.22Å; F103-Y110 HydrophobicContact CE2-CG 3.22Å; F103-Y110 HydrophobicContact CZ-CD1 4.14Å; F103-Y110 AromaticContact CZ-CG 3.94Å; F103-Y110 HydrophobicContact CZ-CG 3.94Å; F103-Y110 PolarHBondContact N-O 2.96Å; F103-Y110 VanDerWaalsContact N-O 3.1Å; F103-Y110 PolarHBondContact O-N 3.24Å; T105-Y110 HydrophobicContact CG2-CE2 3.84Å; K108-Y110 HydrophobicContact CB-CD2 4.39Å; K108-Y110 HydrophobicContact CB-CE2 3.57Å; K108-Y110 WeakPolarHBondContact CD-OH 3.33Å
111	F	87.9	Confident	88.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.5	166.2	-56.5	-65.5	0	0	0	108.3	V63 K64 L66 I80 R84 L99	V63-F111 CarbonylContact C-O 3.49Å; V63-F111 WeakPolarHBondContact CA-O 3.29Å; K64-F111 HydrophobicContact CB-CB 4.26Å; K64-F111 HydrophobicContact CB-CD2 4.5Å; K64-F111 HydrophobicContact CD-CD2 4.45Å; K64-F111 PolarHBondContact N-O 3.43Å; K64-F111 PolarHBondContact O-N 2.89Å; L66-F111 HydrophobicContact CD1-CD2 4.01Å; L66-F111 HydrophobicContact CD1-CE2 3.52Å; I80-F111 HydrophobicContact CG2-CE2 4.34Å; I80-F111 HydrophobicContact CG2-CZ 4.31Å; R84-F111 HydrophobicContact CB-CE1 3.77Å; R84-F111 HydrophobicContact CB-CZ 3.88Å; R84-F111 HydrophobicContact CG-CE1 3.96Å; L99-F111 HydrophobicContact CD1-CB 3.96Å; L99-F111 HydrophobicContact CD1-CD1 4.2Å
112	V	89.9	Confident	89	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	107.1	177.2	-173.8	0	0	0	0	108.1	F35 Y61 V63 R100 Y101 F103	F35-V112 HydrophobicContact CE1-CG1 3.84Å; F35-V112 HydrophobicContact CE1-CG2 4.35Å; F35-V112 HydrophobicContact CE2-CG2 4.33Å; F35-V112 HydrophobicContact CZ-CG1 4.09Å; F35-V112 HydrophobicContact CZ-CG2 3.94Å; Y61-V112 HydrophobicContact CD1-CG1 3.77Å; Y61-V112 HydrophobicContact CD2-CG1 4.27Å; Y61-V112 HydrophobicContact CG-CG1 3.58Å; V63-V112 HydrophobicContact CG1-CG2 4.24Å; V63-V112 HydrophobicContact CG2-CG1 4.24Å; V63-V112 HydrophobicContact CG2-CG2 4.22Å; R100-V112 PolarHBondContact N-O 2.8Å; Y101-V112 HydrophobicContact CD2-CB 3.82Å; Y101-V112 HydrophobicContact CD2-CG1 3.69Å; Y101-V112 HydrophobicContact CD2-CG2 4.33Å; Y101-V112 HydrophobicContact CE2-CG1 4.44Å; Y101-V112 HydrophobicContact CG-CB 4.36Å; Y101-V112 PolarHBondContact N-O 3.43Å; Y101-V112 PolarHBondContact O-N 3.12Å; F103-V112 HydrophobicContact CD1-CG2 4.49Å; F103-V112 HydrophobicContact CE1-CG2 3.58Å; F103-V112 HydrophobicContact CZ-CG2 4.11Å
113	L	90.3	Very high	89.2	Confident	11 Å²	11	35.9 Å²	35.9	6%	0.058	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	160.3	-174.4	-57.8	169.5	0	0	0	110.6	A62 L87 V97 G98 L99 Y115	A62-L113 HydrophobicContact CB-CB 4.42Å; A62-L113 PolarHBondContact N-O 3.2Å; A62-L113 WeakPolarHBondContact O-CB 3.48Å; A62-L113 PolarHBondContact O-N 2.97Å; L87-L113 HydrophobicContact CD1-CD2 4.02Å; L87-L113 HydrophobicContact CD2-CD2 4.02Å; V97-L113 HydrophobicContact CG2-CB 4.04Å; G98-L113 WeakPolarHBondContact O-CA 3.36Å; L99-L113 HydrophobicContact CB-CD2 4.18Å; L99-L113 HydrophobicContact CD1-CD2 3.89Å; L113-Y115 PolarHBondContact O-N 3.16Å
114	D	90	Very high	89.5	Confident	46 Å²	46	35.7 Å²	35.7	25%	0.246	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	134.5	167.3	-73.1	-35.3	0	0	0	111.3	V97 G98 R100	V97-D114 HydrophobicContact CG2-CB 4.11Å; G98-D114 WeakPolarHBondContact CA-OD2 3.44Å; G98-D114 PolarHBondContact N-OD2 2.78Å; G98-D114 PolarHBondContact O-N 3.16Å; R100-D114 IonicContact CZ-OD1 4Å; R100-D114 VanDerWaalsContact CZ-OD1 3.25Å; R100-D114 IonicContact CZ-OD2 2.78Å; R100-D114 IonicContact NE-OD1 3.68Å; R100-D114 PolarHBondContact NE-OD1 2.75Å; R100-D114 IonicContact NE-OD2 3.1Å; R100-D114 PolarHBondContact NE-OD2 2.87Å; R100-D114 VanDerWaalsContact NH2-CG 3.27Å; R100-D114 IonicContact NH2-OD1 3.29Å; R100-D114 PolarHBondContact NH2-OD1 3.46Å; R100-D114 IonicContact NH2-OD2 4Å; R100-D114 PolarHBondContact NH2-OD2 2.78Å
115	Y	90.8	Very high	89.7	Confident	68 Å²	68	33.4 Å²	33.4	27%	0.267	17%	0.17	S	C	.	.			trans	-83.9	117.9	174.9	178.6	-126.6	0	0	0	110.6	I41 L51 F60 A62 L113 N117	I41-Y115 HydrophobicContact CD1-CD2 4.2Å; I41-Y115 HydrophobicContact CD1-CE2 4.04Å; L51-Y115 HydrophobicContact CD1-CD1 3.81Å; L51-Y115 HydrophobicContact CD1-CD2 3.81Å; L51-Y115 HydrophobicContact CD1-CE1 3.82Å; L51-Y115 HydrophobicContact CD1-CE2 3.86Å; L51-Y115 HydrophobicContact CD1-CG 3.81Å; F60-Y115 HydrophobicContact CB-CD1 4.01Å; A62-Y115 HydrophobicContact CB-CD2 4.49Å; L113-Y115 PolarHBondContact O-N 3.16Å; Y115-N117 HydrophobicContact CD1-CB 4.25Å; Y115-N117 HydrophobicContact CE1-CB 3.6Å
116	V	90	Very high	89.8	Confident	22 Å²	22	33 Å²	33	13%	0.133	17%	0.166	C	C	.	.			trans	-106.9	116.9	178.5	-169.9	0	0	0	0	108.7	L166 L167 D168 V174	V116-L166 HydrophobicContact CB-CB 4.17Å; V116-L166 HydrophobicContact CB-CD1 3.84Å; V116-L166 HydrophobicContact CG1-CB 3.63Å; V116-L166 HydrophobicContact CG1-CD1 4.25Å; V116-L166 HydrophobicContact CG2-CD1 4.35Å; V116-L167 WeakPolarHBondContact CG1-O 3.3Å; V116-D168 HydrophobicContact CG1-CB 4.28Å; V116-V174 HydrophobicContact CG1-CB 4.21Å; V116-V174 HydrophobicContact CG1-CG2 4.13Å; V116-V174 HydrophobicContact CG2-CB 4.12Å; V116-V174 HydrophobicContact CG2-CG1 3.91Å; V116-V174 HydrophobicContact CG2-CG2 4.3Å
117	N	86.9	Confident	90	Very high	26 Å²	26	34 Å²	34	14%	0.139	16%	0.156	C	C	.	.			trans	-109.9	-3.2	-163.7	69	-19.2	0	0	0	115.5	Y115 G119 C169 V313 D314	Y115-N117 HydrophobicContact CD1-CB 4.25Å; Y115-N117 HydrophobicContact CE1-CB 3.6Å; N117-G119 VanDerWaalsContact C-N 3.27Å; N117-G119 PolarHBondContact O-N 2.86Å; N117-C169 WeakPolarHBondContact OD1-CA 3.25Å; N117-C169 VanDerWaalsContact OD1-CB 3.29Å; N117-C169 WeakPolarHBondContact OD1-CB 3.49Å; N117-C169 PolarHBondContact OD1-N 3.47Å; N117-V313 HydrophobicContact CB-CG2 4.49Å; N117-V313 WeakPolarHBondContact ND2-CG2 3.44Å; N117-V313 WeakPolarHBondContact OD1-CG2 3.25Å; N117-D314 PolarHBondContact ND2-O 3.42Å
118	G	88.6	Confident	90.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-80.5	-5.4	177	0	0	0	0	0	114	H124 L167	G118-H124 PolarHBondContact O-CE1 2.91Å; G118-H124 PolarHBondContact O-NE2 2.83Å; G118-L167 CarbonylContact C-O 3.54Å; G118-L167 WeakPolarHBondContact CA-O 3.25Å; G118-L167 PolarHBondContact N-O 2.81Å
119	G	89.8	Confident	90.4	Very high	15 Å²	15	37.2 Å²	37.2	16%	0.155	16%	0.164	C	C	.	.			trans	83.8	175	175.3	0	0	0	0	0	114.2	N117 L166 L167	N117-G119 VanDerWaalsContact C-N 3.27Å; N117-G119 PolarHBondContact O-N 2.86Å; G119-L166 CarbonylContact O-C 3.57Å; G119-L166 WeakPolarHBondContact O-CA 3.31Å; G119-L167 PolarHBondContact O-N 2.93Å
120	E	91.5	Very high	90.7	Very high	71 Å²	71	43.8 Å²	43.8	33%	0.332	19%	0.189	S	C	.	.	B	Isolated β-bridge	trans	-70.2	140.9	-179.2	-64	160.1	-156.6	0	0	111.7	F122 F123 H124 L166	E120-F122 HydrophobicContact CB-CB 4.3Å; E120-F122 PolarHBondContact O-N 3.33Å; E120-F123 WeakPolarHBondContact O-CB 3.34Å; E120-F123 PolarHBondContact O-N 3.38Å; E120-F123 VanDerWaalsContact O-N 3.1Å; E120-H124 PolarHBondContact O-CD2 2.85Å; E120-H124 PolarHBondContact O-N 3.22Å; E120-L166 HydrophobicContact CB-CD2 4.12Å; E120-L166 HydrophobicContact CG-CD2 3.5Å; E120-L166 VanDerWaalsContact CG-CD2 3.5Å
121	L	94.8	Very high	91.1	Very high	1 Å²	1	43 Å²	43	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-37.6	173.2	-171.8	72.2	0	0	0	110.5	F123 H124 L125 F131 Y139 P162 I165 L167 M227	L121-F123 VanDerWaalsContact C-N 3.3Å; L121-F123 PolarHBondContact O-N 3.24Å; L121-H124 PolarHBondContact O-N 3.49Å; L121-H124 VanDerWaalsContact O-N 3.14Å; L121-L125 WeakPolarHBondContact O-CB 3.1Å; L121-L125 PolarHBondContact O-N 3Å; L121-F131 HydrophobicContact CD1-CE2 3.71Å; L121-F131 HydrophobicContact CD1-CZ 4.09Å; L121-F131 HydrophobicContact CG-CE2 4.16Å; L121-Y139 HydrophobicContact CD1-CD2 3.69Å; L121-Y139 HydrophobicContact CD1-CE2 3.69Å; L121-Y139 HydrophobicContact CD1-CG 4.42Å; L121-P162 HydrophobicContact CB-CB 4.42Å; L121-P162 PolarHBondContact N-O 2.86Å; L121-I165 HydrophobicContact CB-CB 3.95Å; L121-I165 HydrophobicContact CB-CG2 3.92Å; L121-I165 WeakPolarHBondContact CB-O 3.49Å; L121-I165 HydrophobicContact CD2-CB 4.23Å; L121-I165 HydrophobicContact CD2-CD1 3.96Å; L121-I165 HydrophobicContact CD2-CG2 3.95Å; L121-I165 HydrophobicContact CG-CG2 4.43Å; L121-I165 PolarHBondContact N-O 3.22Å; L121-L167 HydrophobicContact CD1-CD2 4.31Å; L121-M227 HydrophobicContact CD2-CG 4.32Å; L121-M227 HydrophobicContact CD2-SD 3.94Å
122	F	91.6	Very high	91.5	Very high	36 Å²	36	49 Å²	49	16%	0.158	22%	0.218	C	C	.	.	H	α-helix	trans	-47.6	-51.4	172.6	-177.4	-102.6	0	0	0	112	E120 H124 L125 Q126 P162 E163 M336	E120-F122 HydrophobicContact CB-CB 4.3Å; E120-F122 PolarHBondContact O-N 3.33Å; F122-H124 PolarHBondContact O-N 2.94Å; F122-L125 PolarHBondContact O-N 3.2Å; F122-Q126 HydrophobicContact CD1-CG 4.11Å; F122-Q126 HydrophobicContact CD2-CG 4.28Å; F122-Q126 HydrophobicContact CE1-CG 3.73Å; F122-Q126 HydrophobicContact CE2-CG 3.91Å; F122-Q126 HydrophobicContact CG-CG 4.37Å; F122-Q126 HydrophobicContact CZ-CG 3.62Å; F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 VanDerWaalsContact O-CG 3.26Å; F122-Q126 WeakPolarHBondContact O-CG 3.46Å; F122-Q126 PolarHBondContact O-N 2.92Å; F122-P162 HydrophobicContact CB-CB 3.85Å; F122-P162 HydrophobicContact CD2-CB 4.35Å; F122-P162 PolarHBondContact N-O 3.12Å; F122-P162 VanDerWaalsContact N-O 3.11Å; F122-E163 HydrophobicContact CB-CG 4.09Å; F122-E163 HydrophobicContact CD2-CG 4.36Å; F122-E163 HydrophobicContact CG-CG 4.12Å; F122-M336 HydrophobicContact CZ-CE 4.1Å
123	F	89.4	Confident	91.8	Very high	58 Å²	58	49.9 Å²	49.9	25%	0.254	22%	0.222	S	C	.	.	H	α-helix	trans	-62	-42.8	-178.9	173.6	-96.4	0	0	0	112.5	E120 L121 R127 F325	E120-F123 WeakPolarHBondContact O-CB 3.34Å; E120-F123 PolarHBondContact O-N 3.38Å; E120-F123 VanDerWaalsContact O-N 3.1Å; L121-F123 VanDerWaalsContact C-N 3.3Å; L121-F123 PolarHBondContact O-N 3.24Å; F123-R127 WeakPolarHBondContact O-CB 3.4Å; F123-R127 PolarHBondContact O-N 3.35Å; F123-R127 VanDerWaalsContact O-N 3.08Å; F123-F325 HydrophobicContact CD1-CZ 4.15Å; F123-F325 HydrophobicContact CE1-CZ 4.02Å
124	H	92.4	Very high	92.2	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-41.3	178.4	-66.2	-71.5	0	0	0	111.5	G118 E120 L121 F122 R127 E128 F131 F309	G118-H124 PolarHBondContact O-CE1 2.91Å; G118-H124 PolarHBondContact O-NE2 2.83Å; E120-H124 PolarHBondContact O-CD2 2.85Å; E120-H124 PolarHBondContact O-N 3.22Å; L121-H124 PolarHBondContact O-N 3.49Å; L121-H124 VanDerWaalsContact O-N 3.14Å; F122-H124 PolarHBondContact O-N 2.94Å; H124-R127 PolarHBondContact O-N 3.35Å; H124-E128 PolarHBondContact O-N 3.06Å; H124-E128 VanDerWaalsContact O-N 3.11Å; H124-F131 HydrophobicContact CB-CE1 4.38Å; H124-F131 HydrophobicContact CB-CZ 4.01Å; H124-F309 AromaticContact CE1-CE1 3.41Å; H124-F309 VanDerWaalsContact CE1-CE1 3.41Å; H124-F309 WeakPolarHBondContact CE1-CE1 3.23Å; H124-F309 AromaticContact CE1-CZ 3.61Å; H124-F309 AromaticContact ND1-CE1 3.52Å; H124-F309 AromaticContact ND1-CZ 3.51Å
125	L	93	Very high	92.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-46.4	178.2	-176.6	56	0	0	0	111.3	L121 F122 R127 E128 R129 F131 E226 M227	L121-L125 WeakPolarHBondContact O-CB 3.1Å; L121-L125 PolarHBondContact O-N 3Å; F122-L125 PolarHBondContact O-N 3.2Å; L125-R127 VanDerWaalsContact C-N 3.3Å; L125-R127 PolarHBondContact O-N 3.35Å; L125-E128 CarbonylContact O-C 3.59Å; L125-E128 PolarHBondContact O-N 3.13Å; L125-R129 CarbonylContact O-C 3.45Å; L125-R129 VanDerWaalsContact O-CA 3.27Å; L125-R129 WeakPolarHBondContact O-CA 3.47Å; L125-R129 PolarHBondContact O-N 3.04Å; L125-F131 HydrophobicContact CB-CE1 4.39Å; L125-F131 HydrophobicContact CB-CE2 4.12Å; L125-F131 HydrophobicContact CB-CZ 3.78Å; L125-F131 HydrophobicContact CD1-CD1 4.3Å; L125-F131 HydrophobicContact CD1-CD2 4.11Å; L125-F131 HydrophobicContact CD1-CE1 4.23Å; L125-F131 HydrophobicContact CD1-CE2 4.02Å; L125-F131 HydrophobicContact CD1-CG 4.23Å; L125-F131 HydrophobicContact CD1-CZ 4.1Å; L125-E226 HydrophobicContact CD2-CB 4.41Å; L125-E226 HydrophobicContact CD2-CG 3.79Å; L125-M227 HydrophobicContact CD2-CG 4.48Å
126	Q	88.8	Confident	92.9	Very high	25 Å²	25	49 Å²	49	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-39	176.9	-70.6	-57.2	-44.2	0	0	112.4	F122	F122-Q126 HydrophobicContact CD1-CG 4.11Å; F122-Q126 HydrophobicContact CD2-CG 4.28Å; F122-Q126 HydrophobicContact CE1-CG 3.73Å; F122-Q126 HydrophobicContact CE2-CG 3.91Å; F122-Q126 HydrophobicContact CG-CG 4.37Å; F122-Q126 HydrophobicContact CZ-CG 3.62Å; F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 VanDerWaalsContact O-CG 3.26Å; F122-Q126 WeakPolarHBondContact O-CG 3.46Å; F122-Q126 PolarHBondContact O-N 2.92Å
127	R	90.8	Very high	93.3	Very high	128 Å²	128	49.9 Å²	49.9	48%	0.483	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-38.8	177.8	-172.6	-177.2	67.6	-174.2	-3.2	112.4	F123 H124 L125	F123-R127 WeakPolarHBondContact O-CB 3.4Å; F123-R127 PolarHBondContact O-N 3.35Å; F123-R127 VanDerWaalsContact O-N 3.08Å; H124-R127 PolarHBondContact O-N 3.35Å; L125-R127 VanDerWaalsContact C-N 3.3Å; L125-R127 PolarHBondContact O-N 3.35Å
128	E	92.4	Very high	93.9	Very high	74 Å²	74	49.2 Å²	49.2	35%	0.346	22%	0.222	S	C	.	.	H	α-helix	trans	-96.1	-5.1	-175.6	-67	177.4	-135.2	0	0	113.3	H124 L125 R130 F131 R135	H124-E128 PolarHBondContact O-N 3.06Å; H124-E128 VanDerWaalsContact O-N 3.11Å; L125-E128 CarbonylContact O-C 3.59Å; L125-E128 PolarHBondContact O-N 3.13Å; E128-R130 PolarHBondContact O-N 2.55Å; E128-F131 HydrophobicContact CB-CD1 4.41Å; E128-F131 HydrophobicContact CB-CE1 4.26Å; E128-R135 IonicContact OE1-CZ 3.09Å; E128-R135 IonicContact OE1-NH1 3.41Å; E128-R135 PolarHBondContact OE1-NH1 2.67Å; E128-R135 IonicContact OE1-NH2 3.39Å; E128-R135 IonicContact OE2-CZ 3.07Å; E128-R135 IonicContact OE2-NH1 3.58Å; E128-R135 PolarHBondContact OE2-NH1 2.92Å
129	R	92.4	Very high	94.4	Very high	180 Å²	180	49.3 Å²	49.3	68%	0.679	22%	0.222	S	C	*	.	S	Bend	trans	64.1	-37.7	-174.1	-53.6	-176.7	177	-149	-1.2	114.8	L125 G230	L125-R129 CarbonylContact O-C 3.45Å; L125-R129 VanDerWaalsContact O-CA 3.27Å; L125-R129 WeakPolarHBondContact O-CA 3.47Å; L125-R129 PolarHBondContact O-N 3.04Å; R129-G230 WeakPolarHBondContact O-CA 3.26Å
130	R	94.8	Very high	94.8	Very high	138 Å²	138	48.6 Å²	48.6	52%	0.521	22%	0.215	S	C	.	.	S	Bend	trans	-160	154.5	174.8	60.3	179.6	-176	150.6	0.3	109.7	E128	E128-R130 PolarHBondContact O-N 2.55Å
131	F	97.3	Very high	95.2	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	20%	0.199	C	C	.	.			trans	-92.9	155.1	170.6	-58.8	-33.9	0	0	0	111.9	L121 H124 L125 E128 R135 A136 Y139 M227	L121-F131 HydrophobicContact CD1-CE2 3.71Å; L121-F131 HydrophobicContact CD1-CZ 4.09Å; L121-F131 HydrophobicContact CG-CE2 4.16Å; H124-F131 HydrophobicContact CB-CE1 4.38Å; H124-F131 HydrophobicContact CB-CZ 4.01Å; L125-F131 HydrophobicContact CB-CE1 4.39Å; L125-F131 HydrophobicContact CB-CE2 4.12Å; L125-F131 HydrophobicContact CB-CZ 3.78Å; L125-F131 HydrophobicContact CD1-CD1 4.3Å; L125-F131 HydrophobicContact CD1-CD2 4.11Å; L125-F131 HydrophobicContact CD1-CE1 4.23Å; L125-F131 HydrophobicContact CD1-CE2 4.02Å; L125-F131 HydrophobicContact CD1-CG 4.23Å; L125-F131 HydrophobicContact CD1-CZ 4.1Å; E128-F131 HydrophobicContact CB-CD1 4.41Å; E128-F131 HydrophobicContact CB-CE1 4.26Å; F131-R135 HydrophobicContact CB-CB 4.29Å; F131-R135 HydrophobicContact CB-CG 4.2Å; F131-R135 HydrophobicContact CD2-CG 4.43Å; F131-R135 HydrophobicContact CG-CG 4.18Å; F131-A136 HydrophobicContact CB-CB 4.46Å; F131-Y139 HydrophobicContact CD2-CD2 4.32Å; F131-Y139 HydrophobicContact CD2-CE2 4.37Å; F131-Y139 HydrophobicContact CE2-CD2 4.22Å; F131-Y139 HydrophobicContact CE2-CE2 4.11Å; F131-M227 HydrophobicContact CD2-CB 3.94Å; F131-M227 HydrophobicContact CD2-CG 3.77Å; F131-M227 HydrophobicContact CD2-SD 3.93Å; F131-M227 HydrophobicContact CE2-CG 4.05Å; F131-M227 HydrophobicContact CE2-SD 4.21Å; F131-M227 PolarHBondContact N-O 2.87Å
132	L	96.4	Very high	95.4	Very high	125 Å²	125	45.1 Å²	45.1	65%	0.654	20%	0.198	S	C	*	.			trans	-72.6	151.8	166.2	-61.1	179.8	0	0	0	109.9	P134 R135 A136	L132-P134 VanDerWaalsContact C-CD 3.47Å; L132-R135 PolarHBondContact O-N 3.34Å; L132-A136 PolarHBondContact O-N 3.02Å
133	E	96.9	Very high	95.7	Very high	19 Å²	19	43.5 Å²	43.5	9%	0.089	19%	0.192	C	C	.	.	H	α-helix	trans	-53.6	-41.8	-176	-168.4	179.6	129.4	0	0	114	R135 A136 R137 L228 T258 A261 F291	E133-R135 VanDerWaalsContact C-N 3.3Å; E133-R135 PolarHBondContact O-N 3.08Å; E133-A136 PolarHBondContact O-N 3.05Å; E133-R137 VanDerWaalsContact O-CB 3.23Å; E133-R137 WeakPolarHBondContact O-CB 2.96Å; E133-R137 PolarHBondContact O-N 3.08Å; E133-R137 IonicContact OE1-CZ 2.96Å; E133-R137 IonicContact OE1-NH2 3.76Å; E133-R137 PolarHBondContact OE1-NH2 3.43Å; E133-L228 HydrophobicContact CB-CD2 4.26Å; E133-L228 HydrophobicContact CG-CD2 4.43Å; E133-T258 VanDerWaalsContact CD-OG1 3.28Å; E133-T258 WeakPolarHBondContact OE1-CG2 3.39Å; E133-T258 PolarHBondContact OE1-OG1 2.63Å; E133-T258 WeakPolarHBondContact OE2-CG2 3.4Å; E133-T258 PolarHBondContact OE2-N 3.28Å; E133-T258 PolarHBondContact OE2-OG1 3.18Å; E133-A261 HydrophobicContact CG-CB 4.5Å; E133-F291 HydrophobicContact CG-CE2 3.69Å; E133-F291 HydrophobicContact CG-CZ 4.22Å
134	P	97.5	Very high	96.2	Very high	85 Å²	85	40.8 Å²	40.8	55%	0.552	18%	0.179	S	C	*	.	H	α-helix	trans	-60.2	-37.6	176.4	-25.2	36.1	0	0	0	113.7	L132 F138	L132-P134 VanDerWaalsContact C-CD 3.47Å; P134-F138 PolarHBondContact O-N 3.49Å; P134-F138 VanDerWaalsContact O-N 3.11Å
135	R	98	Very high	96.5	Very high	20 Å²	20	41.1 Å²	41.1	8%	0.075	18%	0.182	C	C	.	.	H	α-helix	trans	-71.7	-45.7	177.8	177.4	170.9	-171.9	-168.7	-2.9	111.3	E128 F131 L132 E133 R137 F138 Y139 P308 F309	E128-R135 IonicContact OE1-CZ 3.09Å; E128-R135 IonicContact OE1-NH1 3.41Å; E128-R135 PolarHBondContact OE1-NH1 2.67Å; E128-R135 IonicContact OE1-NH2 3.39Å; E128-R135 IonicContact OE2-CZ 3.07Å; E128-R135 IonicContact OE2-NH1 3.58Å; E128-R135 PolarHBondContact OE2-NH1 2.92Å; F131-R135 HydrophobicContact CB-CB 4.29Å; F131-R135 HydrophobicContact CB-CG 4.2Å; F131-R135 HydrophobicContact CD2-CG 4.43Å; F131-R135 HydrophobicContact CG-CG 4.18Å; L132-R135 PolarHBondContact O-N 3.34Å; E133-R135 VanDerWaalsContact C-N 3.3Å; E133-R135 PolarHBondContact O-N 3.08Å; R135-R137 VanDerWaalsContact C-N 3.31Å; R135-R137 PolarHBondContact O-N 3.37Å; R135-F138 PolarHBondContact O-N 2.9Å; R135-Y139 HydrophobicContact CG-CD2 4.01Å; R135-Y139 HydrophobicContact CG-CE2 3.53Å; R135-Y139 PolarHBondContact NE-OH 3.4Å; R135-Y139 VanDerWaalsContact NE-OH 3.16Å; R135-Y139 PolarHBondContact NH2-OH 3.24Å; R135-Y139 PolarHBondContact O-N 3.11Å; R135-Y139 VanDerWaalsContact O-N 3.14Å; R135-P308 HydrophobicContact CB-CB 4.1Å; R135-P308 HydrophobicContact CB-CG 4.08Å; R135-P308 HydrophobicContact CG-CB 4.18Å; R135-P308 HydrophobicContact CG-CG 3.76Å; R135-F309 VanDerWaalsContact NH2-CD1 3.32Å
136	A	98.4	Very high	96.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-40.2	176.6	0	0	0	0	0	111.7	F131 L132 E133 A140 L224 M227 L228	F131-A136 HydrophobicContact CB-CB 4.46Å; L132-A136 PolarHBondContact O-N 3.02Å; E133-A136 PolarHBondContact O-N 3.05Å; A136-A140 WeakPolarHBondContact O-CB 3.49Å; A136-A140 PolarHBondContact O-N 2.86Å; A136-L224 HydrophobicContact CB-CD1 3.94Å; A136-M227 HydrophobicContact CB-CB 3.96Å; A136-M227 HydrophobicContact CB-CE 4.23Å; A136-M227 HydrophobicContact CB-SD 4.35Å; A136-M227 WeakPolarHBondContact O-CE 3.28Å; A136-L228 HydrophobicContact CB-CD2 3.74Å; A136-L228 HydrophobicContact CB-CG 4.16Å
137	R	98.7	Very high	97.1	Very high	41 Å²	41	39.9 Å²	39.9	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-46.8	174.8	-177.4	-173.6	-60.5	142.1	1.6	112.2	E133 R135 A140 A141 F291 F292 I295	E133-R137 VanDerWaalsContact O-CB 3.23Å; E133-R137 WeakPolarHBondContact O-CB 2.96Å; E133-R137 PolarHBondContact O-N 3.08Å; E133-R137 IonicContact OE1-CZ 2.96Å; E133-R137 IonicContact OE1-NH2 3.76Å; E133-R137 PolarHBondContact OE1-NH2 3.43Å; R135-R137 VanDerWaalsContact C-N 3.31Å; R135-R137 PolarHBondContact O-N 3.37Å; R137-A140 PolarHBondContact O-N 2.97Å; R137-A141 WeakPolarHBondContact O-CB 3.41Å; R137-A141 PolarHBondContact O-N 3Å; R137-F291 HydrophobicContact CB-CE1 3.66Å; R137-F291 HydrophobicContact CB-CE2 4.48Å; R137-F291 HydrophobicContact CB-CZ 3.62Å; R137-F291 WeakPolarHBondContact CD-O 3.22Å; R137-F291 HydrophobicContact CG-CD1 4.05Å; R137-F291 HydrophobicContact CG-CE1 3.63Å; R137-F291 HydrophobicContact CG-CZ 4Å; R137-F291 PolarHBondContact NE-O 2.9Å; R137-F292 HydrophobicContact CG-CD1 4.1Å; R137-F292 HydrophobicContact CG-CE1 4.46Å; R137-I295 HydrophobicContact CG-CD1 4.34Å; R137-I295 HydrophobicContact CG-CG1 4.21Å
138	F	98.8	Very high	97.5	Very high	13 Å²	13	34.1 Å²	34.1	6%	0.057	16%	0.156	C	C	.	.	H	α-helix	trans	-58.8	-53.1	178.9	-177.7	-87.6	0	0	0	111.1	P134 R135 A140 A141 E142 H172 L300 L305 P307 P308	P134-F138 PolarHBondContact O-N 3.49Å; P134-F138 VanDerWaalsContact O-N 3.11Å; R135-F138 PolarHBondContact O-N 2.9Å; F138-A140 PolarHBondContact O-N 3.32Å; F138-A141 WeakPolarHBondContact O-CB 2.95Å; F138-A141 PolarHBondContact O-N 3.08Å; F138-E142 HydrophobicContact CD1-CG 4.49Å; F138-E142 HydrophobicContact CE1-CG 4.16Å; F138-E142 VanDerWaalsContact CE1-OE1 3.23Å; F138-E142 WeakPolarHBondContact CE1-OE1 2.92Å; F138-E142 WeakPolarHBondContact CE1-OE2 3.27Å; F138-E142 VanDerWaalsContact CZ-OE1 3.28Å; F138-E142 WeakPolarHBondContact CZ-OE1 3.5Å; F138-E142 PolarHBondContact O-N 3.45Å; F138-E142 VanDerWaalsContact O-N 3.12Å; F138-H172 AromaticContact CZ-ND1 3.87Å; F138-L300 HydrophobicContact CE2-CD1 4.25Å; F138-L305 HydrophobicContact CE2-CB 3.82Å; F138-P307 HydrophobicContact CE1-CB 4.17Å; F138-P307 HydrophobicContact CE1-CG 4.44Å; F138-P307 HydrophobicContact CZ-CB 4.22Å; F138-P307 HydrophobicContact CZ-CG 4.17Å; F138-P308 HydrophobicContact CB-CG 4.09Å; F138-P308 HydrophobicContact CD1-CG 3.96Å; F138-P308 HydrophobicContact CG-CG 4.06Å
139	Y	98.8	Very high	97.7	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-65	-41.5	179.3	-62.4	-33.3	0	0	0	112.8	L121 F131 R135 A141 E142 V143 L167 G171 V173 M227 P308 F309	L121-Y139 HydrophobicContact CD1-CD2 3.69Å; L121-Y139 HydrophobicContact CD1-CE2 3.69Å; L121-Y139 HydrophobicContact CD1-CG 4.42Å; F131-Y139 HydrophobicContact CD2-CD2 4.32Å; F131-Y139 HydrophobicContact CD2-CE2 4.37Å; F131-Y139 HydrophobicContact CE2-CD2 4.22Å; F131-Y139 HydrophobicContact CE2-CE2 4.11Å; R135-Y139 HydrophobicContact CG-CD2 4.01Å; R135-Y139 HydrophobicContact CG-CE2 3.53Å; R135-Y139 PolarHBondContact NE-OH 3.4Å; R135-Y139 VanDerWaalsContact NE-OH 3.16Å; R135-Y139 PolarHBondContact NH2-OH 3.24Å; R135-Y139 PolarHBondContact O-N 3.11Å; R135-Y139 VanDerWaalsContact O-N 3.14Å; Y139-A141 VanDerWaalsContact C-N 3.25Å; Y139-A141 PolarHBondContact O-N 3.35Å; Y139-E142 PolarHBondContact O-N 3.49Å; Y139-V143 VanDerWaalsContact O-CG2 3.26Å; Y139-V143 WeakPolarHBondContact O-CG2 3.48Å; Y139-V143 PolarHBondContact O-N 3.01Å; Y139-L167 HydrophobicContact CD1-CD2 4.38Å; Y139-L167 HydrophobicContact CE1-CD2 3.86Å; Y139-G171 WeakPolarHBondContact CE1-O 3.19Å; Y139-V173 HydrophobicContact CD1-CG2 3.74Å; Y139-V173 HydrophobicContact CG-CG2 4.13Å; Y139-M227 HydrophobicContact CD2-SD 4.07Å; Y139-P308 HydrophobicContact CE1-CG 4.23Å; Y139-F309 WeakPolarHBondContact OH-CB 3Å
140	A	98.8	Very high	97.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-35.5	176.1	0	0	0	0	0	112	A136 R137 F138 A144 L220 L224 M227 F292	A136-A140 WeakPolarHBondContact O-CB 3.49Å; A136-A140 PolarHBondContact O-N 2.86Å; R137-A140 PolarHBondContact O-N 2.97Å; F138-A140 PolarHBondContact O-N 3.32Å; A140-A144 WeakPolarHBondContact O-CB 3.33Å; A140-A144 PolarHBondContact O-N 3.21Å; A140-L220 HydrophobicContact CB-CD1 4.28Å; A140-L224 HydrophobicContact CB-CD1 4.16Å; A140-M227 HydrophobicContact CB-CE 4.14Å; A140-F292 HydrophobicContact CB-CE1 4.08Å; A140-F292 HydrophobicContact CB-CZ 4.21Å
141	A	98.9	Very high	98	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.2	-44.3	175.7	0	0	0	0	0	111.9	R137 F138 Y139 A144 S145 F292 I295 W297 L300	R137-A141 WeakPolarHBondContact O-CB 3.41Å; R137-A141 PolarHBondContact O-N 3Å; F138-A141 WeakPolarHBondContact O-CB 2.95Å; F138-A141 PolarHBondContact O-N 3.08Å; Y139-A141 VanDerWaalsContact C-N 3.25Å; Y139-A141 PolarHBondContact O-N 3.35Å; A141-A144 PolarHBondContact O-N 3.47Å; A141-S145 WeakPolarHBondContact O-CB 3.41Å; A141-S145 PolarHBondContact O-N 3.38Å; A141-F292 HydrophobicContact CB-CD1 3.92Å; A141-F292 HydrophobicContact CB-CE1 3.95Å; A141-I295 HydrophobicContact CB-CG1 4.21Å; A141-I295 HydrophobicContact CB-CG2 4.17Å; A141-W297 HydrophobicContact CB-CH2 3.93Å; A141-W297 HydrophobicContact CB-CZ3 4.01Å; A141-W297 WeakPolarHBondContact O-CZ3 3.4Å; A141-L300 HydrophobicContact CB-CD1 4.4Å; A141-L300 HydrophobicContact CB-CD2 3.8Å
142	E	98.8	Very high	97.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-44.5	177	-65.4	-170.9	143.1	0	0	111.9	F95 F138 Y139 S145 A146 H172 V173 L300	F95-E142 HydrophobicContact CD1-CB 4.25Å; F95-E142 HydrophobicContact CD1-CG 4.35Å; F95-E142 HydrophobicContact CD2-CB 3.76Å; F95-E142 HydrophobicContact CD2-CG 4.19Å; F95-E142 WeakPolarHBondContact CD2-O 3.41Å; F95-E142 HydrophobicContact CE1-CB 4.28Å; F95-E142 HydrophobicContact CE1-CG 3.89Å; F95-E142 WeakPolarHBondContact CE1-OE1 3.28Å; F95-E142 HydrophobicContact CE2-CB 3.85Å; F95-E142 HydrophobicContact CE2-CG 3.78Å; F95-E142 HydrophobicContact CG-CB 4Å; F95-E142 HydrophobicContact CG-CG 4.49Å; F95-E142 HydrophobicContact CZ-CB 4.1Å; F95-E142 HydrophobicContact CZ-CG 3.6Å; F95-E142 WeakPolarHBondContact CZ-OE1 3.42Å; F138-E142 HydrophobicContact CD1-CG 4.49Å; F138-E142 HydrophobicContact CE1-CG 4.16Å; F138-E142 VanDerWaalsContact CE1-OE1 3.23Å; F138-E142 WeakPolarHBondContact CE1-OE1 2.92Å; F138-E142 WeakPolarHBondContact CE1-OE2 3.27Å; F138-E142 VanDerWaalsContact CZ-OE1 3.28Å; F138-E142 WeakPolarHBondContact CZ-OE1 3.5Å; F138-E142 PolarHBondContact O-N 3.45Å; F138-E142 VanDerWaalsContact O-N 3.12Å; Y139-E142 PolarHBondContact O-N 3.49Å; E142-S145 PolarHBondContact O-N 3.31Å; E142-A146 PolarHBondContact O-N 2.92Å; E142-H172 IonicContact OE1-CE1 3.69Å; E142-H172 IonicContact OE1-CG 3.49Å; E142-H172 IonicContact OE1-ND1 2.67Å; E142-H172 PolarHBondContact OE1-ND1 3.27Å; E142-V173 HydrophobicContact CB-CB 3.95Å; E142-V173 HydrophobicContact CB-CG2 4.34Å; E142-V173 WeakPolarHBondContact OE2-CB 3.35Å; E142-V173 PolarHBondContact OE2-N 3.22Å; E142-L300 HydrophobicContact CG-CD1 3.69Å; E142-L300 HydrophobicContact CG-CD2 4.46Å; E142-L300 HydrophobicContact CG-CG 4.18Å
143	V	98.8	Very high	97.7	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-60.4	-48.7	174.6	175.1	0	0	0	0	110.4	Y139 S145 A146 I147 L160 I165 V173 L175 L220	Y139-V143 VanDerWaalsContact O-CG2 3.26Å; Y139-V143 WeakPolarHBondContact O-CG2 3.48Å; Y139-V143 PolarHBondContact O-N 3.01Å; V143-S145 VanDerWaalsContact C-N 3.3Å; V143-S145 PolarHBondContact O-N 3.1Å; V143-A146 WeakPolarHBondContact O-CB 3.46Å; V143-A146 PolarHBondContact O-N 3.41Å; V143-A146 VanDerWaalsContact O-N 3.13Å; V143-I147 HydrophobicContact CG1-CG1 4.2Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.46Å; V143-L160 HydrophobicContact CG1-CD1 3.67Å; V143-L160 HydrophobicContact CG1-CD2 3.67Å; V143-L160 HydrophobicContact CG1-CG 4.29Å; V143-I165 HydrophobicContact CG2-CD1 4.02Å; V143-I165 HydrophobicContact CG2-CG1 4.41Å; V143-I165 HydrophobicContact CG2-CG2 4.49Å; V143-V173 HydrophobicContact CG2-CG1 3.84Å; V143-V173 HydrophobicContact CG2-CG2 4.39Å; V143-L175 HydrophobicContact CG1-CD2 4.41Å; V143-L175 HydrophobicContact CG2-CD2 4.23Å; V143-L220 HydrophobicContact CB-CD1 4.08Å; V143-L220 HydrophobicContact CG1-CD1 3.78Å
144	A	98.8	Very high	97.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.9	-40.1	179.4	0	0	0	0	0	112.2	A140 A141 I147 G148 W217 L220 F283 I286 W297	A140-A144 WeakPolarHBondContact O-CB 3.33Å; A140-A144 PolarHBondContact O-N 3.21Å; A141-A144 PolarHBondContact O-N 3.47Å; A144-I147 PolarHBondContact O-N 3.32Å; A144-G148 PolarHBondContact O-N 3.04Å; A144-W217 HydrophobicContact CB-CZ3 4.14Å; A144-L220 HydrophobicContact CB-CD2 3.86Å; A144-F283 VanDerWaalsContact C-CE2 3.46Å; A144-F283 HydrophobicContact CB-CD2 4.34Å; A144-F283 HydrophobicContact CB-CE2 3.91Å; A144-F283 WeakPolarHBondContact O-CD2 3.49Å; A144-F283 WeakPolarHBondContact O-CE2 3.32Å; A144-I286 HydrophobicContact CB-CG2 3.86Å; A144-W297 HydrophobicContact CB-CH2 4.43Å
145	S	98.6	Very high	97.4	Very high	10 Å²	10	15.5 Å²	15.5	7%	0.07	8%	0.082	C	C	.	.	H	α-helix	trans	-61.2	-43.8	174.8	-173.8	0	0	0	0	111.9	H93 A141 E142 V143 Y149	H93-S145 PolarHBondContact CE1-OG 2.92Å; H93-S145 PolarHBondContact NE2-O 3.15Å; H93-S145 PolarHBondContact NE2-OG 3.27Å; A141-S145 WeakPolarHBondContact O-CB 3.41Å; A141-S145 PolarHBondContact O-N 3.38Å; E142-S145 PolarHBondContact O-N 3.31Å; V143-S145 VanDerWaalsContact C-N 3.3Å; V143-S145 PolarHBondContact O-N 3.1Å; S145-Y149 PolarHBondContact O-N 3.34Å; S145-Y149 VanDerWaalsContact O-N 3.08Å
146	A	98.2	Very high	97.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65	-45	176.6	0	0	0	0	0	112.7	F95 L96 E142 V143 Y149 L150 L175	F95-A146 HydrophobicContact CB-CB 4.06Å; L96-A146 HydrophobicContact CD2-CB 3.62Å; L96-A146 HydrophobicContact CG-CB 3.98Å; E142-A146 PolarHBondContact O-N 2.92Å; V143-A146 WeakPolarHBondContact O-CB 3.46Å; V143-A146 PolarHBondContact O-N 3.41Å; V143-A146 VanDerWaalsContact O-N 3.13Å; A146-Y149 PolarHBondContact O-N 2.89Å; A146-L150 PolarHBondContact O-N 3.3Å; A146-L150 VanDerWaalsContact O-N 3.08Å; A146-L175 HydrophobicContact CB-CD1 3.76Å; A146-L175 HydrophobicContact CB-CG 4.21Å
147	I	98.3	Very high	97.2	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.4	-46.9	177.4	-67.1	-65.1	0	0	0	110.7	V143 A144 Y149 L150 H151 Y157 L175 D216 W217	V143-I147 HydrophobicContact CG1-CG1 4.2Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.46Å; A144-I147 PolarHBondContact O-N 3.32Å; I147-Y149 VanDerWaalsContact C-N 3.26Å; I147-Y149 PolarHBondContact O-N 2.73Å; I147-L150 WeakPolarHBondContact O-CB 3.44Å; I147-L150 PolarHBondContact O-N 2.82Å; I147-H151 WeakPolarHBondContact CG2-NE2 3.45Å; I147-H151 PolarHBondContact O-CD2 3.22Å; I147-H151 PolarHBondContact O-N 3.06Å; I147-Y157 HydrophobicContact CD1-CD1 4.05Å; I147-Y157 HydrophobicContact CD1-CG 3.94Å; I147-L175 HydrophobicContact CD1-CD1 4.04Å; I147-L175 HydrophobicContact CG1-CD1 4.33Å; I147-D216 HydrophobicContact CD1-CB 4.45Å; I147-D216 HydrophobicContact CG2-CB 3.81Å; I147-W217 HydrophobicContact CB-CH2 4.07Å; I147-W217 HydrophobicContact CB-CZ3 4.08Å; I147-W217 HydrophobicContact CG2-CE3 4.22Å; I147-W217 HydrophobicContact CG2-CH2 3.61Å; I147-W217 HydrophobicContact CG2-CZ2 4.02Å; I147-W217 HydrophobicContact CG2-CZ3 3.72Å
148	G	97.8	Very high	97	Very high	6 Å²	6	13.5 Å²	13.5	6%	0.062	7%	0.074	C	C	.	.	H	α-helix	trans	-59	-37	176.5	0	0	0	0	0	113.1	A144 H151 S152	A144-G148 PolarHBondContact O-N 3.04Å; G148-H151 PolarHBondContact O-N 2.84Å; G148-S152 PolarHBondContact O-N 2.7Å
149	Y	97.3	Very high	96.8	Very high	56 Å²	56	13.5 Å²	13.5	22%	0.22	8%	0.075	C	C	.	.	H	α-helix	trans	-64.5	-44.4	172.6	176.8	-104.6	0	0	0	112.4	V91 R92 H93 L96 S145 A146 I147 H151 S152 L153	V91-Y149 HydrophobicContact CB-CE1 4.35Å; V91-Y149 HydrophobicContact CG1-CD1 4.2Å; V91-Y149 HydrophobicContact CG1-CE1 3.63Å; R92-Y149 PolarHBondContact N-OH 3.32Å; R92-Y149 VanDerWaalsContact N-OH 3.15Å; H93-Y149 HydrophobicContact CB-CD1 3.65Å; H93-Y149 HydrophobicContact CB-CE1 3.9Å; H93-Y149 HydrophobicContact CB-CG 4.15Å; H93-Y149 VanDerWaalsContact CD2-CB 3.44Å; H93-Y149 WeakPolarHBondContact CD2-CB 3.35Å; H93-Y149 AromaticContact CD2-CD1 3.97Å; H93-Y149 AromaticContact CD2-CG 3.55Å; L96-Y149 HydrophobicContact CD1-CD1 3.73Å; L96-Y149 HydrophobicContact CD1-CE1 4.25Å; S145-Y149 PolarHBondContact O-N 3.34Å; S145-Y149 VanDerWaalsContact O-N 3.08Å; A146-Y149 PolarHBondContact O-N 2.89Å; I147-Y149 VanDerWaalsContact C-N 3.26Å; I147-Y149 PolarHBondContact O-N 2.73Å; Y149-H151 VanDerWaalsContact C-N 3.34Å; Y149-H151 PolarHBondContact O-N 3.09Å; Y149-S152 WeakPolarHBondContact O-CB 3.36Å; Y149-S152 PolarHBondContact O-N 2.78Å; Y149-S152 PolarHBondContact O-OG 3.4Å; Y149-L153 HydrophobicContact CD1-CD1 4.34Å; Y149-L153 HydrophobicContact CE1-CD1 3.74Å; Y149-L153 HydrophobicContact CE2-CD1 4.42Å; Y149-L153 PolarHBondContact O-N 3Å
150	L	96	Very high	96.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.8	-43.3	175.2	-69.7	173.9	0	0	0	111.7	V91 L96 A146 I147 S152 L153 N154 I155 Y157 F178	V91-L150 HydrophobicContact CG1-CD2 4.21Å; L96-L150 HydrophobicContact CD1-CD1 4.46Å; L96-L150 HydrophobicContact CD1-CD2 3.83Å; L96-L150 HydrophobicContact CD1-CG 3.93Å; L96-L150 HydrophobicContact CD2-CD1 4.28Å; A146-L150 PolarHBondContact O-N 3.3Å; A146-L150 VanDerWaalsContact O-N 3.08Å; I147-L150 WeakPolarHBondContact O-CB 3.44Å; I147-L150 PolarHBondContact O-N 2.82Å; L150-S152 VanDerWaalsContact C-N 3.27Å; L150-S152 PolarHBondContact O-N 2.81Å; L150-L153 CarbonylContact O-C 3.5Å; L150-L153 WeakPolarHBondContact O-CA 3.48Å; L150-L153 WeakPolarHBondContact O-CB 3.4Å; L150-L153 PolarHBondContact O-N 3.33Å; L150-N154 PolarHBondContact O-N 2.75Å; L150-I155 CarbonylContact C-O 3.48Å; L150-I155 VanDerWaalsContact C-O 3.28Å; L150-I155 HydrophobicContact CB-CB 4.26Å; L150-I155 HydrophobicContact CD2-CB 4.46Å; L150-I155 HydrophobicContact CD2-CD1 4.41Å; L150-I155 HydrophobicContact CD2-CG2 4.37Å; L150-I155 WeakPolarHBondContact O-CB 3.47Å; L150-I155 PolarHBondContact O-N 3.45Å; L150-Y157 HydrophobicContact CD1-CD2 3.86Å; L150-Y157 HydrophobicContact CD1-CG 4.32Å; L150-F178 HydrophobicContact CD1-CE1 4.23Å; L150-F178 HydrophobicContact CD2-CE1 4.45Å
151	H	96.4	Very high	96.5	Very high	2 Å²	2	15 Å²	15	1%	0.009	8%	0.082	C	C	.	.	H	α-helix	trans	-62	-34.7	176.6	-69.5	-172	0	0	0	112.3	I147 G148 Y149 L153 N154 I155 R213 D216 W217 D282	I147-H151 WeakPolarHBondContact CG2-NE2 3.45Å; I147-H151 PolarHBondContact O-CD2 3.22Å; I147-H151 PolarHBondContact O-N 3.06Å; G148-H151 PolarHBondContact O-N 2.84Å; Y149-H151 VanDerWaalsContact C-N 3.34Å; Y149-H151 PolarHBondContact O-N 3.09Å; H151-L153 PolarHBondContact O-N 3.18Å; H151-N154 PolarHBondContact O-N 3.08Å; H151-I155 PolarHBondContact CD2-O 3.4Å; H151-I155 PolarHBondContact N-O 3.18Å; H151-R213 PolarHBondContact CE1-O 3.33Å; H151-R213 VanDerWaalsContact CE1-O 3.3Å; H151-R213 PolarHBondContact O-NH1 3.37Å; H151-D216 IonicContact CD2-OD2 3.3Å; H151-D216 IonicContact NE2-OD2 2.63Å; H151-D216 PolarHBondContact NE2-OD2 3.18Å; H151-D216 VanDerWaalsContact NE2-OD2 3.1Å; H151-W217 AromaticContact CE1-CE2 3.77Å; H151-W217 AromaticContact CE1-CZ2 3.84Å; H151-W217 AromaticContact CE1-NE1 3.76Å; H151-W217 AromaticContact ND1-CE2 3.87Å; H151-W217 AromaticContact ND1-CZ2 3.63Å; H151-W217 AromaticContact ND1-NE1 3.85Å; H151-D282 VanDerWaalsContact CB-OD2 3.27Å; H151-D282 WeakPolarHBondContact CB-OD2 3.28Å; H151-D282 IonicContact CE1-OD1 2.8Å; H151-D282 IonicContact CG-OD1 3.88Å; H151-D282 IonicContact CG-OD2 3.07Å; H151-D282 IonicContact ND1-OD1 2.66Å; H151-D282 PolarHBondContact ND1-OD1 2.86Å; H151-D282 IonicContact ND1-OD2 3.78Å; H151-D282 PolarHBondContact ND1-OD2 3.28Å
152	S	94.9	Very high	96.4	Very high	80 Å²	80	15 Å²	15	56%	0.559	8%	0.082	S	C	*	.	H	α-helix	trans	-66.2	-16.7	173.9	81	0	0	0	0	113.8	G148 Y149 L150	G148-S152 PolarHBondContact O-N 2.7Å; Y149-S152 WeakPolarHBondContact O-CB 3.36Å; Y149-S152 PolarHBondContact O-N 2.78Å; Y149-S152 PolarHBondContact O-OG 3.4Å; L150-S152 VanDerWaalsContact C-N 3.27Å; L150-S152 PolarHBondContact O-N 2.81Å
153	L	93.7	Very high	96.1	Very high	60 Å²	60	18 Å²	18	31%	0.314	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	11.1	174.6	-59.1	178.2	0	0	0	112.4	V91 Y149 L150 H151 I155	V91-L153 HydrophobicContact CG2-CD1 4.33Å; Y149-L153 HydrophobicContact CD1-CD1 4.34Å; Y149-L153 HydrophobicContact CE1-CD1 3.74Å; Y149-L153 HydrophobicContact CE2-CD1 4.42Å; Y149-L153 PolarHBondContact O-N 3Å; L150-L153 CarbonylContact O-C 3.5Å; L150-L153 WeakPolarHBondContact O-CA 3.48Å; L150-L153 WeakPolarHBondContact O-CB 3.4Å; L150-L153 PolarHBondContact O-N 3.33Å; H151-L153 PolarHBondContact O-N 3.18Å; L153-I155 VanDerWaalsContact C-N 3.31Å; L153-I155 HydrophobicContact CB-CD1 4Å; L153-I155 HydrophobicContact CB-CG1 4.08Å; L153-I155 WeakPolarHBondContact O-CG1 3.49Å; L153-I155 PolarHBondContact O-N 3.1Å
154	N	94.1	Very high	95.9	Very high	33 Å²	33	18.4 Å²	18.4	18%	0.176	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	43.3	-175	-61.7	-29.5	0	0	0	112.4	L150 H151 E183 G184 V185 E186	L150-N154 PolarHBondContact O-N 2.75Å; H151-N154 PolarHBondContact O-N 3.08Å; N154-E183 CarbonylContact O-C 3.53Å; N154-E183 WeakPolarHBondContact O-CA 3.34Å; N154-G184 PolarHBondContact O-N 3.4Å; N154-V185 WeakPolarHBondContact CB-O 3.49Å; N154-V185 PolarHBondContact O-N 3.14Å; N154-E186 PolarHBondContact ND2-OE1 3.47Å; N154-E186 PolarHBondContact ND2-OE2 2.85Å
155	I	93.6	Very high	95.8	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.7	177.3	-52.9	177.5	0	0	0	109.1	V86 K89 L150 H151 L153 C181 K182 E183	V86-I155 HydrophobicContact CG1-CD1 4.19Å; V86-I155 HydrophobicContact CG1-CG2 4.45Å; V86-I155 HydrophobicContact CG2-CD1 4.29Å; V86-I155 HydrophobicContact CG2-CG2 4.05Å; K89-I155 HydrophobicContact CD-CD1 4.15Å; L150-I155 CarbonylContact C-O 3.48Å; L150-I155 VanDerWaalsContact C-O 3.28Å; L150-I155 HydrophobicContact CB-CB 4.26Å; L150-I155 HydrophobicContact CD2-CB 4.46Å; L150-I155 HydrophobicContact CD2-CD1 4.41Å; L150-I155 HydrophobicContact CD2-CG2 4.37Å; L150-I155 WeakPolarHBondContact O-CB 3.47Å; L150-I155 PolarHBondContact O-N 3.45Å; H151-I155 PolarHBondContact CD2-O 3.4Å; H151-I155 PolarHBondContact N-O 3.18Å; L153-I155 VanDerWaalsContact C-N 3.31Å; L153-I155 HydrophobicContact CB-CD1 4Å; L153-I155 HydrophobicContact CB-CG1 4.08Å; L153-I155 WeakPolarHBondContact O-CG1 3.49Å; L153-I155 PolarHBondContact O-N 3.1Å; I155-C181 HydrophobicContact CG2-CB 3.99Å; I155-K182 CarbonylContact C-O 3.57Å; I155-K182 VanDerWaalsContact CA-O 3.31Å; I155-K182 WeakPolarHBondContact CA-O 3.4Å; I155-E183 HydrophobicContact CG1-CG 4.19Å; I155-E183 HydrophobicContact CG2-CG 4.5Å
156	I	95.6	Very high	95.6	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.8	170.5	-47.4	177.3	0	0	0	108.3	R158 C181 K182 V185 R213 V215 D216	I156-R158 HydrophobicContact CB-CG 4.05Å; I156-R158 HydrophobicContact CG2-CG 3.44Å; I156-R158 VanDerWaalsContact CG2-CG 3.44Å; I156-C181 CarbonylContact O-C 3.57Å; I156-C181 WeakPolarHBondContact O-CA 3.19Å; I156-K182 PolarHBondContact N-O 3.3Å; I156-K182 PolarHBondContact O-N 3.45Å; I156-V185 HydrophobicContact CD1-CB 3.93Å; I156-V185 HydrophobicContact CD1-CG1 3.8Å; I156-V185 HydrophobicContact CD1-CG2 3.96Å; I156-V185 HydrophobicContact CG1-CB 4.26Å; I156-V185 HydrophobicContact CG1-CG2 4.34Å; I156-R213 HydrophobicContact CD1-CB 4.34Å; I156-R213 HydrophobicContact CG1-CB 4.1Å; I156-V215 HydrophobicContact CG2-CG2 3.85Å; I156-D216 VanDerWaalsContact CG2-OD2 3.28Å; I156-D216 WeakPolarHBondContact CG2-OD2 3.39Å
157	Y	95.6	Very high	95.5	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	10%	0.102	C	C	.	.			trans	-79.7	-48.8	-173.5	-176.6	-104	0	0	0	113.6	I147 L150 D159 L160 N164 T176 F178 L180 D216	I147-Y157 HydrophobicContact CD1-CD1 4.05Å; I147-Y157 HydrophobicContact CD1-CG 3.94Å; L150-Y157 HydrophobicContact CD1-CD2 3.86Å; L150-Y157 HydrophobicContact CD1-CG 4.32Å; Y157-D159 VanDerWaalsContact C-N 3.3Å; Y157-D159 VanDerWaalsContact CE1-C 3.43Å; Y157-D159 WeakPolarHBondContact CE1-O 3.23Å; Y157-D159 PolarHBondContact O-N 2.84Å; Y157-L160 HydrophobicContact CD1-CB 3.9Å; Y157-L160 HydrophobicContact CE1-CB 3.94Å; Y157-L160 HydrophobicContact CE1-CD1 4.23Å; Y157-N164 WeakPolarHBondContact OH-CB 3.48Å; Y157-T176 PolarHBondContact OH-O 3.29Å; Y157-F178 AromaticContact CD2-CD1 3.92Å; Y157-F178 HydrophobicContact CD2-CD1 3.92Å; Y157-F178 HydrophobicContact CD2-CE1 4.17Å; Y157-F178 AromaticContact CE2-CD1 3.78Å; Y157-F178 HydrophobicContact CE2-CD1 3.78Å; Y157-F178 AromaticContact CE2-CE1 3.95Å; Y157-F178 HydrophobicContact CE2-CE1 3.95Å; Y157-L180 CarbonylContact O-C 3.52Å; Y157-D216 WeakPolarHBondContact CB-OD2 3.42Å; Y157-D216 PolarHBondContact N-OD2 3.1Å
158	R	95.8	Very high	95.2	Very high	16 Å²	16	20.2 Å²	20.2	6%	0.06	11%	0.107	C	C	.	.			trans	66.1	0.1	170.4	-52.4	-170.2	-62.6	172.8	1.1	119	I156 L180 C195 Y211 V215 D216	I156-R158 HydrophobicContact CB-CG 4.05Å; I156-R158 HydrophobicContact CG2-CG 3.44Å; I156-R158 VanDerWaalsContact CG2-CG 3.44Å; R158-L180 PolarHBondContact NE-O 3.22Å; R158-L180 PolarHBondContact NH2-O 3.26Å; R158-C195 VanDerWaalsContact CZ-SG 3.55Å; R158-Y211 PolarHBondContact NH1-OH 2.82Å; R158-V215 HydrophobicContact CG-CG2 4.32Å; R158-D216 WeakPolarHBondContact CA-OD1 3.34Å; R158-D216 PolarHBondContact N-OD1 2.99Å
159	D	93.4	Very high	94.8	Very high	14 Å²	14	21.5 Å²	21.5	8%	0.075	11%	0.114	C	C	.	.			trans	-136.2	42.4	176.7	-159.7	36.5	0	0	0	112.8	Y157 K161 N164 L180 T197	Y157-D159 VanDerWaalsContact C-N 3.3Å; Y157-D159 VanDerWaalsContact CE1-C 3.43Å; Y157-D159 WeakPolarHBondContact CE1-O 3.23Å; Y157-D159 PolarHBondContact O-N 2.84Å; D159-K161 PolarHBondContact O-N 3.11Å; D159-K161 IonicContact OD1-NZ 3.3Å; D159-K161 PolarHBondContact OD1-NZ 3.34Å; D159-K161 WeakPolarHBondContact OD2-CE 3.07Å; D159-K161 IonicContact OD2-NZ 3.78Å; D159-K161 PolarHBondContact OD2-NZ 3.31Å; D159-K161 VanDerWaalsContact OD2-NZ 3.09Å; D159-N164 PolarHBondContact O-ND2 3.39Å; D159-N164 PolarHBondContact OD2-ND2 2.71Å; D159-L180 HydrophobicContact CB-CB 4.18Å; D159-L180 HydrophobicContact CB-CD1 3.89Å; D159-L180 HydrophobicContact CB-CG 4.36Å; D159-T197 PolarHBondContact OD1-OG1 3.14Å
160	L	97.1	Very high	94.5	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.129	C	C	.	.			trans	-76.4	116.2	178.4	-176.1	71.5	0	0	0	110.9	V143 Y157 I165 L175 C219 L220 V223	V143-L160 HydrophobicContact CG1-CD1 3.67Å; V143-L160 HydrophobicContact CG1-CD2 3.67Å; V143-L160 HydrophobicContact CG1-CG 4.29Å; Y157-L160 HydrophobicContact CD1-CB 3.9Å; Y157-L160 HydrophobicContact CE1-CB 3.94Å; Y157-L160 HydrophobicContact CE1-CD1 4.23Å; L160-I165 HydrophobicContact CD1-CD1 4.01Å; L160-I165 HydrophobicContact CD1-CG1 4.06Å; L160-L175 HydrophobicContact CD1-CD1 4.44Å; L160-L175 HydrophobicContact CD1-CD2 3.9Å; L160-C219 HydrophobicContact CB-CB 3.69Å; L160-C219 HydrophobicContact CD2-CB 4.13Å; L160-C219 HydrophobicContact CG-CB 4.33Å; L160-L220 HydrophobicContact CD2-CB 4.06Å; L160-L220 HydrophobicContact CD2-CD1 4.49Å; L160-V223 HydrophobicContact CG-CG2 4.27Å
161	K	95.7	Very high	94.5	Very high	31 Å²	31	24.2 Å²	24.2	14%	0.135	13%	0.129	C	C	.	.	S	Bend	trans	-156.8	160.3	179.5	61.5	-175.9	166.3	-162.9	0	110.4	D159 E163 N164 I165 T197 Y200	D159-K161 PolarHBondContact O-N 3.11Å; D159-K161 IonicContact OD1-NZ 3.3Å; D159-K161 PolarHBondContact OD1-NZ 3.34Å; D159-K161 WeakPolarHBondContact OD2-CE 3.07Å; D159-K161 IonicContact OD2-NZ 3.78Å; D159-K161 PolarHBondContact OD2-NZ 3.31Å; D159-K161 VanDerWaalsContact OD2-NZ 3.09Å; K161-E163 WeakPolarHBondContact CB-OE2 3.46Å; K161-E163 HydrophobicContact CD-CB 4.38Å; K161-E163 WeakPolarHBondContact CD-OE2 3.39Å; K161-E163 HydrophobicContact CG-CB 4.3Å; K161-E163 VanDerWaalsContact CG-OE2 3.25Å; K161-E163 WeakPolarHBondContact CG-OE2 3.44Å; K161-E163 PolarHBondContact O-N 3.46Å; K161-E163 VanDerWaalsContact O-N 3.12Å; K161-N164 VanDerWaalsContact CE-ND2 3.28Å; K161-N164 WeakPolarHBondContact CE-ND2 3.32Å; K161-N164 HydrophobicContact CG-CB 4.16Å; K161-N164 PolarHBondContact O-N 2.78Å; K161-I165 WeakPolarHBondContact O-CG1 3.48Å; K161-I165 PolarHBondContact O-N 3.04Å; K161-T197 HydrophobicContact CD-CG2 4.14Å; K161-T197 WeakPolarHBondContact CD-OG1 3.49Å; K161-T197 PolarHBondContact NZ-OG1 2.88Å; K161-Y200 HydrophobicContact CB-CD1 4.45Å; K161-Y200 HydrophobicContact CB-CD2 3.8Å; K161-Y200 HydrophobicContact CB-CE1 4.28Å; K161-Y200 HydrophobicContact CB-CE2 3.58Å; K161-Y200 HydrophobicContact CB-CG 4.24Å
162	P	95.7	Very high	94.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.1	-176.9	-22.3	33.6	0	0	0	115.2	L121 F122 Y200 E226	L121-P162 HydrophobicContact CB-CB 4.42Å; L121-P162 PolarHBondContact N-O 2.86Å; F122-P162 HydrophobicContact CB-CB 3.85Å; F122-P162 HydrophobicContact CD2-CB 4.35Å; F122-P162 PolarHBondContact N-O 3.12Å; F122-P162 VanDerWaalsContact N-O 3.11Å; P162-Y200 WeakPolarHBondContact CD-OH 3.33Å; P162-E226 WeakPolarHBondContact CG-OE2 3.35Å
163	E	92.3	Very high	94.6	Very high	62 Å²	62	20.6 Å²	20.6	29%	0.29	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-30.2	176.4	-59	91.4	148.2	0	0	112.3	F122 K161 I165	F122-E163 HydrophobicContact CB-CG 4.09Å; F122-E163 HydrophobicContact CD2-CG 4.36Å; F122-E163 HydrophobicContact CG-CG 4.12Å; K161-E163 WeakPolarHBondContact CB-OE2 3.46Å; K161-E163 HydrophobicContact CD-CB 4.38Å; K161-E163 WeakPolarHBondContact CD-OE2 3.39Å; K161-E163 HydrophobicContact CG-CB 4.3Å; K161-E163 VanDerWaalsContact CG-OE2 3.25Å; K161-E163 WeakPolarHBondContact CG-OE2 3.44Å; K161-E163 PolarHBondContact O-N 3.46Å; K161-E163 VanDerWaalsContact O-N 3.12Å; E163-I165 VanDerWaalsContact C-N 3.34Å
164	N	94.2	Very high	94.8	Very high	11 Å²	11	18.3 Å²	18.3	6%	0.059	9%	0.092	C	C	.	.	S	Bend	trans	-92	2.1	178.4	-71.2	-6.6	0	0	0	112.8	Y157 D159 K161 T176	Y157-N164 WeakPolarHBondContact OH-CB 3.48Å; D159-N164 PolarHBondContact O-ND2 3.39Å; D159-N164 PolarHBondContact OD2-ND2 2.71Å; K161-N164 VanDerWaalsContact CE-ND2 3.28Å; K161-N164 WeakPolarHBondContact CE-ND2 3.32Å; K161-N164 HydrophobicContact CG-CB 4.16Å; K161-N164 PolarHBondContact O-N 2.78Å; N164-T176 WeakPolarHBondContact O-CG2 3.47Å; N164-T176 PolarHBondContact O-N 3.11Å
165	I	96.9	Very high	94.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	111.3	174	-58.2	165.8	0	0	0	107.5	L121 V143 L160 K161 E163 V173 L175 V223	L121-I165 HydrophobicContact CB-CB 3.95Å; L121-I165 HydrophobicContact CB-CG2 3.92Å; L121-I165 WeakPolarHBondContact CB-O 3.49Å; L121-I165 HydrophobicContact CD2-CB 4.23Å; L121-I165 HydrophobicContact CD2-CD1 3.96Å; L121-I165 HydrophobicContact CD2-CG2 3.95Å; L121-I165 HydrophobicContact CG-CG2 4.43Å; L121-I165 PolarHBondContact N-O 3.22Å; V143-I165 HydrophobicContact CG2-CD1 4.02Å; V143-I165 HydrophobicContact CG2-CG1 4.41Å; V143-I165 HydrophobicContact CG2-CG2 4.49Å; L160-I165 HydrophobicContact CD1-CD1 4.01Å; L160-I165 HydrophobicContact CD1-CG1 4.06Å; K161-I165 WeakPolarHBondContact O-CG1 3.48Å; K161-I165 PolarHBondContact O-N 3.04Å; E163-I165 VanDerWaalsContact C-N 3.34Å; I165-V173 HydrophobicContact CG2-CB 4.22Å; I165-V173 HydrophobicContact CG2-CG1 3.57Å; I165-V173 HydrophobicContact CG2-CG2 3.77Å; I165-L175 HydrophobicContact CB-CD2 4.41Å; I165-L175 HydrophobicContact CG1-CD2 3.64Å; I165-V223 HydrophobicContact CD1-CG1 3.8Å
166	L	95.2	Very high	94.7	Very high	30 Å²	30	18 Å²	18	16%	0.157	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	159	174.5	-56.1	-174.3	0	0	0	110.6	V116 G119 E120 V173 V174 T176	V116-L166 HydrophobicContact CB-CB 4.17Å; V116-L166 HydrophobicContact CB-CD1 3.84Å; V116-L166 HydrophobicContact CG1-CB 3.63Å; V116-L166 HydrophobicContact CG1-CD1 4.25Å; V116-L166 HydrophobicContact CG2-CD1 4.35Å; G119-L166 CarbonylContact O-C 3.57Å; G119-L166 WeakPolarHBondContact O-CA 3.31Å; E120-L166 HydrophobicContact CB-CD2 4.12Å; E120-L166 HydrophobicContact CG-CD2 3.5Å; E120-L166 VanDerWaalsContact CG-CD2 3.5Å; L166-V173 CarbonylContact O-C 3.53Å; L166-V173 WeakPolarHBondContact O-CA 3.44Å; L166-V174 PolarHBondContact N-O 2.87Å; L166-V174 PolarHBondContact O-N 2.89Å; L166-T176 HydrophobicContact CD1-CG2 4.03Å; L166-T176 HydrophobicContact CD2-CG2 4.46Å; L166-T176 HydrophobicContact CG-CG2 3.88Å
167	L	95.7	Very high	94.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134	167.1	-59.7	-175.6	0	0	0	110.1	V116 G118 G119 L121 Y139 H172 V173 F309 P311	V116-L167 WeakPolarHBondContact CG1-O 3.3Å; G118-L167 CarbonylContact C-O 3.54Å; G118-L167 WeakPolarHBondContact CA-O 3.25Å; G118-L167 PolarHBondContact N-O 2.81Å; G119-L167 PolarHBondContact O-N 2.93Å; L121-L167 HydrophobicContact CD1-CD2 4.31Å; Y139-L167 HydrophobicContact CD1-CD2 4.38Å; Y139-L167 HydrophobicContact CE1-CD2 3.86Å; L167-H172 CarbonylContact C-O 3.57Å; L167-H172 VanDerWaalsContact CA-O 3.31Å; L167-H172 WeakPolarHBondContact CA-O 3.45Å; L167-V173 HydrophobicContact CD2-CG2 4.12Å; L167-F309 HydrophobicContact CD1-CD1 3.85Å; L167-F309 HydrophobicContact CD1-CE1 4.06Å; L167-P311 HydrophobicContact CB-CG 4.24Å
168	D	92.1	Very high	93.7	Very high	19 Å²	19	20.7 Å²	20.7	10%	0.102	11%	0.105	C	C	.	.			trans	-75.1	176.8	170	74.1	16.2	0	0	0	112.1	V116 Q170 G171 H172 V174 K303 P311	V116-D168 HydrophobicContact CG1-CB 4.28Å; D168-Q170 PolarHBondContact O-N 3.44Å; D168-Q170 VanDerWaalsContact O-N 3.11Å; D168-Q170 WeakPolarHBondContact OD1-CA 3.5Å; D168-Q170 WeakPolarHBondContact OD1-CB 3.42Å; D168-Q170 PolarHBondContact OD1-N 2.99Å; D168-G171 PolarHBondContact O-N 3.03Å; D168-G171 PolarHBondContact OD1-N 2.9Å; D168-H172 PolarHBondContact N-O 3.03Å; D168-H172 IonicContact OD1-CD2 2.76Å; D168-H172 PolarHBondContact OD1-N 3.36Å; D168-H172 IonicContact OD2-CD2 2.66Å; D168-V174 HydrophobicContact CB-CG2 4.16Å; D168-K303 IonicContact OD2-NZ 3.56Å; D168-K303 PolarHBondContact OD2-NZ 3.34Å; D168-P311 WeakPolarHBondContact O-CG 3.47Å
169	C	89.4	Confident	92.9	Very high	32 Å²	32	20.5 Å²	20.5	22%	0.216	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.4	-178.7	62	0	0	0	0	114.6	N117 V313 T315	N117-C169 WeakPolarHBondContact OD1-CA 3.25Å; N117-C169 VanDerWaalsContact OD1-CB 3.29Å; N117-C169 WeakPolarHBondContact OD1-CB 3.49Å; N117-C169 PolarHBondContact OD1-N 3.47Å; C169-V313 HydrophobicContact CB-CG2 3.92Å; C169-T315 HydrophobicContact CB-CG2 4.4Å
170	Q	91.4	Very high	92.5	Very high	114 Å²	114	21.7 Å²	21.7	53%	0.533	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-17.5	177.8	-62	179.6	-66	0	0	111.6	D168 P307	D168-Q170 PolarHBondContact O-N 3.44Å; D168-Q170 VanDerWaalsContact O-N 3.11Å; D168-Q170 WeakPolarHBondContact OD1-CA 3.5Å; D168-Q170 WeakPolarHBondContact OD1-CB 3.42Å; D168-Q170 PolarHBondContact OD1-N 2.99Å; Q170-P307 WeakPolarHBondContact O-CB 3.41Å; Q170-P307 WeakPolarHBondContact O-CG 3.5Å
171	G	95.1	Very high	92.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	102.8	11.6	179.2	0	0	0	0	0	114.7	Y139 D168 F309	Y139-G171 WeakPolarHBondContact CE1-O 3.19Å; D168-G171 PolarHBondContact O-N 3.03Å; D168-G171 PolarHBondContact OD1-N 2.9Å; G171-F309 WeakPolarHBondContact CA-O 3.23Å
172	H	97.6	Very high	91.9	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.023	13%	0.126	C	C	.	.			trans	-80.3	149.4	172.9	-65	-80.9	0	0	0	111.3	F95 F138 E142 L167 D168 L305 P307	F95-H172 HydrophobicContact CD1-CB 4.44Å; F95-H172 HydrophobicContact CE1-CB 4.21Å; F138-H172 AromaticContact CZ-ND1 3.87Å; E142-H172 IonicContact OE1-CE1 3.69Å; E142-H172 IonicContact OE1-CG 3.49Å; E142-H172 IonicContact OE1-ND1 2.67Å; E142-H172 PolarHBondContact OE1-ND1 3.27Å; L167-H172 CarbonylContact C-O 3.57Å; L167-H172 VanDerWaalsContact CA-O 3.31Å; L167-H172 WeakPolarHBondContact CA-O 3.45Å; D168-H172 PolarHBondContact N-O 3.03Å; D168-H172 IonicContact OD1-CD2 2.76Å; D168-H172 PolarHBondContact OD1-N 3.36Å; D168-H172 IonicContact OD2-CD2 2.66Å; H172-L305 PolarHBondContact CE1-O 3.2Å; H172-P307 VanDerWaalsContact CE1-CG 3.44Å; H172-P307 WeakPolarHBondContact CE1-CG 3.33Å; H172-P307 WeakPolarHBondContact NE2-CG 3.46Å
173	V	97.4	Very high	91.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	141	173.6	165.2	0	0	0	0	111.4	F95 Y139 E142 V143 I165 L166 L167 L175	F95-V173 WeakPolarHBondContact CA-O 3.27Å; F95-V173 WeakPolarHBondContact CB-O 3.15Å; F95-V173 WeakPolarHBondContact CD1-O 3.29Å; Y139-V173 HydrophobicContact CD1-CG2 3.74Å; Y139-V173 HydrophobicContact CG-CG2 4.13Å; E142-V173 HydrophobicContact CB-CB 3.95Å; E142-V173 HydrophobicContact CB-CG2 4.34Å; E142-V173 WeakPolarHBondContact OE2-CB 3.35Å; E142-V173 PolarHBondContact OE2-N 3.22Å; V143-V173 HydrophobicContact CG2-CG1 3.84Å; V143-V173 HydrophobicContact CG2-CG2 4.39Å; I165-V173 HydrophobicContact CG2-CB 4.22Å; I165-V173 HydrophobicContact CG2-CG1 3.57Å; I165-V173 HydrophobicContact CG2-CG2 3.77Å; L166-V173 CarbonylContact O-C 3.53Å; L166-V173 WeakPolarHBondContact O-CA 3.44Å; L167-V173 HydrophobicContact CD2-CG2 4.12Å; V173-L175 HydrophobicContact CG1-CD2 4.08Å
174	V	96.4	Very high	91.3	Very high	12 Å²	12	25.6 Å²	25.6	7%	0.073	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	114.3	165.1	-174.8	0	0	0	0	108.3	F95 V97 V116 L166 D168	F95-V174 WeakPolarHBondContact O-CA 3.26Å; V97-V174 HydrophobicContact CB-CG1 3.88Å; V116-V174 HydrophobicContact CG1-CB 4.21Å; V116-V174 HydrophobicContact CG1-CG2 4.13Å; V116-V174 HydrophobicContact CG2-CB 4.12Å; V116-V174 HydrophobicContact CG2-CG1 3.91Å; V116-V174 HydrophobicContact CG2-CG2 4.3Å; L166-V174 PolarHBondContact N-O 2.87Å; L166-V174 PolarHBondContact O-N 2.89Å; D168-V174 HydrophobicContact CB-CG2 4.16Å
175	L	95.6	Very high	90.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.9	171.5	-55.9	-173.2	0	0	0	110	F95 L96 V97 V143 A146 I147 L160 I165 V173	F95-L175 PolarHBondContact O-N 2.9Å; L96-L175 HydrophobicContact CD2-CB 3.74Å; L96-L175 HydrophobicContact CD2-CD1 3.86Å; L96-L175 HydrophobicContact CD2-CG 4.06Å; V97-L175 WeakPolarHBondContact CB-O 3.18Å; V97-L175 WeakPolarHBondContact CG1-O 3.33Å; V97-L175 PolarHBondContact N-O 3.23Å; V143-L175 HydrophobicContact CG1-CD2 4.41Å; V143-L175 HydrophobicContact CG2-CD2 4.23Å; A146-L175 HydrophobicContact CB-CD1 3.76Å; A146-L175 HydrophobicContact CB-CG 4.21Å; I147-L175 HydrophobicContact CD1-CD1 4.04Å; I147-L175 HydrophobicContact CG1-CD1 4.33Å; L160-L175 HydrophobicContact CD1-CD1 4.44Å; L160-L175 HydrophobicContact CD1-CD2 3.9Å; I165-L175 HydrophobicContact CB-CD2 4.41Å; I165-L175 HydrophobicContact CG1-CD2 3.64Å; V173-L175 HydrophobicContact CG1-CD2 4.08Å
176	T	90.8	Very high	90.5	Very high	28 Å²	28	29.6 Å²	29.6	17%	0.172	16%	0.164	C	C	.	.			trans	-125.3	176.7	178.3	-177.3	0	0	0	0	111	Y157 N164 L166	Y157-T176 PolarHBondContact OH-O 3.29Å; N164-T176 WeakPolarHBondContact O-CG2 3.47Å; N164-T176 PolarHBondContact O-N 3.11Å; L166-T176 HydrophobicContact CD1-CG2 4.03Å; L166-T176 HydrophobicContact CD2-CG2 4.46Å; L166-T176 HydrophobicContact CG-CG2 3.88Å
177	D	84.4	Confident	89.9	Confident	56 Å²	56	31.5 Å²	31.5	30%	0.299	18%	0.178	S	C	.	.			trans	56.3	81.3	173.3	-153.5	5	0	0	0	115.6	K64 G179	K64-D177 IonicContact NZ-OD1 3.25Å; K64-D177 PolarHBondContact NZ-OD1 3.05Å; D177-G179 PolarHBondContact O-N 2.86Å
178	F	85.4	Confident	89.4	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.013	21%	0.214	C	C	.	.			trans	-86.3	18.9	177.3	-56.8	-83.5	0	0	0	113.1	E83 V86 L87 L96 V97 L150 Y157 L180 C181	E83-F178 HydrophobicContact CG-CB 4.25Å; V86-F178 HydrophobicContact CB-CB 4.42Å; V86-F178 HydrophobicContact CG1-CB 4.09Å; V86-F178 HydrophobicContact CG1-CD1 3.95Å; V86-F178 HydrophobicContact CG1-CG 4.03Å; L87-F178 HydrophobicContact CD2-CD2 3.44Å; L87-F178 VanDerWaalsContact CD2-CD2 3.44Å; L87-F178 HydrophobicContact CD2-CE2 3.61Å; L87-F178 HydrophobicContact CG-CD2 4.01Å; L96-F178 HydrophobicContact CB-CZ 4.26Å; L96-F178 HydrophobicContact CD2-CE1 4.09Å; L96-F178 HydrophobicContact CD2-CZ 4.08Å; V97-F178 HydrophobicContact CG1-CD2 4.39Å; V97-F178 HydrophobicContact CG1-CE2 3.53Å; V97-F178 HydrophobicContact CG1-CZ 4.27Å; L150-F178 HydrophobicContact CD1-CE1 4.23Å; L150-F178 HydrophobicContact CD2-CE1 4.45Å; Y157-F178 AromaticContact CD2-CD1 3.92Å; Y157-F178 HydrophobicContact CD2-CD1 3.92Å; Y157-F178 HydrophobicContact CD2-CE1 4.17Å; Y157-F178 AromaticContact CE2-CD1 3.78Å; Y157-F178 HydrophobicContact CE2-CD1 3.78Å; Y157-F178 AromaticContact CE2-CE1 3.95Å; Y157-F178 HydrophobicContact CE2-CE1 3.95Å; F178-L180 PolarHBondContact O-N 2.82Å; F178-C181 VanDerWaalsContact CA-SG 3.58Å; F178-C181 HydrophobicContact CB-CB 4.44Å; F178-C181 WeakPolarHBondContact O-CB 3.44Å; F178-C181 PolarHBondContact O-N 3.16Å; F178-C181 VanDerWaalsContact O-N 3.14Å
179	G	80.1	Confident	89.3	Confident	12 Å²	12	41.8 Å²	41.8	12%	0.124	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.5	-173.8	0	0	0	0	0	114.6	D177	D177-G179 PolarHBondContact O-N 2.86Å
180	L	83.8	Confident	89.5	Confident	40 Å²	40	44.2 Å²	44.2	21%	0.209	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	6.5	-179.8	-61.2	-171.6	0	0	0	113.3	Y157 R158 D159 F178 C195	Y157-L180 CarbonylContact O-C 3.52Å; R158-L180 PolarHBondContact NE-O 3.22Å; R158-L180 PolarHBondContact NH2-O 3.26Å; D159-L180 HydrophobicContact CB-CB 4.18Å; D159-L180 HydrophobicContact CB-CD1 3.89Å; D159-L180 HydrophobicContact CB-CG 4.36Å; F178-L180 PolarHBondContact O-N 2.82Å; L180-C195 HydrophobicContact CD1-CB 4.3Å; L180-C195 HydrophobicContact CD2-CB 4.47Å
181	C	89.9	Confident	89.6	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.02	22%	0.221	C	C	.	.			trans	-63.7	150	179.3	-66.1	0	0	0	0	112.4	V86 I155 I156 F178	V86-C181 HydrophobicContact CG2-CB 3.85Å; I155-C181 HydrophobicContact CG2-CB 3.99Å; I156-C181 CarbonylContact O-C 3.57Å; I156-C181 WeakPolarHBondContact O-CA 3.19Å; F178-C181 VanDerWaalsContact CA-SG 3.58Å; F178-C181 HydrophobicContact CB-CB 4.44Å; F178-C181 WeakPolarHBondContact O-CB 3.44Å; F178-C181 PolarHBondContact O-N 3.16Å; F178-C181 VanDerWaalsContact O-N 3.14Å
182	K	89.8	Confident	89.5	Confident	83 Å²	83	43.6 Å²	43.6	36%	0.361	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.2	174.2	-175.3	68.2	177.6	178.4	0	109.4	I155 I156 V185	I155-K182 CarbonylContact C-O 3.57Å; I155-K182 VanDerWaalsContact CA-O 3.31Å; I155-K182 WeakPolarHBondContact CA-O 3.4Å; I156-K182 PolarHBondContact N-O 3.3Å; I156-K182 PolarHBondContact O-N 3.45Å; K182-V185 HydrophobicContact CB-CG2 4.31Å; K182-V185 HydrophobicContact CG-CG2 3.5Å
183	E	89.6	Confident	89.3	Confident	40 Å²	40	45.9 Å²	45.9	19%	0.187	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	159.9	179.4	-57.4	-178.2	-106.8	0	0	112.2	S85 V86 K89 N154 I155 V185	S85-E183 WeakPolarHBondContact CB-OE1 3.43Å; S85-E183 VanDerWaalsContact OG-CD 3.31Å; S85-E183 PolarHBondContact OG-OE1 2.84Å; S85-E183 PolarHBondContact OG-OE2 2.98Å; V86-E183 HydrophobicContact CG2-CG 3.47Å; V86-E183 VanDerWaalsContact CG2-CG 3.47Å; V86-E183 PolarHBondContact N-OE1 3.19Å; K89-E183 VanDerWaalsContact CD-OE2 3.27Å; K89-E183 WeakPolarHBondContact CD-OE2 3.18Å; K89-E183 WeakPolarHBondContact CE-OE2 3.33Å; K89-E183 IonicContact NZ-OE2 2.81Å; K89-E183 PolarHBondContact NZ-OE2 2.98Å; N154-E183 CarbonylContact O-C 3.53Å; N154-E183 WeakPolarHBondContact O-CA 3.34Å; I155-E183 HydrophobicContact CG1-CG 4.19Å; I155-E183 HydrophobicContact CG2-CG 4.5Å; E183-V185 VanDerWaalsContact C-N 3.31Å
184	G	86	Confident	89	Confident	49 Å²	49	50.7 Å²	50.7	51%	0.505	29%	0.285	S	S	.	.			trans	69.6	32.1	173.1	0	0	0	0	0	112.3	N154	N154-G184 PolarHBondContact O-N 3.4Å
185	V	87.1	Confident	88.7	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.042	29%	0.288	C	S	.	.			trans	-99.8	95.8	172.9	-167.9	0	0	0	0	106.9	N154 I156 K182 E183 D189	N154-V185 WeakPolarHBondContact CB-O 3.49Å; N154-V185 PolarHBondContact O-N 3.14Å; I156-V185 HydrophobicContact CD1-CB 3.93Å; I156-V185 HydrophobicContact CD1-CG1 3.8Å; I156-V185 HydrophobicContact CD1-CG2 3.96Å; I156-V185 HydrophobicContact CG1-CB 4.26Å; I156-V185 HydrophobicContact CG1-CG2 4.34Å; K182-V185 HydrophobicContact CB-CG2 4.31Å; K182-V185 HydrophobicContact CG-CG2 3.5Å; E183-V185 VanDerWaalsContact C-N 3.31Å; V185-D189 HydrophobicContact CG1-CB 3.67Å; V185-D189 WeakPolarHBondContact CG1-O 3.45Å
186	E	88.7	Confident	88.4	Confident	89 Å²	89	52.3 Å²	52.3	42%	0.416	30%	0.301	S	S	.	.			trans	-62.8	165	173.7	-62.5	-61.8	145.7	0	0	110.4	N154 E188 D189	N154-E186 PolarHBondContact ND2-OE1 3.47Å; N154-E186 PolarHBondContact ND2-OE2 2.85Å; E186-E188 PolarHBondContact O-N 3.25Å; E186-E188 VanDerWaalsContact O-N 3.08Å; E186-D189 WeakPolarHBondContact CB-OD2 3.18Å; E186-D189 PolarHBondContact N-OD2 3.43Å; E186-D189 PolarHBondContact O-N 3.15Å
187	P	81.6	Confident	88.3	Confident	69 Å²	69	52.1 Å²	52.1	45%	0.448	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-29.8	-178.4	-26.3	34.3	0	0	0	115.3
188	E	84.3	Confident	88.7	Confident	160 Å²	160	51.4 Å²	51.4	75%	0.748	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-8.9	-178.8	-57.3	74.8	-167.2	0	0	113.1	E186	E186-E188 PolarHBondContact O-N 3.25Å; E186-E188 VanDerWaalsContact O-N 3.08Å
189	D	91.1	Very high	89.1	Confident	75 Å²	75	54 Å²	54	40%	0.401	31%	0.31	S	S	.	.			trans	-86.6	154.4	-177.8	-72.2	-30.6	0	0	0	111.9	V185 E186	V185-D189 HydrophobicContact CG1-CB 3.67Å; V185-D189 WeakPolarHBondContact CG1-O 3.45Å; E186-D189 WeakPolarHBondContact CB-OD2 3.18Å; E186-D189 PolarHBondContact N-OD2 3.43Å; E186-D189 PolarHBondContact O-N 3.15Å
190	T	94.2	Very high	89.9	Confident	83 Å²	83	54 Å²	54	51%	0.509	31%	0.307	S	S	.	.			trans	-129.3	162.7	175.1	56.3	0	0	0	0	111.3	P210 Y211	T190-P210 HydrophobicContact CG2-CB 4.28Å; T190-Y211 CarbonylContact C-O 3.48Å; T190-Y211 WeakPolarHBondContact CA-O 3.37Å; T190-Y211 WeakPolarHBondContact CB-O 3.34Å
191	T	93.6	Very high	90.6	Very high	15 Å²	15	52.4 Å²	52.4	9%	0.092	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-128.8	165.3	168.4	-160.7	0	0	0	0	110.5	P210 Y211	T191-P210 WeakPolarHBondContact O-CA 3.44Å; T191-Y211 HydrophobicContact CG2-CD2 3.9Å; T191-Y211 HydrophobicContact CG2-CE1 4.17Å; T191-Y211 HydrophobicContact CG2-CE2 3.29Å; T191-Y211 VanDerWaalsContact CG2-CZ 3.44Å; T191-Y211 PolarHBondContact N-O 2.79Å; T191-Y211 WeakPolarHBondContact O-CD1 3.3Å; T191-Y211 PolarHBondContact O-N 2.84Å
192	S	93.1	Very high	91	Very high	86 Å²	86	52.3 Å²	52.3	60%	0.601	30%	0.298	S	S	*	.			trans	-134.6	10.7	-173.3	57.3	0	0	0	0	113.2	F194	S192-F194 PolarHBondContact O-N 3.1Å
193	T	91.4	Very high	91.4	Very high	54 Å²	54	48.4 Å²	48.4	33%	0.331	28%	0.281	S	S	.	.			trans	-68.8	123.5	179	-49.9	0	0	0	0	110.1	C195 Y211	T193-C195 HydrophobicContact CG2-CB 4.35Å; T193-C195 PolarHBondContact O-N 2.71Å; T193-Y211 WeakPolarHBondContact O-CE1 3.27Å; T193-Y211 PolarHBondContact O-OH 3.5Å
194	F	92.1	Very high	91.8	Very high	101 Å²	101	46.5 Å²	46.5	44%	0.443	27%	0.272	S	S	.	.			trans	-76	105	170.7	-171	-83.2	0	0	0	109.6	S192 L201 V205 L206 K208	S192-F194 PolarHBondContact O-N 3.1Å; F194-L201 HydrophobicContact CE1-CD1 4.31Å; F194-L201 HydrophobicContact CZ-CD1 3.88Å; F194-V205 HydrophobicContact CD2-CG1 4.15Å; F194-V205 VanDerWaalsContact CD2-O 3.32Å; F194-V205 WeakPolarHBondContact CD2-O 3.39Å; F194-V205 HydrophobicContact CE2-CG1 4.48Å; F194-L206 HydrophobicContact CE2-CD2 4.17Å; F194-L206 HydrophobicContact CZ-CD2 4.18Å; F194-K208 HydrophobicContact CD2-CG 4.44Å
195	C	89.6	Confident	92.3	Very high	20 Å²	20	44.5 Å²	44.5	14%	0.135	25%	0.25	C	S	.	.			trans	-153.9	162.2	179.4	63.7	0	0	0	0	111.3	R158 L180 T193 L201	R158-C195 VanDerWaalsContact CZ-SG 3.55Å; L180-C195 HydrophobicContact CD1-CB 4.3Å; L180-C195 HydrophobicContact CD2-CB 4.47Å; T193-C195 HydrophobicContact CG2-CB 4.35Å; T193-C195 PolarHBondContact O-N 2.71Å; C195-L201 WeakPolarHBondContact O-CD2 3.44Å
196	G	89.9	Confident	92.8	Very high	26 Å²	26	45.2 Å²	45.2	27%	0.268	25%	0.254	S	S	.	.	S	Bend	trans	120.7	-178.5	-178.1	0	0	0	0	0	111.4
197	T	88.6	Confident	93.2	Very high	24 Å²	24	45.7 Å²	45.7	15%	0.147	25%	0.252	C	S	.	.			trans	-98.8	130.5	-177.7	-58.5	0	0	0	0	109.7	D159 K161 E199 Y200 L201	D159-T197 PolarHBondContact OD1-OG1 3.14Å; K161-T197 HydrophobicContact CD-CG2 4.14Å; K161-T197 WeakPolarHBondContact CD-OG1 3.49Å; K161-T197 PolarHBondContact NZ-OG1 2.88Å; T197-E199 VanDerWaalsContact C-N 3.28Å; T197-E199 WeakPolarHBondContact CG2-OE2 3.39Å; T197-E199 PolarHBondContact O-N 3.14Å; T197-Y200 HydrophobicContact CG2-CD2 3.92Å; T197-Y200 HydrophobicContact CG2-CE2 4.15Å; T197-Y200 PolarHBondContact O-N 3.2Å; T197-L201 PolarHBondContact O-N 3.38Å
198	P	92.6	Very high	93.9	Very high	40 Å²	40	50.2 Å²	50.2	26%	0.26	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-47	-43.1	-167.1	-33.4	38.1	0	0	0	116	Y200 L201 V239 M242 Y243	P198-Y200 PolarHBondContact O-N 3.2Å; P198-L201 PolarHBondContact O-N 2.97Å; P198-V239 HydrophobicContact CB-CG1 4.46Å; P198-M242 HydrophobicContact CB-CE 3.46Å; P198-M242 VanDerWaalsContact CB-CE 3.46Å; P198-Y243 HydrophobicContact CB-CE1 3.97Å
199	E	94.2	Very high	94.5	Very high	58 Å²	58	46.4 Å²	46.4	27%	0.271	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-66.5	-19.8	-177.7	-62.6	82.9	167.4	0	0	113.6	T197 P232 Y235 M242	T197-E199 VanDerWaalsContact C-N 3.28Å; T197-E199 WeakPolarHBondContact CG2-OE2 3.39Å; T197-E199 PolarHBondContact O-N 3.14Å; E199-P232 HydrophobicContact CB-CB 4.18Å; E199-P232 HydrophobicContact CB-CG 3.96Å; E199-P232 HydrophobicContact CG-CG 4.28Å; E199-Y235 HydrophobicContact CG-CD2 4.1Å; E199-Y235 HydrophobicContact CG-CE2 4.44Å; E199-M242 HydrophobicContact CB-SD 4.26Å; E199-M242 HydrophobicContact CG-CE 4.02Å; E199-M242 HydrophobicContact CG-SD 3.79Å
200	Y	97.3	Very high	94.8	Very high	11 Å²	11	46.4 Å²	46.4	4%	0.043	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-117.4	0.9	-174.2	-50.8	-87.7	0	0	0	112.8	K161 P162 T197 P198 A202 W218 C219 A222 V223 E226	K161-Y200 HydrophobicContact CB-CD1 4.45Å; K161-Y200 HydrophobicContact CB-CD2 3.8Å; K161-Y200 HydrophobicContact CB-CE1 4.28Å; K161-Y200 HydrophobicContact CB-CE2 3.58Å; K161-Y200 HydrophobicContact CB-CG 4.24Å; P162-Y200 WeakPolarHBondContact CD-OH 3.33Å; T197-Y200 HydrophobicContact CG2-CD2 3.92Å; T197-Y200 HydrophobicContact CG2-CE2 4.15Å; T197-Y200 PolarHBondContact O-N 3.2Å; P198-Y200 PolarHBondContact O-N 3.2Å; Y200-A202 PolarHBondContact O-N 3.28Å; Y200-W218 VanDerWaalsContact O-CD1 3.32Å; Y200-C219 PolarHBondContact O-SG 3.21Å; Y200-C219 VanDerWaalsContact O-SG 3.36Å; Y200-A222 HydrophobicContact CD1-CB 3.84Å; Y200-V223 HydrophobicContact CD1-CG2 4.13Å; Y200-V223 HydrophobicContact CE1-CG2 4Å; Y200-E226 PolarHBondContact OH-OE2 3.19Å
201	L	97.4	Very high	94.9	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	23%	0.227	C	C	.	.			trans	-63.6	133.4	178	-71.1	176.9	0	0	0	111.1	F194 C195 T197 P198 V205 L206 W218 Y243	F194-L201 HydrophobicContact CE1-CD1 4.31Å; F194-L201 HydrophobicContact CZ-CD1 3.88Å; C195-L201 WeakPolarHBondContact O-CD2 3.44Å; T197-L201 PolarHBondContact O-N 3.38Å; P198-L201 PolarHBondContact O-N 2.97Å; L201-V205 HydrophobicContact CD2-CG1 4.05Å; L201-L206 HydrophobicContact CB-CD2 3.98Å; L201-L206 HydrophobicContact CB-CG 4.14Å; L201-L206 HydrophobicContact CD1-CD2 3.61Å; L201-L206 HydrophobicContact CG-CD2 4.44Å; L201-W218 PolarHBondContact O-NE1 3.11Å; L201-W218 VanDerWaalsContact O-NE1 3.13Å; L201-Y243 HydrophobicContact CD1-CE1 4.19Å
202	A	98.1	Very high	94.9	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.017	23%	0.233	C	C	.	.			trans	-75.1	152.3	174.3	0	0	0	0	0	111.6	Y200 E204 V205 L206 V215 W218	Y200-A202 PolarHBondContact O-N 3.28Å; A202-E204 VanDerWaalsContact C-N 3.33Å; A202-E204 HydrophobicContact CB-CG 4.39Å; A202-E204 WeakPolarHBondContact CB-OE1 3.4Å; A202-E204 PolarHBondContact O-N 3.48Å; A202-V205 HydrophobicContact CB-CG2 4.25Å; A202-V205 WeakPolarHBondContact O-CB 3.48Å; A202-V205 PolarHBondContact O-N 2.94Å; A202-V205 VanDerWaalsContact O-N 3.08Å; A202-L206 PolarHBondContact O-N 3.1Å; A202-V215 HydrophobicContact CB-CB 4.39Å; A202-V215 HydrophobicContact CB-CG1 4.17Å; A202-W218 HydrophobicContact CB-CB 3.95Å; A202-W218 HydrophobicContact CB-CD2 4.15Å; A202-W218 HydrophobicContact CB-CG 3.68Å
203	P	98.4	Very high	95.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.1	-41.2	-177.2	-28.6	37.6	0	0	0	114.3	V205 L206 R207 W218 I246 L247 K271	P203-V205 VanDerWaalsContact C-N 3.31Å; P203-V205 PolarHBondContact O-N 2.74Å; P203-L206 PolarHBondContact O-N 3.07Å; P203-R207 WeakPolarHBondContact O-CG 3.45Å; P203-R207 PolarHBondContact O-N 3.05Å; P203-W218 HydrophobicContact CG-CE3 4.32Å; P203-W218 HydrophobicContact CG-CH2 3.57Å; P203-W218 HydrophobicContact CG-CZ2 4.03Å; P203-W218 HydrophobicContact CG-CZ3 3.72Å; P203-I246 HydrophobicContact CG-CG2 3.95Å; P203-L247 HydrophobicContact CB-CD2 4.24Å; P203-K271 HydrophobicContact CG-CB 4.12Å; P203-K271 HydrophobicContact CG-CG 4.22Å
204	E	98.4	Very high	95.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-35.2	177.7	59.7	-86.2	-159.1	0	0	112.5	A202 R207 K208 E209 V215 R276	A202-E204 VanDerWaalsContact C-N 3.33Å; A202-E204 HydrophobicContact CB-CG 4.39Å; A202-E204 WeakPolarHBondContact CB-OE1 3.4Å; A202-E204 PolarHBondContact O-N 3.48Å; E204-R207 PolarHBondContact O-N 3.39Å; E204-K208 PolarHBondContact O-N 3.29Å; E204-K208 VanDerWaalsContact O-N 3.14Å; E204-E209 HydrophobicContact CB-CB 4.29Å; E204-E209 PolarHBondContact O-N 2.83Å; E204-V215 HydrophobicContact CG-CG1 4.22Å; E204-V215 WeakPolarHBondContact OE1-CG1 3.44Å; E204-R276 VanDerWaalsContact CD-NH2 3.33Å; E204-R276 IonicContact OE1-CZ 3.93Å; E204-R276 VanDerWaalsContact OE1-CZ 3.3Å; E204-R276 IonicContact OE1-NH1 2.65Å; E204-R276 PolarHBondContact OE1-NH1 3.3Å; E204-R276 IonicContact OE1-NH2 3.55Å; E204-R276 PolarHBondContact OE1-NH2 3.42Å; E204-R276 IonicContact OE2-CZ 3.98Å; E204-R276 IonicContact OE2-NH1 2.67Å; E204-R276 IonicContact OE2-NH2 2.82Å; E204-R276 PolarHBondContact OE2-NH2 3.48Å
205	V	97.8	Very high	95.6	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-68.3	-42.2	175.7	-175.4	0	0	0	0	109.9	F194 L201 A202 P203 R207 K208 Y211 V215	F194-V205 HydrophobicContact CD2-CG1 4.15Å; F194-V205 VanDerWaalsContact CD2-O 3.32Å; F194-V205 WeakPolarHBondContact CD2-O 3.39Å; F194-V205 HydrophobicContact CE2-CG1 4.48Å; L201-V205 HydrophobicContact CD2-CG1 4.05Å; A202-V205 HydrophobicContact CB-CG2 4.25Å; A202-V205 WeakPolarHBondContact O-CB 3.48Å; A202-V205 PolarHBondContact O-N 2.94Å; A202-V205 VanDerWaalsContact O-N 3.08Å; P203-V205 VanDerWaalsContact C-N 3.31Å; P203-V205 PolarHBondContact O-N 2.74Å; V205-R207 VanDerWaalsContact C-N 3.34Å; V205-R207 PolarHBondContact O-N 3.42Å; V205-K208 PolarHBondContact O-N 3.3Å; V205-Y211 HydrophobicContact CG1-CE1 4.36Å; V205-Y211 HydrophobicContact CG2-CD1 3.8Å; V205-Y211 HydrophobicContact CG2-CD2 4.47Å; V205-Y211 HydrophobicContact CG2-CE1 3.91Å; V205-Y211 HydrophobicContact CG2-CG 4.09Å; V205-V215 HydrophobicContact CG2-CG1 3.92Å
206	L	97.1	Very high	96.1	Very high	22 Å²	22	33.3 Å²	33.3	12%	0.115	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-38.4	175.7	-67.3	-177.8	0	0	0	112.6	F194 L201 A202 P203 K208 Y243 I246 L247	F194-L206 HydrophobicContact CE2-CD2 4.17Å; F194-L206 HydrophobicContact CZ-CD2 4.18Å; L201-L206 HydrophobicContact CB-CD2 3.98Å; L201-L206 HydrophobicContact CB-CG 4.14Å; L201-L206 HydrophobicContact CD1-CD2 3.61Å; L201-L206 HydrophobicContact CG-CD2 4.44Å; A202-L206 PolarHBondContact O-N 3.1Å; P203-L206 PolarHBondContact O-N 3.07Å; L206-K208 PolarHBondContact O-N 3.37Å; L206-Y243 HydrophobicContact CD1-CD1 3.89Å; L206-Y243 HydrophobicContact CD1-CG 4.14Å; L206-Y243 HydrophobicContact CD2-CD1 3.66Å; L206-Y243 HydrophobicContact CD2-CD2 4.22Å; L206-Y243 HydrophobicContact CD2-CE1 3.69Å; L206-Y243 HydrophobicContact CD2-CE2 4.26Å; L206-Y243 HydrophobicContact CD2-CG 3.93Å; L206-Y243 HydrophobicContact CG-CD1 4.47Å; L206-I246 HydrophobicContact CD1-CB 3.74Å; L206-I246 HydrophobicContact CD1-CD1 4.01Å; L206-I246 HydrophobicContact CD1-CG1 4.49Å; L206-I246 HydrophobicContact CD1-CG2 3.5Å; L206-L247 HydrophobicContact CB-CD2 4.01Å; L206-L247 HydrophobicContact CB-CG 4.44Å; L206-L247 HydrophobicContact CD1-CD2 4.5Å; L206-L247 HydrophobicContact CD1-CG 4.29Å
207	R	96.9	Very high	96.5	Very high	98 Å²	98	32.1 Å²	32.1	37%	0.37	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-7.6	173.8	-67.2	-176.7	-167.5	112.6	6.2	113.6	P203 E204 V205 E209 L247	P203-R207 WeakPolarHBondContact O-CG 3.45Å; P203-R207 PolarHBondContact O-N 3.05Å; E204-R207 PolarHBondContact O-N 3.39Å; V205-R207 VanDerWaalsContact C-N 3.34Å; V205-R207 PolarHBondContact O-N 3.42Å; R207-E209 HydrophobicContact CB-CG 3.76Å; R207-E209 VanDerWaalsContact CD-OE1 3.23Å; R207-E209 WeakPolarHBondContact CD-OE1 3.28Å; R207-E209 PolarHBondContact O-N 2.87Å; R207-L247 HydrophobicContact CG-CD2 3.7Å
208	K	95.9	Very high	97	Very high	165 Å²	165	31 Å²	31	72%	0.717	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	31.3	-173.7	-52.2	175.8	-178.5	174.8	0	112.3	F194 E204 V205 L206	F194-K208 HydrophobicContact CD2-CG 4.44Å; E204-K208 PolarHBondContact O-N 3.29Å; E204-K208 VanDerWaalsContact O-N 3.14Å; V205-K208 PolarHBondContact O-N 3.3Å; L206-K208 PolarHBondContact O-N 3.37Å
209	E	96.9	Very high	97.2	Very high	80 Å²	80	29.6 Å²	29.6	37%	0.374	14%	0.14	S	C	.	.			trans	-79.2	152.7	173.5	-69.1	166.9	175.5	0	0	109.5	E204 R207 Y211	E204-E209 HydrophobicContact CB-CB 4.29Å; E204-E209 PolarHBondContact O-N 2.83Å; R207-E209 HydrophobicContact CB-CG 3.76Å; R207-E209 VanDerWaalsContact CD-OE1 3.23Å; R207-E209 WeakPolarHBondContact CD-OE1 3.28Å; R207-E209 PolarHBondContact O-N 2.87Å; E209-Y211 PolarHBondContact O-N 2.76Å
210	P	96.4	Very high	97.5	Very high	74 Å²	74	26.9 Å²	26.9	48%	0.481	13%	0.128	S	C	.	.			trans	-58.6	134.3	165.5	-20.7	32.8	0	0	0	110.4	T190 T191 Q273	T190-P210 HydrophobicContact CG2-CB 4.28Å; T191-P210 WeakPolarHBondContact O-CA 3.44Å; P210-Q273 PolarHBondContact O-NE2 3.34Å
211	Y	96.6	Very high	97.5	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.016	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-133.5	158.1	-177.2	64.8	-98.2	0	0	0	111.1	R158 T190 T191 T193 V205 E209 V215	R158-Y211 PolarHBondContact NH1-OH 2.82Å; T190-Y211 CarbonylContact C-O 3.48Å; T190-Y211 WeakPolarHBondContact CA-O 3.37Å; T190-Y211 WeakPolarHBondContact CB-O 3.34Å; T191-Y211 HydrophobicContact CG2-CD2 3.9Å; T191-Y211 HydrophobicContact CG2-CE1 4.17Å; T191-Y211 HydrophobicContact CG2-CE2 3.29Å; T191-Y211 VanDerWaalsContact CG2-CZ 3.44Å; T191-Y211 PolarHBondContact N-O 2.79Å; T191-Y211 WeakPolarHBondContact O-CD1 3.3Å; T191-Y211 PolarHBondContact O-N 2.84Å; T193-Y211 WeakPolarHBondContact O-CE1 3.27Å; T193-Y211 PolarHBondContact O-OH 3.5Å; V205-Y211 HydrophobicContact CG1-CE1 4.36Å; V205-Y211 HydrophobicContact CG2-CD1 3.8Å; V205-Y211 HydrophobicContact CG2-CD2 4.47Å; V205-Y211 HydrophobicContact CG2-CE1 3.91Å; V205-Y211 HydrophobicContact CG2-CG 4.09Å; E209-Y211 PolarHBondContact O-N 2.76Å; Y211-V215 HydrophobicContact CD2-CB 4.33Å; Y211-V215 HydrophobicContact CD2-CG1 3.41Å; Y211-V215 VanDerWaalsContact CD2-CG1 3.41Å; Y211-V215 HydrophobicContact CD2-CG2 3.98Å; Y211-V215 HydrophobicContact CE2-CG1 4.17Å; Y211-V215 HydrophobicContact CE2-CG2 4.13Å; Y211-V215 HydrophobicContact CG-CG1 3.77Å
212	D	95.1	Very high	97.6	Very high	40 Å²	40	26 Å²	26	21%	0.214	12%	0.124	C	C	.	.			trans	-117.7	-161.7	-178.3	63.1	29.5	0	0	0	111.1	A214 V215	D212-A214 PolarHBondContact O-N 3.35Å; D212-A214 VanDerWaalsContact O-N 3.17Å; D212-A214 WeakPolarHBondContact OD1-CA 3.27Å; D212-A214 WeakPolarHBondContact OD1-CB 3.22Å; D212-A214 PolarHBondContact OD1-N 3.4Å; D212-V215 WeakPolarHBondContact O-CG2 3.47Å; D212-V215 PolarHBondContact O-N 3.48Å
213	R	96.1	Very high	97.6	Very high	35 Å²	35	26 Å²	26	13%	0.132	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.6	179.4	71.5	-175.5	76.5	-156.1	-7.7	114.1	H151 I156 V215 D216 D282	H151-R213 PolarHBondContact CE1-O 3.33Å; H151-R213 VanDerWaalsContact CE1-O 3.3Å; H151-R213 PolarHBondContact O-NH1 3.37Å; I156-R213 HydrophobicContact CD1-CB 4.34Å; I156-R213 HydrophobicContact CG1-CB 4.1Å; R213-V215 PolarHBondContact O-N 3.15Å; R213-V215 VanDerWaalsContact O-N 3.13Å; R213-D216 PolarHBondContact O-N 3.48Å; R213-D216 VanDerWaalsContact O-N 3.11Å; R213-D282 VanDerWaalsContact CD-OD1 3.27Å; R213-D282 WeakPolarHBondContact CD-OD1 3.43Å
214	A	97	Very high	97.7	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-14.7	-179.4	0	0	0	0	0	113.8	D212 D216 W217 W218 R276	D212-A214 PolarHBondContact O-N 3.35Å; D212-A214 VanDerWaalsContact O-N 3.17Å; D212-A214 WeakPolarHBondContact OD1-CA 3.27Å; D212-A214 WeakPolarHBondContact OD1-CB 3.22Å; D212-A214 PolarHBondContact OD1-N 3.4Å; A214-D216 VanDerWaalsContact C-N 3.26Å; A214-D216 PolarHBondContact O-N 3.08Å; A214-W217 PolarHBondContact O-N 2.84Å; A214-W218 PolarHBondContact O-N 3.21Å; A214-R276 WeakPolarHBondContact O-CD 3.46Å; A214-R276 PolarHBondContact O-NH1 3.32Å
215	V	98	Very high	97.7	Very high	6 Å²	6	27 Å²	27	4%	0.036	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-33.5	171.4	-62.1	0	0	0	0	112.2	I156 R158 A202 E204 V205 Y211 D212 R213 W217 W218 C219	I156-V215 HydrophobicContact CG2-CG2 3.85Å; R158-V215 HydrophobicContact CG-CG2 4.32Å; A202-V215 HydrophobicContact CB-CB 4.39Å; A202-V215 HydrophobicContact CB-CG1 4.17Å; E204-V215 HydrophobicContact CG-CG1 4.22Å; E204-V215 WeakPolarHBondContact OE1-CG1 3.44Å; V205-V215 HydrophobicContact CG2-CG1 3.92Å; Y211-V215 HydrophobicContact CD2-CB 4.33Å; Y211-V215 HydrophobicContact CD2-CG1 3.41Å; Y211-V215 VanDerWaalsContact CD2-CG1 3.41Å; Y211-V215 HydrophobicContact CD2-CG2 3.98Å; Y211-V215 HydrophobicContact CE2-CG1 4.17Å; Y211-V215 HydrophobicContact CE2-CG2 4.13Å; Y211-V215 HydrophobicContact CG-CG1 3.77Å; D212-V215 WeakPolarHBondContact O-CG2 3.47Å; D212-V215 PolarHBondContact O-N 3.48Å; R213-V215 PolarHBondContact O-N 3.15Å; R213-V215 VanDerWaalsContact O-N 3.13Å; V215-W217 VanDerWaalsContact C-N 3.31Å; V215-W217 PolarHBondContact O-N 2.75Å; V215-W218 WeakPolarHBondContact O-CB 3.16Å; V215-W218 PolarHBondContact O-N 3.01Å; V215-C219 PolarHBondContact O-N 3.35Å; V215-C219 VanDerWaalsContact O-N 3.09Å; V215-C219 PolarHBondContact O-SG 3.41Å
216	D	98.6	Very high	97.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.5	-30.8	179.2	-74.5	-25.8	0	0	0	111.7	I147 H151 I156 Y157 R158 R213 A214 C219 L220	I147-D216 HydrophobicContact CD1-CB 4.45Å; I147-D216 HydrophobicContact CG2-CB 3.81Å; H151-D216 IonicContact CD2-OD2 3.3Å; H151-D216 IonicContact NE2-OD2 2.63Å; H151-D216 PolarHBondContact NE2-OD2 3.18Å; H151-D216 VanDerWaalsContact NE2-OD2 3.1Å; I156-D216 VanDerWaalsContact CG2-OD2 3.28Å; I156-D216 WeakPolarHBondContact CG2-OD2 3.39Å; Y157-D216 WeakPolarHBondContact CB-OD2 3.42Å; Y157-D216 PolarHBondContact N-OD2 3.1Å; R158-D216 WeakPolarHBondContact CA-OD1 3.34Å; R158-D216 PolarHBondContact N-OD1 2.99Å; R213-D216 PolarHBondContact O-N 3.48Å; R213-D216 VanDerWaalsContact O-N 3.11Å; A214-D216 VanDerWaalsContact C-N 3.26Å; A214-D216 PolarHBondContact O-N 3.08Å; D216-C219 PolarHBondContact O-N 3.4Å; D216-L220 PolarHBondContact O-N 2.95Å
217	W	98.8	Very high	97.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-70.7	-34.1	173.8	-57.5	131.6	0	0	0	112.4	A144 I147 H151 A214 V215 L220 G221 L268 G278 D282 F283 I286	A144-W217 HydrophobicContact CB-CZ3 4.14Å; I147-W217 HydrophobicContact CB-CH2 4.07Å; I147-W217 HydrophobicContact CB-CZ3 4.08Å; I147-W217 HydrophobicContact CG2-CE3 4.22Å; I147-W217 HydrophobicContact CG2-CH2 3.61Å; I147-W217 HydrophobicContact CG2-CZ2 4.02Å; I147-W217 HydrophobicContact CG2-CZ3 3.72Å; H151-W217 AromaticContact CE1-CE2 3.77Å; H151-W217 AromaticContact CE1-CZ2 3.84Å; H151-W217 AromaticContact CE1-NE1 3.76Å; H151-W217 AromaticContact ND1-CE2 3.87Å; H151-W217 AromaticContact ND1-CZ2 3.63Å; H151-W217 AromaticContact ND1-NE1 3.85Å; A214-W217 PolarHBondContact O-N 2.84Å; V215-W217 VanDerWaalsContact C-N 3.31Å; V215-W217 PolarHBondContact O-N 2.75Å; W217-L220 HydrophobicContact CE3-CD2 3.8Å; W217-L220 HydrophobicContact CZ3-CD2 3.96Å; W217-L220 PolarHBondContact O-N 3.48Å; W217-G221 PolarHBondContact O-N 3.35Å; W217-L268 HydrophobicContact CB-CD2 4.04Å; W217-G278 PolarHBondContact NE1-O 2.93Å; W217-D282 WeakPolarHBondContact CZ2-OD1 3.45Å; W217-D282 PolarHBondContact NE1-OD1 2.89Å; W217-F283 HydrophobicContact CH2-CB 4.07Å; W217-F283 AromaticContact CH2-CD2 3.92Å; W217-F283 HydrophobicContact CH2-CD2 3.92Å; W217-F283 HydrophobicContact CH2-CG 4.45Å; W217-F283 HydrophobicContact CZ2-CB 4.03Å; W217-I286 HydrophobicContact CD2-CD1 3.97Å; W217-I286 HydrophobicContact CD2-CG1 3.95Å; W217-I286 HydrophobicContact CE3-CD1 3.93Å; W217-I286 HydrophobicContact CE3-CG1 3.77Å; W217-I286 HydrophobicContact CG-CD1 4.32Å; W217-I286 HydrophobicContact CH2-CG1 3.96Å; W217-I286 HydrophobicContact CZ2-CG1 4.1Å; W217-I286 HydrophobicContact CZ3-CD1 4.43Å; W217-I286 HydrophobicContact CZ3-CG1 3.78Å
218	W	98.8	Very high	97.8	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-48.7	168.4	173	-85.8	0	0	0	111.1	Y200 L201 A202 P203 A214 V215 L220 G221 A222 F234 I246 L269 K271	Y200-W218 VanDerWaalsContact O-CD1 3.32Å; L201-W218 PolarHBondContact O-NE1 3.11Å; L201-W218 VanDerWaalsContact O-NE1 3.13Å; A202-W218 HydrophobicContact CB-CB 3.95Å; A202-W218 HydrophobicContact CB-CD2 4.15Å; A202-W218 HydrophobicContact CB-CG 3.68Å; P203-W218 HydrophobicContact CG-CE3 4.32Å; P203-W218 HydrophobicContact CG-CH2 3.57Å; P203-W218 HydrophobicContact CG-CZ2 4.03Å; P203-W218 HydrophobicContact CG-CZ3 3.72Å; A214-W218 PolarHBondContact O-N 3.21Å; V215-W218 WeakPolarHBondContact O-CB 3.16Å; V215-W218 PolarHBondContact O-N 3.01Å; W218-L220 VanDerWaalsContact C-N 3.3Å; W218-L220 PolarHBondContact O-N 2.87Å; W218-G221 WeakPolarHBondContact O-CA 3.46Å; W218-G221 PolarHBondContact O-N 2.9Å; W218-A222 PolarHBondContact O-N 3.1Å; W218-F234 HydrophobicContact CH2-CD2 4.44Å; W218-F234 AromaticContact CH2-CE2 3.65Å; W218-F234 HydrophobicContact CH2-CE2 3.65Å; W218-F234 HydrophobicContact CH2-CZ 4.34Å; W218-F234 HydrophobicContact CZ2-CD2 4.1Å; W218-F234 AromaticContact CZ2-CE2 3.69Å; W218-F234 HydrophobicContact CZ2-CE2 3.69Å; W218-I246 HydrophobicContact CH2-CG2 4.48Å; W218-I246 HydrophobicContact CZ2-CG2 3.95Å; W218-L269 HydrophobicContact CD2-CD2 3.9Å; W218-L269 HydrophobicContact CE3-CB 4.46Å; W218-L269 HydrophobicContact CE3-CD2 4.06Å; W218-L269 HydrophobicContact CG-CD2 4.42Å; W218-L269 HydrophobicContact CH2-CD2 4.36Å; W218-L269 HydrophobicContact CZ2-CD2 4.19Å; W218-L269 VanDerWaalsContact CZ3-C 3.47Å; W218-L269 HydrophobicContact CZ3-CB 4.2Å; W218-L269 HydrophobicContact CZ3-CD2 4.3Å; W218-L269 VanDerWaalsContact CZ3-O 3.29Å; W218-L269 WeakPolarHBondContact CZ3-O 3.32Å; W218-K271 HydrophobicContact CH2-CG 4.45Å; W218-K271 HydrophobicContact CZ3-CG 4.42Å
219	C	98.6	Very high	97.8	Very high	10 Å²	10	15.5 Å²	15.5	7%	0.068	8%	0.079	C	C	.	.	H	α-helix	trans	-60.7	-39.4	178.4	-60.6	0	0	0	0	111.9	L160 Y200 V215 D216 G221 A222 V223	L160-C219 HydrophobicContact CB-CB 3.69Å; L160-C219 HydrophobicContact CD2-CB 4.13Å; L160-C219 HydrophobicContact CG-CB 4.33Å; Y200-C219 PolarHBondContact O-SG 3.21Å; Y200-C219 VanDerWaalsContact O-SG 3.36Å; V215-C219 PolarHBondContact O-N 3.35Å; V215-C219 VanDerWaalsContact O-N 3.09Å; V215-C219 PolarHBondContact O-SG 3.41Å; D216-C219 PolarHBondContact O-N 3.4Å; C219-G221 VanDerWaalsContact C-N 3.3Å; C219-G221 PolarHBondContact O-N 3.15Å; C219-A222 PolarHBondContact O-N 3.08Å; C219-V223 WeakPolarHBondContact O-CG2 3.31Å; C219-V223 PolarHBondContact O-N 2.91Å
220	L	98.9	Very high	97.7	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-60	-42.4	173.8	178.3	65.9	0	0	0	111.1	A140 V143 A144 L160 D216 W217 W218 L224 L268 I286	A140-L220 HydrophobicContact CB-CD1 4.28Å; V143-L220 HydrophobicContact CB-CD1 4.08Å; V143-L220 HydrophobicContact CG1-CD1 3.78Å; A144-L220 HydrophobicContact CB-CD2 3.86Å; L160-L220 HydrophobicContact CD2-CB 4.06Å; L160-L220 HydrophobicContact CD2-CD1 4.49Å; D216-L220 PolarHBondContact O-N 2.95Å; W217-L220 HydrophobicContact CE3-CD2 3.8Å; W217-L220 HydrophobicContact CZ3-CD2 3.96Å; W217-L220 PolarHBondContact O-N 3.48Å; W218-L220 VanDerWaalsContact C-N 3.3Å; W218-L220 PolarHBondContact O-N 2.87Å; L220-L224 VanDerWaalsContact O-CB 3.25Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 2.98Å; L220-L268 HydrophobicContact CD2-CD1 4.41Å; L220-L268 HydrophobicContact CG-CD1 4.36Å; L220-I286 HydrophobicContact CD2-CG2 4.34Å
221	G	98.8	Very high	97.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.2	-43.5	174	0	0	0	0	0	112.6	W217 W218 C219 L224 Y225	W217-G221 PolarHBondContact O-N 3.35Å; W218-G221 WeakPolarHBondContact O-CA 3.46Å; W218-G221 PolarHBondContact O-N 2.9Å; C219-G221 VanDerWaalsContact C-N 3.3Å; C219-G221 PolarHBondContact O-N 3.15Å; G221-L224 PolarHBondContact O-N 2.84Å; G221-Y225 WeakPolarHBondContact O-CB 3.49Å; G221-Y225 PolarHBondContact O-N 2.88Å
222	A	98.8	Very high	97.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-67	-44.9	179.5	0	0	0	0	0	111.8	Y200 W218 C219 Y225 E226 P233 L269	Y200-A222 HydrophobicContact CD1-CB 3.84Å; W218-A222 PolarHBondContact O-N 3.1Å; C219-A222 PolarHBondContact O-N 3.08Å; A222-Y225 WeakPolarHBondContact O-CB 3.21Å; A222-Y225 PolarHBondContact O-N 3.27Å; A222-E226 PolarHBondContact O-N 3.32Å; A222-P233 HydrophobicContact CB-CG 4.35Å; A222-L269 HydrophobicContact CB-CD2 4.29Å
223	V	98.7	Very high	97.6	Very high	1 Å²	1	11 Å²	11	1%	0.006	6%	0.058	C	C	.	.	H	α-helix	trans	-63.7	-42.4	174.8	171	0	0	0	0	111.3	L160 I165 Y200 C219 Y225 E226 M227	L160-V223 HydrophobicContact CG-CG2 4.27Å; I165-V223 HydrophobicContact CD1-CG1 3.8Å; Y200-V223 HydrophobicContact CD1-CG2 4.13Å; Y200-V223 HydrophobicContact CE1-CG2 4Å; C219-V223 WeakPolarHBondContact O-CG2 3.31Å; C219-V223 PolarHBondContact O-N 2.91Å; V223-Y225 VanDerWaalsContact C-N 3.35Å; V223-E226 PolarHBondContact O-N 3.15Å; V223-M227 HydrophobicContact CG1-CE 4.28Å; V223-M227 WeakPolarHBondContact O-CG 3.27Å; V223-M227 PolarHBondContact O-N 2.71Å
224	L	98.8	Very high	97.7	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63.1	-42.6	175.6	176.3	59	0	0	0	111.4	A136 A140 L220 G221 E226 M227 L228 L264 L265 F291	A136-L224 HydrophobicContact CB-CD1 3.94Å; A140-L224 HydrophobicContact CB-CD1 4.16Å; L220-L224 VanDerWaalsContact O-CB 3.25Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 2.98Å; G221-L224 PolarHBondContact O-N 2.84Å; L224-E226 VanDerWaalsContact C-N 3.33Å; L224-E226 PolarHBondContact O-N 3.02Å; L224-M227 HydrophobicContact CB-CE 4.4Å; L224-M227 HydrophobicContact CD1-CE 3.99Å; L224-M227 PolarHBondContact O-N 2.81Å; L224-L228 HydrophobicContact CD1-CD1 3.93Å; L224-L228 HydrophobicContact CD1-CG 4.2Å; L224-L228 HydrophobicContact CG-CD1 4.09Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.16Å; L224-L228 PolarHBondContact O-N 2.74Å; L224-L264 HydrophobicContact CD2-CD2 3.52Å; L224-L264 HydrophobicContact CD2-CG 4.16Å; L224-L265 HydrophobicContact CB-CD2 4.21Å; L224-L265 HydrophobicContact CD2-CD2 4.07Å; L224-L265 HydrophobicContact CG-CD2 3.95Å; L224-F291 HydrophobicContact CD1-CE1 4.45Å; L224-F291 HydrophobicContact CD1-CZ 4.19Å; L224-F291 HydrophobicContact CD2-CE1 4.21Å; L224-F291 HydrophobicContact CD2-CZ 4.38Å
225	Y	98.7	Very high	97.6	Very high	21 Å²	21	12.9 Å²	12.9	8%	0.082	7%	0.065	C	C	.	.	H	α-helix	trans	-59	-47.5	175.9	-174.7	-79.6	0	0	0	110.6	G221 A222 V223 L228 H229 L231 P233 L251 Q252 L265 L269	G221-Y225 WeakPolarHBondContact O-CB 3.49Å; G221-Y225 PolarHBondContact O-N 2.88Å; A222-Y225 WeakPolarHBondContact O-CB 3.21Å; A222-Y225 PolarHBondContact O-N 3.27Å; V223-Y225 VanDerWaalsContact C-N 3.35Å; Y225-L228 CarbonylContact O-C 3.45Å; Y225-L228 PolarHBondContact O-N 3.38Å; Y225-L228 VanDerWaalsContact O-N 3.13Å; Y225-H229 HydrophobicContact CD1-CB 4.09Å; Y225-H229 AromaticContact CD1-ND1 3.67Å; Y225-H229 AromaticContact CD2-CE1 3.94Å; Y225-H229 AromaticContact CD2-ND1 3.53Å; Y225-H229 HydrophobicContact CE1-CB 3.63Å; Y225-H229 AromaticContact CE1-CG 3.81Å; Y225-H229 AromaticContact CE1-ND1 3.6Å; Y225-H229 AromaticContact CE2-CE1 3.8Å; Y225-H229 AromaticContact CE2-ND1 3.46Å; Y225-H229 WeakPolarHBondContact CE2-ND1 3.42Å; Y225-H229 AromaticContact CG-ND1 3.62Å; Y225-H229 AromaticContact CZ-CG 3.8Å; Y225-H229 AromaticContact CZ-ND1 3.5Å; Y225-H229 WeakPolarHBondContact O-CB 3.44Å; Y225-H229 PolarHBondContact O-N 3.38Å; Y225-H229 PolarHBondContact O-ND1 3.2Å; Y225-L231 WeakPolarHBondContact CD1-O 3.43Å; Y225-L231 WeakPolarHBondContact CE1-O 3.4Å; Y225-P233 HydrophobicContact CD1-CB 3.77Å; Y225-P233 HydrophobicContact CD1-CG 4.36Å; Y225-P233 HydrophobicContact CD2-CB 3.94Å; Y225-P233 VanDerWaalsContact CE1-CA 3.45Å; Y225-P233 HydrophobicContact CE1-CB 4.02Å; Y225-P233 HydrophobicContact CE2-CB 4.17Å; Y225-P233 HydrophobicContact CG-CB 3.74Å; Y225-P233 HydrophobicContact CG-CG 4.28Å; Y225-L251 HydrophobicContact CD2-CD1 4.07Å; Y225-L251 HydrophobicContact CE2-CD1 3.96Å; Y225-Q252 VanDerWaalsContact CE2-O 3.3Å; Y225-Q252 WeakPolarHBondContact CE2-O 3.41Å; Y225-Q252 PolarHBondContact OH-O 2.88Å; Y225-L265 HydrophobicContact CD2-CD1 4.07Å; Y225-L265 HydrophobicContact CD2-CD2 4.38Å; Y225-L269 HydrophobicContact CD2-CD1 4.48Å
226	E	98.1	Very high	97.4	Very high	5 Å²	5	13.9 Å²	13.9	2%	0.023	7%	0.073	C	C	.	.	H	α-helix	trans	-65.1	-41.7	179.3	-166.9	-168.6	170.8	0	0	111.9	L125 P162 Y200 A222 V223 L224 L228 H229 G230 L231 P232	L125-E226 HydrophobicContact CD2-CB 4.41Å; L125-E226 HydrophobicContact CD2-CG 3.79Å; P162-E226 WeakPolarHBondContact CG-OE2 3.35Å; Y200-E226 PolarHBondContact OH-OE2 3.19Å; A222-E226 PolarHBondContact O-N 3.32Å; V223-E226 PolarHBondContact O-N 3.15Å; L224-E226 VanDerWaalsContact C-N 3.33Å; L224-E226 PolarHBondContact O-N 3.02Å; E226-L228 PolarHBondContact O-N 2.87Å; E226-H229 PolarHBondContact O-N 3.06Å; E226-G230 VanDerWaalsContact O-CA 3.23Å; E226-G230 WeakPolarHBondContact O-CA 3.45Å; E226-G230 PolarHBondContact O-N 3.45Å; E226-L231 WeakPolarHBondContact CA-O 3.47Å; E226-P232 HydrophobicContact CG-CG 4.44Å
227	M	98.4	Very high	97.1	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-55.6	-37.9	172.6	-76.7	-166.6	-67.8	0	0	111.5	L121 L125 F131 A136 Y139 A140 V223 L224	L121-M227 HydrophobicContact CD2-CG 4.32Å; L121-M227 HydrophobicContact CD2-SD 3.94Å; L125-M227 HydrophobicContact CD2-CG 4.48Å; F131-M227 HydrophobicContact CD2-CB 3.94Å; F131-M227 HydrophobicContact CD2-CG 3.77Å; F131-M227 HydrophobicContact CD2-SD 3.93Å; F131-M227 HydrophobicContact CE2-CG 4.05Å; F131-M227 HydrophobicContact CE2-SD 4.21Å; F131-M227 PolarHBondContact N-O 2.87Å; A136-M227 HydrophobicContact CB-CB 3.96Å; A136-M227 HydrophobicContact CB-CE 4.23Å; A136-M227 HydrophobicContact CB-SD 4.35Å; A136-M227 WeakPolarHBondContact O-CE 3.28Å; Y139-M227 HydrophobicContact CD2-SD 4.07Å; A140-M227 HydrophobicContact CB-CE 4.14Å; V223-M227 HydrophobicContact CG1-CE 4.28Å; V223-M227 WeakPolarHBondContact O-CG 3.27Å; V223-M227 PolarHBondContact O-N 2.71Å; L224-M227 HydrophobicContact CB-CE 4.4Å; L224-M227 HydrophobicContact CD1-CE 3.99Å; L224-M227 PolarHBondContact O-N 2.81Å
228	L	97.9	Very high	96.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-82.7	-34.3	-178.9	-67	171.3	0	0	0	112.8	E133 A136 L224 Y225 E226 R257 L265	E133-L228 HydrophobicContact CB-CD2 4.26Å; E133-L228 HydrophobicContact CG-CD2 4.43Å; A136-L228 HydrophobicContact CB-CD2 3.74Å; A136-L228 HydrophobicContact CB-CG 4.16Å; L224-L228 HydrophobicContact CD1-CD1 3.93Å; L224-L228 HydrophobicContact CD1-CG 4.2Å; L224-L228 HydrophobicContact CG-CD1 4.09Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.16Å; L224-L228 PolarHBondContact O-N 2.74Å; Y225-L228 CarbonylContact O-C 3.45Å; Y225-L228 PolarHBondContact O-N 3.38Å; Y225-L228 VanDerWaalsContact O-N 3.13Å; E226-L228 PolarHBondContact O-N 2.87Å; L228-R257 PolarHBondContact O-NH2 2.79Å; L228-L265 HydrophobicContact CD1-CD1 4.1Å
229	H	95.9	Very high	96.7	Very high	45 Å²	45	27.9 Å²	27.9	21%	0.208	15%	0.145	C	C	.	.	H	α-helix	trans	-115.8	-10.1	-168.6	-57.1	103.1	0	0	0	114.3	Y225 E226 L231	Y225-H229 HydrophobicContact CD1-CB 4.09Å; Y225-H229 AromaticContact CD1-ND1 3.67Å; Y225-H229 AromaticContact CD2-CE1 3.94Å; Y225-H229 AromaticContact CD2-ND1 3.53Å; Y225-H229 HydrophobicContact CE1-CB 3.63Å; Y225-H229 AromaticContact CE1-CG 3.81Å; Y225-H229 AromaticContact CE1-ND1 3.6Å; Y225-H229 AromaticContact CE2-CE1 3.8Å; Y225-H229 AromaticContact CE2-ND1 3.46Å; Y225-H229 WeakPolarHBondContact CE2-ND1 3.42Å; Y225-H229 AromaticContact CG-ND1 3.62Å; Y225-H229 AromaticContact CZ-CG 3.8Å; Y225-H229 AromaticContact CZ-ND1 3.5Å; Y225-H229 WeakPolarHBondContact O-CB 3.44Å; Y225-H229 PolarHBondContact O-N 3.38Å; Y225-H229 PolarHBondContact O-ND1 3.2Å; E226-H229 PolarHBondContact O-N 3.06Å; H229-L231 VanDerWaalsContact C-N 3.3Å
230	G	94.4	Very high	96.6	Very high	12 Å²	12	31.2 Å²	31.2	12%	0.124	17%	0.169	C	C	.	.	S	Bend	trans	86.4	-11.3	177.8	0	0	0	0	0	115.4	R129 E226	R129-G230 WeakPolarHBondContact O-CA 3.26Å; E226-G230 VanDerWaalsContact O-CA 3.23Å; E226-G230 WeakPolarHBondContact O-CA 3.45Å; E226-G230 PolarHBondContact O-N 3.45Å
231	L	94.3	Very high	96.5	Very high	67 Å²	67	35.5 Å²	35.5	35%	0.351	19%	0.189	S	C	.	.	S	Bend	trans	-139.4	152.6	177.3	-68.7	175.3	0	0	0	110.6	Y225 E226 H229 Y340	Y225-L231 WeakPolarHBondContact CD1-O 3.43Å; Y225-L231 WeakPolarHBondContact CE1-O 3.4Å; E226-L231 WeakPolarHBondContact CA-O 3.47Å; H229-L231 VanDerWaalsContact C-N 3.3Å; L231-Y340 VanDerWaalsContact CD2-OH 3.25Å; L231-Y340 WeakPolarHBondContact CD2-OH 3.45Å
232	P	96.1	Very high	96.4	Very high	11 Å²	11	35.6 Å²	35.6	7%	0.071	19%	0.19	C	C	.	.			trans	-57.4	152.7	172.9	-23.9	33.9	0	0	0	112.4	E199 E226 F234 Y235	E199-P232 HydrophobicContact CB-CB 4.18Å; E199-P232 HydrophobicContact CB-CG 3.96Å; E199-P232 HydrophobicContact CG-CG 4.28Å; E226-P232 HydrophobicContact CG-CG 4.44Å; P232-F234 VanDerWaalsContact C-N 3.29Å; P232-F234 PolarHBondContact O-N 2.87Å; P232-Y235 HydrophobicContact CG-CD2 4.49Å; P232-Y235 WeakPolarHBondContact O-CB 3.35Å; P232-Y235 PolarHBondContact O-N 3.12Å
233	P	96.9	Very high	96.4	Very high	14 Å²	14	38.5 Å²	38.5	9%	0.091	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.9	-168.1	22.4	-32.8	0	0	0	115.2	A222 Y225 L251 L269	A222-P233 HydrophobicContact CB-CG 4.35Å; Y225-P233 HydrophobicContact CD1-CB 3.77Å; Y225-P233 HydrophobicContact CD1-CG 4.36Å; Y225-P233 HydrophobicContact CD2-CB 3.94Å; Y225-P233 VanDerWaalsContact CE1-CA 3.45Å; Y225-P233 HydrophobicContact CE1-CB 4.02Å; Y225-P233 HydrophobicContact CE2-CB 4.17Å; Y225-P233 HydrophobicContact CG-CB 3.74Å; Y225-P233 HydrophobicContact CG-CG 4.28Å; P233-L251 HydrophobicContact CB-CD1 3.69Å; P233-L269 HydrophobicContact CB-CD1 4.09Å; P233-L269 HydrophobicContact CG-CD1 3.94Å; P233-L269 HydrophobicContact CG-CD2 4.44Å
234	F	97.7	Very high	96.4	Very high	9 Å²	9	43 Å²	43	4%	0.039	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	17.4	-174.6	-57	-67.5	0	0	0	112.7	W218 P232 N245 I246 Q249 L251	W218-F234 HydrophobicContact CH2-CD2 4.44Å; W218-F234 AromaticContact CH2-CE2 3.65Å; W218-F234 HydrophobicContact CH2-CE2 3.65Å; W218-F234 HydrophobicContact CH2-CZ 4.34Å; W218-F234 HydrophobicContact CZ2-CD2 4.1Å; W218-F234 AromaticContact CZ2-CE2 3.69Å; W218-F234 HydrophobicContact CZ2-CE2 3.69Å; P232-F234 VanDerWaalsContact C-N 3.29Å; P232-F234 PolarHBondContact O-N 2.87Å; F234-N245 HydrophobicContact CB-CB 3.85Å; F234-N245 HydrophobicContact CD1-CB 4.37Å; F234-N245 PolarHBondContact O-ND2 3.32Å; F234-I246 HydrophobicContact CB-CG1 3.67Å; F234-I246 HydrophobicContact CD2-CG1 3.92Å; F234-I246 HydrophobicContact CG-CG1 4.04Å; F234-Q249 HydrophobicContact CD1-CB 4.39Å; F234-Q249 WeakPolarHBondContact CE1-O 3.28Å; F234-L251 HydrophobicContact CZ-CB 4.35Å; F234-L251 HydrophobicContact CZ-CD1 4.1Å
235	Y	95	Very high	96.3	Very high	64 Å²	64	44.1 Å²	44.1	25%	0.251	23%	0.228	S	C	.	.			trans	-55.7	137.6	-171.6	-179	-99.5	0	0	0	112.9	E199 P232 M242	E199-Y235 HydrophobicContact CG-CD2 4.1Å; E199-Y235 HydrophobicContact CG-CE2 4.44Å; P232-Y235 HydrophobicContact CG-CD2 4.49Å; P232-Y235 WeakPolarHBondContact O-CB 3.35Å; P232-Y235 PolarHBondContact O-N 3.12Å; Y235-M242 HydrophobicContact CD2-SD 4.38Å
236	S	93.7	Very high	96.3	Very high	27 Å²	27	43.2 Å²	43.2	19%	0.189	22%	0.224	C	C	.	.			trans	-147.9	148	170.8	163.3	0	0	0	0	108.5	D238	S236-D238 WeakPolarHBondContact CB-O 3.35Å; S236-D238 PolarHBondContact O-N 3.07Å; S236-D238 PolarHBondContact OG-N 3.44Å; S236-D238 VanDerWaalsContact OG-N 3.11Å; S236-D238 PolarHBondContact OG-O 3.44Å
237	Q	91.3	Very high	96.3	Very high	141 Å²	141	44.2 Å²	44.2	66%	0.659	23%	0.23	S	C	*	.	S	Bend	trans	-66.3	-30.1	173.2	-69.9	-177.9	-16.7	0	0	112.2
238	D	95.2	Very high	96.3	Very high	89 Å²	89	50 Å²	50	48%	0.476	26%	0.257	S	S	.	.	S	Bend	trans	-87.6	117.3	169.7	179.7	2.8	0	0	0	109.5	S236 S240 Q241 M242	S236-D238 WeakPolarHBondContact CB-O 3.35Å; S236-D238 PolarHBondContact O-N 3.07Å; S236-D238 PolarHBondContact OG-N 3.44Å; S236-D238 VanDerWaalsContact OG-N 3.11Å; S236-D238 PolarHBondContact OG-O 3.44Å; D238-S240 VanDerWaalsContact C-N 3.29Å; D238-S240 PolarHBondContact O-N 3.05Å; D238-S240 WeakPolarHBondContact OD1-CB 3.1Å; D238-S240 PolarHBondContact OD1-N 3.39Å; D238-Q241 HydrophobicContact CB-CB 3.96Å; D238-Q241 PolarHBondContact O-N 3.02Å; D238-M242 PolarHBondContact O-N 3.37Å
239	V	94.4	Very high	96.3	Very high	66 Å²	66	53.4 Å²	53.4	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-36.9	179	177.6	0	0	0	0	111.4	P198 M242 Y243	P198-V239 HydrophobicContact CB-CG1 4.46Å; V239-M242 HydrophobicContact CG1-CE 4.49Å; V239-M242 WeakPolarHBondContact O-CB 3.36Å; V239-M242 PolarHBondContact O-N 2.91Å; V239-Y243 HydrophobicContact CG1-CD1 4.36Å; V239-Y243 HydrophobicContact CG1-CD2 4.35Å; V239-Y243 HydrophobicContact CG1-CE1 3.82Å; V239-Y243 HydrophobicContact CG1-CE2 3.81Å; V239-Y243 PolarHBondContact O-N 3.34Å
240	S	96.1	Very high	96.3	Very high	81 Å²	81	55.4 Å²	55.4	57%	0.566	29%	0.29	S	S	*	.	H	α-helix	trans	-64.4	-46.5	176.8	-73.1	0	0	0	0	110.5	D238 M242 Y243 E244	D238-S240 VanDerWaalsContact C-N 3.29Å; D238-S240 PolarHBondContact O-N 3.05Å; D238-S240 WeakPolarHBondContact OD1-CB 3.1Å; D238-S240 PolarHBondContact OD1-N 3.39Å; S240-M242 VanDerWaalsContact C-N 3.32Å; S240-M242 PolarHBondContact O-N 3.19Å; S240-Y243 PolarHBondContact O-N 3.09Å; S240-E244 WeakPolarHBondContact O-CG 3.41Å; S240-E244 PolarHBondContact O-N 3.39Å
241	Q	97.4	Very high	96.5	Very high	91 Å²	91	56.5 Å²	56.5	43%	0.425	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-36.9	174.3	-174.7	61.2	63	0	0	112.3	D238 Y243 E244 N245	D238-Q241 HydrophobicContact CB-CB 3.96Å; D238-Q241 PolarHBondContact O-N 3.02Å; Q241-Y243 VanDerWaalsContact C-N 3.33Å; Q241-Y243 PolarHBondContact O-N 2.87Å; Q241-E244 PolarHBondContact O-N 2.83Å; Q241-N245 PolarHBondContact NE2-OD1 2.9Å; Q241-N245 PolarHBondContact O-N 3.45Å; Q241-N245 PolarHBondContact O-ND2 3.3Å; Q241-N245 PolarHBondContact O-OD1 3.13Å
242	M	97.4	Very high	96.5	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-42.1	175.1	-175.7	164.5	63.6	0	0	111.5	P198 E199 Y235 D238 V239 S240 N245 I246	P198-M242 HydrophobicContact CB-CE 3.46Å; P198-M242 VanDerWaalsContact CB-CE 3.46Å; E199-M242 HydrophobicContact CB-SD 4.26Å; E199-M242 HydrophobicContact CG-CE 4.02Å; E199-M242 HydrophobicContact CG-SD 3.79Å; Y235-M242 HydrophobicContact CD2-SD 4.38Å; D238-M242 PolarHBondContact O-N 3.37Å; V239-M242 HydrophobicContact CG1-CE 4.49Å; V239-M242 WeakPolarHBondContact O-CB 3.36Å; V239-M242 PolarHBondContact O-N 2.91Å; S240-M242 VanDerWaalsContact C-N 3.32Å; S240-M242 PolarHBondContact O-N 3.19Å; M242-N245 WeakPolarHBondContact O-CB 3.06Å; M242-N245 PolarHBondContact O-N 3.26Å; M242-I246 HydrophobicContact CG-CD1 4.08Å; M242-I246 VanDerWaalsContact O-CG1 3.29Å; M242-I246 WeakPolarHBondContact O-CG1 3.25Å; M242-I246 PolarHBondContact O-N 3.21Å
243	Y	98.1	Very high	96.5	Very high	60 Å²	60	60 Å²	60	24%	0.235	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-43.5	174.9	-67.1	-11.8	0	0	0	111.9	P198 L201 L206 V239 S240 Q241 N245 I246 L247	P198-Y243 HydrophobicContact CB-CE1 3.97Å; L201-Y243 HydrophobicContact CD1-CE1 4.19Å; L206-Y243 HydrophobicContact CD1-CD1 3.89Å; L206-Y243 HydrophobicContact CD1-CG 4.14Å; L206-Y243 HydrophobicContact CD2-CD1 3.66Å; L206-Y243 HydrophobicContact CD2-CD2 4.22Å; L206-Y243 HydrophobicContact CD2-CE1 3.69Å; L206-Y243 HydrophobicContact CD2-CE2 4.26Å; L206-Y243 HydrophobicContact CD2-CG 3.93Å; L206-Y243 HydrophobicContact CG-CD1 4.47Å; V239-Y243 HydrophobicContact CG1-CD1 4.36Å; V239-Y243 HydrophobicContact CG1-CD2 4.35Å; V239-Y243 HydrophobicContact CG1-CE1 3.82Å; V239-Y243 HydrophobicContact CG1-CE2 3.81Å; V239-Y243 PolarHBondContact O-N 3.34Å; S240-Y243 PolarHBondContact O-N 3.09Å; Q241-Y243 VanDerWaalsContact C-N 3.33Å; Q241-Y243 PolarHBondContact O-N 2.87Å; Y243-N245 VanDerWaalsContact C-N 3.3Å; Y243-N245 PolarHBondContact O-N 2.75Å; Y243-I246 HydrophobicContact CD1-CD1 4.41Å; Y243-I246 PolarHBondContact O-N 2.95Å; Y243-L247 WeakPolarHBondContact O-CB 3.35Å; Y243-L247 VanDerWaalsContact O-CG 3.25Å; Y243-L247 WeakPolarHBondContact O-CG 3.33Å; Y243-L247 PolarHBondContact O-N 3.09Å
244	E	98.2	Very high	96.1	Very high	97 Å²	97	62.7 Å²	62.7	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-41.4	173.4	-67.3	-57.5	139.1	0	0	111.8	S240 Q241 L247 H248	S240-E244 WeakPolarHBondContact O-CG 3.41Å; S240-E244 PolarHBondContact O-N 3.39Å; Q241-E244 PolarHBondContact O-N 2.83Å; E244-L247 PolarHBondContact O-N 2.85Å; E244-H248 WeakPolarHBondContact O-CB 3.25Å; E244-H248 PolarHBondContact O-N 3.29Å; E244-H248 IonicContact OE2-CD2 3.04Å; E244-H248 PolarHBondContact OE2-CD2 3.42Å; E244-H248 VanDerWaalsContact OE2-CD2 3.3Å; E244-H248 IonicContact OE2-NE2 2.92Å
245	N	98.1	Very high	95.6	Very high	23 Å²	23	66 Å²	66	12%	0.123	36%	0.361	C	S	.	.	H	α-helix	trans	-63.4	-46.5	176.5	-63.4	-11.8	0	0	0	111.3	F234 Q241 M242 Y243 L247 H248 Q249 K271	F234-N245 HydrophobicContact CB-CB 3.85Å; F234-N245 HydrophobicContact CD1-CB 4.37Å; F234-N245 PolarHBondContact O-ND2 3.32Å; Q241-N245 PolarHBondContact NE2-OD1 2.9Å; Q241-N245 PolarHBondContact O-N 3.45Å; Q241-N245 PolarHBondContact O-ND2 3.3Å; Q241-N245 PolarHBondContact O-OD1 3.13Å; M242-N245 WeakPolarHBondContact O-CB 3.06Å; M242-N245 PolarHBondContact O-N 3.26Å; Y243-N245 VanDerWaalsContact C-N 3.3Å; Y243-N245 PolarHBondContact O-N 2.75Å; N245-L247 VanDerWaalsContact C-N 3.26Å; N245-L247 PolarHBondContact O-N 3.43Å; N245-H248 PolarHBondContact O-N 3.11Å; N245-Q249 HydrophobicContact CB-CB 4.11Å; N245-Q249 VanDerWaalsContact O-CB 3.27Å; N245-Q249 WeakPolarHBondContact O-CB 3.4Å; N245-Q249 PolarHBondContact O-N 3.27Å; N245-Q249 PolarHBondContact OD1-OE1 3.13Å; N245-K271 PolarHBondContact O-NZ 3Å
246	I	98.3	Very high	95.1	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-38.9	176.5	-68.7	165.4	0	0	0	110.7	P203 L206 W218 F234 M242 Y243 K271	P203-I246 HydrophobicContact CG-CG2 3.95Å; L206-I246 HydrophobicContact CD1-CB 3.74Å; L206-I246 HydrophobicContact CD1-CD1 4.01Å; L206-I246 HydrophobicContact CD1-CG1 4.49Å; L206-I246 HydrophobicContact CD1-CG2 3.5Å; W218-I246 HydrophobicContact CH2-CG2 4.48Å; W218-I246 HydrophobicContact CZ2-CG2 3.95Å; F234-I246 HydrophobicContact CB-CG1 3.67Å; F234-I246 HydrophobicContact CD2-CG1 3.92Å; F234-I246 HydrophobicContact CG-CG1 4.04Å; M242-I246 HydrophobicContact CG-CD1 4.08Å; M242-I246 VanDerWaalsContact O-CG1 3.29Å; M242-I246 WeakPolarHBondContact O-CG1 3.25Å; M242-I246 PolarHBondContact O-N 3.21Å; Y243-I246 HydrophobicContact CD1-CD1 4.41Å; Y243-I246 PolarHBondContact O-N 2.95Å; I246-K271 PolarHBondContact O-NZ 2.8Å
247	L	98.1	Very high	95	Very high	26 Å²	26	67.4 Å²	67.4	14%	0.136	39%	0.386	C	S	.	.	H	α-helix	trans	-77.8	-36.3	-177.8	-69.5	171.7	0	0	0	113.5	P203 L206 R207 Y243 E244 N245 K271	P203-L247 HydrophobicContact CB-CD2 4.24Å; L206-L247 HydrophobicContact CB-CD2 4.01Å; L206-L247 HydrophobicContact CB-CG 4.44Å; L206-L247 HydrophobicContact CD1-CD2 4.5Å; L206-L247 HydrophobicContact CD1-CG 4.29Å; R207-L247 HydrophobicContact CG-CD2 3.7Å; Y243-L247 WeakPolarHBondContact O-CB 3.35Å; Y243-L247 VanDerWaalsContact O-CG 3.25Å; Y243-L247 WeakPolarHBondContact O-CG 3.33Å; Y243-L247 PolarHBondContact O-N 3.09Å; E244-L247 PolarHBondContact O-N 2.85Å; N245-L247 VanDerWaalsContact C-N 3.26Å; N245-L247 PolarHBondContact O-N 3.43Å; L247-K271 WeakPolarHBondContact O-CD 3.14Å
248	H	97.6	Very high	95.2	Very high	125 Å²	125	63.7 Å²	63.7	58%	0.579	37%	0.372	S	S	*	.	H	α-helix	trans	-129.3	-30.7	-163.4	-59.5	-59.2	0	0	0	115.1	E244 N245	E244-H248 WeakPolarHBondContact O-CB 3.25Å; E244-H248 PolarHBondContact O-N 3.29Å; E244-H248 IonicContact OE2-CD2 3.04Å; E244-H248 PolarHBondContact OE2-CD2 3.42Å; E244-H248 VanDerWaalsContact OE2-CD2 3.3Å; E244-H248 IonicContact OE2-NE2 2.92Å; N245-H248 PolarHBondContact O-N 3.11Å
249	Q	97.6	Very high	95.3	Very high	70 Å²	70	65.5 Å²	65.5	33%	0.327	39%	0.387	S	S	.	.	S	Bend	trans	-71.2	130	-176.4	-173.4	-178.8	-23.7	0	0	111.1	F234 N245 K271	F234-Q249 HydrophobicContact CD1-CB 4.39Å; F234-Q249 WeakPolarHBondContact CE1-O 3.28Å; N245-Q249 HydrophobicContact CB-CB 4.11Å; N245-Q249 VanDerWaalsContact O-CB 3.27Å; N245-Q249 WeakPolarHBondContact O-CB 3.4Å; N245-Q249 PolarHBondContact O-N 3.27Å; N245-Q249 PolarHBondContact OD1-OE1 3.13Å; Q249-K271 WeakPolarHBondContact O-CE 3.42Å; Q249-K271 PolarHBondContact O-NZ 3.35Å
250	P	97	Very high	95.4	Very high	88 Å²	88	63.4 Å²	63.4	57%	0.571	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-62.8	140.2	171.3	-21.2	32.7	0	0	0	111.4	Q252	P250-Q252 PolarHBondContact O-N 3.45Å; P250-Q252 PolarHBondContact O-NE2 2.9Å; P250-Q252 VanDerWaalsContact O-NE2 3.13Å
251	L	97.4	Very high	95.5	Very high	35 Å²	35	59.5 Å²	59.5	18%	0.183	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-57.8	124.4	176.4	179.7	66.4	0	0	0	110.2	Y225 P233 F234 I253 L265 Q266 L269	Y225-L251 HydrophobicContact CD2-CD1 4.07Å; Y225-L251 HydrophobicContact CE2-CD1 3.96Å; P233-L251 HydrophobicContact CB-CD1 3.69Å; F234-L251 HydrophobicContact CZ-CB 4.35Å; F234-L251 HydrophobicContact CZ-CD1 4.1Å; L251-I253 HydrophobicContact CD2-CD1 3.82Å; L251-I253 HydrophobicContact CD2-CG1 3.95Å; L251-I253 HydrophobicContact CG-CD1 4.35Å; L251-I253 HydrophobicContact CG-CG1 3.94Å; L251-L265 HydrophobicContact CD2-CB 4.28Å; L251-Q266 HydrophobicContact CD2-CG 4.29Å; L251-L269 HydrophobicContact CD1-CD1 3.75Å; L251-L269 HydrophobicContact CD2-CB 4.14Å; L251-L269 HydrophobicContact CD2-CD1 3.98Å
252	Q	96	Very high	95.6	Very high	114 Å²	114	56.6 Å²	56.6	53%	0.533	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-99.1	125.5	173.7	-60.3	-55.4	-55.9	0	0	108.8	Y225 P250	Y225-Q252 VanDerWaalsContact CE2-O 3.3Å; Y225-Q252 WeakPolarHBondContact CE2-O 3.41Å; Y225-Q252 PolarHBondContact OH-O 2.88Å; P250-Q252 PolarHBondContact O-N 3.45Å; P250-Q252 PolarHBondContact O-NE2 2.9Å; P250-Q252 VanDerWaalsContact O-NE2 3.13Å
253	I	94.6	Very high	95.6	Very high	38 Å²	38	59.9 Å²	59.9	20%	0.195	36%	0.356	C	S	.	.			trans	-119.3	107.8	175.2	-52.5	-179.4	0	0	0	107.5	L251 C262 L265 Q266	L251-I253 HydrophobicContact CD2-CD1 3.82Å; L251-I253 HydrophobicContact CD2-CG1 3.95Å; L251-I253 HydrophobicContact CG-CD1 4.35Å; L251-I253 HydrophobicContact CG-CG1 3.94Å; I253-C262 HydrophobicContact CD1-CB 4.21Å; I253-L265 HydrophobicContact CD1-CB 3.86Å; I253-L265 HydrophobicContact CD1-CD1 4.21Å; I253-L265 HydrophobicContact CG2-CD1 4.49Å; I253-Q266 HydrophobicContact CD1-CG 3.94Å
254	P	89.5	Confident	95.7	Very high	70 Å²	70	57 Å²	57	46%	0.455	34%	0.344	S	S	.	.			trans	-56.3	146.7	175.3	-24.4	33.8	0	0	0	111.7
255	G	86.1	Confident	95.7	Very high	79 Å²	79	52.4 Å²	52.4	81%	0.814	32%	0.323	S	S	*	.	S	Bend	trans	-59.7	162.7	177.9	0	0	0	0	0	113.6
256	G	85.1	Confident	95.7	Very high	76 Å²	76	56.5 Å²	56.5	78%	0.784	34%	0.341	S	S	*	.	S	Bend	trans	95.3	15.3	178.4	0	0	0	0	0	115
257	R	90.9	Very high	95.7	Very high	44 Å²	44	58 Å²	58	17%	0.166	35%	0.352	C	S	.	.	S	Bend	trans	-106.2	155.7	169.7	-57.6	-56.5	174.6	-160.5	3.2	110.9	L228 A261	L228-R257 PolarHBondContact O-NH2 2.79Å; R257-A261 HydrophobicContact CB-CB 4.33Å
258	T	96	Very high	95.8	Very high	62 Å²	62	56.8 Å²	56.8	38%	0.38	35%	0.346	S	S	.	.			trans	-66.6	152.7	174.2	65.1	0	0	0	0	110.1	E133 A260 A261 C262	E133-T258 VanDerWaalsContact CD-OG1 3.28Å; E133-T258 WeakPolarHBondContact OE1-CG2 3.39Å; E133-T258 PolarHBondContact OE1-OG1 2.63Å; E133-T258 WeakPolarHBondContact OE2-CG2 3.4Å; E133-T258 PolarHBondContact OE2-N 3.28Å; E133-T258 PolarHBondContact OE2-OG1 3.18Å; T258-A260 PolarHBondContact O-N 3.2Å; T258-A261 PolarHBondContact O-N 3.17Å; T258-A261 WeakPolarHBondContact OG1-CB 3.4Å; T258-A261 PolarHBondContact OG1-N 2.85Å; T258-A261 VanDerWaalsContact OG1-N 3.15Å; T258-C262 PolarHBondContact O-N 3.05Å; T258-C262 PolarHBondContact O-SG 3.41Å
259	V	97.1	Very high	95.8	Very high	128 Å²	128	51.2 Å²	51.2	78%	0.776	32%	0.32	S	S	*	.	H	α-helix	trans	-54.3	-41	174	177.4	0	0	0	0	110.5	A261 C262 D263	V259-A261 PolarHBondContact O-N 3.12Å; V259-C262 PolarHBondContact O-N 3.34Å; V259-D263 VanDerWaalsContact O-CB 3.28Å; V259-D263 WeakPolarHBondContact O-CB 3.41Å; V259-D263 PolarHBondContact O-N 2.95Å
260	A	97.9	Very high	95.9	Very high	21 Å²	21	51.5 Å²	51.5	17%	0.174	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-40	176.8	0	0	0	0	0	113.5	T258 L264 H289 V290 F291	T258-A260 PolarHBondContact O-N 3.2Å; A260-L264 WeakPolarHBondContact O-CB 3.13Å; A260-L264 PolarHBondContact O-N 3.47Å; A260-L264 VanDerWaalsContact O-N 3.08Å; A260-H289 PolarHBondContact O-CE1 2.83Å; A260-V290 HydrophobicContact CB-CG1 3.81Å; A260-F291 HydrophobicContact CB-CB 4.3Å
261	A	98.1	Very high	95.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-70.1	-41.9	177.4	0	0	0	0	0	111.8	E133 R257 T258 V259 L265 F291	E133-A261 HydrophobicContact CG-CB 4.5Å; R257-A261 HydrophobicContact CB-CB 4.33Å; T258-A261 PolarHBondContact O-N 3.17Å; T258-A261 WeakPolarHBondContact OG1-CB 3.4Å; T258-A261 PolarHBondContact OG1-N 2.85Å; T258-A261 VanDerWaalsContact OG1-N 3.15Å; V259-A261 PolarHBondContact O-N 3.12Å; A261-L265 WeakPolarHBondContact O-CB 3.08Å; A261-L265 VanDerWaalsContact O-CG 3.32Å; A261-L265 WeakPolarHBondContact O-CG 3.49Å; A261-L265 PolarHBondContact O-N 3.19Å; A261-F291 HydrophobicContact CB-CD2 3.87Å; A261-F291 HydrophobicContact CB-CE2 3.7Å
262	C	98.3	Very high	95.9	Very high	30 Å²	30	51.1 Å²	51.1	20%	0.203	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-46.7	176.1	-65	0	0	0	0	111.6	I253 T258 V259 L265 Q266	I253-C262 HydrophobicContact CD1-CB 4.21Å; T258-C262 PolarHBondContact O-N 3.05Å; T258-C262 PolarHBondContact O-SG 3.41Å; V259-C262 PolarHBondContact O-N 3.34Å; C262-L265 PolarHBondContact O-N 3.32Å; C262-Q266 WeakPolarHBondContact O-CB 3.36Å; C262-Q266 VanDerWaalsContact O-CG 3.3Å; C262-Q266 WeakPolarHBondContact O-CG 3.45Å; C262-Q266 PolarHBondContact O-N 2.64Å
263	D	98.4	Very high	95.9	Very high	70 Å²	70	47.1 Å²	47.1	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-44.1	179.3	-173.4	57.4	0	0	0	112.1	V259 L265 Q266 S267 H289	V259-D263 VanDerWaalsContact O-CB 3.28Å; V259-D263 WeakPolarHBondContact O-CB 3.41Å; V259-D263 PolarHBondContact O-N 2.95Å; D263-L265 PolarHBondContact O-N 2.72Å; D263-Q266 PolarHBondContact O-N 3.36Å; D263-S267 WeakPolarHBondContact O-CB 3.34Å; D263-S267 PolarHBondContact O-N 3.28Å; D263-S267 PolarHBondContact O-OG 2.77Å; D263-H289 IonicContact OD2-CE1 3.27Å; D263-H289 IonicContact OD2-NE2 3.14Å; D263-H289 PolarHBondContact OD2-NE2 2.91Å; D263-H289 VanDerWaalsContact OD2-NE2 3.07Å
264	L	98.8	Very high	96	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-47.4	175.5	-177.4	60.8	0	0	0	111.6	L224 A260 S267 L268 L277 H289 F291 F292	L224-L264 HydrophobicContact CD2-CD2 3.52Å; L224-L264 HydrophobicContact CD2-CG 4.16Å; A260-L264 WeakPolarHBondContact O-CB 3.13Å; A260-L264 PolarHBondContact O-N 3.47Å; A260-L264 VanDerWaalsContact O-N 3.08Å; L264-S267 PolarHBondContact O-N 2.97Å; L264-L268 HydrophobicContact CD1-CD1 3.73Å; L264-L268 HydrophobicContact CD1-CG 3.89Å; L264-L268 HydrophobicContact CD2-CD1 4.31Å; L264-L268 HydrophobicContact CG-CD1 3.75Å; L264-L268 HydrophobicContact CG-CG 4.26Å; L264-L268 WeakPolarHBondContact O-CB 3.39Å; L264-L268 WeakPolarHBondContact O-CG 3.49Å; L264-L268 PolarHBondContact O-N 2.6Å; L264-L277 HydrophobicContact CD1-CD2 3.55Å; L264-H289 VanDerWaalsContact CB-CE1 3.41Å; L264-H289 WeakPolarHBondContact CB-CE1 3.42Å; L264-H289 HydrophobicContact CD1-CB 4.28Å; L264-H289 PolarHBondContact N-CE1 3.07Å; L264-F291 HydrophobicContact CB-CB 4.11Å; L264-F291 HydrophobicContact CB-CG 4.37Å; L264-F291 HydrophobicContact CD2-CB 3.79Å; L264-F291 HydrophobicContact CD2-CD1 3.18Å; L264-F291 HydrophobicContact CD2-CD2 4.41Å; L264-F291 HydrophobicContact CD2-CE1 3.75Å; L264-F291 HydrophobicContact CD2-CG 3.55Å; L264-F291 HydrophobicContact CG-CB 4.49Å; L264-F292 HydrophobicContact CD1-CE2 4.16Å; L264-F292 HydrophobicContact CD2-CD2 4.43Å; L264-F292 HydrophobicContact CD2-CE2 3.6Å; L264-F292 HydrophobicContact CD2-CZ 3.79Å
265	L	98.8	Very high	96.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-43.4	179.7	-75.2	174.3	0	0	0	111.6	L224 Y225 L228 L251 I253 A261 C262 D263 S267 L269	L224-L265 HydrophobicContact CB-CD2 4.21Å; L224-L265 HydrophobicContact CD2-CD2 4.07Å; L224-L265 HydrophobicContact CG-CD2 3.95Å; Y225-L265 HydrophobicContact CD2-CD1 4.07Å; Y225-L265 HydrophobicContact CD2-CD2 4.38Å; L228-L265 HydrophobicContact CD1-CD1 4.1Å; L251-L265 HydrophobicContact CD2-CB 4.28Å; I253-L265 HydrophobicContact CD1-CB 3.86Å; I253-L265 HydrophobicContact CD1-CD1 4.21Å; I253-L265 HydrophobicContact CG2-CD1 4.49Å; A261-L265 WeakPolarHBondContact O-CB 3.08Å; A261-L265 VanDerWaalsContact O-CG 3.32Å; A261-L265 WeakPolarHBondContact O-CG 3.49Å; A261-L265 PolarHBondContact O-N 3.19Å; C262-L265 PolarHBondContact O-N 3.32Å; D263-L265 PolarHBondContact O-N 2.72Å; L265-S267 VanDerWaalsContact C-N 3.29Å; L265-S267 PolarHBondContact O-N 3.13Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 VanDerWaalsContact O-CB 3.22Å; L265-L269 WeakPolarHBondContact O-CB 3.12Å; L265-L269 PolarHBondContact O-N 3.47Å
266	Q	98.4	Very high	97	Very high	110 Å²	110	52.8 Å²	52.8	51%	0.514	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-38.7	177.1	-74	174.4	-4.1	0	0	111.9	L251 I253 C262 D263 H270	L251-Q266 HydrophobicContact CD2-CG 4.29Å; I253-Q266 HydrophobicContact CD1-CG 3.94Å; C262-Q266 WeakPolarHBondContact O-CB 3.36Å; C262-Q266 VanDerWaalsContact O-CG 3.3Å; C262-Q266 WeakPolarHBondContact O-CG 3.45Å; C262-Q266 PolarHBondContact O-N 2.64Å; D263-Q266 PolarHBondContact O-N 3.36Å; Q266-H270 PolarHBondContact O-N 3Å
267	S	98.6	Very high	97.6	Very high	33 Å²	33	50.4 Å²	50.4	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-79.4	-35.6	-176.4	-54	0	0	0	0	112.8	D263 L264 L265 R276 L277	D263-S267 WeakPolarHBondContact O-CB 3.34Å; D263-S267 PolarHBondContact O-N 3.28Å; D263-S267 PolarHBondContact O-OG 2.77Å; L264-S267 PolarHBondContact O-N 2.97Å; L265-S267 VanDerWaalsContact C-N 3.29Å; L265-S267 PolarHBondContact O-N 3.13Å; S267-R276 WeakPolarHBondContact O-CA 3.27Å; S267-L277 PolarHBondContact O-N 3.07Å
268	L	98.8	Very high	97.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-73.3	-38.9	173	-71.8	175.5	0	0	0	112.7	W217 L220 L264 H270 R276 L277 I286	W217-L268 HydrophobicContact CB-CD2 4.04Å; L220-L268 HydrophobicContact CD2-CD1 4.41Å; L220-L268 HydrophobicContact CG-CD1 4.36Å; L264-L268 HydrophobicContact CD1-CD1 3.73Å; L264-L268 HydrophobicContact CD1-CG 3.89Å; L264-L268 HydrophobicContact CD2-CD1 4.31Å; L264-L268 HydrophobicContact CG-CD1 3.75Å; L264-L268 HydrophobicContact CG-CG 4.26Å; L264-L268 WeakPolarHBondContact O-CB 3.39Å; L264-L268 WeakPolarHBondContact O-CG 3.49Å; L264-L268 PolarHBondContact O-N 2.6Å; L268-H270 PolarHBondContact O-N 2.76Å; L268-R276 WeakPolarHBondContact O-CD 3.37Å; L268-R276 WeakPolarHBondContact O-CG 3.5Å; L268-L277 HydrophobicContact CD2-CB 4.24Å; L268-L277 HydrophobicContact CD2-CD2 4.23Å; L268-L277 HydrophobicContact CG-CD2 4.44Å; L268-I286 HydrophobicContact CD2-CD1 3.71Å
269	L	98.8	Very high	97.9	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	28.6	179.9	-61.7	171.1	0	0	0	112.1	W218 A222 Y225 P233 L251 L265 K271	W218-L269 HydrophobicContact CD2-CD2 3.9Å; W218-L269 HydrophobicContact CE3-CB 4.46Å; W218-L269 HydrophobicContact CE3-CD2 4.06Å; W218-L269 HydrophobicContact CG-CD2 4.42Å; W218-L269 HydrophobicContact CH2-CD2 4.36Å; W218-L269 HydrophobicContact CZ2-CD2 4.19Å; W218-L269 VanDerWaalsContact CZ3-C 3.47Å; W218-L269 HydrophobicContact CZ3-CB 4.2Å; W218-L269 HydrophobicContact CZ3-CD2 4.3Å; W218-L269 VanDerWaalsContact CZ3-O 3.29Å; W218-L269 WeakPolarHBondContact CZ3-O 3.32Å; A222-L269 HydrophobicContact CB-CD2 4.29Å; Y225-L269 HydrophobicContact CD2-CD1 4.48Å; P233-L269 HydrophobicContact CB-CD1 4.09Å; P233-L269 HydrophobicContact CG-CD1 3.94Å; P233-L269 HydrophobicContact CG-CD2 4.44Å; L251-L269 HydrophobicContact CD1-CD1 3.75Å; L251-L269 HydrophobicContact CD2-CB 4.14Å; L251-L269 HydrophobicContact CD2-CD1 3.98Å; L265-L269 HydrophobicContact CD2-CD1 4.45Å; L265-L269 VanDerWaalsContact O-CB 3.22Å; L265-L269 WeakPolarHBondContact O-CB 3.12Å; L265-L269 PolarHBondContact O-N 3.47Å; L269-K271 PolarHBondContact O-N 3.3Å
270	H	98.6	Very high	97.8	Very high	77 Å²	77	48.7 Å²	48.7	36%	0.356	24%	0.236	S	C	.	.			trans	-70	127	171.3	-161.6	-77.8	0	0	0	109.8	Q266 L268 D272 Q275 R276	Q266-H270 PolarHBondContact O-N 3Å; L268-H270 PolarHBondContact O-N 2.76Å; H270-D272 PolarHBondContact ND1-N 3.2Å; H270-D272 PolarHBondContact ND1-O 3.13Å; H270-D272 VanDerWaalsContact ND1-O 3.12Å; H270-D272 PolarHBondContact O-N 3.07Å; H270-Q275 VanDerWaalsContact CE1-CB 3.49Å; H270-Q275 WeakPolarHBondContact CE1-CB 2.98Å; H270-R276 HydrophobicContact CB-CB 4.31Å; H270-R276 HydrophobicContact CB-CG 4.5Å; H270-R276 PolarHBondContact O-NE 2.91Å; H270-R276 VanDerWaalsContact O-NE 3.1Å; H270-R276 PolarHBondContact O-NH2 3.48Å
271	K	98.1	Very high	97.7	Very high	43 Å²	43	50 Å²	50	19%	0.187	25%	0.247	C	C	.	.	S	Bend	trans	-73.2	-25.4	-172.9	-61.8	-170.5	-168.5	-71.3	0	114.1	P203 W218 N245 I246 L247 Q249 L269	P203-K271 HydrophobicContact CG-CB 4.12Å; P203-K271 HydrophobicContact CG-CG 4.22Å; W218-K271 HydrophobicContact CH2-CG 4.45Å; W218-K271 HydrophobicContact CZ3-CG 4.42Å; N245-K271 PolarHBondContact O-NZ 3Å; I246-K271 PolarHBondContact O-NZ 2.8Å; L247-K271 WeakPolarHBondContact O-CD 3.14Å; Q249-K271 WeakPolarHBondContact O-CE 3.42Å; Q249-K271 PolarHBondContact O-NZ 3.35Å; L269-K271 PolarHBondContact O-N 3.3Å
272	D	97.6	Very high	97.7	Very high	72 Å²	72	51.2 Å²	51.2	39%	0.385	25%	0.254	S	S	.	.	S	Bend	trans	-85.4	115.3	166.8	-179.6	-6.2	0	0	0	108.9	H270 R274 Q275 R276	H270-D272 PolarHBondContact ND1-N 3.2Å; H270-D272 PolarHBondContact ND1-O 3.13Å; H270-D272 VanDerWaalsContact ND1-O 3.12Å; H270-D272 PolarHBondContact O-N 3.07Å; D272-R274 PolarHBondContact O-N 2.94Å; D272-R274 WeakPolarHBondContact OD1-CB 3.42Å; D272-R274 PolarHBondContact OD1-N 2.78Å; D272-Q275 HydrophobicContact CB-CB 4.44Å; D272-Q275 HydrophobicContact CB-CG 4.32Å; D272-Q275 PolarHBondContact O-N 3.24Å; D272-R276 PolarHBondContact O-N 2.86Å
273	Q	96.3	Very high	97.7	Very high	29 Å²	29	51.8 Å²	51.8	14%	0.136	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.1	-179.7	64.4	178.8	-18.6	0	0	113.3	P210 R276 S279	P210-Q273 PolarHBondContact O-NE2 3.34Å; Q273-R276 WeakPolarHBondContact O-CB 3.23Å; Q273-R276 PolarHBondContact O-N 3.25Å; Q273-S279 WeakPolarHBondContact O-CB 3.31Å
274	R	95.6	Very high	97.7	Very high	190 Å²	190	53 Å²	53	72%	0.717	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.6	-178.9	-60.9	176.5	179.6	168.6	0.8	114.1	D272 S279	D272-R274 PolarHBondContact O-N 2.94Å; D272-R274 WeakPolarHBondContact OD1-CB 3.42Å; D272-R274 PolarHBondContact OD1-N 2.78Å; R274-S279 PolarHBondContact O-OG 3.06Å
275	Q	97.7	Very high	97.7	Very high	115 Å²	115	55.1 Å²	55.1	54%	0.537	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-5.1	176	-59	-60.1	-29.9	0	0	111.5	H270 D272	H270-Q275 VanDerWaalsContact CE1-CB 3.49Å; H270-Q275 WeakPolarHBondContact CE1-CB 2.98Å; D272-Q275 HydrophobicContact CB-CB 4.44Å; D272-Q275 HydrophobicContact CB-CG 4.32Å; D272-Q275 PolarHBondContact O-N 3.24Å
276	R	98.4	Very high	97.7	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.008	27%	0.269	C	S	.	.	S	Bend	trans	-68.4	140.5	-180	-166	178.7	-61.9	145.2	4.5	110.4	E204 A214 S267 L268 H270 D272 Q273 G278 S279	E204-R276 VanDerWaalsContact CD-NH2 3.33Å; E204-R276 IonicContact OE1-CZ 3.93Å; E204-R276 VanDerWaalsContact OE1-CZ 3.3Å; E204-R276 IonicContact OE1-NH1 2.65Å; E204-R276 PolarHBondContact OE1-NH1 3.3Å; E204-R276 IonicContact OE1-NH2 3.55Å; E204-R276 PolarHBondContact OE1-NH2 3.42Å; E204-R276 IonicContact OE2-CZ 3.98Å; E204-R276 IonicContact OE2-NH1 2.67Å; E204-R276 IonicContact OE2-NH2 2.82Å; E204-R276 PolarHBondContact OE2-NH2 3.48Å; A214-R276 WeakPolarHBondContact O-CD 3.46Å; A214-R276 PolarHBondContact O-NH1 3.32Å; S267-R276 WeakPolarHBondContact O-CA 3.27Å; L268-R276 WeakPolarHBondContact O-CD 3.37Å; L268-R276 WeakPolarHBondContact O-CG 3.5Å; H270-R276 HydrophobicContact CB-CB 4.31Å; H270-R276 HydrophobicContact CB-CG 4.5Å; H270-R276 PolarHBondContact O-NE 2.91Å; H270-R276 VanDerWaalsContact O-NE 3.1Å; H270-R276 PolarHBondContact O-NH2 3.48Å; D272-R276 PolarHBondContact O-N 2.86Å; Q273-R276 WeakPolarHBondContact O-CB 3.23Å; Q273-R276 PolarHBondContact O-N 3.25Å; R276-G278 PolarHBondContact O-N 3.05Å; R276-S279 VanDerWaalsContact O-CB 3.23Å; R276-S279 WeakPolarHBondContact O-CB 3.47Å; R276-S279 PolarHBondContact O-N 3.32Å; R276-S279 VanDerWaalsContact O-N 3.09Å; R276-S279 PolarHBondContact O-OG 3.08Å
277	L	98.6	Very high	97.7	Very high	26 Å²	26	53.9 Å²	53.9	14%	0.136	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	129.7	172.2	-170	74.6	0	0	0	109.9	L264 S267 L268 E285 I286 H289	L264-L277 HydrophobicContact CD1-CD2 3.55Å; S267-L277 PolarHBondContact O-N 3.07Å; L268-L277 HydrophobicContact CD2-CB 4.24Å; L268-L277 HydrophobicContact CD2-CD2 4.23Å; L268-L277 HydrophobicContact CG-CD2 4.44Å; L277-E285 HydrophobicContact CD1-CB 3.85Å; L277-E285 HydrophobicContact CG-CB 4.21Å; L277-I286 HydrophobicContact CB-CD1 4.49Å; L277-I286 HydrophobicContact CD2-CD1 3.84Å; L277-I286 HydrophobicContact CG-CD1 3.88Å; L277-H289 HydrophobicContact CD2-CB 4.32Å
278	G	97.8	Very high	97.6	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.01	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	2.1	-174.8	0	0	0	0	0	114	W217 R276 D282 E285	W217-G278 PolarHBondContact NE1-O 2.93Å; R276-G278 PolarHBondContact O-N 3.05Å; G278-D282 VanDerWaalsContact O-CA 3.22Å; G278-D282 WeakPolarHBondContact O-CA 3.43Å; G278-D282 PolarHBondContact O-N 3.31Å; G278-E285 VanDerWaalsContact C-OE2 3.26Å; G278-E285 WeakPolarHBondContact CA-OE2 3.43Å; G278-E285 PolarHBondContact N-OE2 2.89Å
279	S	96.2	Very high	97.6	Very high	37 Å²	37	58.7 Å²	58.7	26%	0.259	28%	0.284	S	S	.	.	S	Bend	trans	-81.8	-19.9	175.6	60.4	0	0	0	0	114.1	Q273 R274 R276 E285	Q273-S279 WeakPolarHBondContact O-CB 3.31Å; R274-S279 PolarHBondContact O-OG 3.06Å; R276-S279 VanDerWaalsContact O-CB 3.23Å; R276-S279 WeakPolarHBondContact O-CB 3.47Å; R276-S279 PolarHBondContact O-N 3.32Å; R276-S279 VanDerWaalsContact O-N 3.09Å; R276-S279 PolarHBondContact O-OG 3.08Å; S279-E285 PolarHBondContact N-OE2 2.83Å
280	K	94.4	Very high	97.6	Very high	159 Å²	159	62.4 Å²	62.4	69%	0.691	31%	0.307	S	S	*	.	S	Bend	trans	-103.6	-50.3	-174.7	-61.3	175.9	-176.8	169.4	0	112.6	E285	K280-E285 PolarHBondContact N-OE2 2.93Å
281	A	96.4	Very high	97.6	Very high	49 Å²	49	58.8 Å²	58.8	41%	0.405	29%	0.29	S	S	.	.	S	Bend	trans	-125	22.3	-179.5	0	0	0	0	0	112.2	F283 L284 E285	A281-F283 PolarHBondContact O-N 3.46Å; A281-L284 HydrophobicContact CB-CB 4.25Å; A281-L284 VanDerWaalsContact O-CB 3.3Å; A281-L284 WeakPolarHBondContact O-CB 3.48Å; A281-L284 PolarHBondContact O-N 3.44Å; A281-E285 HydrophobicContact CB-CG 3.86Å; A281-E285 PolarHBondContact N-OE2 2.92Å; A281-E285 VanDerWaalsContact N-OE2 3.13Å
282	D	97.4	Very high	97.7	Very high	26 Å²	26	56.8 Å²	56.8	14%	0.139	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	-130.8	172	-167	55.8	0	0	0	112.2	H151 R213 W217 G278 L284 E285	H151-D282 VanDerWaalsContact CB-OD2 3.27Å; H151-D282 WeakPolarHBondContact CB-OD2 3.28Å; H151-D282 IonicContact CE1-OD1 2.8Å; H151-D282 IonicContact CG-OD1 3.88Å; H151-D282 IonicContact CG-OD2 3.07Å; H151-D282 IonicContact ND1-OD1 2.66Å; H151-D282 PolarHBondContact ND1-OD1 2.86Å; H151-D282 IonicContact ND1-OD2 3.78Å; H151-D282 PolarHBondContact ND1-OD2 3.28Å; R213-D282 VanDerWaalsContact CD-OD1 3.27Å; R213-D282 WeakPolarHBondContact CD-OD1 3.43Å; W217-D282 WeakPolarHBondContact CZ2-OD1 3.45Å; W217-D282 PolarHBondContact NE1-OD1 2.89Å; G278-D282 VanDerWaalsContact O-CA 3.22Å; G278-D282 WeakPolarHBondContact O-CA 3.43Å; G278-D282 PolarHBondContact O-N 3.31Å; D282-L284 PolarHBondContact O-N 3.39Å; D282-E285 PolarHBondContact O-N 3.49Å; D282-E285 VanDerWaalsContact O-N 3.1Å
283	F	98.1	Very high	97.7	Very high	42 Å²	42	57.8 Å²	57.8	18%	0.184	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-25.3	-178.4	179.7	-126.4	0	0	0	113.9	A144 W217 A281 E285 I286 K287 W297	A144-F283 VanDerWaalsContact C-CE2 3.46Å; A144-F283 HydrophobicContact CB-CD2 4.34Å; A144-F283 HydrophobicContact CB-CE2 3.91Å; A144-F283 WeakPolarHBondContact O-CD2 3.49Å; A144-F283 WeakPolarHBondContact O-CE2 3.32Å; W217-F283 HydrophobicContact CH2-CB 4.07Å; W217-F283 AromaticContact CH2-CD2 3.92Å; W217-F283 HydrophobicContact CH2-CD2 3.92Å; W217-F283 HydrophobicContact CH2-CG 4.45Å; W217-F283 HydrophobicContact CZ2-CB 4.03Å; A281-F283 PolarHBondContact O-N 3.46Å; F283-E285 VanDerWaalsContact C-N 3.32Å; F283-E285 PolarHBondContact O-N 2.98Å; F283-I286 HydrophobicContact CD2-CB 4.25Å; F283-I286 WeakPolarHBondContact O-CB 3.3Å; F283-I286 PolarHBondContact O-N 3.34Å; F283-K287 VanDerWaalsContact O-CB 3.32Å; F283-K287 WeakPolarHBondContact O-CB 3.34Å; F283-K287 PolarHBondContact O-N 3.47Å; F283-W297 HydrophobicContact CE2-CE3 4.35Å; F283-W297 HydrophobicContact CE2-CH2 4.01Å; F283-W297 AromaticContact CE2-CZ3 3.71Å; F283-W297 HydrophobicContact CE2-CZ3 3.71Å; F283-W297 AromaticContact CZ-CE3 3.74Å; F283-W297 HydrophobicContact CZ-CE3 3.74Å; F283-W297 HydrophobicContact CZ-CH2 4.21Å; F283-W297 AromaticContact CZ-CZ3 3.55Å; F283-W297 HydrophobicContact CZ-CZ3 3.55Å
284	L	98.3	Very high	97.7	Very high	95 Å²	95	60.4 Å²	60.4	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-35.9	179.2	-173.6	61.1	0	0	0	112.1	A281 D282 I286 K287 N288	A281-L284 HydrophobicContact CB-CB 4.25Å; A281-L284 VanDerWaalsContact O-CB 3.3Å; A281-L284 WeakPolarHBondContact O-CB 3.48Å; A281-L284 PolarHBondContact O-N 3.44Å; D282-L284 PolarHBondContact O-N 3.39Å; L284-I286 VanDerWaalsContact C-N 3.35Å; L284-K287 PolarHBondContact O-N 3.23Å; L284-N288 WeakPolarHBondContact O-CB 3.35Å; L284-N288 VanDerWaalsContact O-CG 3.24Å; L284-N288 PolarHBondContact O-N 3.45Å; L284-N288 VanDerWaalsContact O-N 3.15Å; L284-N288 PolarHBondContact O-ND2 3.27Å; L284-N288 VanDerWaalsContact O-ND2 3.16Å
285	E	98.5	Very high	97.9	Very high	45 Å²	45	52.5 Å²	52.5	21%	0.21	29%	0.285	C	S	.	.	H	α-helix	trans	-65.8	-41.8	175.4	-62.2	-172.5	105.2	0	0	110.8	L277 G278 S279 K280 A281 D282 F283 N288 H289	L277-E285 HydrophobicContact CD1-CB 3.85Å; L277-E285 HydrophobicContact CG-CB 4.21Å; G278-E285 VanDerWaalsContact C-OE2 3.26Å; G278-E285 WeakPolarHBondContact CA-OE2 3.43Å; G278-E285 PolarHBondContact N-OE2 2.89Å; S279-E285 PolarHBondContact N-OE2 2.83Å; K280-E285 PolarHBondContact N-OE2 2.93Å; A281-E285 HydrophobicContact CB-CG 3.86Å; A281-E285 PolarHBondContact N-OE2 2.92Å; A281-E285 VanDerWaalsContact N-OE2 3.13Å; D282-E285 PolarHBondContact O-N 3.49Å; D282-E285 VanDerWaalsContact O-N 3.1Å; F283-E285 VanDerWaalsContact C-N 3.32Å; F283-E285 PolarHBondContact O-N 2.98Å; E285-N288 PolarHBondContact O-N 3.36Å; E285-H289 PolarHBondContact O-N 2.91Å
286	I	98.6	Very high	97.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-48.8	176.8	-46.7	-59.4	0	0	0	110.2	A144 W217 L220 L268 L277 F283 L284 N288 H289 F292	A144-I286 HydrophobicContact CB-CG2 3.86Å; W217-I286 HydrophobicContact CD2-CD1 3.97Å; W217-I286 HydrophobicContact CD2-CG1 3.95Å; W217-I286 HydrophobicContact CE3-CD1 3.93Å; W217-I286 HydrophobicContact CE3-CG1 3.77Å; W217-I286 HydrophobicContact CG-CD1 4.32Å; W217-I286 HydrophobicContact CH2-CG1 3.96Å; W217-I286 HydrophobicContact CZ2-CG1 4.1Å; W217-I286 HydrophobicContact CZ3-CD1 4.43Å; W217-I286 HydrophobicContact CZ3-CG1 3.78Å; L220-I286 HydrophobicContact CD2-CG2 4.34Å; L268-I286 HydrophobicContact CD2-CD1 3.71Å; L277-I286 HydrophobicContact CB-CD1 4.49Å; L277-I286 HydrophobicContact CD2-CD1 3.84Å; L277-I286 HydrophobicContact CG-CD1 3.88Å; F283-I286 HydrophobicContact CD2-CB 4.25Å; F283-I286 WeakPolarHBondContact O-CB 3.3Å; F283-I286 PolarHBondContact O-N 3.34Å; L284-I286 VanDerWaalsContact C-N 3.35Å; I286-N288 PolarHBondContact O-N 3.09Å; I286-H289 WeakPolarHBondContact O-CB 3.47Å; I286-H289 PolarHBondContact O-N 3.13Å; I286-F292 HydrophobicContact CG2-CD2 4.36Å; I286-F292 HydrophobicContact CG2-CE2 3.72Å; I286-F292 HydrophobicContact CG2-CZ 4.33Å; I286-F292 WeakPolarHBondContact O-CD2 3.43Å
287	K	98.1	Very high	97.9	Very high	83 Å²	83	52 Å²	52	36%	0.361	28%	0.284	S	S	.	.	H	α-helix	trans	-57.3	-38.5	-178.4	-168.8	-178.1	178.8	174.5	0	112.7	F283 L284 W297	F283-K287 VanDerWaalsContact O-CB 3.32Å; F283-K287 WeakPolarHBondContact O-CB 3.34Å; F283-K287 PolarHBondContact O-N 3.47Å; L284-K287 PolarHBondContact O-N 3.23Å; K287-W297 HydrophobicContact CB-CZ2 4.28Å; K287-W297 HydrophobicContact CD-CD2 4.45Å; K287-W297 HydrophobicContact CD-CG 4.14Å; K287-W297 VanDerWaalsContact CE-CD1 3.48Å; K287-W297 VanDerWaalsContact CE-CG 3.45Å; K287-W297 VanDerWaalsContact CG-CD1 3.5Å; K287-W297 HydrophobicContact CG-CD2 3.75Å; K287-W297 VanDerWaalsContact CG-CE2 3.49Å; K287-W297 HydrophobicContact CG-CG 3.75Å; K287-W297 HydrophobicContact CG-CZ2 4.1Å; K287-W297 VanDerWaalsContact CG-NE1 3.31Å; K287-W297 PolarHBondContact O-NE1 2.6Å
288	N	98.4	Very high	97.8	Very high	116 Å²	116	54.7 Å²	54.7	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-88.5	-6.7	-174.8	-68.2	-22.7	0	0	0	113.8	L284 E285 I286	L284-N288 WeakPolarHBondContact O-CB 3.35Å; L284-N288 VanDerWaalsContact O-CG 3.24Å; L284-N288 PolarHBondContact O-N 3.45Å; L284-N288 VanDerWaalsContact O-N 3.15Å; L284-N288 PolarHBondContact O-ND2 3.27Å; L284-N288 VanDerWaalsContact O-ND2 3.16Å; E285-N288 PolarHBondContact O-N 3.36Å; I286-N288 PolarHBondContact O-N 3.09Å
289	H	98.8	Very high	97.9	Very high	18 Å²	18	56.6 Å²	56.6	8%	0.083	31%	0.309	C	S	.	.	S	Bend	trans	-66.2	137.5	-179.7	-169.2	-81.3	0	0	0	111.7	A260 D263 L264 L277 E285 I286 F291 F292	A260-H289 PolarHBondContact O-CE1 2.83Å; D263-H289 IonicContact OD2-CE1 3.27Å; D263-H289 IonicContact OD2-NE2 3.14Å; D263-H289 PolarHBondContact OD2-NE2 2.91Å; D263-H289 VanDerWaalsContact OD2-NE2 3.07Å; L264-H289 VanDerWaalsContact CB-CE1 3.41Å; L264-H289 WeakPolarHBondContact CB-CE1 3.42Å; L264-H289 HydrophobicContact CD1-CB 4.28Å; L264-H289 PolarHBondContact N-CE1 3.07Å; L277-H289 HydrophobicContact CD2-CB 4.32Å; E285-H289 PolarHBondContact O-N 2.91Å; I286-H289 WeakPolarHBondContact O-CB 3.47Å; I286-H289 PolarHBondContact O-N 3.13Å; H289-F291 WeakPolarHBondContact ND1-CB 3.35Å; H289-F291 PolarHBondContact ND1-N 3.25Å; H289-F291 VanDerWaalsContact ND1-N 3.2Å; H289-F291 PolarHBondContact O-N 3.1Å; H289-F292 HydrophobicContact CB-CD2 4.25Å; H289-F292 PolarHBondContact O-N 2.64Å
290	V	98.4	Very high	98	Very high	86 Å²	86	54.9 Å²	54.9	52%	0.521	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-57.8	-29.7	-172.8	65.9	0	0	0	0	113.9	A260 F292 S293	A260-V290 HydrophobicContact CB-CG1 3.81Å; V290-F292 PolarHBondContact O-N 3.37Å; V290-S293 VanDerWaalsContact O-CB 3.27Å; V290-S293 WeakPolarHBondContact O-CB 3.21Å; V290-S293 PolarHBondContact O-N 3.22Å; V290-S293 PolarHBondContact O-OG 3.45Å
291	F	98.8	Very high	98.1	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-54.6	-33.9	172.9	-179.8	-100.7	0	0	0	113.3	E133 R137 L224 A260 A261 L264 H289	E133-F291 HydrophobicContact CG-CE2 3.69Å; E133-F291 HydrophobicContact CG-CZ 4.22Å; R137-F291 HydrophobicContact CB-CE1 3.66Å; R137-F291 HydrophobicContact CB-CE2 4.48Å; R137-F291 HydrophobicContact CB-CZ 3.62Å; R137-F291 WeakPolarHBondContact CD-O 3.22Å; R137-F291 HydrophobicContact CG-CD1 4.05Å; R137-F291 HydrophobicContact CG-CE1 3.63Å; R137-F291 HydrophobicContact CG-CZ 4Å; R137-F291 PolarHBondContact NE-O 2.9Å; L224-F291 HydrophobicContact CD1-CE1 4.45Å; L224-F291 HydrophobicContact CD1-CZ 4.19Å; L224-F291 HydrophobicContact CD2-CE1 4.21Å; L224-F291 HydrophobicContact CD2-CZ 4.38Å; A260-F291 HydrophobicContact CB-CB 4.3Å; A261-F291 HydrophobicContact CB-CD2 3.87Å; A261-F291 HydrophobicContact CB-CE2 3.7Å; L264-F291 HydrophobicContact CB-CB 4.11Å; L264-F291 HydrophobicContact CB-CG 4.37Å; L264-F291 HydrophobicContact CD2-CB 3.79Å; L264-F291 HydrophobicContact CD2-CD1 3.18Å; L264-F291 HydrophobicContact CD2-CD2 4.41Å; L264-F291 HydrophobicContact CD2-CE1 3.75Å; L264-F291 HydrophobicContact CD2-CG 3.55Å; L264-F291 HydrophobicContact CG-CB 4.49Å; H289-F291 WeakPolarHBondContact ND1-CB 3.35Å; H289-F291 PolarHBondContact ND1-N 3.25Å; H289-F291 VanDerWaalsContact ND1-N 3.2Å; H289-F291 PolarHBondContact O-N 3.1Å
292	F	98.7	Very high	98.1	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-95.2	4	179.4	-61.5	-71.8	0	0	0	113.6	R137 A140 A141 L264 I286 H289 V290 P294 I295 W297	R137-F292 HydrophobicContact CG-CD1 4.1Å; R137-F292 HydrophobicContact CG-CE1 4.46Å; A140-F292 HydrophobicContact CB-CE1 4.08Å; A140-F292 HydrophobicContact CB-CZ 4.21Å; A141-F292 HydrophobicContact CB-CD1 3.92Å; A141-F292 HydrophobicContact CB-CE1 3.95Å; L264-F292 HydrophobicContact CD1-CE2 4.16Å; L264-F292 HydrophobicContact CD2-CD2 4.43Å; L264-F292 HydrophobicContact CD2-CE2 3.6Å; L264-F292 HydrophobicContact CD2-CZ 3.79Å; I286-F292 HydrophobicContact CG2-CD2 4.36Å; I286-F292 HydrophobicContact CG2-CE2 3.72Å; I286-F292 HydrophobicContact CG2-CZ 4.33Å; I286-F292 WeakPolarHBondContact O-CD2 3.43Å; H289-F292 HydrophobicContact CB-CD2 4.25Å; H289-F292 PolarHBondContact O-N 2.64Å; V290-F292 PolarHBondContact O-N 3.37Å; F292-P294 VanDerWaalsContact O-N 3.1Å; F292-I295 HydrophobicContact CD1-CG1 4.46Å; F292-I295 WeakPolarHBondContact O-CB 3.18Å; F292-I295 PolarHBondContact O-N 3.25Å; F292-W297 HydrophobicContact CB-CZ2 3.61Å; F292-W297 HydrophobicContact CD1-CH2 4.24Å; F292-W297 HydrophobicContact CD1-CZ2 4.11Å; F292-W297 HydrophobicContact CD2-CZ2 4.25Å; F292-W297 HydrophobicContact CG-CH2 4.24Å; F292-W297 AromaticContact CG-CZ2 3.75Å; F292-W297 HydrophobicContact CG-CZ2 3.75Å
293	S	97.7	Very high	98.1	Very high	92 Å²	92	55.7 Å²	55.7	64%	0.643	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-30.4	178.8	59.3	0	0	0	0	115.4	V290 I295	V290-S293 VanDerWaalsContact O-CB 3.27Å; V290-S293 WeakPolarHBondContact O-CB 3.21Å; V290-S293 PolarHBondContact O-N 3.22Å; V290-S293 PolarHBondContact O-OG 3.45Å; S293-I295 VanDerWaalsContact C-N 3.26Å; S293-I295 PolarHBondContact O-N 3.19Å
294	P	97.5	Very high	98.1	Very high	85 Å²	85	60.3 Å²	60.3	55%	0.552	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.7	175	-18.3	35.9	0	0	0	114.6	F292	F292-P294 VanDerWaalsContact O-N 3.1Å
295	I	98.3	Very high	98	Very high	23 Å²	23	57.8 Å²	57.8	12%	0.118	29%	0.292	C	S	.	.			trans	-93.8	117.4	-176.3	-56.8	-60.8	0	0	0	109.7	R137 A141 F292 S293 W297 L300 L305	R137-I295 HydrophobicContact CG-CD1 4.34Å; R137-I295 HydrophobicContact CG-CG1 4.21Å; A141-I295 HydrophobicContact CB-CG1 4.21Å; A141-I295 HydrophobicContact CB-CG2 4.17Å; F292-I295 HydrophobicContact CD1-CG1 4.46Å; F292-I295 WeakPolarHBondContact O-CB 3.18Å; F292-I295 PolarHBondContact O-N 3.25Å; S293-I295 VanDerWaalsContact C-N 3.26Å; S293-I295 PolarHBondContact O-N 3.19Å; I295-W297 HydrophobicContact CG2-CD2 4.25Å; I295-W297 PolarHBondContact O-N 3.07Å; I295-L300 HydrophobicContact CG2-CB 4.21Å; I295-L300 HydrophobicContact CG2-CD1 4.24Å; I295-L300 HydrophobicContact CG2-CD2 4.14Å; I295-L300 HydrophobicContact CG2-CG 4.44Å; I295-L305 HydrophobicContact CG2-CD1 4.25Å
296	N	98.4	Very high	97.9	Very high	78 Å²	78	61.6 Å²	61.6	42%	0.417	32%	0.319	S	S	.	.			trans	-78.4	107.6	161.3	-176.9	-24.5	0	0	0	108.8	D298 D299 L300	N296-D298 VanDerWaalsContact C-N 3.3Å; N296-D298 PolarHBondContact O-N 2.8Å; N296-D298 WeakPolarHBondContact OD1-CB 3.13Å; N296-D298 PolarHBondContact OD1-N 3.22Å; N296-D299 HydrophobicContact CB-CB 3.99Å; N296-D299 WeakPolarHBondContact CB-OD2 3.23Å; N296-D299 PolarHBondContact ND2-OD2 3.27Å; N296-D299 PolarHBondContact O-N 2.84Å; N296-D299 PolarHBondContact OD1-N 3.26Å; N296-L300 WeakPolarHBondContact O-CB 3.49Å; N296-L300 PolarHBondContact O-N 2.97Å
297	W	98.3	Very high	97.7	Very high	28 Å²	28	62.7 Å²	62.7	11%	0.106	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-27.8	-176.5	-66.6	94.4	0	0	0	114.3	A141 A144 F283 K287 F292 I295 L300 Y301	A141-W297 HydrophobicContact CB-CH2 3.93Å; A141-W297 HydrophobicContact CB-CZ3 4.01Å; A141-W297 WeakPolarHBondContact O-CZ3 3.4Å; A144-W297 HydrophobicContact CB-CH2 4.43Å; F283-W297 HydrophobicContact CE2-CE3 4.35Å; F283-W297 HydrophobicContact CE2-CH2 4.01Å; F283-W297 AromaticContact CE2-CZ3 3.71Å; F283-W297 HydrophobicContact CE2-CZ3 3.71Å; F283-W297 AromaticContact CZ-CE3 3.74Å; F283-W297 HydrophobicContact CZ-CE3 3.74Å; F283-W297 HydrophobicContact CZ-CH2 4.21Å; F283-W297 AromaticContact CZ-CZ3 3.55Å; F283-W297 HydrophobicContact CZ-CZ3 3.55Å; K287-W297 HydrophobicContact CB-CZ2 4.28Å; K287-W297 HydrophobicContact CD-CD2 4.45Å; K287-W297 HydrophobicContact CD-CG 4.14Å; K287-W297 VanDerWaalsContact CE-CD1 3.48Å; K287-W297 VanDerWaalsContact CE-CG 3.45Å; K287-W297 VanDerWaalsContact CG-CD1 3.5Å; K287-W297 HydrophobicContact CG-CD2 3.75Å; K287-W297 VanDerWaalsContact CG-CE2 3.49Å; K287-W297 HydrophobicContact CG-CG 3.75Å; K287-W297 HydrophobicContact CG-CZ2 4.1Å; K287-W297 VanDerWaalsContact CG-NE1 3.31Å; K287-W297 PolarHBondContact O-NE1 2.6Å; F292-W297 HydrophobicContact CB-CZ2 3.61Å; F292-W297 HydrophobicContact CD1-CH2 4.24Å; F292-W297 HydrophobicContact CD1-CZ2 4.11Å; F292-W297 HydrophobicContact CD2-CZ2 4.25Å; F292-W297 HydrophobicContact CG-CH2 4.24Å; F292-W297 AromaticContact CG-CZ2 3.75Å; F292-W297 HydrophobicContact CG-CZ2 3.75Å; I295-W297 HydrophobicContact CG2-CD2 4.25Å; I295-W297 PolarHBondContact O-N 3.07Å; W297-L300 HydrophobicContact CE3-CD2 3.69Å; W297-L300 HydrophobicContact CZ3-CD2 3.89Å; W297-Y301 WeakPolarHBondContact O-CB 3.5Å; W297-Y301 PolarHBondContact O-N 2.66Å
298	D	97.9	Very high	97.5	Very high	84 Å²	84	61.8 Å²	61.8	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-72.3	-43.3	175	-174	63.9	0	0	0	110.8	N296 L300 Y301 H302 R304	N296-D298 VanDerWaalsContact C-N 3.3Å; N296-D298 PolarHBondContact O-N 2.8Å; N296-D298 WeakPolarHBondContact OD1-CB 3.13Å; N296-D298 PolarHBondContact OD1-N 3.22Å; D298-L300 VanDerWaalsContact C-N 3.31Å; D298-L300 PolarHBondContact O-N 2.88Å; D298-Y301 PolarHBondContact O-N 3.32Å; D298-H302 PolarHBondContact O-N 2.92Å; D298-H302 PolarHBondContact O-ND1 3.25Å; D298-H302 IonicContact OD1-CE1 2.74Å; D298-H302 PolarHBondContact OD1-CE1 2.89Å; D298-H302 IonicContact OD1-ND1 3.78Å; D298-H302 PolarHBondContact OD1-ND1 3.43Å; D298-H302 IonicContact OD2-ND1 3.58Å; D298-R304 IonicContact OD2-CZ 3.72Å; D298-R304 IonicContact OD2-NH1 2.67Å; D298-R304 IonicContact OD2-NH2 3.96Å; D298-R304 PolarHBondContact OD2-NH2 3.08Å
299	D	98.4	Very high	97.1	Very high	40 Å²	40	58 Å²	58	21%	0.214	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-38.3	173.6	-68.7	-29.7	0	0	0	111.8	N296 K303 R304 L305	N296-D299 HydrophobicContact CB-CB 3.99Å; N296-D299 WeakPolarHBondContact CB-OD2 3.23Å; N296-D299 PolarHBondContact ND2-OD2 3.27Å; N296-D299 PolarHBondContact O-N 2.84Å; N296-D299 PolarHBondContact OD1-N 3.26Å; D299-K303 PolarHBondContact O-N 2.89Å; D299-R304 HydrophobicContact CB-CB 4.05Å; D299-R304 PolarHBondContact O-N 3.47Å; D299-R304 IonicContact OD1-CZ 3.39Å; D299-R304 IonicContact OD1-NE 3.14Å; D299-R304 PolarHBondContact OD1-NE 3.31Å; D299-R304 IonicContact OD1-NH2 3.62Å; D299-R304 PolarHBondContact OD1-NH2 3.29Å; D299-L305 HydrophobicContact CB-CD2 3.63Å; D299-L305 HydrophobicContact CB-CG 3.78Å
300	L	98.2	Very high	96.7	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-55.4	175	-172	82.4	0	0	0	110	F95 F138 A141 E142 I295 N296 W297 D298 H302 K303 L305	F95-L300 HydrophobicContact CE2-CD2 4.4Å; F95-L300 HydrophobicContact CE2-CG 4.11Å; F95-L300 HydrophobicContact CZ-CG 4.18Å; F95-L300 VanDerWaalsContact CZ-O 3.26Å; F95-L300 WeakPolarHBondContact CZ-O 3.15Å; F138-L300 HydrophobicContact CE2-CD1 4.25Å; A141-L300 HydrophobicContact CB-CD1 4.4Å; A141-L300 HydrophobicContact CB-CD2 3.8Å; E142-L300 HydrophobicContact CG-CD1 3.69Å; E142-L300 HydrophobicContact CG-CD2 4.46Å; E142-L300 HydrophobicContact CG-CG 4.18Å; I295-L300 HydrophobicContact CG2-CB 4.21Å; I295-L300 HydrophobicContact CG2-CD1 4.24Å; I295-L300 HydrophobicContact CG2-CD2 4.14Å; I295-L300 HydrophobicContact CG2-CG 4.44Å; N296-L300 WeakPolarHBondContact O-CB 3.49Å; N296-L300 PolarHBondContact O-N 2.97Å; W297-L300 HydrophobicContact CE3-CD2 3.69Å; W297-L300 HydrophobicContact CZ3-CD2 3.89Å; D298-L300 VanDerWaalsContact C-N 3.31Å; D298-L300 PolarHBondContact O-N 2.88Å; L300-H302 VanDerWaalsContact C-N 3.29Å; L300-H302 PolarHBondContact O-N 2.97Å; L300-K303 PolarHBondContact O-N 3.19Å; L300-L305 HydrophobicContact CB-CD1 3.94Å; L300-L305 HydrophobicContact CD1-CD1 3.83Å
301	Y	96.9	Very high	95.9	Very high	90 Å²	90	57.7 Å²	57.7	35%	0.353	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-41.5	-179.1	-177.5	-92.3	0	0	0	112.1	H93 P94 W297 D298 K303	H93-Y301 AromaticContact CD2-CE2 3.59Å; H93-Y301 AromaticContact NE2-CD2 3.65Å; H93-Y301 AromaticContact NE2-CE2 3.54Å; P94-Y301 HydrophobicContact CG-CD2 4.11Å; P94-Y301 HydrophobicContact CG-CE2 4.2Å; P94-Y301 VanDerWaalsContact CG-O 3.29Å; P94-Y301 WeakPolarHBondContact CG-O 3.41Å; W297-Y301 WeakPolarHBondContact O-CB 3.5Å; W297-Y301 PolarHBondContact O-N 2.66Å; D298-Y301 PolarHBondContact O-N 3.32Å; Y301-K303 PolarHBondContact O-N 3.35Å
302	H	97.1	Very high	95	Very high	97 Å²	97	63.8 Å²	63.8	45%	0.449	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	11.1	178.6	-64	99.4	0	0	0	114	D298 L300 R304	D298-H302 PolarHBondContact O-N 2.92Å; D298-H302 PolarHBondContact O-ND1 3.25Å; D298-H302 IonicContact OD1-CE1 2.74Å; D298-H302 PolarHBondContact OD1-CE1 2.89Å; D298-H302 IonicContact OD1-ND1 3.78Å; D298-H302 PolarHBondContact OD1-ND1 3.43Å; D298-H302 IonicContact OD2-ND1 3.58Å; L300-H302 VanDerWaalsContact C-N 3.29Å; L300-H302 PolarHBondContact O-N 2.97Å; H302-R304 HydrophobicContact CB-CG 4.01Å; H302-R304 PolarHBondContact O-N 3.28Å
303	K	97	Very high	94	Very high	64 Å²	64	65 Å²	65	28%	0.278	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	35.5	-176.2	-66.2	-171	171.6	-171.8	0	113.3	P94 F95 D168 D299 L300 Y301	P94-K303 HydrophobicContact CB-CD 4.43Å; P94-K303 HydrophobicContact CB-CG 4.29Å; P94-K303 VanDerWaalsContact O-CE 3.29Å; P94-K303 WeakPolarHBondContact O-CE 3.42Å; P94-K303 PolarHBondContact O-NZ 3.45Å; F95-K303 HydrophobicContact CE1-CD 4.43Å; F95-K303 HydrophobicContact CE1-CG 3.95Å; F95-K303 HydrophobicContact CZ-CG 4.4Å; D168-K303 IonicContact OD2-NZ 3.56Å; D168-K303 PolarHBondContact OD2-NZ 3.34Å; D299-K303 PolarHBondContact O-N 2.89Å; L300-K303 PolarHBondContact O-N 3.19Å; Y301-K303 PolarHBondContact O-N 3.35Å
304	R	97.3	Very high	92.4	Very high	139 Å²	139	63.3 Å²	63.3	53%	0.525	33%	0.327	S	S	.	.			trans	-85.5	-19.1	175.6	-62	-165.4	-65.1	-124	-0.8	112.7	D298 D299 H302	D298-R304 IonicContact OD2-CZ 3.72Å; D298-R304 IonicContact OD2-NH1 2.67Å; D298-R304 IonicContact OD2-NH2 3.96Å; D298-R304 PolarHBondContact OD2-NH2 3.08Å; D299-R304 HydrophobicContact CB-CB 4.05Å; D299-R304 PolarHBondContact O-N 3.47Å; D299-R304 IonicContact OD1-CZ 3.39Å; D299-R304 IonicContact OD1-NE 3.14Å; D299-R304 PolarHBondContact OD1-NE 3.31Å; D299-R304 IonicContact OD1-NH2 3.62Å; D299-R304 PolarHBondContact OD1-NH2 3.29Å; H302-R304 HydrophobicContact CB-CG 4.01Å; H302-R304 PolarHBondContact O-N 3.28Å
305	L	96.6	Very high	90.7	Very high	42 Å²	42	64.6 Å²	64.6	22%	0.22	33%	0.333	C	S	.	.	S	Bend	trans	-77.1	132.7	172	-58.9	-176.1	0	0	0	110.3	F138 H172 I295 D299 L300 P307	F138-L305 HydrophobicContact CE2-CB 3.82Å; H172-L305 PolarHBondContact CE1-O 3.2Å; I295-L305 HydrophobicContact CG2-CD1 4.25Å; D299-L305 HydrophobicContact CB-CD2 3.63Å; D299-L305 HydrophobicContact CB-CG 3.78Å; L300-L305 HydrophobicContact CB-CD1 3.94Å; L300-L305 HydrophobicContact CD1-CD1 3.83Å; L305-P307 WeakPolarHBondContact O-CD 3.39Å
306	T	95.6	Very high	88.6	Confident	125 Å²	125	69.8 Å²	69.8	77%	0.767	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-72.4	125.2	177.2	-57.6	0	0	0	0	110.4
307	P	95.7	Very high	86.4	Confident	24 Å²	24	66.4 Å²	66.4	16%	0.156	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-59.4	143.3	175.8	-28.8	38.4	0	0	0	112.8	F138 Q170 H172 L305 F309	F138-P307 HydrophobicContact CE1-CB 4.17Å; F138-P307 HydrophobicContact CE1-CG 4.44Å; F138-P307 HydrophobicContact CZ-CB 4.22Å; F138-P307 HydrophobicContact CZ-CG 4.17Å; Q170-P307 WeakPolarHBondContact O-CB 3.41Å; Q170-P307 WeakPolarHBondContact O-CG 3.5Å; H172-P307 VanDerWaalsContact CE1-CG 3.44Å; H172-P307 WeakPolarHBondContact CE1-CG 3.33Å; H172-P307 WeakPolarHBondContact NE2-CG 3.46Å; L305-P307 WeakPolarHBondContact O-CD 3.39Å; P307-F309 PolarHBondContact O-N 3.12Å
308	P	92.9	Very high	84.1	Confident	63 Å²	63	69.1 Å²	69.1	41%	0.409	37%	0.366	S	S	.	.	S	Bend	trans	-71.8	-9	-178.4	30.6	-37.9	0	0	0	113.6	R135 F138 Y139	R135-P308 HydrophobicContact CB-CB 4.1Å; R135-P308 HydrophobicContact CB-CG 4.08Å; R135-P308 HydrophobicContact CG-CB 4.18Å; R135-P308 HydrophobicContact CG-CG 3.76Å; F138-P308 HydrophobicContact CB-CG 4.09Å; F138-P308 HydrophobicContact CD1-CG 3.96Å; F138-P308 HydrophobicContact CG-CG 4.06Å; Y139-P308 HydrophobicContact CE1-CG 4.23Å
309	F	91.6	Very high	81.7	Confident	37 Å²	37	68.4 Å²	68.4	16%	0.162	38%	0.379	C	S	.	.			trans	-148.2	132.1	-178.2	167.4	-98.2	0	0	0	109.7	H124 R135 Y139 L167 G171 P307 P311	H124-F309 AromaticContact CE1-CE1 3.41Å; H124-F309 VanDerWaalsContact CE1-CE1 3.41Å; H124-F309 WeakPolarHBondContact CE1-CE1 3.23Å; H124-F309 AromaticContact CE1-CZ 3.61Å; H124-F309 AromaticContact ND1-CE1 3.52Å; H124-F309 AromaticContact ND1-CZ 3.51Å; R135-F309 VanDerWaalsContact NH2-CD1 3.32Å; Y139-F309 WeakPolarHBondContact OH-CB 3Å; L167-F309 HydrophobicContact CD1-CD1 3.85Å; L167-F309 HydrophobicContact CD1-CE1 4.06Å; G171-F309 WeakPolarHBondContact CA-O 3.23Å; P307-F309 PolarHBondContact O-N 3.12Å; F309-P311 HydrophobicContact CD1-CG 4.19Å; F309-P311 HydrophobicContact CE1-CB 3.95Å; F309-P311 HydrophobicContact CE1-CG 3.78Å; F309-P311 HydrophobicContact CZ-CB 4.49Å
310	N	88.8	Confident	79	Confident	83 Å²	83	70.8 Å²	70.8	44%	0.444	39%	0.394	S	S	.	.			trans	-102.9	122.2	171.2	-175.2	-27.2	0	0	0	109.2	N312	N310-N312 PolarHBondContact O-N 3.22Å; N310-N312 VanDerWaalsContact O-N 3.1Å; N310-N312 PolarHBondContact OD1-N 3.22Å
311	P	82.2	Confident	76.1	Confident	14 Å²	14	80.7 Å²	80.7	9%	0.091	43%	0.432	C	S	.	.			trans	-64.5	-9.9	178.8	-21.1	32.9	0	0	0	115.4	L167 D168 F309 V313	L167-P311 HydrophobicContact CB-CG 4.24Å; D168-P311 WeakPolarHBondContact O-CG 3.47Å; F309-P311 HydrophobicContact CD1-CG 4.19Å; F309-P311 HydrophobicContact CE1-CB 3.95Å; F309-P311 HydrophobicContact CE1-CG 3.78Å; F309-P311 HydrophobicContact CZ-CB 4.49Å; P311-V313 HydrophobicContact CB-CG1 4.32Å; P311-V313 HydrophobicContact CB-CG2 4.15Å
312	N	79.9	Confident	73.1	Confident	130 Å²	130	87.1 Å²	87.1	70%	0.695	46%	0.462	S	S	*	.			trans	56.9	47.4	-177.8	-66.6	-32.3	0	0	0	112.8	N310	N310-N312 PolarHBondContact O-N 3.22Å; N310-N312 VanDerWaalsContact O-N 3.1Å; N310-N312 PolarHBondContact OD1-N 3.22Å
313	V	77.5	Confident	70.2	Confident	27 Å²	27	85.7 Å²	85.7	16%	0.164	47%	0.467	C	S	.	.			trans	-116.3	143.1	178.4	-63.6	0	0	0	0	110.7	N117 C169 P311 F325	N117-V313 HydrophobicContact CB-CG2 4.49Å; N117-V313 WeakPolarHBondContact ND2-CG2 3.44Å; N117-V313 WeakPolarHBondContact OD1-CG2 3.25Å; C169-V313 HydrophobicContact CB-CG2 3.92Å; P311-V313 HydrophobicContact CB-CG1 4.32Å; P311-V313 HydrophobicContact CB-CG2 4.15Å; V313-F325 HydrophobicContact CG1-CD2 4.25Å
314	D	65.3	Low	67.2	Low	55 Å²	55	87.8 Å²	87.8	29%	0.294	49%	0.489	S	S	.	.			trans	-64.7	137.2	-179.3	-74.1	-33.6	0	0	0	111.2	N117 L316 T320 R321	N117-D314 PolarHBondContact ND2-O 3.42Å; D314-L316 PolarHBondContact O-N 3.4Å; D314-T320 PolarHBondContact OD2-OG1 3.14Å; D314-R321 PolarHBondContact OD2-N 2.94Å
315	T	60.5	Low	64.5	Low	112 Å²	112	85.5 Å²	85.5	69%	0.687	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.2	174.6	55.8	0	0	0	0	112.9	C169	C169-T315 HydrophobicContact CB-CG2 4.4Å
316	L	54.2	Low	61.7	Low	132 Å²	132	92.8 Å²	92.8	69%	0.691	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	14	-172	-67.4	169.5	0	0	0	114.4	F60 D314	F60-L316 WeakPolarHBondContact CE2-O 3.35Å; D314-L316 PolarHBondContact O-N 3.4Å
317	G	53	Low	59	Low	8 Å²	8	93.6 Å²	93.6	8%	0.082	50%	0.497	C	S	.	.			trans	88.6	172.5	-179.1	0	0	0	0	0	113.7	G319	G317-G319 PolarHBondContact O-N 2.93Å
318	P	50.5	Low	56.3	Low	85 Å²	85	95.7 Å²	95.7	55%	0.552	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	91.4	-172.6	26.9	-31.1	0	0	0	110.8	L51 F60	L51-P318 HydrophobicContact CD2-CG 3.63Å; F60-P318 HydrophobicContact CE1-CG 4.47Å
319	G	45.9	Very low	53.8	Low	69 Å²	69	95.7 Å²	95.7	71%	0.711	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	176.4	-1.3	175.3	0	0	0	0	0	120	G317	G317-G319 PolarHBondContact O-N 2.93Å
320	T	41.9	Very low	51.1	Low	89 Å²	89	102 Å²	102	55%	0.546	53%	0.528	S	S	.	.	S	Bend	trans	-106.2	-17	-173	45.1	0	0	0	0	116.5	D314	D314-T320 PolarHBondContact OD2-OG1 3.14Å
321	R	37.1	Very low	48.7	Very low	210 Å²	210	104.6 Å²	104.6	79%	0.792	54%	0.535	S	S	*	.	S	Bend	trans	-139.6	157.9	156.8	-64.4	-174	-165.5	-165.5	3.8	111.2	D314 A323	D314-R321 PolarHBondContact OD2-N 2.94Å; R321-A323 PolarHBondContact O-N 3.22Å
322	K	34.8	Very low	46.7	Very low	225 Å²	225	105 Å²	105	98%	0.978	54%	0.537	S	S	*	.	S	Bend	trans	-64.6	68.8	171.1	-74.8	-178	177	176.1	0	111.1
323	A	35.8	Very low	44.8	Very low	67 Å²	67	99.8 Å²	99.8	55%	0.554	51%	0.51	S	S	*	.			trans	-115.6	79.4	155.6	0	0	0	0	0	105.8	R321 F325	R321-A323 PolarHBondContact O-N 3.22Å; A323-F325 PolarHBondContact O-N 3.05Å
324	S	34.1	Very low	42.8	Very low	107 Å²	107	105.3 Å²	105.3	75%	0.748	53%	0.532	S	S	*	.			trans	-65.5	100.9	172	60.1	0	0	0	0	107.9	R326	S324-R326 PolarHBondContact O-N 3.31Å
325	F	40.7	Very low	41.6	Very low	91 Å²	91	105.4 Å²	105.4	40%	0.399	53%	0.532	S	S	.	.			trans	-70	79	159	-146.3	-89.6	0	0	0	106.9	F123 V313 A323 W327	F123-F325 HydrophobicContact CD1-CZ 4.15Å; F123-F325 HydrophobicContact CE1-CZ 4.02Å; V313-F325 HydrophobicContact CG1-CD2 4.25Å; A323-F325 PolarHBondContact O-N 3.05Å; F325-W327 PolarHBondContact O-N 3.49Å
326	R	37.5	Very low	40.6	Very low	196 Å²	196	101.2 Å²	101.2	74%	0.74	51%	0.505	S	S	*	.			trans	-85.6	103	169.5	-160.1	174	-175.8	171	1.4	104.2	S324 D328	S324-R326 PolarHBondContact O-N 3.31Å; R326-D328 PolarHBondContact O-N 3.03Å
327	W	38.3	Very low	40	Very low	141 Å²	141	96.9 Å²	96.9	53%	0.534	49%	0.486	S	S	.	.			trans	-55	99.6	158.9	-178	86	0	0	0	106.1	F325 F329	F325-W327 PolarHBondContact O-N 3.49Å; W327-F329 HydrophobicContact CE3-CB 3.97Å; W327-F329 HydrophobicContact CH2-CB 3.84Å; W327-F329 AromaticContact CH2-CD2 3.16Å; W327-F329 HydrophobicContact CH2-CD2 3.16Å; W327-F329 AromaticContact CH2-CE2 3.96Å; W327-F329 HydrophobicContact CH2-CE2 3.96Å; W327-F329 AromaticContact CH2-CG 3.85Å; W327-F329 HydrophobicContact CH2-CG 3.85Å; W327-F329 AromaticContact CZ2-CD2 3.72Å; W327-F329 HydrophobicContact CZ2-CD2 3.72Å; W327-F329 HydrophobicContact CZ3-CB 3.53Å; W327-F329 AromaticContact CZ3-CD2 3.78Å; W327-F329 HydrophobicContact CZ3-CD2 3.78Å; W327-F329 AromaticContact CZ3-CG 3.97Å; W327-F329 HydrophobicContact CZ3-CG 3.97Å; W327-F329 PolarHBondContact O-N 3.37Å
328	D	40.5	Very low	39.4	Very low	68 Å²	68	102.1 Å²	102.1	36%	0.364	51%	0.512	S	S	.	.			trans	-96	87.1	-177.6	-173.8	-8.3	0	0	0	106.9	R326 K330 K331 T332	R326-D328 PolarHBondContact O-N 3.03Å; D328-K330 PolarHBondContact O-N 3.32Å; D328-K330 VanDerWaalsContact O-N 3.1Å; D328-K330 WeakPolarHBondContact OD1-CA 3.47Å; D328-K330 VanDerWaalsContact OD1-CB 3.31Å; D328-K330 WeakPolarHBondContact OD1-CB 3.29Å; D328-K330 PolarHBondContact OD1-N 3.23Å; D328-K331 HydrophobicContact CB-CB 3.75Å; D328-K331 WeakPolarHBondContact O-CA 3.29Å; D328-K331 WeakPolarHBondContact O-CB 3.48Å; D328-K331 PolarHBondContact O-N 3.43Å; D328-K331 PolarHBondContact OD1-N 2.98Å; D328-K331 VanDerWaalsContact OD1-N 3.15Å; D328-T332 PolarHBondContact O-N 3.43Å; D328-T332 PolarHBondContact O-OG1 3.46Å
329	F	39.3	Very low	38.8	Very low	64 Å²	64	101.1 Å²	101.1	28%	0.281	50%	0.501	S	S	.	.	H	α-helix	trans	-45.9	-38.2	172.5	-173.8	-113.5	0	0	0	112	W327 T332 V333 L350	W327-F329 HydrophobicContact CE3-CB 3.97Å; W327-F329 HydrophobicContact CH2-CB 3.84Å; W327-F329 AromaticContact CH2-CD2 3.16Å; W327-F329 HydrophobicContact CH2-CD2 3.16Å; W327-F329 AromaticContact CH2-CE2 3.96Å; W327-F329 HydrophobicContact CH2-CE2 3.96Å; W327-F329 AromaticContact CH2-CG 3.85Å; W327-F329 HydrophobicContact CH2-CG 3.85Å; W327-F329 AromaticContact CZ2-CD2 3.72Å; W327-F329 HydrophobicContact CZ2-CD2 3.72Å; W327-F329 HydrophobicContact CZ3-CB 3.53Å; W327-F329 AromaticContact CZ3-CD2 3.78Å; W327-F329 HydrophobicContact CZ3-CD2 3.78Å; W327-F329 AromaticContact CZ3-CG 3.97Å; W327-F329 HydrophobicContact CZ3-CG 3.97Å; W327-F329 PolarHBondContact O-N 3.37Å; F329-T332 PolarHBondContact O-N 3.11Å; F329-V333 HydrophobicContact CD1-CG2 4.17Å; F329-V333 HydrophobicContact CD2-CG2 4.25Å; F329-V333 HydrophobicContact CE1-CG2 3.93Å; F329-V333 HydrophobicContact CE2-CG2 4.07Å; F329-V333 HydrophobicContact CG-CG2 4.35Å; F329-V333 HydrophobicContact CZ-CG2 3.89Å; F329-V333 VanDerWaalsContact O-CB 3.27Å; F329-V333 WeakPolarHBondContact O-CB 3.21Å; F329-V333 WeakPolarHBondContact O-CG2 3.3Å; F329-V333 PolarHBondContact O-N 3.34Å; F329-L350 HydrophobicContact CD2-CD1 4.47Å; F329-L350 HydrophobicContact CE2-CB 4Å; F329-L350 HydrophobicContact CE2-CD1 3.75Å; F329-L350 HydrophobicContact CE2-CG 4.45Å; F329-L350 HydrophobicContact CZ-CB 4.34Å
330	K	35.4	Very low	38.5	Very low	170 Å²	170	99.6 Å²	99.6	74%	0.739	47%	0.474	S	S	*	.	H	α-helix	trans	-71	-34.9	-179.8	-62.5	-178.5	175.7	-176.9	0	111.4	D328 K334	D328-K330 PolarHBondContact O-N 3.32Å; D328-K330 VanDerWaalsContact O-N 3.1Å; D328-K330 WeakPolarHBondContact OD1-CA 3.47Å; D328-K330 VanDerWaalsContact OD1-CB 3.31Å; D328-K330 WeakPolarHBondContact OD1-CB 3.29Å; D328-K330 PolarHBondContact OD1-N 3.23Å; K330-K334 WeakPolarHBondContact O-CB 3.33Å; K330-K334 PolarHBondContact O-N 3.33Å
331	K	38.4	Very low	38	Very low	136 Å²	136	100.9 Å²	100.9	59%	0.591	48%	0.484	S	S	*	.	H	α-helix	trans	-70.6	-42.6	174.8	-164.1	175.5	-176.1	179.6	0	111.5	D328 K334 I335	D328-K331 HydrophobicContact CB-CB 3.75Å; D328-K331 WeakPolarHBondContact O-CA 3.29Å; D328-K331 WeakPolarHBondContact O-CB 3.48Å; D328-K331 PolarHBondContact O-N 3.43Å; D328-K331 PolarHBondContact OD1-N 2.98Å; D328-K331 VanDerWaalsContact OD1-N 3.15Å; K331-K334 PolarHBondContact O-N 3.25Å; K331-I335 HydrophobicContact CG-CD1 4.08Å; K331-I335 WeakPolarHBondContact O-CB 3.49Å; K331-I335 WeakPolarHBondContact O-CD1 3.35Å; K331-I335 WeakPolarHBondContact O-CG1 3.39Å; K331-I335 PolarHBondContact O-N 2.86Å
332	T	39.8	Very low	38.1	Very low	22 Å²	22	94.5 Å²	94.5	14%	0.135	48%	0.484	C	S	.	.	H	α-helix	trans	-63.3	-49.1	174.4	-54.2	0	0	0	0	110.9	D328 F329 K334 I335 M336	D328-T332 PolarHBondContact O-N 3.43Å; D328-T332 PolarHBondContact O-OG1 3.46Å; F329-T332 PolarHBondContact O-N 3.11Å; T332-K334 VanDerWaalsContact C-N 3.29Å; T332-K334 PolarHBondContact O-N 3.24Å; T332-I335 PolarHBondContact O-N 2.9Å; T332-M336 HydrophobicContact CG2-CG 4.3Å; T332-M336 WeakPolarHBondContact O-CB 3.32Å; T332-M336 WeakPolarHBondContact O-CG 3.46Å; T332-M336 PolarHBondContact O-N 2.88Å
333	V	39.8	Very low	38.4	Very low	22 Å²	22	86 Å²	86	13%	0.133	45%	0.448	C	S	.	.	H	α-helix	trans	-59.8	-38.6	175.4	169.6	0	0	0	0	111.6	F329 M336 S337 I346	F329-V333 HydrophobicContact CD1-CG2 4.17Å; F329-V333 HydrophobicContact CD2-CG2 4.25Å; F329-V333 HydrophobicContact CE1-CG2 3.93Å; F329-V333 HydrophobicContact CE2-CG2 4.07Å; F329-V333 HydrophobicContact CG-CG2 4.35Å; F329-V333 HydrophobicContact CZ-CG2 3.89Å; F329-V333 VanDerWaalsContact O-CB 3.27Å; F329-V333 WeakPolarHBondContact O-CB 3.21Å; F329-V333 WeakPolarHBondContact O-CG2 3.3Å; F329-V333 PolarHBondContact O-N 3.34Å; V333-M336 PolarHBondContact O-N 3.39Å; V333-S337 VanDerWaalsContact O-CB 3.32Å; V333-S337 WeakPolarHBondContact O-CB 3.47Å; V333-S337 PolarHBondContact O-N 2.77Å; V333-S337 PolarHBondContact O-OG 2.93Å; V333-I346 HydrophobicContact CG1-CG2 4.15Å; V333-I346 HydrophobicContact CG2-CG2 4.47Å
334	K	35.6	Very low	38.4	Very low	143 Å²	143	94.7 Å²	94.7	62%	0.622	47%	0.466	S	S	*	.	H	α-helix	trans	-70	-37.1	176.9	-173.5	169.8	-176.7	174.4	0	112.9	K330 K331 T332 N338	K330-K334 WeakPolarHBondContact O-CB 3.33Å; K330-K334 PolarHBondContact O-N 3.33Å; K331-K334 PolarHBondContact O-N 3.25Å; T332-K334 VanDerWaalsContact C-N 3.29Å; T332-K334 PolarHBondContact O-N 3.24Å; K334-N338 WeakPolarHBondContact O-CB 3.03Å; K334-N338 PolarHBondContact O-N 3.43Å; K334-N338 VanDerWaalsContact O-N 3.12Å; K334-N338 PolarHBondContact O-ND2 3.34Å
335	I	40.9	Very low	38.8	Very low	57 Å²	57	93.8 Å²	93.8	29%	0.292	46%	0.456	S	S	.	.	H	α-helix	trans	-65.9	-46.1	172.9	-70.7	165.1	0	0	0	109.8	K331 T332 N338 L339	K331-I335 HydrophobicContact CG-CD1 4.08Å; K331-I335 WeakPolarHBondContact O-CB 3.49Å; K331-I335 WeakPolarHBondContact O-CD1 3.35Å; K331-I335 WeakPolarHBondContact O-CG1 3.39Å; K331-I335 PolarHBondContact O-N 2.86Å; T332-I335 PolarHBondContact O-N 2.9Å; I335-N338 PolarHBondContact O-N 3.25Å; I335-L339 HydrophobicContact CG2-CD1 3.69Å; I335-L339 HydrophobicContact CG2-CG 4.44Å; I335-L339 WeakPolarHBondContact O-CB 3.27Å; I335-L339 WeakPolarHBondContact O-CG 3.47Å; I335-L339 PolarHBondContact O-N 3.25Å
336	M	39.9	Very low	38.8	Very low	24 Å²	24	90.5 Å²	90.5	12%	0.118	44%	0.443	C	S	.	.	H	α-helix	trans	-61.8	-43.4	175.7	-63.7	-72.2	-95.8	0	0	111.4	F122 T332 V333 N338 L339 Y340 I346	F122-M336 HydrophobicContact CZ-CE 4.1Å; T332-M336 HydrophobicContact CG2-CG 4.3Å; T332-M336 WeakPolarHBondContact O-CB 3.32Å; T332-M336 WeakPolarHBondContact O-CG 3.46Å; T332-M336 PolarHBondContact O-N 2.88Å; V333-M336 PolarHBondContact O-N 3.39Å; M336-N338 PolarHBondContact O-N 3.28Å; M336-L339 PolarHBondContact O-N 3.07Å; M336-Y340 HydrophobicContact CB-CD2 4.43Å; M336-Y340 HydrophobicContact CE-CE2 4.34Å; M336-Y340 WeakPolarHBondContact O-CB 3.25Å; M336-Y340 VanDerWaalsContact O-CD2 3.23Å; M336-Y340 WeakPolarHBondContact O-CD2 3.45Å; M336-Y340 PolarHBondContact O-N 2.95Å; M336-Y340 HydrophobicContact SD-CD2 4.34Å; M336-Y340 HydrophobicContact SD-CE2 3.84Å; M336-I346 HydrophobicContact CB-CG2 4.16Å
337	S	40.6	Very low	38.8	Very low	41 Å²	41	83.7 Å²	83.7	29%	0.287	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-32.2	176.2	-55	0	0	0	0	113	V333 Y340 I346	V333-S337 VanDerWaalsContact O-CB 3.32Å; V333-S337 WeakPolarHBondContact O-CB 3.47Å; V333-S337 PolarHBondContact O-N 2.77Å; V333-S337 PolarHBondContact O-OG 2.93Å; S337-Y340 CarbonylContact O-C 3.6Å; S337-I346 WeakPolarHBondContact OG-CD1 3.23Å
338	N	40.2	Very low	38.6	Very low	118 Å²	118	79.4 Å²	79.4	63%	0.631	42%	0.419	S	S	*	.	H	α-helix	trans	-84.2	-28.4	-179.8	-73.1	-12.4	0	0	0	112.7	K334 I335 M336	K334-N338 WeakPolarHBondContact O-CB 3.03Å; K334-N338 PolarHBondContact O-N 3.43Å; K334-N338 VanDerWaalsContact O-N 3.12Å; K334-N338 PolarHBondContact O-ND2 3.34Å; I335-N338 PolarHBondContact O-N 3.25Å; M336-N338 PolarHBondContact O-N 3.28Å
339	L	37.7	Very low	38.4	Very low	64 Å²	64	81.7 Å²	81.7	34%	0.335	43%	0.43	S	S	.	.	H	α-helix	trans	-84.4	-25.6	175.7	-69.8	170.5	0	0	0	112.1	I335 M336	I335-L339 HydrophobicContact CG2-CD1 3.69Å; I335-L339 HydrophobicContact CG2-CG 4.44Å; I335-L339 WeakPolarHBondContact O-CB 3.27Å; I335-L339 WeakPolarHBondContact O-CG 3.47Å; I335-L339 PolarHBondContact O-N 3.25Å; M336-L339 PolarHBondContact O-N 3.07Å
340	Y	39.8	Very low	38.3	Very low	36 Å²	36	81.9 Å²	81.9	14%	0.141	43%	0.434	C	S	.	.	S	Bend	trans	-126.5	71.9	179.3	-51.6	-74.2	0	0	0	111.3	L231 M336 S337 G342	L231-Y340 VanDerWaalsContact CD2-OH 3.25Å; L231-Y340 WeakPolarHBondContact CD2-OH 3.45Å; M336-Y340 HydrophobicContact CB-CD2 4.43Å; M336-Y340 HydrophobicContact CE-CE2 4.34Å; M336-Y340 WeakPolarHBondContact O-CB 3.25Å; M336-Y340 VanDerWaalsContact O-CD2 3.23Å; M336-Y340 WeakPolarHBondContact O-CD2 3.45Å; M336-Y340 PolarHBondContact O-N 2.95Å; M336-Y340 HydrophobicContact SD-CD2 4.34Å; M336-Y340 HydrophobicContact SD-CE2 3.84Å; S337-Y340 CarbonylContact O-C 3.6Å; Y340-G342 PolarHBondContact O-N 3.24Å
341	P	31.6	Very low	38.2	Very low	116 Å²	116	77.2 Å²	77.2	75%	0.753	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	101.2	-178.7	17.5	-8.8	0	0	0	109.8
342	G	39.1	Very low	37.9	Very low	77 Å²	77	78.3 Å²	78.3	79%	0.794	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	149.7	-11.3	177.4	0	0	0	0	0	115.9	Y340 R344	Y340-G342 PolarHBondContact O-N 3.24Å; G342-R344 PolarHBondContact O-N 3.47Å
343	E	40.9	Very low	37.6	Very low	46 Å²	46	83.8 Å²	83.8	22%	0.215	46%	0.462	C	S	.	.			trans	-74.7	115.4	179.4	-70.8	-173.7	172.7	0	0	112.4	T345 I346	E343-T345 PolarHBondContact O-N 3.28Å; E343-I346 HydrophobicContact CB-CG1 3.79Å
344	R	37.3	Very low	37	Very low	250 Å²	250	90.8 Å²	90.8	94%	0.943	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	4.2	158.9	-91.9	-171.2	-95.8	-153.4	-3.8	112.8	G342	G342-R344 PolarHBondContact O-N 3.47Å
345	T	42.6	Very low	36.6	Very low	87 Å²	87	92.7 Å²	92.7	53%	0.534	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	30	-165.2	-13.5	0	0	0	0	114.5	E343 H347 G348	E343-T345 PolarHBondContact O-N 3.28Å; T345-H347 PolarHBondContact O-N 3.43Å; T345-G348 PolarHBondContact O-N 3.13Å
346	I	39	Very low	35.9	Very low	23 Å²	23	96.5 Å²	96.5	12%	0.118	52%	0.523	C	S	.	.	H	α-helix	trans	-57.8	-16.4	165.3	-33.5	179.4	0	0	0	111.3	V333 M336 S337 E343	V333-I346 HydrophobicContact CG1-CG2 4.15Å; V333-I346 HydrophobicContact CG2-CG2 4.47Å; M336-I346 HydrophobicContact CB-CG2 4.16Å; S337-I346 WeakPolarHBondContact OG-CD1 3.23Å; E343-I346 HydrophobicContact CB-CG1 3.79Å
347	H	38.3	Very low	35.4	Very low	52 Å²	52	101.8 Å²	101.8	24%	0.241	55%	0.551	C	S	.	*	H	α-helix	trans	-94.5	-7	176.6	-74.8	-71.5	0	0	0	115.4	T345 L350 G351 R352	T345-H347 PolarHBondContact O-N 3.43Å; H347-L350 CarbonylContact C-O 3.57Å; H347-L350 CarbonylContact O-C 3.48Å; H347-G351 CarbonylContact O-C 3.6Å; H347-G351 WeakPolarHBondContact O-CA 3.44Å; H347-R352 HydrophobicContact CB-CB 4.1Å; H347-R352 VanDerWaalsContact CB-CD 3.43Å; H347-R352 HydrophobicContact CB-CG 3.59Å; H347-R352 PolarHBondContact CD2-NE 2.89Å; H347-R352 PolarHBondContact CD2-NH2 3.3Å; H347-R352 PolarHBondContact CE1-NE 3.28Å; H347-R352 VanDerWaalsContact CE1-NE 3.28Å; H347-R352 PolarHBondContact CE1-NH2 2.67Å; H347-R352 VanDerWaalsContact CG-CD 3.49Å; H347-R352 VanDerWaalsContact CG-CZ 3.43Å; H347-R352 WeakPolarHBondContact ND1-CG 3.5Å; H347-R352 PolarHBondContact ND1-NE 3.16Å; H347-R352 PolarHBondContact NE2-NE 2.87Å; H347-R352 PolarHBondContact NE2-NH2 2.92Å; H347-R352 PolarHBondContact O-N 2.91Å
348	G	33.9	Very low	34.8	Very low	51 Å²	51	112.3 Å²	112.3	53%	0.526	60%	0.596	S	S	.	*	H	α-helix	trans	-89.7	-34.3	174.6	0	0	0	0	0	112.6	T345 L350	T345-G348 PolarHBondContact O-N 3.13Å; G348-L350 VanDerWaalsContact C-N 3.33Å
349	I	35.7	Very low	34.5	Very low	116 Å²	116	112 Å²	112	60%	0.595	59%	0.594	S	S	*	*	H	α-helix	trans	-71.5	-32.2	174.2	-59.9	173.9	0	0	0	110.6
350	L	38.9	Very low	34.3	Very low	69 Å²	69	114.5 Å²	114.5	36%	0.361	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.4	81.3	173.8	-63	169.6	0	0	0	108	F329 H347 G348 R352	F329-L350 HydrophobicContact CD2-CD1 4.47Å; F329-L350 HydrophobicContact CE2-CB 4Å; F329-L350 HydrophobicContact CE2-CD1 3.75Å; F329-L350 HydrophobicContact CE2-CG 4.45Å; F329-L350 HydrophobicContact CZ-CB 4.34Å; H347-L350 CarbonylContact C-O 3.57Å; H347-L350 CarbonylContact O-C 3.48Å; G348-L350 VanDerWaalsContact C-N 3.33Å; L350-R352 PolarHBondContact O-N 3.28Å
351	G	31.3	Very low	34	Very low	71 Å²	71	118.9 Å²	118.9	73%	0.732	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-31.5	115.3	-168.6	0	0	0	0	0	115.9	H347	H347-G351 CarbonylContact O-C 3.6Å; H347-G351 WeakPolarHBondContact O-CA 3.44Å
352	R	33.7	Very low	34.2	Very low	159 Å²	159	119.1 Å²	119.1	60%	0.6	63%	0.626	S	S	*	*			trans	-72.9	136.5	153.2	-100.1	-173.9	-162.7	-174.5	7.2	107.8	H347 L350	H347-R352 HydrophobicContact CB-CB 4.1Å; H347-R352 VanDerWaalsContact CB-CD 3.43Å; H347-R352 HydrophobicContact CB-CG 3.59Å; H347-R352 PolarHBondContact CD2-NE 2.89Å; H347-R352 PolarHBondContact CD2-NH2 3.3Å; H347-R352 PolarHBondContact CE1-NE 3.28Å; H347-R352 VanDerWaalsContact CE1-NE 3.28Å; H347-R352 PolarHBondContact CE1-NH2 2.67Å; H347-R352 VanDerWaalsContact CG-CD 3.49Å; H347-R352 VanDerWaalsContact CG-CZ 3.43Å; H347-R352 WeakPolarHBondContact ND1-CG 3.5Å; H347-R352 PolarHBondContact ND1-NE 3.16Å; H347-R352 PolarHBondContact NE2-NE 2.87Å; H347-R352 PolarHBondContact NE2-NH2 2.92Å; H347-R352 PolarHBondContact O-N 2.91Å; L350-R352 PolarHBondContact O-N 3.28Å
353	D	32	Very low	33.9	Very low	138 Å²	138	121.7 Å²	121.7	74%	0.738	62%	0.616	S	S	*	*				-149.1	155.5	64.2	-80.7	-47.9	0	0	0	115.3
354	E	28.6	Very low	33.4	Very low	168 Å²	168	126.7 Å²	126.7	79%	0.785	64%	0.642	S	S	*	*			trans	70.4	102	155.8	-70.3	175.7	-175.2	0	0	120.6
355	W	27	Very low	33.1	Very low	184 Å²	184	117.9 Å²	117.9	70%	0.697	62%	0.621	S	S	*	*			trans	-124.3	92.4	146.2	-69	89	0	0	0	107.9	K43 L357	K43-W355 VanDerWaalsContact NZ-NE1 3.19Å; W355-L357 HydrophobicContact CE3-CB 4.33Å; W355-L357 HydrophobicContact CE3-CD1 3.29Å; W355-L357 HydrophobicContact CE3-CG 3.52Å; W355-L357 HydrophobicContact CH2-CD1 4.37Å; W355-L357 HydrophobicContact CZ3-CD1 3.17Å; W355-L357 HydrophobicContact CZ3-CD2 4.48Å; W355-L357 HydrophobicContact CZ3-CG 3.67Å
356	T	26.9	Very low	32.4	Very low	137 Å²	137	120.3 Å²	120.3	84%	0.84	63%	0.628	S	S	*	*			trans	-86.8	125.8	131.4	41.3	0	0	0	0	106.1
357	L	27.8	Very low	31.9	Very low	135 Å²	135	128.4 Å²	128.4	71%	0.707	67%	0.67	S	S	*	*			trans	-135.5	126.7	164.4	-101.9	-176.4	0	0	0	107.2	W355	W355-L357 HydrophobicContact CE3-CB 4.33Å; W355-L357 HydrophobicContact CE3-CD1 3.29Å; W355-L357 HydrophobicContact CE3-CG 3.52Å; W355-L357 HydrophobicContact CH2-CD1 4.37Å; W355-L357 HydrophobicContact CZ3-CD1 3.17Å; W355-L357 HydrophobicContact CZ3-CD2 4.48Å; W355-L357 HydrophobicContact CZ3-CG 3.67Å
358	E	28.3	Very low	31.3	Very low	261 Å²	261	135.4 Å²	135.4	100%	1.22	71%	0.709	S	S	*	*			trans	-57.6	0	149.6	-67.1	178.6	152.9	0	0	111.2

Retrieved 358 of 358 residues in 83.5 ms (Link to these results)

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