A0A3Q0KU59_SCHMA Loading...

Large ribosomal subunit protein uL18m

AlphaFold DB , UniProt , Accession A0A3Q0KU59, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 285 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	38.4	Very low	241 Å²	241	151.3 Å²	151.3	100%	1.187	82%	0.822	S	S	*	*				0	114.6	0	-128.3	168.8	173.4	0	0	107.2	V3	M1-V3 PolarHBondContact O-N 3.09Å
2	L	39.6	Very low	38.3	Very low	177 Å²	177	154.8 Å²	154.8	93%	0.927	83%	0.825	S	S	*	*			trans	2.5	98.1	177.1	-68.3	156.1	0	0	0	117.8	G4	L2-G4 PolarHBondContact O-N 3.34Å
3	V	36	Very low	38.1	Very low	143 Å²	143	153.5 Å²	153.5	87%	0.867	82%	0.818	S	S	*	*			trans	-84.1	98.9	154.7	178.3	0	0	0	0	106	M1 Q5	M1-V3 PolarHBondContact O-N 3.09Å; V3-Q5 PolarHBondContact O-N 3.15Å
4	G	38.5	Very low	38	Very low	59 Å²	59	150.2 Å²	150.2	61%	0.608	81%	0.813	S	S	*	*			trans	-58.3	119.6	178.3	0	0	0	0	0	110.6	L2 I6	L2-G4 PolarHBondContact O-N 3.34Å; G4-I6 PolarHBondContact O-N 3.1Å; G4-I6 VanDerWaalsContact O-N 3.15Å
5	Q	39.1	Very low	37.6	Very low	185 Å²	185	146.5 Å²	146.5	86%	0.864	80%	0.802	S	S	*	*			trans	-62.6	113.2	169.7	-74.3	179.9	-31.7	0	0	108.6	V3 M7	V3-Q5 PolarHBondContact O-N 3.15Å; Q5-M7 PolarHBondContact O-N 3.06Å; Q5-M7 VanDerWaalsContact O-N 3.1Å
6	I	38.2	Very low	37.5	Very low	161 Å²	161	143.4 Å²	143.4	83%	0.826	80%	0.801	S	S	*	*			trans	-64.7	107.1	172	-66.7	160.7	0	0	0	107	G4 P8	G4-I6 PolarHBondContact O-N 3.1Å; G4-I6 VanDerWaalsContact O-N 3.15Å; I6-P8 WeakPolarHBondContact O-CD 3.31Å
7	M	36.8	Very low	37.7	Very low	161 Å²	161	146.1 Å²	146.1	79%	0.793	80%	0.803	S	S	*	*			trans	-60.4	121.8	167.5	-74.4	-75.8	179.6	0	0	108.4	Q5 N9	Q5-M7 PolarHBondContact O-N 3.06Å; Q5-M7 VanDerWaalsContact O-N 3.1Å; M7-N9 PolarHBondContact O-N 3.44Å
8	P	43.2	Very low	38	Very low	105 Å²	105	142.4 Å²	142.4	68%	0.682	80%	0.795	S	S	*	*			trans	-72.3	120.5	175.1	28.4	-30.5	0	0	0	108.8	I6 N10	I6-P8 WeakPolarHBondContact O-CD 3.31Å; P8-N10 PolarHBondContact O-N 3.16Å
9	N	40.9	Very low	38.5	Very low	146 Å²	146	144 Å²	144	78%	0.781	80%	0.802	S	S	*	*			trans	-57.9	101.8	174.7	-76	-32.1	0	0	0	110.2	M7 L11	M7-N9 PolarHBondContact O-N 3.44Å; N9-L11 PolarHBondContact O-N 3.27Å
10	N	35.2	Very low	39.4	Very low	135 Å²	135	142.5 Å²	142.5	72%	0.722	80%	0.796	S	S	*	*			trans	-74.3	50.9	178.3	-113.6	-10.2	0	0	0	112.2	P8	P8-N10 PolarHBondContact O-N 3.16Å
11	L	37.2	Very low	40.4	Very low	151 Å²	151	139.3 Å²	139.3	79%	0.791	78%	0.783	S	S	*	*			trans	-101.6	7.3	179.3	-85.8	166.5	0	0	0	114.6	N9	N9-L11 PolarHBondContact O-N 3.27Å
12	F	37.7	Very low	41.4	Very low	194 Å²	194	134.6 Å²	134.6	85%	0.851	77%	0.768	S	S	*	*	S	Bend	trans	-91.6	2	173.3	-87.8	-75.1	0	0	0	115.1	S14	F12-S14 PolarHBondContact O-N 3.27Å
13	N	35.9	Very low	42.5	Very low	138 Å²	138	135 Å²	135	74%	0.738	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	32.4	-175.1	-77.8	-14.2	0	0	0	115.7
14	S	35.5	Very low	43.6	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-7.1	170.4	64.7	0	0	0	0	115	F12 A16	F12-S14 PolarHBondContact O-N 3.27Å; S14-A16 VanDerWaalsContact C-N 3.33Å; S14-A16 PolarHBondContact O-N 3.21Å; S14-A16 VanDerWaalsContact O-N 3.13Å
15	C	32.3	Very low	45	Very low	95 Å²	95	132.7 Å²	132.7	64%	0.642	73%	0.734	S	S	*	*			trans	-87.4	78.3	167	-58.9	0	0	0	0	108.7	F17	C15-F17 VanDerWaalsContact C-N 3.28Å; C15-F17 WeakPolarHBondContact O-CD2 3.45Å; C15-F17 PolarHBondContact O-N 3.45Å
16	A	36.8	Very low	46.2	Very low	96 Å²	96	131 Å²	131	79%	0.793	73%	0.73	S	S	*	*			trans	-59.7	95	167.4	0	0	0	0	0	108.3	S14 A18	S14-A16 VanDerWaalsContact C-N 3.33Å; S14-A16 PolarHBondContact O-N 3.21Å; S14-A16 VanDerWaalsContact O-N 3.13Å; A16-A18 PolarHBondContact O-N 2.99Å
17	F	39.7	Very low	47.5	Very low	190 Å²	190	131.7 Å²	131.7	83%	0.833	73%	0.727	S	S	*	*			trans	-62	90.5	157.3	-70.6	-85.2	0	0	0	105.4	C15 N19	C15-F17 VanDerWaalsContact C-N 3.28Å; C15-F17 WeakPolarHBondContact O-CD2 3.45Å; C15-F17 PolarHBondContact O-N 3.45Å; F17-N19 PolarHBondContact O-N 3.26Å; F17-N19 VanDerWaalsContact O-N 3.12Å
18	A	43.6	Very low	48.7	Very low	80 Å²	80	128.5 Å²	128.5	66%	0.661	71%	0.711	S	S	*	*			trans	-49.6	124.1	170.8	0	0	0	0	0	107	A16 V20	A16-A18 PolarHBondContact O-N 2.99Å; A18-V20 WeakPolarHBondContact O-CG2 3.19Å; A18-V20 PolarHBondContact O-N 3.43Å
19	N	48.5	Very low	49.4	Very low	172 Å²	172	128.5 Å²	128.5	92%	0.92	70%	0.704	S	S	*	*			trans	-39.7	98	178.1	-82.9	-33.6	0	0	0	110.7	F17 S21	F17-N19 PolarHBondContact O-N 3.26Å; F17-N19 VanDerWaalsContact O-N 3.12Å; N19-S21 PolarHBondContact O-N 3.06Å
20	V	55.1	Low	50.8	Low	113 Å²	113	126.5 Å²	126.5	69%	0.685	70%	0.701	S	S	*	*			trans	-78	114.3	171.7	176.2	0	0	0	0	105.4	A18 T22 F24	A18-V20 WeakPolarHBondContact O-CG2 3.19Å; A18-V20 PolarHBondContact O-N 3.43Å; V20-T22 PolarHBondContact O-N 3.22Å; V20-T22 VanDerWaalsContact O-N 3.11Å; V20-F24 HydrophobicContact CG1-CE2 3.66Å; V20-F24 HydrophobicContact CG1-CZ 4.2Å
21	S	60.7	Low	52.5	Low	76 Å²	76	125 Å²	125	53%	0.531	70%	0.697	S	S	.	*			trans	-51.7	119.3	176	179.7	0	0	0	0	109.7	N19 K23 F24	N19-S21 PolarHBondContact O-N 3.06Å; S21-K23 PolarHBondContact O-N 2.98Å; S21-F24 VanDerWaalsContact O-CD2 3.29Å; S21-F24 WeakPolarHBondContact O-CD2 3.47Å; S21-F24 WeakPolarHBondContact O-CE2 3.49Å
22	T	59.9	Low	54	Low	142 Å²	142	121.8 Å²	121.8	87%	0.871	68%	0.68	S	S	*	*	S	Bend	trans	-76.2	1.2	-178.6	49.1	0	0	0	0	113.3	V20 F24	V20-T22 PolarHBondContact O-N 3.22Å; V20-T22 VanDerWaalsContact O-N 3.11Å; T22-F24 PolarHBondContact O-N 3.14Å
23	K	61.3	Low	55.9	Low	187 Å²	187	119 Å²	119	81%	0.813	68%	0.678	S	S	*	*			trans	-102.1	65.5	179.6	-65.6	-172.6	-179.6	-178.5	0	111.4	S21	S21-K23 PolarHBondContact O-N 2.98Å
24	F	59.6	Low	57.6	Low	77 Å²	77	123 Å²	123	34%	0.338	69%	0.685	S	S	.	*			trans	-88	126.3	165.4	-69.2	-71.6	0	0	0	109.8	V20 S21 T22 M28 M29	V20-F24 HydrophobicContact CG1-CE2 3.66Å; V20-F24 HydrophobicContact CG1-CZ 4.2Å; S21-F24 VanDerWaalsContact O-CD2 3.29Å; S21-F24 WeakPolarHBondContact O-CD2 3.47Å; S21-F24 WeakPolarHBondContact O-CE2 3.49Å; T22-F24 PolarHBondContact O-N 3.14Å; F24-M28 HydrophobicContact CD1-CB 4.41Å; F24-M28 HydrophobicContact CD1-CE 3.39Å; F24-M28 HydrophobicContact CD1-SD 3.84Å; F24-M28 HydrophobicContact CE1-CE 3.37Å; F24-M28 HydrophobicContact CE1-SD 4.39Å; F24-M29 HydrophobicContact CB-CG 4.22Å
25	S	67.1	Low	59.1	Low	75 Å²	75	128.3 Å²	128.3	52%	0.524	69%	0.688	S	S	.	*			trans	-62.3	144.4	167.1	171.2	0	0	0	0	109.7	K27 M28 M29	S25-K27 PolarHBondContact O-N 2.88Å; S25-K27 VanDerWaalsContact O-N 3.08Å; S25-K27 PolarHBondContact OG-N 3.2Å; S25-M28 WeakPolarHBondContact O-CA 3.18Å; S25-M28 VanDerWaalsContact O-CB 3.27Å; S25-M28 WeakPolarHBondContact O-CB 3.41Å; S25-M28 PolarHBondContact O-N 3.46Å; S25-M29 PolarHBondContact O-N 2.74Å; S25-M29 VanDerWaalsContact O-N 3.17Å
26	L	65.4	Low	61.1	Low	151 Å²	151	127.8 Å²	127.8	79%	0.791	68%	0.679	S	S	*	*	H	α-helix	trans	-51	-33.1	173.8	-78	166.2	0	0	0	112.5	M28 M29 S30	L26-M28 VanDerWaalsContact C-N 3.31Å; L26-M28 PolarHBondContact O-N 3.41Å; L26-M29 PolarHBondContact O-N 3.27Å; L26-S30 PolarHBondContact O-N 3.06Å
27	K	65.9	Low	62.5	Low	175 Å²	175	132.6 Å²	132.6	76%	0.761	68%	0.682	S	S	*	*	H	α-helix	trans	-68.6	-28.2	176.1	-166	173.4	-175.3	178	0	113.2	S25 S30 T31	S25-K27 PolarHBondContact O-N 2.88Å; S25-K27 VanDerWaalsContact O-N 3.08Å; S25-K27 PolarHBondContact OG-N 3.2Å; K27-S30 PolarHBondContact O-OG 3.34Å; K27-T31 PolarHBondContact O-OG1 3.21Å
28	M	60.7	Low	63.9	Low	94 Å²	94	129 Å²	129	46%	0.463	67%	0.672	S	S	.	*	H	α-helix	trans	-76.7	-34.4	173.6	-119.1	176.6	109.4	0	0	111.2	F24 S25 L26 S30 T31 L32	F24-M28 HydrophobicContact CD1-CB 4.41Å; F24-M28 HydrophobicContact CD1-CE 3.39Å; F24-M28 HydrophobicContact CD1-SD 3.84Å; F24-M28 HydrophobicContact CE1-CE 3.37Å; F24-M28 HydrophobicContact CE1-SD 4.39Å; S25-M28 WeakPolarHBondContact O-CA 3.18Å; S25-M28 VanDerWaalsContact O-CB 3.27Å; S25-M28 WeakPolarHBondContact O-CB 3.41Å; S25-M28 PolarHBondContact O-N 3.46Å; L26-M28 VanDerWaalsContact C-N 3.31Å; L26-M28 PolarHBondContact O-N 3.41Å; M28-S30 PolarHBondContact O-N 3.45Å; M28-T31 PolarHBondContact O-N 3.46Å; M28-T31 PolarHBondContact O-OG1 3.14Å; M28-L32 WeakPolarHBondContact O-CG 3.17Å; M28-L32 PolarHBondContact O-N 3Å
29	M	58.1	Low	64.9	Low	105 Å²	105	130.8 Å²	130.8	52%	0.517	68%	0.676	S	S	.	*	H	α-helix	trans	-63.8	-36.7	-179.3	-64.1	-142.4	83.8	0	0	113.2	F24 S25 L26 T31 L32	F24-M29 HydrophobicContact CB-CG 4.22Å; S25-M29 PolarHBondContact O-N 2.74Å; S25-M29 VanDerWaalsContact O-N 3.17Å; L26-M29 PolarHBondContact O-N 3.27Å; M29-T31 PolarHBondContact O-N 3.22Å; M29-L32 HydrophobicContact CB-CD1 4.4Å; M29-L32 HydrophobicContact CE-CD1 3.76Å; M29-L32 HydrophobicContact CG-CD1 4.34Å; M29-L32 PolarHBondContact O-N 2.65Å
30	S	69.8	Low	66.1	Low	103 Å²	103	131.2 Å²	131.2	72%	0.72	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-19.8	177.3	60.1	0	0	0	0	113.8	L26 K27 M28	L26-S30 PolarHBondContact O-N 3.06Å; K27-S30 PolarHBondContact O-OG 3.34Å; M28-S30 PolarHBondContact O-N 3.45Å
31	T	72.3	Confident	67.6	Low	104 Å²	104	128.6 Å²	128.6	64%	0.638	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-0.9	175.1	36.4	0	0	0	0	114.3	K27 M28 M29 V33	K27-T31 PolarHBondContact O-OG1 3.21Å; M28-T31 PolarHBondContact O-N 3.46Å; M28-T31 PolarHBondContact O-OG1 3.14Å; M29-T31 PolarHBondContact O-N 3.22Å; T31-V33 PolarHBondContact O-N 2.93Å
32	L	68.5	Low	68.9	Low	83 Å²	83	129.3 Å²	129.3	44%	0.435	65%	0.645	S	S	.	*			trans	-70.7	105.9	-180	-70.1	174.8	0	0	0	110.3	M28 M29 Y34	M28-L32 WeakPolarHBondContact O-CG 3.17Å; M28-L32 PolarHBondContact O-N 3Å; M29-L32 HydrophobicContact CB-CD1 4.4Å; M29-L32 HydrophobicContact CE-CD1 3.76Å; M29-L32 HydrophobicContact CG-CD1 4.34Å; M29-L32 PolarHBondContact O-N 2.65Å; L32-Y34 PolarHBondContact O-N 3.35Å; L32-Y34 VanDerWaalsContact O-N 3.14Å
33	V	78	Confident	70.4	Confident	136 Å²	136	124.4 Å²	124.4	82%	0.824	61%	0.612	S	S	*	*			trans	-72.5	104.2	167.5	180	0	0	0	0	108	T31 R35	T31-V33 PolarHBondContact O-N 2.93Å; V33-R35 PolarHBondContact O-N 3.4Å; V33-R35 VanDerWaalsContact O-N 3.09Å
34	Y	71.8	Confident	71.7	Confident	221 Å²	221	119.2 Å²	119.2	87%	0.867	59%	0.592	S	S	*	*			trans	-74.1	102.1	175.7	-145.3	-95.6	0	0	0	109.4	L32	L32-Y34 PolarHBondContact O-N 3.35Å; L32-Y34 VanDerWaalsContact O-N 3.14Å
35	R	65.9	Low	73.1	Confident	220 Å²	220	119.4 Å²	119.4	83%	0.83	60%	0.597	S	S	*	*			trans	-94.4	104.8	172.2	-146.6	177.7	-164.9	160.8	3.4	107.7	V33 K37	V33-R35 PolarHBondContact O-N 3.4Å; V33-R35 VanDerWaalsContact O-N 3.09Å; R35-K37 PolarHBondContact O-N 2.87Å
36	N	74.6	Confident	74.2	Confident	84 Å²	84	115.9 Å²	115.9	45%	0.449	57%	0.572	S	S	.	*			trans	-55.1	111.9	170.9	-177	0.9	0	0	0	108.1	N38	N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 VanDerWaalsContact OD1-CB 3.26Å; N36-N38 WeakPolarHBondContact OD1-CB 3.49Å; N36-N38 PolarHBondContact OD1-N 2.94Å
37	K	66.4	Low	75.4	Confident	197 Å²	197	112.8 Å²	112.8	86%	0.857	56%	0.556	S	S	*	*			trans	-81.6	-8.4	-179.8	-69.3	-171	-179.9	-179	0	112.7	R35 P39	R35-K37 PolarHBondContact O-N 2.87Å; K37-P39 WeakPolarHBondContact O-CD 3.13Å
38	N	68.6	Low	76.6	Confident	115 Å²	115	105 Å²	105	62%	0.615	52%	0.524	S	S	*	.	S	Bend	trans	-69.6	112.5	173.7	-158	9.2	0	0	0	107.5	N36 R40	N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 VanDerWaalsContact OD1-CB 3.26Å; N36-N38 WeakPolarHBondContact OD1-CB 3.49Å; N36-N38 PolarHBondContact OD1-N 2.94Å; N38-R40 PolarHBondContact O-N 3.07Å
39	P	64	Low	78	Confident	116 Å²	116	105.6 Å²	105.6	75%	0.753	54%	0.535	S	S	*	.			trans	-59.7	110.7	177.4	24.9	-32.1	0	0	0	107.8	K37 N41	K37-P39 WeakPolarHBondContact O-CD 3.13Å; P39-N41 PolarHBondContact O-N 2.89Å
40	R	75.1	Confident	79.6	Confident	182 Å²	182	102.7 Å²	102.7	69%	0.687	52%	0.52	S	S	*	.			trans	-74.8	109.8	175.2	-77.1	-173.1	-107.1	172.2	-4.5	107.5	N38 L42 L45	N38-R40 PolarHBondContact O-N 3.07Å; R40-L42 PolarHBondContact O-N 3.46Å; R40-L45 HydrophobicContact CB-CD1 4.01Å; R40-L45 HydrophobicContact CG-CD1 4.36Å
41	N	85.9	Confident	80.3	Confident	57 Å²	57	101.7 Å²	101.7	31%	0.305	51%	0.509	S	S	.	.			trans	-72.1	115.6	168.7	-173.7	-2	0	0	0	108.4	P39 E43 L44 L45	P39-N41 PolarHBondContact O-N 2.89Å; N41-E43 PolarHBondContact O-N 2.87Å; N41-E43 WeakPolarHBondContact OD1-CB 3.29Å; N41-E43 PolarHBondContact OD1-N 2.89Å; N41-L44 HydrophobicContact CB-CB 4.19Å; N41-L44 HydrophobicContact CB-CD1 3.96Å; N41-L44 HydrophobicContact CB-CG 4.1Å; N41-L44 PolarHBondContact O-N 3.44Å; N41-L45 WeakPolarHBondContact O-CG 3.38Å; N41-L45 PolarHBondContact O-N 2.86Å
42	L	89	Confident	80.8	Confident	92 Å²	92	103.9 Å²	103.9	48%	0.482	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-27	179.4	-65.3	177	0	0	0	112.3	R40 L45 G46 L47 A48	R40-L42 PolarHBondContact O-N 3.46Å; L42-L45 PolarHBondContact O-N 2.93Å; L42-G46 PolarHBondContact O-N 3.4Å; L42-G46 VanDerWaalsContact O-N 3.15Å; L42-L47 HydrophobicContact CB-CB 4.47Å; L42-L47 HydrophobicContact CD2-CB 4.09Å; L42-L47 HydrophobicContact CD2-CD1 4.19Å; L42-L47 PolarHBondContact O-N 3.45Å; L42-A48 HydrophobicContact CB-CB 3.85Å; L42-A48 PolarHBondContact O-N 2.81Å; L42-A48 VanDerWaalsContact O-N 3.08Å
43	E	90.8	Very high	81.5	Confident	39 Å²	39	101.8 Å²	101.8	18%	0.182	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-50.1	176.6	-59.9	164.7	-159.2	0	0	110.3	N41 L45 G46 A48 W64 N65 H82	N41-E43 PolarHBondContact O-N 2.87Å; N41-E43 WeakPolarHBondContact OD1-CB 3.29Å; N41-E43 PolarHBondContact OD1-N 2.89Å; E43-L45 PolarHBondContact O-N 2.86Å; E43-G46 PolarHBondContact O-N 3.46Å; E43-A48 HydrophobicContact CG-CB 4Å; E43-W64 HydrophobicContact CB-CB 4.27Å; E43-W64 HydrophobicContact CB-CD2 4.1Å; E43-W64 HydrophobicContact CB-CE3 4.42Å; E43-W64 HydrophobicContact CB-CG 4.03Å; E43-W64 HydrophobicContact CG-CB 4.12Å; E43-W64 HydrophobicContact CG-CD2 4.4Å; E43-W64 HydrophobicContact CG-CG 3.89Å; E43-W64 WeakPolarHBondContact O-CZ3 3.45Å; E43-N65 PolarHBondContact OE2-ND2 3.2Å; E43-H82 IonicContact OE1-CD2 3.64Å; E43-H82 IonicContact OE1-NE2 2.79Å; E43-H82 PolarHBondContact OE1-NE2 3.32Å
44	L	87.9	Confident	81.9	Confident	77 Å²	77	105.3 Å²	105.3	40%	0.403	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.2	176.7	-68.2	175.7	0	0	0	113.2	N41	N41-L44 HydrophobicContact CB-CB 4.19Å; N41-L44 HydrophobicContact CB-CD1 3.96Å; N41-L44 HydrophobicContact CB-CG 4.1Å; N41-L44 PolarHBondContact O-N 3.44Å
45	L	89.3	Confident	82.2	Confident	81 Å²	81	104.2 Å²	104.2	42%	0.424	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-8	175.3	-68	173.7	0	0	0	113	R40 N41 L42 E43 L47	R40-L45 HydrophobicContact CB-CD1 4.01Å; R40-L45 HydrophobicContact CG-CD1 4.36Å; N41-L45 WeakPolarHBondContact O-CG 3.38Å; N41-L45 PolarHBondContact O-N 2.86Å; L42-L45 PolarHBondContact O-N 2.93Å; E43-L45 PolarHBondContact O-N 2.86Å; L45-L47 HydrophobicContact CB-CB 4.45Å; L45-L47 HydrophobicContact CB-CD1 4.06Å; L45-L47 HydrophobicContact CB-CG 4Å; L45-L47 HydrophobicContact CD1-CD1 4.15Å; L45-L47 PolarHBondContact O-N 2.88Å
46	G	90.8	Very high	83.1	Confident	1 Å²	1	101.7 Å²	101.7	1%	0.01	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	5	-172.8	0	0	0	0	0	115.1	L42 E43 H163 I164	L42-G46 PolarHBondContact O-N 3.4Å; L42-G46 VanDerWaalsContact O-N 3.15Å; E43-G46 PolarHBondContact O-N 3.46Å; G46-H163 WeakPolarHBondContact O-CA 3.24Å; G46-H163 PolarHBondContact O-ND1 3.2Å; G46-I164 PolarHBondContact O-N 2.98Å
47	L	90.7	Very high	83.6	Confident	86 Å²	86	100.7 Å²	100.7	45%	0.45	50%	0.504	S	S	.	.			trans	-84.4	-20.6	-178.1	-64.3	175.6	0	0	0	112.8	L42 L45 I164	L42-L47 HydrophobicContact CB-CB 4.47Å; L42-L47 HydrophobicContact CD2-CB 4.09Å; L42-L47 HydrophobicContact CD2-CD1 4.19Å; L42-L47 PolarHBondContact O-N 3.45Å; L45-L47 HydrophobicContact CB-CB 4.45Å; L45-L47 HydrophobicContact CB-CD1 4.06Å; L45-L47 HydrophobicContact CB-CG 4Å; L45-L47 HydrophobicContact CD1-CD1 4.15Å; L45-L47 PolarHBondContact O-N 2.88Å; L47-I164 HydrophobicContact CD2-CB 4.41Å; L47-I164 HydrophobicContact CD2-CD1 3.97Å
48	A	91.1	Very high	84.4	Confident	12 Å²	12	95.8 Å²	95.8	10%	0.099	50%	0.501	C	S	.	.	S	Bend	trans	-68.1	132.1	177	0	0	0	0	0	110.1	L42 E43 K50 W64 H163	L42-A48 HydrophobicContact CB-CB 3.85Å; L42-A48 PolarHBondContact O-N 2.81Å; L42-A48 VanDerWaalsContact O-N 3.08Å; E43-A48 HydrophobicContact CG-CB 4Å; A48-K50 PolarHBondContact O-N 3.41Å; A48-W64 WeakPolarHBondContact O-CZ2 3.34Å; A48-W64 PolarHBondContact O-NE1 2.97Å; A48-H163 PolarHBondContact O-ND1 3.1Å; A48-H163 VanDerWaalsContact O-ND1 3.08Å
49	P	90.2	Very high	85.1	Confident	106 Å²	106	95 Å²	95	69%	0.688	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-64.5	137.3	176.7	26.7	-33.8	0	0	0	110.6
50	K	89.9	Confident	86.2	Confident	44 Å²	44	94.6 Å²	94.6	19%	0.191	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-90.2	142.9	168.7	-73	-173.6	170.8	-169.9	0	110	A48 K52 W64 E160 H163	A48-K50 PolarHBondContact O-N 3.41Å; K50-K52 PolarHBondContact O-N 3.01Å; K50-W64 HydrophobicContact CD-CD2 4.48Å; K50-W64 HydrophobicContact CD-CH2 4.43Å; K50-W64 HydrophobicContact CD-CZ2 4.07Å; K50-W64 VanDerWaalsContact CE-CE3 3.44Å; K50-W64 VanDerWaalsContact CE-CH2 3.45Å; K50-W64 VanDerWaalsContact CE-CZ2 3.42Å; K50-W64 VanDerWaalsContact CE-CZ3 3.49Å; K50-W64 HydrophobicContact CG-CD2 4.23Å; K50-W64 HydrophobicContact CG-CZ2 3.72Å; K50-E160 WeakPolarHBondContact CE-OE2 3.37Å; K50-E160 IonicContact NZ-OE2 3.6Å; K50-E160 PolarHBondContact NZ-OE2 3Å; K50-H163 HydrophobicContact CD-CB 4.19Å; K50-H163 HydrophobicContact CG-CB 4.27Å
51	T	86	Confident	86.7	Confident	82 Å²	82	90.9 Å²	90.9	50%	0.503	47%	0.474	S	S	.	.			trans	-71.2	103.3	168.3	43.8	0	0	0	0	109	G53 K61 D62	T51-G53 PolarHBondContact O-N 3.42Å; T51-K61 CarbonylContact O-C 2.98Å; T51-K61 PolarHBondContact OG1-O 3.36Å; T51-D62 WeakPolarHBondContact O-CA 3.05Å
52	K	81.4	Confident	86.9	Confident	150 Å²	150	90.3 Å²	90.3	65%	0.652	47%	0.471	S	S	*	.			trans	-57.4	-31.2	-178.7	-69.5	-174.6	173.9	-173.3	0	112.6	K50 E165	K50-K52 PolarHBondContact O-N 3.01Å; K52-E165 IonicContact NZ-OE1 3.99Å; K52-E165 PolarHBondContact NZ-OE1 3.21Å
53	G	84.1	Confident	87.1	Confident	39 Å²	39	87 Å²	87	40%	0.402	45%	0.453	S	S	.	.			trans	60.8	-166.9	-175.7	0	0	0	0	0	111.9	T51	T51-G53 PolarHBondContact O-N 3.42Å
54	W	85.4	Confident	87.3	Confident	210 Å²	210	85.7 Å²	85.7	80%	0.795	45%	0.446	S	S	*	.			trans	-99.8	146.8	167.3	-52.8	89	0	0	0	109.8	L56 Q57	W54-L56 PolarHBondContact O-N 2.66Å; W54-L56 VanDerWaalsContact O-N 3.15Å; W54-Q57 HydrophobicContact CB-CB 3.96Å; W54-Q57 WeakPolarHBondContact O-CB 3.32Å; W54-Q57 PolarHBondContact O-N 2.71Å
55	E	80	Confident	87.6	Confident	198 Å²	198	82.3 Å²	82.3	93%	0.925	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-37	-178.1	-172.9	177	-178.8	0	0	113.2
56	L	84	Confident	87.8	Confident	168 Å²	168	79.8 Å²	79.8	88%	0.88	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	7.2	178.6	-59.6	176.1	0	0	0	113.6	W54 A58	W54-L56 PolarHBondContact O-N 2.66Å; W54-L56 VanDerWaalsContact O-N 3.15Å; L56-A58 PolarHBondContact O-N 3.07Å
57	Q	84.4	Confident	88	Confident	62 Å²	62	79.8 Å²	79.8	29%	0.29	41%	0.414	S	S	.	.			trans	-74.7	114.3	180	-177	170.4	13.9	0	0	110.5	W54 P59 R60	W54-Q57 HydrophobicContact CB-CB 3.96Å; W54-Q57 WeakPolarHBondContact O-CB 3.32Å; W54-Q57 PolarHBondContact O-N 2.71Å; Q57-P59 CarbonylContact O-C 3.59Å; Q57-P59 VanDerWaalsContact O-C 3.31Å; Q57-R60 PolarHBondContact O-N 2.99Å
58	A	83.1	Confident	88.2	Confident	95 Å²	95	77.1 Å²	77.1	79%	0.785	40%	0.401	S	S	*	.	S	Bend	trans	-103	131.9	167	0	0	0	0	0	110.1	L56	L56-A58 PolarHBondContact O-N 3.07Å
59	P	85.1	Confident	88.4	Confident	98 Å²	98	77.8 Å²	77.8	64%	0.636	40%	0.403	S	S	*	.	S	Bend	cis	-73.5	154.5	-6.5	31.7	-34.9	0	0	0	112.3	Q57	Q57-P59 CarbonylContact O-C 3.59Å; Q57-P59 VanDerWaalsContact O-C 3.31Å
60	R	85.3	Confident	88.6	Confident	107 Å²	107	76.2 Å²	76.2	40%	0.404	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-54.4	146.2	169.7	-79.1	-178.6	74.6	164.2	10.7	111.1	Q57 D62 F63 E133	Q57-R60 PolarHBondContact O-N 2.99Å; R60-D62 WeakPolarHBondContact CB-OD1 3.21Å; R60-D62 IonicContact CZ-OD1 2.79Å; R60-D62 IonicContact CZ-OD2 3.12Å; R60-D62 IonicContact NE-OD1 2.77Å; R60-D62 PolarHBondContact NE-OD1 3.05Å; R60-D62 IonicContact NE-OD2 3.2Å; R60-D62 PolarHBondContact NE-OD2 3.08Å; R60-D62 IonicContact NH2-OD1 2.88Å; R60-D62 IonicContact NH2-OD2 3.97Å; R60-D62 PolarHBondContact NH2-OD2 3.5Å; R60-F63 VanDerWaalsContact O-CE1 3.29Å; R60-F63 WeakPolarHBondContact O-CE1 3.28Å; R60-E133 WeakPolarHBondContact CD-OE1 3.37Å; R60-E133 WeakPolarHBondContact CD-OE2 3.43Å; R60-E133 IonicContact CZ-OE1 2.62Å; R60-E133 IonicContact NH1-OE1 3.35Å; R60-E133 PolarHBondContact NH1-OE1 3.44Å; R60-E133 VanDerWaalsContact NH1-OE1 3.12Å
61	K	87	Confident	88.7	Confident	104 Å²	104	79 Å²	79	45%	0.452	40%	0.398	S	S	.	.			trans	-126.2	4.8	-179.9	-65.1	-171.6	176.6	-174.1	0	113	T51 F63	T51-K61 CarbonylContact O-C 2.98Å; T51-K61 PolarHBondContact OG1-O 3.36Å; K61-F63 VanDerWaalsContact C-N 3.26Å; K61-F63 PolarHBondContact O-N 3.5Å; K61-F63 VanDerWaalsContact O-N 3.11Å
62	D	90	Very high	89.1	Confident	46 Å²	46	78.7 Å²	78.7	25%	0.246	39%	0.391	C	S	.	.			trans	-88.5	48.6	-173.3	61	-43.9	0	0	0	113	T51 R60	T51-D62 WeakPolarHBondContact O-CA 3.05Å; R60-D62 WeakPolarHBondContact CB-OD1 3.21Å; R60-D62 IonicContact CZ-OD1 2.79Å; R60-D62 IonicContact CZ-OD2 3.12Å; R60-D62 IonicContact NE-OD1 2.77Å; R60-D62 PolarHBondContact NE-OD1 3.05Å; R60-D62 IonicContact NE-OD2 3.2Å; R60-D62 PolarHBondContact NE-OD2 3.08Å; R60-D62 IonicContact NH2-OD1 2.88Å; R60-D62 IonicContact NH2-OD2 3.97Å; R60-D62 PolarHBondContact NH2-OD2 3.5Å
63	F	92.4	Very high	89.6	Confident	23 Å²	23	76.7 Å²	76.7	10%	0.101	39%	0.393	C	S	.	.			trans	-139.4	157.5	178.9	61.2	-97.2	0	0	0	110.7	R60 K61 K66 A83 F131	R60-F63 VanDerWaalsContact O-CE1 3.29Å; R60-F63 WeakPolarHBondContact O-CE1 3.28Å; K61-F63 VanDerWaalsContact C-N 3.26Å; K61-F63 PolarHBondContact O-N 3.5Å; K61-F63 VanDerWaalsContact O-N 3.11Å; F63-K66 HydrophobicContact CD1-CB 4.33Å; F63-K66 HydrophobicContact CD2-CB 3.54Å; F63-K66 HydrophobicContact CE1-CB 4.25Å; F63-K66 HydrophobicContact CE1-CD 4.09Å; F63-K66 HydrophobicContact CE2-CB 3.48Å; F63-K66 VanDerWaalsContact CE2-CB 3.48Å; F63-K66 HydrophobicContact CG-CB 3.99Å; F63-K66 HydrophobicContact CZ-CB 3.86Å; F63-K66 HydrophobicContact CZ-CD 4.2Å; F63-A83 WeakPolarHBondContact O-CB 3.23Å; F63-F131 HydrophobicContact CB-CB 3.7Å; F63-F131 HydrophobicContact CB-CD1 3.65Å; F63-F131 HydrophobicContact CB-CD2 4.25Å; F63-F131 HydrophobicContact CB-CE1 4.32Å; F63-F131 HydrophobicContact CB-CG 3.61Å; F63-F131 HydrophobicContact CD1-CD1 4Å; F63-F131 HydrophobicContact CD1-CE1 4.14Å; F63-F131 AromaticContact CG-CD1 3.95Å; F63-F131 HydrophobicContact CG-CD1 3.95Å; F63-F131 HydrophobicContact CG-CG 4.39Å
64	W	94.5	Very high	90.1	Very high	10 Å²	10	81.6 Å²	81.6	4%	0.038	41%	0.406	C	S	.	.	S	Bend	trans	-90.6	-49	166.7	-61.2	-60	0	0	0	110.9	E43 A48 K50 H82 A83 E160 T161 H163	E43-W64 HydrophobicContact CB-CB 4.27Å; E43-W64 HydrophobicContact CB-CD2 4.1Å; E43-W64 HydrophobicContact CB-CE3 4.42Å; E43-W64 HydrophobicContact CB-CG 4.03Å; E43-W64 HydrophobicContact CG-CB 4.12Å; E43-W64 HydrophobicContact CG-CD2 4.4Å; E43-W64 HydrophobicContact CG-CG 3.89Å; E43-W64 WeakPolarHBondContact O-CZ3 3.45Å; A48-W64 WeakPolarHBondContact O-CZ2 3.34Å; A48-W64 PolarHBondContact O-NE1 2.97Å; K50-W64 HydrophobicContact CD-CD2 4.48Å; K50-W64 HydrophobicContact CD-CH2 4.43Å; K50-W64 HydrophobicContact CD-CZ2 4.07Å; K50-W64 VanDerWaalsContact CE-CE3 3.44Å; K50-W64 VanDerWaalsContact CE-CH2 3.45Å; K50-W64 VanDerWaalsContact CE-CZ2 3.42Å; K50-W64 VanDerWaalsContact CE-CZ3 3.49Å; K50-W64 HydrophobicContact CG-CD2 4.23Å; K50-W64 HydrophobicContact CG-CZ2 3.72Å; W64-H82 CarbonylContact O-C 3.57Å; W64-H82 VanDerWaalsContact O-C 3.31Å; W64-H82 WeakPolarHBondContact O-CA 3.29Å; W64-H82 PolarHBondContact O-CD2 3.17Å; W64-A83 PolarHBondContact O-N 2.91Å; W64-E160 HydrophobicContact CE3-CB 4.31Å; W64-E160 HydrophobicContact CZ3-CB 4.34Å; W64-E160 PolarHBondContact N-OE1 2.94Å; W64-E160 PolarHBondContact N-OE2 3.18Å; W64-E160 VanDerWaalsContact N-OE2 3.07Å; W64-T161 WeakPolarHBondContact CH2-O 3.48Å; W64-T161 WeakPolarHBondContact CZ3-O 3.37Å; W64-H163 HydrophobicContact CH2-CB 4.26Å; W64-H163 HydrophobicContact CZ2-CB 4.1Å
65	N	94.6	Very high	90.6	Very high	6 Å²	6	72.6 Å²	72.6	3%	0.032	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	100.3	-171.2	-64.8	-49.2	0	0	0	110.6	E43 V80 V81 H82 L88 L130 F131 E160	E43-N65 PolarHBondContact OE2-ND2 3.2Å; N65-V80 HydrophobicContact CB-CG1 4.29Å; N65-V81 CarbonylContact C-O 3.58Å; N65-V81 WeakPolarHBondContact CA-O 3.05Å; N65-H82 PolarHBondContact OD1-CD2 2.96Å; N65-L88 WeakPolarHBondContact OD1-CD1 3.48Å; N65-L130 HydrophobicContact CB-CD2 3.81Å; N65-L130 CarbonylContact O-C 3.58Å; N65-F131 PolarHBondContact O-N 3.13Å; N65-E160 WeakPolarHBondContact CA-OE1 3.36Å; N65-E160 PolarHBondContact N-OE1 3.24Å; N65-E160 VanDerWaalsContact O-OE1 3.05Å
66	K	94.2	Very high	91.4	Very high	29 Å²	29	63.1 Å²	63.1	13%	0.126	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.5	179.2	177.5	172.5	179.3	176.4	0	112.1	F63 V68 V80 V81 F131 E136	F63-K66 HydrophobicContact CD1-CB 4.33Å; F63-K66 HydrophobicContact CD2-CB 3.54Å; F63-K66 HydrophobicContact CE1-CB 4.25Å; F63-K66 HydrophobicContact CE1-CD 4.09Å; F63-K66 HydrophobicContact CE2-CB 3.48Å; F63-K66 VanDerWaalsContact CE2-CB 3.48Å; F63-K66 HydrophobicContact CG-CB 3.99Å; F63-K66 HydrophobicContact CZ-CB 3.86Å; F63-K66 HydrophobicContact CZ-CD 4.2Å; K66-V68 HydrophobicContact CD-CG2 4.15Å; K66-V68 HydrophobicContact CG-CG2 3.99Å; K66-V80 CarbonylContact O-C 3.59Å; K66-V80 WeakPolarHBondContact O-CA 3.33Å; K66-V81 PolarHBondContact N-O 3.23Å; K66-V81 PolarHBondContact O-N 2.76Å; K66-F131 CarbonylContact C-O 3.31Å; K66-F131 WeakPolarHBondContact CA-O 3.43Å; K66-F131 HydrophobicContact CB-CD1 4.11Å; K66-F131 HydrophobicContact CD-CD1 4.18Å; K66-F131 HydrophobicContact CD-CE1 4.4Å; K66-F131 HydrophobicContact CG-CD1 4Å; K66-E136 WeakPolarHBondContact CE-OE1 3.31Å; K66-E136 IonicContact NZ-OE1 3.64Å; K66-E136 PolarHBondContact NZ-OE1 2.68Å
67	V	95.5	Very high	92.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.5	165	-174	0	0	0	0	109.9	L79 L130 F131 F147 Y148 L151	V67-L79 CarbonylContact C-O 3.6Å; V67-L79 WeakPolarHBondContact CA-O 3.21Å; V67-L130 HydrophobicContact CG2-CB 3.53Å; V67-L130 HydrophobicContact CG2-CD1 3.45Å; V67-L130 VanDerWaalsContact CG2-CD1 3.45Å; V67-L130 HydrophobicContact CG2-CG 4.09Å; V67-F131 PolarHBondContact N-O 2.58Å; V67-F147 HydrophobicContact CG1-CE1 3.63Å; V67-F147 HydrophobicContact CG1-CZ 3.74Å; V67-Y148 HydrophobicContact CG1-CE1 4.49Å; V67-L151 HydrophobicContact CG1-CD1 3.87Å
68	V	94.2	Very high	92.7	Very high	30 Å²	30	52.8 Å²	52.8	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.5	176	-178.3	0	0	0	0	109.4	K66 N70 L79 V81	K66-V68 HydrophobicContact CD-CG2 4.15Å; K66-V68 HydrophobicContact CG-CG2 3.99Å; V68-N70 VanDerWaalsContact CG1-OD1 3.31Å; V68-N70 WeakPolarHBondContact CG1-OD1 3.24Å; V68-L79 HydrophobicContact CB-CB 4.38Å; V68-L79 PolarHBondContact N-O 3.1Å; V68-L79 PolarHBondContact O-N 2.85Å; V68-V81 HydrophobicContact CB-CG2 4.5Å; V68-V81 HydrophobicContact CG2-CG2 3.98Å
69	L	94.8	Very high	93.4	Very high	26 Å²	26	49.7 Å²	49.7	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	108	169.4	-178.2	66.4	0	0	0	109.9	R71 T144 F147	L69-R71 HydrophobicContact CG-CG 4.43Å; L69-T144 HydrophobicContact CD2-CG2 3.98Å; L69-F147 HydrophobicContact CB-CD1 4.06Å; L69-F147 HydrophobicContact CB-CE1 3.96Å; L69-F147 HydrophobicContact CB-CZ 4.42Å; L69-F147 HydrophobicContact CD1-CD1 4.35Å; L69-F147 HydrophobicContact CD1-CD2 3.9Å; L69-F147 HydrophobicContact CD1-CE1 4.46Å; L69-F147 HydrophobicContact CD1-CE2 4.04Å; L69-F147 HydrophobicContact CD1-CG 4.05Å; L69-F147 HydrophobicContact CD1-CZ 4.31Å; L69-F147 HydrophobicContact CD2-CB 3.93Å; L69-F147 HydrophobicContact CD2-CD1 4.03Å; L69-F147 HydrophobicContact CD2-CG 3.94Å; L69-F147 HydrophobicContact CG-CD1 4.37Å; L69-F147 HydrophobicContact CG-CG 4.41Å
70	N	94.2	Very high	93.9	Very high	73 Å²	73	45 Å²	45	39%	0.39	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.2	175.7	-80.2	-9.3	0	0	0	110	V68 T77 L79	V68-N70 VanDerWaalsContact CG1-OD1 3.31Å; V68-N70 WeakPolarHBondContact CG1-OD1 3.24Å; N70-T77 WeakPolarHBondContact CB-OG1 3.32Å; N70-T77 PolarHBondContact N-O 2.56Å; N70-T77 PolarHBondContact O-N 3.33Å; N70-T77 PolarHBondContact O-OG1 2.95Å; N70-L79 VanDerWaalsContact ND2-CD1 3.25Å; N70-L79 WeakPolarHBondContact ND2-CD1 3.19Å
71	R	92.3	Very high	94.4	Very high	104 Å²	104	41.3 Å²	41.3	39%	0.392	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	100.6	177.7	-63.6	-179.7	61.3	78.5	3	109	L69 T76 I106 S143	L69-R71 HydrophobicContact CG-CG 4.43Å; R71-T76 HydrophobicContact CG-CG2 4.28Å; R71-I106 PolarHBondContact NH1-O 3.11Å; R71-I106 PolarHBondContact NH2-O 3.14Å; R71-S143 PolarHBondContact NH1-OG 3.46Å
72	E	94	Very high	94.8	Very high	74 Å²	74	38 Å²	38	35%	0.346	19%	0.192	S	C	.	.			trans	-84.7	161.4	169.3	-62	178	177.1	0	0	109.9	H74 N75 K94	E72-H74 PolarHBondContact O-N 2.9Å; E72-N75 CarbonylContact C-O 3.57Å; E72-N75 WeakPolarHBondContact CA-O 3.36Å; E72-N75 HydrophobicContact CB-CB 4.39Å; E72-N75 WeakPolarHBondContact CB-O 3.26Å; E72-N75 PolarHBondContact N-O 3.05Å; E72-N75 PolarHBondContact O-N 3.28Å; E72-N75 VanDerWaalsContact O-O 3.05Å; E72-K94 IonicContact OE1-NZ 2.9Å; E72-K94 PolarHBondContact OE1-NZ 3.26Å; E72-K94 WeakPolarHBondContact OE2-CE 3.14Å; E72-K94 IonicContact OE2-NZ 3.68Å; E72-K94 PolarHBondContact OE2-NZ 3.17Å
73	P	93.4	Very high	94.9	Very high	108 Å²	108	37.9 Å²	37.9	70%	0.701	20%	0.197	S	C	*	.	S	Bend	trans	-56.9	-25.5	180	-27.5	35.6	0	0	0	115.1	I106	P73-I106 WeakPolarHBondContact O-CD1 3.44Å
74	H	94.4	Very high	94.8	Very high	142 Å²	142	39.6 Å²	39.6	66%	0.657	21%	0.212	S	C	*	.	S	Bend	trans	-125	-5.2	-177	-58.5	-54.9	0	0	0	114	E72 C105	E72-H74 PolarHBondContact O-N 2.9Å; H74-C105 VanDerWaalsContact O-CB 3.23Å; H74-C105 WeakPolarHBondContact O-CB 3.16Å
75	N	96.1	Very high	94.6	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.112	25%	0.245	C	C	.	.			trans	-144.6	146.9	-175.4	-60.5	-69.9	0	0	0	110.6	E72 T93 K94 R99	E72-N75 CarbonylContact C-O 3.57Å; E72-N75 WeakPolarHBondContact CA-O 3.36Å; E72-N75 HydrophobicContact CB-CB 4.39Å; E72-N75 WeakPolarHBondContact CB-O 3.26Å; E72-N75 PolarHBondContact N-O 3.05Å; E72-N75 PolarHBondContact O-N 3.28Å; E72-N75 VanDerWaalsContact O-O 3.05Å; N75-T93 WeakPolarHBondContact CA-OG1 3.31Å; N75-T93 VanDerWaalsContact CB-OG1 3.29Å; N75-T93 WeakPolarHBondContact CB-OG1 3.36Å; N75-T93 PolarHBondContact OD1-OG1 3.46Å; N75-K94 HydrophobicContact CB-CG 4.05Å; N75-K94 VanDerWaalsContact ND2-CE 3.28Å; N75-K94 WeakPolarHBondContact ND2-CE 3.47Å; N75-R99 PolarHBondContact OD1-NH2 2.83Å
76	T	96.9	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.2	167.6	44.6	0	0	0	0	108.6	R71 S92 T93 C105 I114	R71-T76 HydrophobicContact CG-CG2 4.28Å; T76-S92 WeakPolarHBondContact O-CA 3.39Å; T76-T93 PolarHBondContact N-OG1 3.37Å; T76-T93 VanDerWaalsContact N-OG1 3.08Å; T76-T93 PolarHBondContact O-N 2.81Å; T76-T93 PolarHBondContact O-OG1 3.45Å; T76-T93 WeakPolarHBondContact OG1-CG2 3.34Å; T76-C105 WeakPolarHBondContact CG2-O 3.44Å; T76-C105 PolarHBondContact N-O 2.99Å; T76-C105 PolarHBondContact OG1-O 3.47Å; T76-I114 VanDerWaalsContact CB-CD1 3.46Å; T76-I114 WeakPolarHBondContact O-CD1 3.43Å; T76-I114 WeakPolarHBondContact OG1-CD1 3.36Å
77	T	97.7	Very high	94.7	Very high	13 Å²	13	53 Å²	53	8%	0.08	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	117.6	-171.2	37.9	0	0	0	0	108.6	N70 A91 S92	N70-T77 WeakPolarHBondContact CB-OG1 3.32Å; N70-T77 PolarHBondContact N-O 2.56Å; N70-T77 PolarHBondContact O-N 3.33Å; N70-T77 PolarHBondContact O-OG1 2.95Å; T77-A91 CarbonylContact C-O 3.59Å; T77-A91 WeakPolarHBondContact CA-O 3.44Å; T77-S92 WeakPolarHBondContact CG2-OG 3.5Å
78	G	97.3	Very high	94.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.7	167.6	0	0	0	0	0	109.6	S90 A91	G78-S90 CarbonylContact O-C 2.92Å; G78-S90 WeakPolarHBondContact O-CA 3.27Å; G78-A91 PolarHBondContact N-O 3.42Å; G78-A91 PolarHBondContact O-N 3.21Å
79	L	97.1	Very high	94.8	Very high	30 Å²	30	56.3 Å²	56.3	16%	0.157	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144	-177.5	-58.7	167.6	0	0	0	109.7	V67 V68 N70 V81 V87	V67-L79 CarbonylContact C-O 3.6Å; V67-L79 WeakPolarHBondContact CA-O 3.21Å; V68-L79 HydrophobicContact CB-CB 4.38Å; V68-L79 PolarHBondContact N-O 3.1Å; V68-L79 PolarHBondContact O-N 2.85Å; N70-L79 VanDerWaalsContact ND2-CD1 3.25Å; N70-L79 WeakPolarHBondContact ND2-CD1 3.19Å; L79-V81 HydrophobicContact CB-CG2 4.15Å; L79-V87 HydrophobicContact CD2-CG1 3.86Å; L79-V87 HydrophobicContact CD2-CG2 4.44Å
80	V	96.8	Very high	94.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	111.8	163.1	-179.1	0	0	0	0	107.3	N65 K66 V87 L88 I89 L118 L127 L130	N65-V80 HydrophobicContact CB-CG1 4.29Å; K66-V80 CarbonylContact O-C 3.59Å; K66-V80 WeakPolarHBondContact O-CA 3.33Å; V80-V87 CarbonylContact O-C 3.57Å; V80-V87 WeakPolarHBondContact O-CA 3.5Å; V80-L88 HydrophobicContact CG1-CB 4.43Å; V80-L88 HydrophobicContact CG1-CD1 4.45Å; V80-L88 PolarHBondContact O-N 2.67Å; V80-I89 HydrophobicContact CB-CB 4.23Å; V80-I89 HydrophobicContact CG2-CB 4.21Å; V80-I89 PolarHBondContact N-O 3.01Å; V80-L118 HydrophobicContact CG2-CD1 4.49Å; V80-L118 HydrophobicContact CG2-CD2 3.85Å; V80-L118 HydrophobicContact CG2-CG 4.44Å; V80-L127 HydrophobicContact CG1-CD1 4.32Å; V80-L130 HydrophobicContact CG1-CD2 3.71Å; V80-L130 HydrophobicContact CG2-CD1 4.02Å
81	V	95.4	Very high	95.1	Very high	29 Å²	29	54.3 Å²	54.3	18%	0.176	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.2	-174.9	-177.8	0	0	0	0	109	N65 K66 V68 L79	N65-V81 CarbonylContact C-O 3.58Å; N65-V81 WeakPolarHBondContact CA-O 3.05Å; K66-V81 PolarHBondContact N-O 3.23Å; K66-V81 PolarHBondContact O-N 2.76Å; V68-V81 HydrophobicContact CB-CG2 4.5Å; V68-V81 HydrophobicContact CG2-CG2 3.98Å; L79-V81 HydrophobicContact CB-CG2 4.15Å
82	H	94.5	Very high	95.3	Very high	35 Å²	35	49.9 Å²	49.9	16%	0.162	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	158	173	178.1	-108.2	0	0	0	111.2	E43 W64 N65 S84 S85 K86 L88	E43-H82 IonicContact OE1-CD2 3.64Å; E43-H82 IonicContact OE1-NE2 2.79Å; E43-H82 PolarHBondContact OE1-NE2 3.32Å; W64-H82 CarbonylContact O-C 3.57Å; W64-H82 VanDerWaalsContact O-C 3.31Å; W64-H82 WeakPolarHBondContact O-CA 3.29Å; W64-H82 PolarHBondContact O-CD2 3.17Å; N65-H82 PolarHBondContact OD1-CD2 2.96Å; H82-S84 VanDerWaalsContact ND1-CB 3.26Å; H82-S84 WeakPolarHBondContact ND1-CB 3.12Å; H82-S84 PolarHBondContact ND1-N 3.35Å; H82-S84 PolarHBondContact ND1-OG 2.92Å; H82-S84 PolarHBondContact O-N 3.39Å; H82-S84 VanDerWaalsContact O-N 3.08Å; H82-S85 WeakPolarHBondContact O-CA 3.34Å; H82-S85 PolarHBondContact O-N 3.36Å; H82-K86 PolarHBondContact N-O 2.98Å; H82-L88 HydrophobicContact CB-CD1 4.1Å; H82-L88 HydrophobicContact CB-CD2 4.01Å; H82-L88 HydrophobicContact CB-CG 3.91Å
83	A	92	Very high	95.5	Very high	42 Å²	42	46.4 Å²	46.4	35%	0.347	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-32.7	176.1	0	0	0	0	0	113	F63 W64 S85	F63-A83 WeakPolarHBondContact O-CB 3.23Å; W64-A83 PolarHBondContact O-N 2.91Å; A83-S85 PolarHBondContact O-N 3.04Å
84	S	91.1	Very high	95.7	Very high	60 Å²	60	46.1 Å²	46.1	42%	0.42	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	11.1	173.5	78.1	0	0	0	0	114.1	H82 K86	H82-S84 VanDerWaalsContact ND1-CB 3.26Å; H82-S84 WeakPolarHBondContact ND1-CB 3.12Å; H82-S84 PolarHBondContact ND1-N 3.35Å; H82-S84 PolarHBondContact ND1-OG 2.92Å; H82-S84 PolarHBondContact O-N 3.39Å; H82-S84 VanDerWaalsContact O-N 3.08Å; S84-K86 PolarHBondContact O-N 2.97Å; S84-K86 VanDerWaalsContact O-N 3.16Å; S84-K86 WeakPolarHBondContact OG-CD 3.27Å; S84-K86 WeakPolarHBondContact OG-CG 3.47Å
85	S	90.7	Very high	95.8	Very high	104 Å²	104	41.5 Å²	41.5	73%	0.727	24%	0.235	S	C	*	.	S	Bend	trans	59.2	20.7	-174	-53	0	0	0	0	114.6	H82 A83	H82-S85 WeakPolarHBondContact O-CA 3.34Å; H82-S85 PolarHBondContact O-N 3.36Å; A83-S85 PolarHBondContact O-N 3.04Å
86	K	94.6	Very high	95.8	Very high	145 Å²	145	44.7 Å²	44.7	63%	0.63	26%	0.255	S	S	*	.			trans	-92	138.3	175.5	-70.2	178.7	-175.1	175.4	0	109.5	H82 S84 L88	H82-K86 PolarHBondContact N-O 2.98Å; S84-K86 PolarHBondContact O-N 2.97Å; S84-K86 VanDerWaalsContact O-N 3.16Å; S84-K86 WeakPolarHBondContact OG-CD 3.27Å; S84-K86 WeakPolarHBondContact OG-CG 3.47Å; K86-L88 PolarHBondContact O-N 2.9Å
87	V	96.6	Very high	95.8	Very high	77 Å²	77	48.1 Å²	48.1	47%	0.467	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.6	172.3	-179.6	0	0	0	0	108.2	L79 V80 I89	L79-V87 HydrophobicContact CD2-CG1 3.86Å; L79-V87 HydrophobicContact CD2-CG2 4.44Å; V80-V87 CarbonylContact O-C 3.57Å; V80-V87 WeakPolarHBondContact O-CA 3.5Å; V87-I89 WeakPolarHBondContact CG1-O 3.39Å
88	L	94.7	Very high	95.7	Very high	82 Å²	82	48.3 Å²	48.3	43%	0.429	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-49.9	176.8	-61	-175.4	0	0	0	110.8	N65 V80 H82 K86 L127	N65-L88 WeakPolarHBondContact OD1-CD1 3.48Å; V80-L88 HydrophobicContact CG1-CB 4.43Å; V80-L88 HydrophobicContact CG1-CD1 4.45Å; V80-L88 PolarHBondContact O-N 2.67Å; H82-L88 HydrophobicContact CB-CD1 4.1Å; H82-L88 HydrophobicContact CB-CD2 4.01Å; H82-L88 HydrophobicContact CB-CG 3.91Å; K86-L88 PolarHBondContact O-N 2.9Å; L88-L127 HydrophobicContact CD1-CD1 4.07Å
89	I	96.4	Very high	95.7	Very high	18 Å²	18	53.3 Å²	53.3	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	-177.9	-59.1	178.9	0	0	0	107.6	V80 V87 R121 C122 C125 L127	V80-I89 HydrophobicContact CB-CB 4.23Å; V80-I89 HydrophobicContact CG2-CB 4.21Å; V80-I89 PolarHBondContact N-O 3.01Å; V87-I89 WeakPolarHBondContact CG1-O 3.39Å; I89-R121 HydrophobicContact CG2-CB 3.59Å; I89-R121 HydrophobicContact CG2-CG 4.47Å; I89-C122 HydrophobicContact CD1-CB 4.34Å; I89-C125 HydrophobicContact CD1-CB 3.57Å; I89-L127 HydrophobicContact CD1-CD1 3.78Å; I89-L127 HydrophobicContact CG1-CD1 4.38Å
90	S	97.3	Very high	95.7	Very high	57 Å²	57	59.7 Å²	59.7	40%	0.399	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.1	171.2	58.9	0	0	0	0	109.2	G78 R121	G78-S90 CarbonylContact O-C 2.92Å; G78-S90 WeakPolarHBondContact O-CA 3.27Å; S90-R121 PolarHBondContact O-NH1 3.19Å
91	A	97.8	Very high	95.6	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	124	167.2	0	0	0	0	0	107.6	T77 G78 I114 V117 L118	T77-A91 CarbonylContact C-O 3.59Å; T77-A91 WeakPolarHBondContact CA-O 3.44Å; G78-A91 PolarHBondContact N-O 3.42Å; G78-A91 PolarHBondContact O-N 3.21Å; A91-I114 HydrophobicContact CB-CG2 4.14Å; A91-V117 HydrophobicContact CB-CB 4.44Å; A91-V117 HydrophobicContact CB-CG1 4.08Å; A91-L118 HydrophobicContact CB-CB 4.12Å
92	S	97.3	Very high	95.6	Very high	11 Å²	11	67.2 Å²	67.2	8%	0.077	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.8	-173.5	-177	0	0	0	0	112.8	T76 T77 K94 E95	T76-S92 WeakPolarHBondContact O-CA 3.39Å; T77-S92 WeakPolarHBondContact CG2-OG 3.5Å; S92-K94 PolarHBondContact O-N 3.19Å; S92-K94 VanDerWaalsContact O-N 3.11Å; S92-K94 VanDerWaalsContact OG-CB 3.32Å; S92-K94 WeakPolarHBondContact OG-CB 3.36Å; S92-K94 WeakPolarHBondContact OG-CG 3.36Å; S92-K94 PolarHBondContact OG-N 2.96Å; S92-E95 PolarHBondContact N-OE1 3.15Å; S92-E95 VanDerWaalsContact O-CB 3.3Å; S92-E95 WeakPolarHBondContact O-CB 3.24Å; S92-E95 WeakPolarHBondContact O-CG 3.29Å; S92-E95 PolarHBondContact O-N 3.46Å
93	T	97.3	Very high	95.6	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.6	163.9	62.4	0	0	0	0	113.6	N75 T76 R99 L102 C105 A110 I114	N75-T93 WeakPolarHBondContact CA-OG1 3.31Å; N75-T93 VanDerWaalsContact CB-OG1 3.29Å; N75-T93 WeakPolarHBondContact CB-OG1 3.36Å; N75-T93 PolarHBondContact OD1-OG1 3.46Å; T76-T93 PolarHBondContact N-OG1 3.37Å; T76-T93 VanDerWaalsContact N-OG1 3.08Å; T76-T93 PolarHBondContact O-N 2.81Å; T76-T93 PolarHBondContact O-OG1 3.45Å; T76-T93 WeakPolarHBondContact OG1-CG2 3.34Å; T93-R99 WeakPolarHBondContact O-CB 3.47Å; T93-R99 PolarHBondContact O-NE 3.33Å; T93-R99 PolarHBondContact O-NH2 3.33Å; T93-L102 HydrophobicContact CG2-CD1 3.49Å; T93-L102 VanDerWaalsContact CG2-CD1 3.49Å; T93-C105 HydrophobicContact CG2-CB 4.09Å; T93-A110 HydrophobicContact CG2-CB 4.32Å; T93-I114 HydrophobicContact CG2-CD1 3.75Å; T93-I114 HydrophobicContact CG2-CG1 4.35Å
94	K	96.9	Very high	95.8	Very high	102 Å²	102	76.5 Å²	76.5	44%	0.443	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.9	167.2	-67.6	178.1	-178	169.2	0	112.1	E72 N75 S92 V96	E72-K94 IonicContact OE1-NZ 2.9Å; E72-K94 PolarHBondContact OE1-NZ 3.26Å; E72-K94 WeakPolarHBondContact OE2-CE 3.14Å; E72-K94 IonicContact OE2-NZ 3.68Å; E72-K94 PolarHBondContact OE2-NZ 3.17Å; N75-K94 HydrophobicContact CB-CG 4.05Å; N75-K94 VanDerWaalsContact ND2-CE 3.28Å; N75-K94 WeakPolarHBondContact ND2-CE 3.47Å; S92-K94 PolarHBondContact O-N 3.19Å; S92-K94 VanDerWaalsContact O-N 3.11Å; S92-K94 VanDerWaalsContact OG-CB 3.32Å; S92-K94 WeakPolarHBondContact OG-CB 3.36Å; S92-K94 WeakPolarHBondContact OG-CG 3.36Å; S92-K94 PolarHBondContact OG-N 2.96Å; K94-V96 PolarHBondContact O-N 3.29Å
95	E	97.3	Very high	96	Very high	46 Å²	46	74.8 Å²	74.8	22%	0.215	38%	0.379	C	S	.	.	S	Bend	trans	-71.3	123.5	177.1	-60.6	175.7	-146.5	0	0	110.4	S92 S97 I98 R99 R121	S92-E95 PolarHBondContact N-OE1 3.15Å; S92-E95 VanDerWaalsContact O-CB 3.3Å; S92-E95 WeakPolarHBondContact O-CB 3.24Å; S92-E95 WeakPolarHBondContact O-CG 3.29Å; S92-E95 PolarHBondContact O-N 3.46Å; E95-S97 PolarHBondContact O-N 3.39Å; E95-I98 HydrophobicContact CB-CB 4.39Å; E95-I98 HydrophobicContact CB-CD1 4.15Å; E95-I98 HydrophobicContact CB-CG1 4.17Å; E95-I98 HydrophobicContact CG-CD1 4.49Å; E95-I98 PolarHBondContact O-N 3.47Å; E95-I98 VanDerWaalsContact O-N 3.1Å; E95-I98 WeakPolarHBondContact OE2-CD1 3.46Å; E95-R99 WeakPolarHBondContact O-CB 3.04Å; E95-R99 PolarHBondContact O-N 2.81Å; E95-R121 IonicContact OE1-CZ 3.56Å; E95-R121 IonicContact OE1-NH1 2.72Å; E95-R121 PolarHBondContact OE1-NH1 3.3Å; E95-R121 IonicContact OE1-NH2 3.67Å; E95-R121 IonicContact OE2-CZ 2.78Å; E95-R121 IonicContact OE2-NH1 2.79Å; E95-R121 PolarHBondContact OE2-NH1 2.95Å; E95-R121 IonicContact OE2-NH2 3.17Å; E95-R121 PolarHBondContact OE2-NH2 2.99Å
96	V	96.5	Very high	96.2	Very high	88 Å²	88	72.9 Å²	72.9	53%	0.533	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-35.2	-176.8	176.6	0	0	0	0	111.8	K94 K100	K94-V96 PolarHBondContact O-N 3.29Å; V96-K100 HydrophobicContact CG1-CD 3.99Å; V96-K100 VanDerWaalsContact CG1-CE 3.44Å; V96-K100 HydrophobicContact CG1-CG 4.29Å; V96-K100 WeakPolarHBondContact O-CB 3.44Å; V96-K100 WeakPolarHBondContact O-CD 3.42Å; V96-K100 WeakPolarHBondContact O-CG 3.39Å; V96-K100 PolarHBondContact O-N 3.08Å; V96-K100 VanDerWaalsContact O-N 3.12Å
97	S	95.8	Very high	96.2	Very high	72 Å²	72	68.2 Å²	68.2	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-62.1	-40.5	176.8	47.3	0	0	0	0	112.6	E95 H101	E95-S97 PolarHBondContact O-N 3.39Å; S97-H101 PolarHBondContact O-CE1 2.82Å; S97-H101 PolarHBondContact O-ND1 3.49Å
98	I	96.7	Very high	96.2	Very high	16 Å²	16	66.9 Å²	66.9	8%	0.082	33%	0.333	C	S	.	.	H	α-helix	trans	-76.9	-49.5	178.4	-59.4	177.9	0	0	0	109.4	E95 K100 H101 L102 V117	E95-I98 HydrophobicContact CB-CB 4.39Å; E95-I98 HydrophobicContact CB-CD1 4.15Å; E95-I98 HydrophobicContact CB-CG1 4.17Å; E95-I98 HydrophobicContact CG-CD1 4.49Å; E95-I98 PolarHBondContact O-N 3.47Å; E95-I98 VanDerWaalsContact O-N 3.1Å; E95-I98 WeakPolarHBondContact OE2-CD1 3.46Å; I98-K100 VanDerWaalsContact C-N 3.28Å; I98-K100 PolarHBondContact O-N 2.92Å; I98-H101 PolarHBondContact O-N 3.5Å; I98-L102 HydrophobicContact CG2-CD1 3.81Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; I98-V117 HydrophobicContact CD1-CB 4.44Å; I98-V117 HydrophobicContact CD1-CG1 3.92Å; I98-V117 HydrophobicContact CD1-CG2 4.38Å
99	R	96.3	Very high	96.2	Very high	106 Å²	106	64.9 Å²	64.9	40%	0.4	33%	0.326	S	S	.	.	H	α-helix	trans	-55.1	-39.6	-176.6	-170.9	179.2	-66.9	-176.4	-11.3	113.4	N75 T93 E95 H101 L102	N75-R99 PolarHBondContact OD1-NH2 2.83Å; T93-R99 WeakPolarHBondContact O-CB 3.47Å; T93-R99 PolarHBondContact O-NE 3.33Å; T93-R99 PolarHBondContact O-NH2 3.33Å; E95-R99 WeakPolarHBondContact O-CB 3.04Å; E95-R99 PolarHBondContact O-N 2.81Å; R99-H101 PolarHBondContact O-N 2.9Å; R99-L102 PolarHBondContact O-N 3.28Å; R99-L102 VanDerWaalsContact O-N 3.11Å
100	K	96.6	Very high	96.2	Very high	164 Å²	164	64 Å²	64	71%	0.713	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.1	179.8	-80	171.2	174.1	179.7	0	114	V96 I98	V96-K100 HydrophobicContact CG1-CD 3.99Å; V96-K100 VanDerWaalsContact CG1-CE 3.44Å; V96-K100 HydrophobicContact CG1-CG 4.29Å; V96-K100 WeakPolarHBondContact O-CB 3.44Å; V96-K100 WeakPolarHBondContact O-CD 3.42Å; V96-K100 WeakPolarHBondContact O-CG 3.39Å; V96-K100 PolarHBondContact O-N 3.08Å; V96-K100 VanDerWaalsContact O-N 3.12Å; I98-K100 VanDerWaalsContact C-N 3.28Å; I98-K100 PolarHBondContact O-N 2.92Å
101	H	95.7	Very high	96.2	Very high	163 Å²	163	61.3 Å²	61.3	76%	0.755	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-1.3	-178.3	-59.7	92.7	0	0	0	112.7	S97 I98 R99	S97-H101 PolarHBondContact O-CE1 2.82Å; S97-H101 PolarHBondContact O-ND1 3.49Å; I98-H101 PolarHBondContact O-N 3.5Å; R99-H101 PolarHBondContact O-N 2.9Å
102	L	96	Very high	96.2	Very high	23 Å²	23	64.3 Å²	64.3	12%	0.12	32%	0.317	C	S	.	.			trans	-104.4	134.1	-178.7	-66.7	178.4	0	0	0	110.4	T93 I98 R99 S104 A110 N113	T93-L102 HydrophobicContact CG2-CD1 3.49Å; T93-L102 VanDerWaalsContact CG2-CD1 3.49Å; I98-L102 HydrophobicContact CG2-CD1 3.81Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; R99-L102 PolarHBondContact O-N 3.28Å; R99-L102 VanDerWaalsContact O-N 3.11Å; L102-S104 WeakPolarHBondContact CB-O 3.35Å; L102-A110 HydrophobicContact CD1-CB 4.12Å; L102-N113 HydrophobicContact CD2-CB 3.95Å; L102-N113 WeakPolarHBondContact CD2-ND2 3.39Å
103	Y	94	Very high	96.2	Very high	231 Å²	231	66 Å²	66	91%	0.906	33%	0.325	S	S	*	.	S	Bend	trans	-72.5	-36.9	172	-178.6	-101.8	0	0	0	111.7
104	S	95.5	Very high	96.2	Very high	42 Å²	42	66 Å²	66	29%	0.294	33%	0.325	S	S	.	.			trans	-137.8	154.9	175.4	179.9	0	0	0	0	110.1	L102	L102-S104 WeakPolarHBondContact CB-O 3.35Å
105	C	96.3	Very high	96.2	Very high	24 Å²	24	61.1 Å²	61.1	16%	0.162	30%	0.304	C	S	.	.	S	Bend	trans	-96.1	-4.5	-179	-67.6	0	0	0	0	113.9	H74 T76 T93	H74-C105 VanDerWaalsContact O-CB 3.23Å; H74-C105 WeakPolarHBondContact O-CB 3.16Å; T76-C105 WeakPolarHBondContact CG2-O 3.44Å; T76-C105 PolarHBondContact N-O 2.99Å; T76-C105 PolarHBondContact OG1-O 3.47Å; T93-C105 HydrophobicContact CG2-CB 4.09Å
106	I	94.6	Very high	96.3	Very high	63 Å²	63	64.9 Å²	64.9	32%	0.323	32%	0.316	S	S	.	.	S	Bend	trans	-124.8	-17.4	-166.3	-53.2	151.3	0	0	0	111.9	R71 P73	R71-I106 PolarHBondContact NH1-O 3.11Å; R71-I106 PolarHBondContact NH2-O 3.14Å; P73-I106 WeakPolarHBondContact O-CD1 3.44Å
107	D	94.5	Very high	96.3	Very high	48 Å²	48	62.6 Å²	62.6	26%	0.257	30%	0.302	S	S	.	.	S	Bend	trans	-69.5	175.1	-175.2	67.4	-26.6	0	0	0	112.8	S109 A110 A111	D107-S109 VanDerWaalsContact CG-OG 3.25Å; D107-S109 PolarHBondContact O-N 2.79Å; D107-S109 PolarHBondContact OD1-OG 3.05Å; D107-S109 WeakPolarHBondContact OD2-CB 3.3Å; D107-S109 PolarHBondContact OD2-OG 3.2Å; D107-A110 PolarHBondContact O-N 3.14Å; D107-A110 WeakPolarHBondContact OD1-CB 3.3Å; D107-A110 PolarHBondContact OD1-N 3.22Å; D107-A111 PolarHBondContact O-N 3.2Å
108	V	95.7	Very high	96.4	Very high	48 Å²	48	59.1 Å²	59.1	29%	0.291	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-37.6	177.2	178.8	0	0	0	0	110.4	A111 E112 E142 A146	V108-A111 PolarHBondContact O-N 2.95Å; V108-E112 PolarHBondContact O-N 3.33Å; V108-E142 HydrophobicContact CG1-CG 4.09Å; V108-E142 HydrophobicContact CG2-CB 4.13Å; V108-E142 HydrophobicContact CG2-CG 4.05Å; V108-A146 HydrophobicContact CG1-CB 3.63Å
109	S	96.2	Very high	96.5	Very high	41 Å²	41	58.5 Å²	58.5	29%	0.287	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-37.6	179.6	87.9	0	0	0	0	112.8	D107 A111 E112 N113	D107-S109 VanDerWaalsContact CG-OG 3.25Å; D107-S109 PolarHBondContact O-N 2.79Å; D107-S109 PolarHBondContact OD1-OG 3.05Å; D107-S109 WeakPolarHBondContact OD2-CB 3.3Å; D107-S109 PolarHBondContact OD2-OG 3.2Å; S109-A111 VanDerWaalsContact C-N 3.34Å; S109-A111 PolarHBondContact O-N 3.38Å; S109-E112 PolarHBondContact O-N 2.88Å; S109-N113 WeakPolarHBondContact O-CB 3.34Å; S109-N113 PolarHBondContact O-N 2.77Å; S109-N113 PolarHBondContact O-ND2 3.45Å; S109-N113 VanDerWaalsContact O-ND2 3.14Å
110	A	96.9	Very high	96.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-43.7	172.1	0	0	0	0	0	111.7	T93 L102 D107 N113 I114	T93-A110 HydrophobicContact CG2-CB 4.32Å; L102-A110 HydrophobicContact CD1-CB 4.12Å; D107-A110 PolarHBondContact O-N 3.14Å; D107-A110 WeakPolarHBondContact OD1-CB 3.3Å; D107-A110 PolarHBondContact OD1-N 3.22Å; A110-N113 PolarHBondContact O-N 3.31Å; A110-I114 WeakPolarHBondContact O-CB 3.48Å; A110-I114 WeakPolarHBondContact O-CG1 3.47Å; A110-I114 PolarHBondContact O-N 3.1Å
111	A	96.4	Very high	96.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-44.4	178	0	0	0	0	0	111.8	D107 V108 S109 I114 G115 S143 F147	D107-A111 PolarHBondContact O-N 3.2Å; V108-A111 PolarHBondContact O-N 2.95Å; S109-A111 VanDerWaalsContact C-N 3.34Å; S109-A111 PolarHBondContact O-N 3.38Å; A111-I114 PolarHBondContact O-N 2.94Å; A111-G115 PolarHBondContact O-N 3.18Å; A111-S143 WeakPolarHBondContact CB-O 3.47Å; A111-F147 HydrophobicContact CB-CB 4.3Å; A111-F147 WeakPolarHBondContact O-CD2 3.42Å
112	E	97	Very high	96.6	Very high	62 Å²	62	46 Å²	46	29%	0.29	22%	0.224	S	C	.	.	H	α-helix	trans	-59.7	-47	174.9	-171.7	-174.5	165.2	0	0	112.1	V108 S109 G115 R116 A146 S150	V108-E112 PolarHBondContact O-N 3.33Å; S109-E112 PolarHBondContact O-N 2.88Å; E112-G115 PolarHBondContact O-N 3.48Å; E112-R116 PolarHBondContact O-N 3.04Å; E112-R116 IonicContact OE1-CZ 2.68Å; E112-R116 IonicContact OE1-NH1 3.46Å; E112-R116 PolarHBondContact OE1-NH1 2.86Å; E112-R116 IonicContact OE1-NH2 3.48Å; E112-R116 PolarHBondContact OE1-NH2 3.09Å; E112-A146 HydrophobicContact CB-CB 4.17Å; E112-S150 WeakPolarHBondContact O-CB 3.46Å; E112-S150 PolarHBondContact O-OG 3.45Å; E112-S150 VanDerWaalsContact O-OG 3.1Å
113	N	97.7	Very high	96.6	Very high	46 Å²	46	51.5 Å²	51.5	25%	0.246	25%	0.249	C	C	.	.	H	α-helix	trans	-69.3	-35.5	-179.1	-73.5	-34.7	0	0	0	112.7	L102 S109 A110 G115 R116 V117	L102-N113 HydrophobicContact CD2-CB 3.95Å; L102-N113 WeakPolarHBondContact CD2-ND2 3.39Å; S109-N113 WeakPolarHBondContact O-CB 3.34Å; S109-N113 PolarHBondContact O-N 2.77Å; S109-N113 PolarHBondContact O-ND2 3.45Å; S109-N113 VanDerWaalsContact O-ND2 3.14Å; A110-N113 PolarHBondContact O-N 3.31Å; N113-G115 VanDerWaalsContact C-N 3.32Å; N113-R116 PolarHBondContact O-N 3.16Å; N113-R116 PolarHBondContact OD1-NH1 3.49Å; N113-V117 WeakPolarHBondContact O-CG2 3.36Å; N113-V117 PolarHBondContact O-N 3.37Å
114	I	97.9	Very high	96.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-43.2	171.3	-72.8	168.3	0	0	0	110.5	T76 A91 T93 A110 A111 R116 V117 L118 F147	T76-I114 VanDerWaalsContact CB-CD1 3.46Å; T76-I114 WeakPolarHBondContact O-CD1 3.43Å; T76-I114 WeakPolarHBondContact OG1-CD1 3.36Å; A91-I114 HydrophobicContact CB-CG2 4.14Å; T93-I114 HydrophobicContact CG2-CD1 3.75Å; T93-I114 HydrophobicContact CG2-CG1 4.35Å; A110-I114 WeakPolarHBondContact O-CB 3.48Å; A110-I114 WeakPolarHBondContact O-CG1 3.47Å; A110-I114 PolarHBondContact O-N 3.1Å; A111-I114 PolarHBondContact O-N 2.94Å; I114-R116 VanDerWaalsContact C-N 3.33Å; I114-R116 PolarHBondContact O-N 3.38Å; I114-V117 PolarHBondContact O-N 3.22Å; I114-L118 VanDerWaalsContact O-CB 3.22Å; I114-L118 WeakPolarHBondContact O-CB 3.37Å; I114-L118 PolarHBondContact O-N 3.12Å; I114-F147 HydrophobicContact CG2-CD2 4.46Å; I114-F147 HydrophobicContact CG2-CE2 4.04Å
115	G	97.6	Very high	96.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-39.4	177.8	0	0	0	0	0	112	A111 E112 N113 L118 A119 S150 L151	A111-G115 PolarHBondContact O-N 3.18Å; E112-G115 PolarHBondContact O-N 3.48Å; N113-G115 VanDerWaalsContact C-N 3.32Å; G115-L118 PolarHBondContact O-N 3.11Å; G115-A119 WeakPolarHBondContact O-CB 3.26Å; G115-A119 PolarHBondContact O-N 2.92Å; G115-S150 WeakPolarHBondContact CA-OG 3.13Å; G115-L151 WeakPolarHBondContact O-CD2 2.79Å
116	R	98.1	Very high	96.2	Very high	125 Å²	125	50 Å²	50	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-58.8	-48.5	170.7	-69	179.7	174.6	130.2	2.8	113	E112 N113 I114 L118 A119 L120	E112-R116 PolarHBondContact O-N 3.04Å; E112-R116 IonicContact OE1-CZ 2.68Å; E112-R116 IonicContact OE1-NH1 3.46Å; E112-R116 PolarHBondContact OE1-NH1 2.86Å; E112-R116 IonicContact OE1-NH2 3.48Å; E112-R116 PolarHBondContact OE1-NH2 3.09Å; N113-R116 PolarHBondContact O-N 3.16Å; N113-R116 PolarHBondContact OD1-NH1 3.49Å; I114-R116 VanDerWaalsContact C-N 3.33Å; I114-R116 PolarHBondContact O-N 3.38Å; R116-L118 VanDerWaalsContact C-N 3.35Å; R116-A119 PolarHBondContact O-N 2.98Å; R116-L120 PolarHBondContact O-N 2.78Å
117	V	98	Very high	96	Very high	40 Å²	40	47.6 Å²	47.6	24%	0.242	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-40.8	179.9	174.6	0	0	0	0	110.9	A91 I98 N113 I114 A119 L120 R121	A91-V117 HydrophobicContact CB-CB 4.44Å; A91-V117 HydrophobicContact CB-CG1 4.08Å; I98-V117 HydrophobicContact CD1-CB 4.44Å; I98-V117 HydrophobicContact CD1-CG1 3.92Å; I98-V117 HydrophobicContact CD1-CG2 4.38Å; N113-V117 WeakPolarHBondContact O-CG2 3.36Å; N113-V117 PolarHBondContact O-N 3.37Å; I114-V117 PolarHBondContact O-N 3.22Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-L120 PolarHBondContact O-N 2.78Å; V117-R121 WeakPolarHBondContact O-CG 3.31Å; V117-R121 PolarHBondContact O-N 3.46Å
118	L	97.7	Very high	95.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-43.3	177.2	-166.5	151	0	0	0	110.3	V80 A91 I114 G115 R116 L120 R121 C122 F147 L151 I156	V80-L118 HydrophobicContact CG2-CD1 4.49Å; V80-L118 HydrophobicContact CG2-CD2 3.85Å; V80-L118 HydrophobicContact CG2-CG 4.44Å; A91-L118 HydrophobicContact CB-CB 4.12Å; I114-L118 VanDerWaalsContact O-CB 3.22Å; I114-L118 WeakPolarHBondContact O-CB 3.37Å; I114-L118 PolarHBondContact O-N 3.12Å; G115-L118 PolarHBondContact O-N 3.11Å; R116-L118 VanDerWaalsContact C-N 3.35Å; L118-L120 PolarHBondContact O-N 3.26Å; L118-R121 PolarHBondContact O-N 3.18Å; L118-C122 WeakPolarHBondContact CD2-SG 3.49Å; L118-C122 WeakPolarHBondContact O-CB 3.31Å; L118-C122 PolarHBondContact O-N 3.43Å; L118-C122 PolarHBondContact O-SG 3.4Å; L118-F147 HydrophobicContact CD1-CE2 4.46Å; L118-F147 HydrophobicContact CD1-CZ 4.29Å; L118-L151 HydrophobicContact CB-CD2 4.2Å; L118-L151 HydrophobicContact CD2-CD2 3.59Å; L118-L151 HydrophobicContact CG-CD2 4.45Å; L118-I156 HydrophobicContact CD2-CD1 4.45Å
119	A	97.9	Very high	95.8	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-57.8	-47.2	175.6	0	0	0	0	0	112.9	G115 R116 V117 R121 C122 H123 L151 I156	G115-A119 WeakPolarHBondContact O-CB 3.26Å; G115-A119 PolarHBondContact O-N 2.92Å; R116-A119 PolarHBondContact O-N 2.98Å; V117-A119 VanDerWaalsContact C-N 3.35Å; A119-R121 VanDerWaalsContact C-N 3.35Å; A119-R121 PolarHBondContact O-N 3Å; A119-C122 PolarHBondContact O-N 3.31Å; A119-H123 PolarHBondContact O-N 2.96Å; A119-L151 HydrophobicContact CB-CD2 4.21Å; A119-I156 VanDerWaalsContact CA-CD1 3.47Å; A119-I156 HydrophobicContact CB-CD1 3.81Å; A119-I156 HydrophobicContact CB-CG1 4.38Å
120	L	97.6	Very high	95.7	Very high	102 Å²	102	46.1 Å²	46.1	53%	0.534	24%	0.237	S	C	.	.	H	α-helix	trans	-59.1	-45.4	176	-179.2	64.9	0	0	0	111.9	R116 V117 L118 H123 Q124	R116-L120 PolarHBondContact O-N 2.78Å; V117-L120 PolarHBondContact O-N 2.78Å; L118-L120 PolarHBondContact O-N 3.26Å; L120-H123 PolarHBondContact O-N 2.81Å; L120-Q124 VanDerWaalsContact O-CG 3.29Å; L120-Q124 WeakPolarHBondContact O-CG 3.17Å; L120-Q124 PolarHBondContact O-N 2.8Å
121	R	97.7	Very high	95.6	Very high	69 Å²	69	47.5 Å²	47.5	26%	0.26	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-41.4	179.1	-72.3	178.6	-177.6	-179.2	3.5	112.2	I89 S90 E95 V117 L118 A119 H123 Q124 C125	I89-R121 HydrophobicContact CG2-CB 3.59Å; I89-R121 HydrophobicContact CG2-CG 4.47Å; S90-R121 PolarHBondContact O-NH1 3.19Å; E95-R121 IonicContact OE1-CZ 3.56Å; E95-R121 IonicContact OE1-NH1 2.72Å; E95-R121 PolarHBondContact OE1-NH1 3.3Å; E95-R121 IonicContact OE1-NH2 3.67Å; E95-R121 IonicContact OE2-CZ 2.78Å; E95-R121 IonicContact OE2-NH1 2.79Å; E95-R121 PolarHBondContact OE2-NH1 2.95Å; E95-R121 IonicContact OE2-NH2 3.17Å; E95-R121 PolarHBondContact OE2-NH2 2.99Å; V117-R121 WeakPolarHBondContact O-CG 3.31Å; V117-R121 PolarHBondContact O-N 3.46Å; L118-R121 PolarHBondContact O-N 3.18Å; A119-R121 VanDerWaalsContact C-N 3.35Å; A119-R121 PolarHBondContact O-N 3Å; R121-H123 VanDerWaalsContact C-N 3.34Å; R121-Q124 PolarHBondContact O-N 3.15Å; R121-C125 WeakPolarHBondContact O-CB 3.26Å; R121-C125 PolarHBondContact O-N 3.18Å
122	C	96.3	Very high	95.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-45.1	174.7	-71.4	0	0	0	0	111.3	I89 L118 A119 Q124 C125 G126 L127 I156	I89-C122 HydrophobicContact CD1-CB 4.34Å; L118-C122 WeakPolarHBondContact CD2-SG 3.49Å; L118-C122 WeakPolarHBondContact O-CB 3.31Å; L118-C122 PolarHBondContact O-N 3.43Å; L118-C122 PolarHBondContact O-SG 3.4Å; A119-C122 PolarHBondContact O-N 3.31Å; C122-Q124 PolarHBondContact O-N 2.81Å; C122-C125 CarbonylContact O-C 3.59Å; C122-C125 PolarHBondContact O-N 2.84Å; C122-C125 VanDerWaalsContact O-N 3.12Å; C122-G126 PolarHBondContact O-N 3.17Å; C122-L127 HydrophobicContact CB-CB 4.23Å; C122-L127 WeakPolarHBondContact CB-O 3.49Å; C122-L127 PolarHBondContact O-N 3.44Å; C122-I156 HydrophobicContact CB-CD1 3.82Å; C122-I156 HydrophobicContact CB-CG1 4.4Å
123	H	94.7	Very high	94.8	Very high	138 Å²	138	46 Å²	46	64%	0.639	24%	0.237	S	C	*	.	H	α-helix	trans	-63.2	-42.7	177.3	-164.4	68.1	0	0	0	112.3	A119 L120 R121 C125 G126	A119-H123 PolarHBondContact O-N 2.96Å; L120-H123 PolarHBondContact O-N 2.81Å; R121-H123 VanDerWaalsContact C-N 3.34Å; H123-C125 PolarHBondContact O-N 3.38Å; H123-G126 PolarHBondContact O-N 3.5Å
124	Q	94.5	Very high	93.7	Very high	146 Å²	146	47.9 Å²	47.9	68%	0.682	25%	0.25	S	C	*	.	H	α-helix	trans	-61.8	-31.1	174.4	-72.3	172.5	-11.8	0	0	112.9	L120 R121 C122	L120-Q124 VanDerWaalsContact O-CG 3.29Å; L120-Q124 WeakPolarHBondContact O-CG 3.17Å; L120-Q124 PolarHBondContact O-N 2.8Å; R121-Q124 PolarHBondContact O-N 3.15Å; C122-Q124 PolarHBondContact O-N 2.81Å
125	C	91.1	Very high	92.6	Very high	81 Å²	81	51.6 Å²	51.6	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-83.9	-11.5	176.1	-166.8	0	0	0	0	113.3	I89 R121 C122 H123 L127	I89-C125 HydrophobicContact CD1-CB 3.57Å; R121-C125 WeakPolarHBondContact O-CB 3.26Å; R121-C125 PolarHBondContact O-N 3.18Å; C122-C125 CarbonylContact O-C 3.59Å; C122-C125 PolarHBondContact O-N 2.84Å; C122-C125 VanDerWaalsContact O-N 3.12Å; H123-C125 PolarHBondContact O-N 3.38Å; C125-L127 HydrophobicContact CB-CG 4.34Å
126	G	91.3	Very high	91.4	Very high	38 Å²	38	53 Å²	53	39%	0.392	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	22	-173.1	0	0	0	0	0	114.5	C122 H123	C122-G126 PolarHBondContact O-N 3.17Å; H123-G126 PolarHBondContact O-N 3.5Å
127	L	92.3	Very high	90.1	Very high	13 Å²	13	50 Å²	50	7%	0.068	28%	0.275	C	S	.	.			trans	-93.9	95.9	173.2	-63	-179	0	0	0	109.8	V80 L88 I89 C122 C125 L130	V80-L127 HydrophobicContact CG1-CD1 4.32Å; L88-L127 HydrophobicContact CD1-CD1 4.07Å; I89-L127 HydrophobicContact CD1-CD1 3.78Å; I89-L127 HydrophobicContact CG1-CD1 4.38Å; C122-L127 HydrophobicContact CB-CB 4.23Å; C122-L127 WeakPolarHBondContact CB-O 3.49Å; C122-L127 PolarHBondContact O-N 3.44Å; C125-L127 HydrophobicContact CB-CG 4.34Å; L127-L130 HydrophobicContact CB-CD2 4.31Å
128	T	91.4	Very high	88.9	Confident	59 Å²	59	55.3 Å²	55.3	36%	0.362	30%	0.297	S	S	.	.			trans	-92.4	-31.8	-179.3	-47.3	0	0	0	0	112.6	I156 Q157	T128-I156 WeakPolarHBondContact O-CA 3.49Å; T128-Q157 PolarHBondContact O-N 3.18Å
129	E	93.7	Very high	87.7	Confident	47 Å²	47	59.7 Å²	59.7	22%	0.22	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-115.5	126.7	-173.9	-60.8	176.3	-172.6	0	0	109.7	Q157 T161	E129-Q157 WeakPolarHBondContact CA-O 3.49Å; E129-Q157 HydrophobicContact CG-CB 4.29Å; E129-T161 VanDerWaalsContact OE2-CB 3.28Å; E129-T161 WeakPolarHBondContact OE2-CB 3.46Å; E129-T161 VanDerWaalsContact OE2-CG2 3.31Å; E129-T161 WeakPolarHBondContact OE2-CG2 3.35Å; E129-T161 PolarHBondContact OE2-N 3.04Å; E129-T161 PolarHBondContact OE2-OG1 2.68Å
130	L	94.8	Very high	86.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.354	C	S	.	.			trans	-137.2	147.2	-179.5	-57.4	172.8	0	0	0	109.8	N65 V67 V80 L127 I156 Q157 L158 K159	N65-L130 HydrophobicContact CB-CD2 3.81Å; N65-L130 CarbonylContact O-C 3.58Å; V67-L130 HydrophobicContact CG2-CB 3.53Å; V67-L130 HydrophobicContact CG2-CD1 3.45Å; V67-L130 VanDerWaalsContact CG2-CD1 3.45Å; V67-L130 HydrophobicContact CG2-CG 4.09Å; V80-L130 HydrophobicContact CG1-CD2 3.71Å; V80-L130 HydrophobicContact CG2-CD1 4.02Å; L127-L130 HydrophobicContact CB-CD2 4.31Å; L130-I156 HydrophobicContact CB-CG2 4.34Å; L130-I156 HydrophobicContact CD1-CD1 4.16Å; L130-I156 HydrophobicContact CD1-CG2 3.85Å; L130-I156 HydrophobicContact CG-CG2 4.1Å; L130-Q157 PolarHBondContact N-O 3.1Å; L130-L158 CarbonylContact O-C 3.47Å; L130-L158 VanDerWaalsContact O-CA 3.23Å; L130-L158 WeakPolarHBondContact O-CA 3.26Å; L130-K159 PolarHBondContact O-N 3.29Å
131	F	93.9	Very high	86.3	Confident	28 Å²	28	67.2 Å²	67.2	12%	0.123	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-79.2	135.3	173.5	179.1	-102.9	0	0	0	110.9	F63 N65 K66 V67 E160	F63-F131 HydrophobicContact CB-CB 3.7Å; F63-F131 HydrophobicContact CB-CD1 3.65Å; F63-F131 HydrophobicContact CB-CD2 4.25Å; F63-F131 HydrophobicContact CB-CE1 4.32Å; F63-F131 HydrophobicContact CB-CG 3.61Å; F63-F131 HydrophobicContact CD1-CD1 4Å; F63-F131 HydrophobicContact CD1-CE1 4.14Å; F63-F131 AromaticContact CG-CD1 3.95Å; F63-F131 HydrophobicContact CG-CD1 3.95Å; F63-F131 HydrophobicContact CG-CG 4.39Å; N65-F131 PolarHBondContact O-N 3.13Å; K66-F131 CarbonylContact C-O 3.31Å; K66-F131 WeakPolarHBondContact CA-O 3.43Å; K66-F131 HydrophobicContact CB-CD1 4.11Å; K66-F131 HydrophobicContact CD-CD1 4.18Å; K66-F131 HydrophobicContact CD-CE1 4.4Å; K66-F131 HydrophobicContact CG-CD1 4Å; V67-F131 PolarHBondContact N-O 2.58Å; F131-E160 HydrophobicContact CB-CG 3.86Å; F131-E160 WeakPolarHBondContact CB-OE1 3.29Å
132	S	90.7	Very high	86.1	Confident	7 Å²	7	70.8 Å²	70.8	5%	0.049	37%	0.37	C	S	.	.			trans	-127.9	139.8	166	65.9	0	0	0	0	109.9	T134 I137 L158	S132-T134 PolarHBondContact O-N 3.22Å; S132-I137 WeakPolarHBondContact OG-CD1 3.18Å; S132-L158 PolarHBondContact OG-O 2.95Å
133	E	85.2	Confident	85.9	Confident	25 Å²	25	71.3 Å²	71.3	12%	0.117	37%	0.374	C	S	.	.			trans	-70.2	131.4	174.7	-165.5	68.2	-125.1	0	0	109.3	R60 S135 E136 I137	R60-E133 WeakPolarHBondContact CD-OE1 3.37Å; R60-E133 WeakPolarHBondContact CD-OE2 3.43Å; R60-E133 IonicContact CZ-OE1 2.62Å; R60-E133 IonicContact NH1-OE1 3.35Å; R60-E133 PolarHBondContact NH1-OE1 3.44Å; R60-E133 VanDerWaalsContact NH1-OE1 3.12Å; E133-S135 PolarHBondContact O-N 2.88Å; E133-E136 HydrophobicContact CB-CB 4.27Å; E133-E136 HydrophobicContact CB-CG 3.92Å; E133-E136 WeakPolarHBondContact O-CA 3.38Å; E133-E136 WeakPolarHBondContact O-CB 3.45Å; E133-E136 PolarHBondContact O-N 3.36Å; E133-I137 PolarHBondContact O-N 3.1Å
134	T	76.3	Confident	85.9	Confident	84 Å²	84	65.2 Å²	65.2	52%	0.515	35%	0.347	S	S	.	.	H	α-helix	trans	-57.3	-36.8	177.4	51.4	0	0	0	0	111.4	S132 E136 I137 H138	S132-T134 PolarHBondContact O-N 3.22Å; T134-E136 PolarHBondContact O-N 2.68Å; T134-I137 PolarHBondContact O-N 2.6Å; T134-H138 PolarHBondContact O-CD2 3.48Å; T134-H138 VanDerWaalsContact O-CD2 3.23Å; T134-H138 PolarHBondContact O-N 3.21Å; T134-H138 VanDerWaalsContact O-N 3.13Å
135	S	74	Confident	85.9	Confident	79 Å²	79	63.5 Å²	63.5	55%	0.552	34%	0.337	S	S	*	.	H	α-helix	trans	-59	-28.5	173.9	-46	0	0	0	0	113.4	E133 K139	E133-S135 PolarHBondContact O-N 2.88Å; S135-K139 WeakPolarHBondContact O-CG 3.35Å
136	E	72.8	Confident	86.1	Confident	29 Å²	29	60.3 Å²	60.3	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-81.9	-35.2	178.7	-68.4	169.2	-166.6	0	0	112.2	K66 E133 T134 K139 Y148	K66-E136 WeakPolarHBondContact CE-OE1 3.31Å; K66-E136 IonicContact NZ-OE1 3.64Å; K66-E136 PolarHBondContact NZ-OE1 2.68Å; E133-E136 HydrophobicContact CB-CB 4.27Å; E133-E136 HydrophobicContact CB-CG 3.92Å; E133-E136 WeakPolarHBondContact O-CA 3.38Å; E133-E136 WeakPolarHBondContact O-CB 3.45Å; E133-E136 PolarHBondContact O-N 3.36Å; T134-E136 PolarHBondContact O-N 2.68Å; E136-K139 WeakPolarHBondContact O-CG 3.47Å; E136-K139 PolarHBondContact O-N 3.06Å; E136-Y148 HydrophobicContact CB-CE2 4.19Å; E136-Y148 WeakPolarHBondContact CB-OH 3.44Å; E136-Y148 PolarHBondContact OE2-OH 3.47Å
137	I	70.8	Confident	86.3	Confident	61 Å²	61	58.5 Å²	58.5	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-67.9	-41.6	177.9	-59.4	162.4	0	0	0	111	S132 E133 T134 K139	S132-I137 WeakPolarHBondContact OG-CD1 3.18Å; E133-I137 PolarHBondContact O-N 3.1Å; T134-I137 PolarHBondContact O-N 2.6Å; I137-K139 VanDerWaalsContact C-N 3.27Å; I137-K139 PolarHBondContact O-N 2.97Å
138	H	71.9	Confident	86.4	Confident	153 Å²	153	58.3 Å²	58.3	71%	0.708	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	4.7	-179.4	-67.5	-67.3	0	0	0	114.3	T134 E140	T134-H138 PolarHBondContact O-CD2 3.48Å; T134-H138 VanDerWaalsContact O-CD2 3.23Å; T134-H138 PolarHBondContact O-N 3.21Å; T134-H138 VanDerWaalsContact O-N 3.13Å; H138-E140 PolarHBondContact O-N 3.13Å
139	K	73.9	Confident	86.6	Confident	91 Å²	91	61.8 Å²	61.8	40%	0.396	31%	0.306	S	S	.	.			trans	-57.8	134.1	175.3	-70.6	-177.4	176	171.2	0	109.8	S135 E136 I137 N141 T144 K145	S135-K139 WeakPolarHBondContact O-CG 3.35Å; E136-K139 WeakPolarHBondContact O-CG 3.47Å; E136-K139 PolarHBondContact O-N 3.06Å; I137-K139 VanDerWaalsContact C-N 3.27Å; I137-K139 PolarHBondContact O-N 2.97Å; K139-N141 PolarHBondContact O-N 3.18Å; K139-N141 VanDerWaalsContact O-N 3.13Å; K139-T144 HydrophobicContact CD-CG2 4.44Å; K139-K145 WeakPolarHBondContact O-CE 3.37Å
140	E	76.2	Confident	86.8	Confident	175 Å²	175	59.7 Å²	59.7	82%	0.818	30%	0.297	S	S	*	.	S	Bend	trans	-62.1	-22.3	-179.8	-64.9	-177.3	163	0	0	112.6	H138 E142 K145	H138-E140 PolarHBondContact O-N 3.13Å; E140-E142 PolarHBondContact O-N 3.4Å; E140-K145 PolarHBondContact O-NZ 3.18Å
141	N	89.3	Confident	86.9	Confident	89 Å²	89	59.7 Å²	59.7	48%	0.476	30%	0.297	S	S	.	.			trans	-55.5	123.4	-178.7	-61.9	-15.6	0	0	0	112.7	K139 S143 T144 K145	K139-N141 PolarHBondContact O-N 3.18Å; K139-N141 VanDerWaalsContact O-N 3.13Å; N141-S143 VanDerWaalsContact C-N 3.32Å; N141-S143 PolarHBondContact O-N 3.32Å; N141-T144 HydrophobicContact CB-CG2 4.14Å; N141-T144 WeakPolarHBondContact CB-OG1 3.17Å; N141-T144 PolarHBondContact O-N 3.47Å; N141-T144 PolarHBondContact O-OG1 3.06Å; N141-K145 WeakPolarHBondContact O-CG 3.33Å; N141-K145 PolarHBondContact O-N 3.06Å
142	E	92.9	Very high	87	Confident	143 Å²	143	62.9 Å²	62.9	67%	0.668	32%	0.315	S	S	*	.	H	α-helix	trans	-62.2	-38.5	179.5	-169.5	177.7	-171.7	0	0	112.6	V108 E140 K145 A146	V108-E142 HydrophobicContact CG1-CG 4.09Å; V108-E142 HydrophobicContact CG2-CB 4.13Å; V108-E142 HydrophobicContact CG2-CG 4.05Å; E140-E142 PolarHBondContact O-N 3.4Å; E142-K145 PolarHBondContact O-N 3.47Å; E142-A146 WeakPolarHBondContact O-CB 3.37Å; E142-A146 PolarHBondContact O-N 3.22Å
143	S	92.9	Very high	87.3	Confident	11 Å²	11	68.3 Å²	68.3	8%	0.077	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-38.2	179	59.1	0	0	0	0	113.9	R71 A111 N141 F147	R71-S143 PolarHBondContact NH1-OG 3.46Å; A111-S143 WeakPolarHBondContact CB-O 3.47Å; N141-S143 VanDerWaalsContact C-N 3.32Å; N141-S143 PolarHBondContact O-N 3.32Å; S143-F147 WeakPolarHBondContact O-CB 3.12Å; S143-F147 PolarHBondContact O-N 2.94Å
144	T	93.8	Very high	87.8	Confident	10 Å²	10	68.9 Å²	68.9	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-41.6	176.3	51.4	0	0	0	0	110	L69 K139 N141 A146 F147 Y148	L69-T144 HydrophobicContact CD2-CG2 3.98Å; K139-T144 HydrophobicContact CD-CG2 4.44Å; N141-T144 HydrophobicContact CB-CG2 4.14Å; N141-T144 WeakPolarHBondContact CB-OG1 3.17Å; N141-T144 PolarHBondContact O-N 3.47Å; N141-T144 PolarHBondContact O-OG1 3.06Å; T144-A146 PolarHBondContact O-N 3.47Å; T144-F147 PolarHBondContact O-N 2.87Å; T144-Y148 WeakPolarHBondContact O-CD2 3.29Å; T144-Y148 PolarHBondContact O-N 3.17Å
145	K	93.8	Very high	88.8	Confident	110 Å²	110	67.3 Å²	67.3	48%	0.478	36%	0.357	S	S	.	.	H	α-helix	trans	-59.7	-46	175.2	-68.7	175.7	-176.5	169.5	0	111.6	K139 E140 N141 E142 F147 Y148 K149	K139-K145 WeakPolarHBondContact O-CE 3.37Å; E140-K145 PolarHBondContact O-NZ 3.18Å; N141-K145 WeakPolarHBondContact O-CG 3.33Å; N141-K145 PolarHBondContact O-N 3.06Å; E142-K145 PolarHBondContact O-N 3.47Å; K145-F147 PolarHBondContact O-N 3.22Å; K145-Y148 PolarHBondContact O-N 3.02Å; K145-K149 WeakPolarHBondContact O-CB 3.11Å; K145-K149 PolarHBondContact O-N 3.48Å
146	A	95.3	Very high	89.8	Confident	15 Å²	15	63.9 Å²	63.9	12%	0.124	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-41.8	177.6	0	0	0	0	0	112.2	V108 E112 E142 T144 S150	V108-A146 HydrophobicContact CG1-CB 3.63Å; E112-A146 HydrophobicContact CB-CB 4.17Å; E142-A146 WeakPolarHBondContact O-CB 3.37Å; E142-A146 PolarHBondContact O-N 3.22Å; T144-A146 PolarHBondContact O-N 3.47Å; A146-S150 WeakPolarHBondContact O-CB 3.39Å; A146-S150 PolarHBondContact O-N 3.02Å; A146-S150 PolarHBondContact O-OG 3.43Å
147	F	96.1	Very high	90.9	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-54.3	174.9	173.4	-102.2	0	0	0	112.1	V67 L69 A111 I114 L118 S143 T144 K145 K149 S150 L151	V67-F147 HydrophobicContact CG1-CE1 3.63Å; V67-F147 HydrophobicContact CG1-CZ 3.74Å; L69-F147 HydrophobicContact CB-CD1 4.06Å; L69-F147 HydrophobicContact CB-CE1 3.96Å; L69-F147 HydrophobicContact CB-CZ 4.42Å; L69-F147 HydrophobicContact CD1-CD1 4.35Å; L69-F147 HydrophobicContact CD1-CD2 3.9Å; L69-F147 HydrophobicContact CD1-CE1 4.46Å; L69-F147 HydrophobicContact CD1-CE2 4.04Å; L69-F147 HydrophobicContact CD1-CG 4.05Å; L69-F147 HydrophobicContact CD1-CZ 4.31Å; L69-F147 HydrophobicContact CD2-CB 3.93Å; L69-F147 HydrophobicContact CD2-CD1 4.03Å; L69-F147 HydrophobicContact CD2-CG 3.94Å; L69-F147 HydrophobicContact CG-CD1 4.37Å; L69-F147 HydrophobicContact CG-CG 4.41Å; A111-F147 HydrophobicContact CB-CB 4.3Å; A111-F147 WeakPolarHBondContact O-CD2 3.42Å; I114-F147 HydrophobicContact CG2-CD2 4.46Å; I114-F147 HydrophobicContact CG2-CE2 4.04Å; L118-F147 HydrophobicContact CD1-CE2 4.46Å; L118-F147 HydrophobicContact CD1-CZ 4.29Å; S143-F147 WeakPolarHBondContact O-CB 3.12Å; S143-F147 PolarHBondContact O-N 2.94Å; T144-F147 PolarHBondContact O-N 2.87Å; K145-F147 PolarHBondContact O-N 3.22Å; F147-K149 VanDerWaalsContact C-N 3.34Å; F147-K149 PolarHBondContact O-N 3.08Å; F147-S150 PolarHBondContact O-N 3.08Å; F147-S150 PolarHBondContact O-OG 2.96Å; F147-L151 HydrophobicContact CD1-CD1 4.07Å; F147-L151 HydrophobicContact CE1-CD1 3.51Å; F147-L151 HydrophobicContact CE1-CG 4.47Å; F147-L151 HydrophobicContact CE2-CD1 4.31Å; F147-L151 HydrophobicContact CZ-CD1 3.66Å; F147-L151 HydrophobicContact CZ-CG 4.36Å; F147-L151 PolarHBondContact O-N 3.2Å; F147-L151 VanDerWaalsContact O-N 3.1Å
148	Y	95.6	Very high	92	Very high	9 Å²	9	65.9 Å²	65.9	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-65.7	-36.8	-179.8	-71	-69.2	0	0	0	112.7	V67 E136 T144 K145 S150 L151 L152 L158	V67-Y148 HydrophobicContact CG1-CE1 4.49Å; E136-Y148 HydrophobicContact CB-CE2 4.19Å; E136-Y148 WeakPolarHBondContact CB-OH 3.44Å; E136-Y148 PolarHBondContact OE2-OH 3.47Å; T144-Y148 WeakPolarHBondContact O-CD2 3.29Å; T144-Y148 PolarHBondContact O-N 3.17Å; K145-Y148 PolarHBondContact O-N 3.02Å; Y148-S150 VanDerWaalsContact C-N 3.33Å; Y148-S150 PolarHBondContact O-N 3.21Å; Y148-L151 HydrophobicContact CD1-CD1 4.18Å; Y148-L151 PolarHBondContact O-N 3.37Å; Y148-L152 WeakPolarHBondContact O-CG 3.28Å; Y148-L152 PolarHBondContact O-N 3.31Å; Y148-L158 HydrophobicContact CD1-CD1 3.77Å; Y148-L158 HydrophobicContact CD1-CD2 4.15Å; Y148-L158 HydrophobicContact CG-CD1 4.34Å
149	K	95.5	Very high	92.9	Very high	131 Å²	131	66.6 Å²	66.6	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-58.4	-46.5	172.8	-175.9	-178.5	176	-176	0	111.2	K145 F147 L151 L152 D153	K145-K149 WeakPolarHBondContact O-CB 3.11Å; K145-K149 PolarHBondContact O-N 3.48Å; F147-K149 VanDerWaalsContact C-N 3.34Å; F147-K149 PolarHBondContact O-N 3.08Å; K149-L151 VanDerWaalsContact C-N 3.29Å; K149-L151 PolarHBondContact O-N 3.15Å; K149-L152 PolarHBondContact O-N 2.98Å; K149-D153 WeakPolarHBondContact O-CB 3.31Å; K149-D153 VanDerWaalsContact O-CG 3.26Å; K149-D153 PolarHBondContact O-N 2.93Å
150	S	97	Very high	93.8	Very high	4 Å²	4	63 Å²	63	3%	0.028	33%	0.327	C	S	.	.	H	α-helix	trans	-65.7	-28.5	178.9	69.6	0	0	0	0	114	E112 G115 A146 F147 Y148 G154	E112-S150 WeakPolarHBondContact O-CB 3.46Å; E112-S150 PolarHBondContact O-OG 3.45Å; E112-S150 VanDerWaalsContact O-OG 3.1Å; G115-S150 WeakPolarHBondContact CA-OG 3.13Å; A146-S150 WeakPolarHBondContact O-CB 3.39Å; A146-S150 PolarHBondContact O-N 3.02Å; A146-S150 PolarHBondContact O-OG 3.43Å; F147-S150 PolarHBondContact O-N 3.08Å; F147-S150 PolarHBondContact O-OG 2.96Å; Y148-S150 VanDerWaalsContact C-N 3.33Å; Y148-S150 PolarHBondContact O-N 3.21Å; S150-G154 PolarHBondContact O-N 3.29Å
151	L	96.7	Very high	94.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69.4	-43.7	171.8	-68.4	173	0	0	0	111.6	V67 G115 L118 A119 F147 Y148 K149 G154 G155 I156 L158	V67-L151 HydrophobicContact CG1-CD1 3.87Å; G115-L151 WeakPolarHBondContact O-CD2 2.79Å; L118-L151 HydrophobicContact CB-CD2 4.2Å; L118-L151 HydrophobicContact CD2-CD2 3.59Å; L118-L151 HydrophobicContact CG-CD2 4.45Å; A119-L151 HydrophobicContact CB-CD2 4.21Å; F147-L151 HydrophobicContact CD1-CD1 4.07Å; F147-L151 HydrophobicContact CE1-CD1 3.51Å; F147-L151 HydrophobicContact CE1-CG 4.47Å; F147-L151 HydrophobicContact CE2-CD1 4.31Å; F147-L151 HydrophobicContact CZ-CD1 3.66Å; F147-L151 HydrophobicContact CZ-CG 4.36Å; F147-L151 PolarHBondContact O-N 3.2Å; F147-L151 VanDerWaalsContact O-N 3.1Å; Y148-L151 HydrophobicContact CD1-CD1 4.18Å; Y148-L151 PolarHBondContact O-N 3.37Å; K149-L151 VanDerWaalsContact C-N 3.29Å; K149-L151 PolarHBondContact O-N 3.15Å; L151-G154 CarbonylContact O-C 3.56Å; L151-G154 PolarHBondContact O-N 3.26Å; L151-G155 PolarHBondContact O-N 2.87Å; L151-I156 HydrophobicContact CB-CB 4.49Å; L151-I156 HydrophobicContact CB-CD1 4.45Å; L151-I156 HydrophobicContact CD2-CD1 3.69Å; L151-I156 WeakPolarHBondContact O-CB 3.21Å; L151-I156 PolarHBondContact O-N 3.42Å; L151-I156 VanDerWaalsContact O-N 3.08Å; L151-L158 HydrophobicContact CD1-CD2 4.27Å
152	L	96	Very high	94.5	Very high	94 Å²	94	57.2 Å²	57.2	49%	0.492	31%	0.311	S	S	.	.	H	α-helix	trans	-63.6	-44.9	176.2	-68.7	171	0	0	0	111.3	Y148 K149 G154 G155 L158	Y148-L152 WeakPolarHBondContact O-CG 3.28Å; Y148-L152 PolarHBondContact O-N 3.31Å; K149-L152 PolarHBondContact O-N 2.98Å; L152-G154 PolarHBondContact O-N 2.9Å; L152-G155 PolarHBondContact O-N 3.38Å; L152-L158 HydrophobicContact CD1-CD1 4.2Å; L152-L158 HydrophobicContact CD2-CB 4.48Å; L152-L158 HydrophobicContact CD2-CD1 3.86Å; L152-L158 HydrophobicContact CD2-CG 3.86Å; L152-L158 HydrophobicContact CG-CD1 3.9Å; L152-L158 HydrophobicContact CG-CG 4.32Å
153	D	97.4	Very high	94.5	Very high	121 Å²	121	52.7 Å²	52.7	65%	0.647	29%	0.29	S	S	*	.	H	α-helix	trans	-62	-31.3	175.1	-67.8	-15.8	0	0	0	111.5	K149 G155	K149-D153 WeakPolarHBondContact O-CB 3.31Å; K149-D153 VanDerWaalsContact O-CG 3.26Å; K149-D153 PolarHBondContact O-N 2.93Å; D153-G155 PolarHBondContact O-N 3.16Å
154	G	96.7	Very high	94.4	Very high	38 Å²	38	56.7 Å²	56.7	39%	0.392	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-0.2	172.8	0	0	0	0	0	114.9	S150 L151 L152	S150-G154 PolarHBondContact O-N 3.29Å; L151-G154 CarbonylContact O-C 3.56Å; L151-G154 PolarHBondContact O-N 3.26Å; L152-G154 PolarHBondContact O-N 2.9Å
155	G	95.8	Very high	93.9	Very high	51 Å²	51	62 Å²	62	53%	0.526	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	13.4	177.5	0	0	0	0	0	115.2	L151 L152 D153	L151-G155 PolarHBondContact O-N 2.87Å; L152-G155 PolarHBondContact O-N 3.38Å; D153-G155 PolarHBondContact O-N 3.16Å
156	I	96.3	Very high	93.1	Very high	7 Å²	7	64.7 Å²	64.7	4%	0.036	35%	0.347	C	S	.	.			trans	-81.2	135	173	-67.9	171.9	0	0	0	109.9	L118 A119 C122 T128 L130 L151 L158	L118-I156 HydrophobicContact CD2-CD1 4.45Å; A119-I156 VanDerWaalsContact CA-CD1 3.47Å; A119-I156 HydrophobicContact CB-CD1 3.81Å; A119-I156 HydrophobicContact CB-CG1 4.38Å; C122-I156 HydrophobicContact CB-CD1 3.82Å; C122-I156 HydrophobicContact CB-CG1 4.4Å; T128-I156 WeakPolarHBondContact O-CA 3.49Å; L130-I156 HydrophobicContact CB-CG2 4.34Å; L130-I156 HydrophobicContact CD1-CD1 4.16Å; L130-I156 HydrophobicContact CD1-CG2 3.85Å; L130-I156 HydrophobicContact CG-CG2 4.1Å; L151-I156 HydrophobicContact CB-CB 4.49Å; L151-I156 HydrophobicContact CB-CD1 4.45Å; L151-I156 HydrophobicContact CD2-CD1 3.69Å; L151-I156 WeakPolarHBondContact O-CB 3.21Å; L151-I156 PolarHBondContact O-N 3.42Å; L151-I156 VanDerWaalsContact O-N 3.08Å; I156-L158 HydrophobicContact CG2-CD2 4.36Å
157	Q	94.9	Very high	92.3	Very high	105 Å²	105	72 Å²	72	49%	0.491	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-88.9	122.2	169.3	-60.5	-178.1	0.4	0	0	109.9	T128 E129 L130 K159	T128-Q157 PolarHBondContact O-N 3.18Å; E129-Q157 WeakPolarHBondContact CA-O 3.49Å; E129-Q157 HydrophobicContact CG-CB 4.29Å; L130-Q157 PolarHBondContact N-O 3.1Å; Q157-K159 PolarHBondContact O-N 2.79Å
158	L	93.6	Very high	91.2	Very high	26 Å²	26	79.2 Å²	79.2	14%	0.136	42%	0.422	C	S	.	.	S	Bend	trans	-82.7	19.7	179.8	-65.9	-179.6	0	0	0	113.8	L130 S132 Y148 L151 L152 I156	L130-L158 CarbonylContact O-C 3.47Å; L130-L158 VanDerWaalsContact O-CA 3.23Å; L130-L158 WeakPolarHBondContact O-CA 3.26Å; S132-L158 PolarHBondContact OG-O 2.95Å; Y148-L158 HydrophobicContact CD1-CD1 3.77Å; Y148-L158 HydrophobicContact CD1-CD2 4.15Å; Y148-L158 HydrophobicContact CG-CD1 4.34Å; L151-L158 HydrophobicContact CD1-CD2 4.27Å; L152-L158 HydrophobicContact CD1-CD1 4.2Å; L152-L158 HydrophobicContact CD2-CB 4.48Å; L152-L158 HydrophobicContact CD2-CD1 3.86Å; L152-L158 HydrophobicContact CD2-CG 3.86Å; L152-L158 HydrophobicContact CG-CD1 3.9Å; L152-L158 HydrophobicContact CG-CG 4.32Å; I156-L158 HydrophobicContact CG2-CD2 4.36Å
159	K	92	Very high	90	Very high	168 Å²	168	83.2 Å²	83.2	73%	0.73	46%	0.457	S	S	*	.	S	Bend	trans	-134	127.4	175.5	-177.6	-180	177.5	-176.9	0	107.5	L130 Q157	L130-K159 PolarHBondContact O-N 3.29Å; Q157-K159 PolarHBondContact O-N 2.79Å
160	E	91.5	Very high	88.7	Confident	16 Å²	16	85.2 Å²	85.2	8%	0.075	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-76.9	155.1	173.9	-64.1	-179.2	163.2	0	0	111.5	K50 W64 N65 F131	K50-E160 WeakPolarHBondContact CE-OE2 3.37Å; K50-E160 IonicContact NZ-OE2 3.6Å; K50-E160 PolarHBondContact NZ-OE2 3Å; W64-E160 HydrophobicContact CE3-CB 4.31Å; W64-E160 HydrophobicContact CZ3-CB 4.34Å; W64-E160 PolarHBondContact N-OE1 2.94Å; W64-E160 PolarHBondContact N-OE2 3.18Å; W64-E160 VanDerWaalsContact N-OE2 3.07Å; N65-E160 WeakPolarHBondContact CA-OE1 3.36Å; N65-E160 PolarHBondContact N-OE1 3.24Å; N65-E160 VanDerWaalsContact O-OE1 3.05Å; F131-E160 HydrophobicContact CB-CG 3.86Å; F131-E160 WeakPolarHBondContact CB-OE1 3.29Å
161	T	90.7	Very high	87.4	Confident	44 Å²	44	88 Å²	88	27%	0.27	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-48.4	139.6	162.2	14.5	0	0	0	0	111.2	W64 E129	W64-T161 WeakPolarHBondContact CH2-O 3.48Å; W64-T161 WeakPolarHBondContact CZ3-O 3.37Å; E129-T161 VanDerWaalsContact OE2-CB 3.28Å; E129-T161 WeakPolarHBondContact OE2-CB 3.46Å; E129-T161 VanDerWaalsContact OE2-CG2 3.31Å; E129-T161 WeakPolarHBondContact OE2-CG2 3.35Å; E129-T161 PolarHBondContact OE2-N 3.04Å; E129-T161 PolarHBondContact OE2-OG1 2.68Å
162	S	90.3	Very high	86.3	Confident	98 Å²	98	91.3 Å²	91.3	69%	0.685	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-67.5	137.6	175.9	47.8	0	0	0	0	109.9	I164	S162-I164 PolarHBondContact O-N 3.46Å
163	H	92	Very high	85.4	Confident	49 Å²	49	91.3 Å²	91.3	23%	0.227	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-63.9	128.7	170.3	173.5	50.4	0	0	0	109.6	G46 A48 K50 W64 E165	G46-H163 WeakPolarHBondContact O-CA 3.24Å; G46-H163 PolarHBondContact O-ND1 3.2Å; A48-H163 PolarHBondContact O-ND1 3.1Å; A48-H163 VanDerWaalsContact O-ND1 3.08Å; K50-H163 HydrophobicContact CD-CB 4.19Å; K50-H163 HydrophobicContact CG-CB 4.27Å; W64-H163 HydrophobicContact CH2-CB 4.26Å; W64-H163 HydrophobicContact CZ2-CB 4.1Å; H163-E165 PolarHBondContact O-N 2.84Å
164	I	90.8	Very high	84.3	Confident	94 Å²	94	90.2 Å²	90.2	48%	0.482	51%	0.507	S	S	.	.			trans	-81.7	108	170.1	-59.6	170	0	0	0	106.2	G46 L47 S162 E166	G46-I164 PolarHBondContact O-N 2.98Å; L47-I164 HydrophobicContact CD2-CB 4.41Å; L47-I164 HydrophobicContact CD2-CD1 3.97Å; S162-I164 PolarHBondContact O-N 3.46Å; I164-E166 PolarHBondContact O-N 2.82Å
165	E	84.3	Confident	83.6	Confident	122 Å²	122	95.7 Å²	95.7	57%	0.57	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-63.2	132.2	173.7	-61.1	-166.8	136.1	0	0	109.1	K52 H163 L167	K52-E165 IonicContact NZ-OE1 3.99Å; K52-E165 PolarHBondContact NZ-OE1 3.21Å; H163-E165 PolarHBondContact O-N 2.84Å; E165-L167 PolarHBondContact O-N 2.74Å
166	E	77.6	Confident	83	Confident	166 Å²	166	97.3 Å²	97.3	78%	0.776	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-62.2	136.9	167.9	-66.1	-176.5	176.2	0	0	107.7	I164 D168	I164-E166 PolarHBondContact O-N 2.82Å; E166-D168 PolarHBondContact O-N 3.08Å
167	L	77.1	Confident	82.2	Confident	169 Å²	169	98.3 Å²	98.3	89%	0.885	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-59.9	125	169.3	-65.9	169.8	0	0	0	106.8	E165 A169	E165-L167 PolarHBondContact O-N 2.74Å; L167-A169 PolarHBondContact O-N 3.41Å
168	D	73.4	Confident	81.7	Confident	152 Å²	152	96 Å²	96	81%	0.813	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-48.2	131.8	170.1	-72.6	-32.9	0	0	0	107.7	E166 I170	E166-D168 PolarHBondContact O-N 3.08Å; D168-I170 PolarHBondContact O-N 3.11Å; D168-I170 VanDerWaalsContact O-N 3.1Å
169	A	69.6	Low	81	Confident	93 Å²	93	100.7 Å²	100.7	77%	0.769	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-49.9	128.9	168.6	0	0	0	0	0	106	L167 G171	L167-A169 PolarHBondContact O-N 3.41Å; A169-G171 PolarHBondContact O-N 3.11Å
170	I	70	Confident	80.4	Confident	172 Å²	172	100.5 Å²	100.5	88%	0.882	56%	0.557	S	S	*	*			trans	-63.5	84.7	177.5	-59.6	163.5	0	0	0	106.1	D168	D168-I170 PolarHBondContact O-N 3.11Å; D168-I170 VanDerWaalsContact O-N 3.1Å
171	G	68.5	Low	79.7	Confident	63 Å²	63	103.9 Å²	103.9	65%	0.649	57%	0.573	S	S	*	*			trans	-71.4	135	170.8	0	0	0	0	0	105.9	A169 D173	A169-G171 PolarHBondContact O-N 3.11Å; G171-D173 PolarHBondContact O-N 2.79Å
172	I	73.5	Confident	79.1	Confident	69 Å²	69	104.9 Å²	104.9	35%	0.354	57%	0.574	S	S	.	*			trans	-77.3	117.5	166.7	-54.1	173.8	0	0	0	104.7	Y174 M177 M185	I172-Y174 VanDerWaalsContact C-N 3.34Å; I172-Y174 HydrophobicContact CB-CE2 4.44Å; I172-Y174 WeakPolarHBondContact O-CD2 3.4Å; I172-Y174 WeakPolarHBondContact O-CE2 3.44Å; I172-Y174 PolarHBondContact O-N 3.07Å; I172-M177 HydrophobicContact CB-CE 4.44Å; I172-M177 HydrophobicContact CG2-CE 3.33Å; I172-M177 HydrophobicContact CG2-CG 4.34Å; I172-M177 HydrophobicContact CG2-SD 3.37Å; I172-M177 WeakPolarHBondContact CG2-SD 3.37Å; I172-M185 HydrophobicContact CD1-CE 3.12Å; I172-M185 HydrophobicContact CD1-SD 4.07Å
173	D	77.7	Confident	78.3	Confident	95 Å²	95	105.5 Å²	105.5	51%	0.508	56%	0.561	S	S	.	*			trans	-70.4	94.5	174.5	-178.6	5.2	0	0	0	108.6	G171 D175 S176 M177	G171-D173 PolarHBondContact O-N 2.79Å; D173-D175 PolarHBondContact O-N 2.72Å; D173-D175 PolarHBondContact OD1-N 2.63Å; D173-D175 VanDerWaalsContact OD1-N 3.1Å; D173-S176 PolarHBondContact O-N 3.31Å; D173-S176 PolarHBondContact O-OG 2.98Å; D173-S176 PolarHBondContact OD1-N 3.12Å; D173-M177 PolarHBondContact O-N 2.7Å
174	Y	74.9	Confident	77.4	Confident	98 Å²	98	106.8 Å²	106.8	38%	0.384	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.7	-25.2	-179.8	-67.9	-85.4	0	0	0	112.3	I172 S176 M177 K182	I172-Y174 VanDerWaalsContact C-N 3.34Å; I172-Y174 HydrophobicContact CB-CE2 4.44Å; I172-Y174 WeakPolarHBondContact O-CD2 3.4Å; I172-Y174 WeakPolarHBondContact O-CE2 3.44Å; I172-Y174 PolarHBondContact O-N 3.07Å; Y174-S176 VanDerWaalsContact C-N 3.31Å; Y174-M177 HydrophobicContact CD1-CE 3.19Å; Y174-M177 HydrophobicContact CE1-CE 3.62Å; Y174-M177 HydrophobicContact CG-CE 3.88Å; Y174-M177 PolarHBondContact O-N 3.2Å; Y174-K182 HydrophobicContact CD1-CG 4.2Å; Y174-K182 WeakPolarHBondContact O-CE 3.44Å; Y174-K182 PolarHBondContact O-NZ 2.79Å
175	D	81.6	Confident	76.6	Confident	152 Å²	152	106.3 Å²	106.3	81%	0.813	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-28.8	178.6	-66	-19.3	0	0	0	111.1	D173 M177	D173-D175 PolarHBondContact O-N 2.72Å; D173-D175 PolarHBondContact OD1-N 2.63Å; D173-D175 VanDerWaalsContact OD1-N 3.1Å; D175-M177 VanDerWaalsContact C-N 3.25Å; D175-M177 PolarHBondContact O-N 2.9Å
176	S	82.4	Confident	75.6	Confident	86 Å²	86	108.2 Å²	108.2	60%	0.601	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-14.9	170.7	77.2	0	0	0	0	114.2	D173 Y174	D173-S176 PolarHBondContact O-N 3.31Å; D173-S176 PolarHBondContact O-OG 2.98Å; D173-S176 PolarHBondContact OD1-N 3.12Å; Y174-S176 VanDerWaalsContact C-N 3.31Å
177	M	79.6	Confident	74.8	Confident	28 Å²	28	103.3 Å²	103.3	14%	0.138	56%	0.562	C	S	.	*	S	Bend	trans	-96.8	142.6	-175.3	-70.1	-164.8	-57.1	0	0	112.7	I172 D173 Y174 D175 E181 K182	I172-M177 HydrophobicContact CB-CE 4.44Å; I172-M177 HydrophobicContact CG2-CE 3.33Å; I172-M177 HydrophobicContact CG2-CG 4.34Å; I172-M177 HydrophobicContact CG2-SD 3.37Å; I172-M177 WeakPolarHBondContact CG2-SD 3.37Å; D173-M177 PolarHBondContact O-N 2.7Å; Y174-M177 HydrophobicContact CD1-CE 3.19Å; Y174-M177 HydrophobicContact CE1-CE 3.62Å; Y174-M177 HydrophobicContact CG-CE 3.88Å; Y174-M177 PolarHBondContact O-N 3.2Å; D175-M177 VanDerWaalsContact C-N 3.25Å; D175-M177 PolarHBondContact O-N 2.9Å; M177-E181 VanDerWaalsContact CA-OE2 3.31Å; M177-E181 WeakPolarHBondContact CA-OE2 3.46Å; M177-E181 HydrophobicContact CB-CB 4.12Å; M177-E181 HydrophobicContact CG-CB 4.38Å; M177-E181 HydrophobicContact SD-CB 4.19Å; M177-K182 HydrophobicContact CB-CG 4.2Å; M177-K182 HydrophobicContact CE-CG 4.02Å; M177-K182 VanDerWaalsContact O-CE 3.26Å; M177-K182 WeakPolarHBondContact O-CE 3.47Å; M177-K182 PolarHBondContact O-NZ 2.8Å
178	S	84.5	Confident	74.1	Confident	55 Å²	55	96.3 Å²	96.3	39%	0.385	53%	0.528	S	S	.	.			trans	-67.9	158	168	65.4	0	0	0	0	111.8	E180 E181 K182	S178-E180 PolarHBondContact O-N 2.85Å; S178-E181 PolarHBondContact N-OE2 3.47Å; S178-E181 PolarHBondContact O-N 3.06Å; S178-E181 VanDerWaalsContact O-N 3.15Å; S178-E181 VanDerWaalsContact OG-CG 3.31Å; S178-E181 WeakPolarHBondContact OG-CG 3.43Å; S178-E181 PolarHBondContact OG-N 3.1Å; S178-E181 PolarHBondContact OG-OE2 3.15Å; S178-K182 WeakPolarHBondContact O-CG 3.37Å; S178-K182 PolarHBondContact O-N 2.98Å
179	D	78.4	Confident	73.6	Confident	126 Å²	126	95.3 Å²	95.3	67%	0.674	52%	0.522	S	S	*	.	H	α-helix	trans	-60.4	-27.4	176.4	-72.8	-21.8	0	0	0	112.9	K182 R183	D179-K182 IonicContact OD1-NZ 2.75Å; D179-R183 VanDerWaalsContact O-CB 3.3Å; D179-R183 WeakPolarHBondContact O-CB 3.41Å; D179-R183 PolarHBondContact O-N 2.9Å
180	E	79.3	Confident	73.2	Confident	163 Å²	163	95.4 Å²	95.4	76%	0.762	51%	0.508	S	S	*	.	H	α-helix	trans	-70.8	-42.8	175.6	-61.6	-176	176.8	0	0	112	S178 R183 A184	S178-E180 PolarHBondContact O-N 2.85Å; E180-R183 CarbonylContact O-C 3.59Å; E180-R183 VanDerWaalsContact O-CB 3.3Å; E180-R183 WeakPolarHBondContact O-CB 3.49Å; E180-R183 PolarHBondContact O-N 2.68Å; E180-A184 WeakPolarHBondContact O-CB 3.23Å; E180-A184 PolarHBondContact O-N 2.66Å
181	E	78.4	Confident	73	Confident	88 Å²	88	91.2 Å²	91.2	41%	0.411	49%	0.485	S	S	.	.	H	α-helix	trans	-64.6	-41.8	174.3	-72.2	167.2	155.4	0	0	111.1	M177 S178 R183 A184 M185	M177-E181 VanDerWaalsContact CA-OE2 3.31Å; M177-E181 WeakPolarHBondContact CA-OE2 3.46Å; M177-E181 HydrophobicContact CB-CB 4.12Å; M177-E181 HydrophobicContact CG-CB 4.38Å; M177-E181 HydrophobicContact SD-CB 4.19Å; S178-E181 PolarHBondContact N-OE2 3.47Å; S178-E181 PolarHBondContact O-N 3.06Å; S178-E181 VanDerWaalsContact O-N 3.15Å; S178-E181 VanDerWaalsContact OG-CG 3.31Å; S178-E181 WeakPolarHBondContact OG-CG 3.43Å; S178-E181 PolarHBondContact OG-N 3.1Å; S178-E181 PolarHBondContact OG-OE2 3.15Å; E181-R183 VanDerWaalsContact C-N 3.27Å; E181-R183 PolarHBondContact O-N 3.46Å; E181-A184 PolarHBondContact O-N 3.27Å; E181-A184 VanDerWaalsContact O-N 3.16Å; E181-M185 PolarHBondContact O-N 2.75Å
182	K	77.7	Confident	72.9	Confident	65 Å²	65	90.1 Å²	90.1	28%	0.283	47%	0.466	S	S	.	.	H	α-helix	trans	-56.7	-44.1	171.4	-67.1	175.9	-171.8	162.7	0	111.1	Y174 M177 S178 D179 A184 M185 Y186	Y174-K182 HydrophobicContact CD1-CG 4.2Å; Y174-K182 WeakPolarHBondContact O-CE 3.44Å; Y174-K182 PolarHBondContact O-NZ 2.79Å; M177-K182 HydrophobicContact CB-CG 4.2Å; M177-K182 HydrophobicContact CE-CG 4.02Å; M177-K182 VanDerWaalsContact O-CE 3.26Å; M177-K182 WeakPolarHBondContact O-CE 3.47Å; M177-K182 PolarHBondContact O-NZ 2.8Å; S178-K182 WeakPolarHBondContact O-CG 3.37Å; S178-K182 PolarHBondContact O-N 2.98Å; D179-K182 IonicContact OD1-NZ 2.75Å; K182-A184 VanDerWaalsContact C-N 3.34Å; K182-M185 PolarHBondContact O-N 2.9Å; K182-Y186 PolarHBondContact O-N 3.15Å
183	R	73.2	Confident	72.3	Confident	110 Å²	110	88.7 Å²	88.7	42%	0.415	46%	0.459	S	S	.	.	H	α-helix	trans	-65.6	-36.3	177.9	-157.8	78.7	174.9	84.5	15	112.4	D179 E180 E181 Y186 P187 S188 E191	D179-R183 VanDerWaalsContact O-CB 3.3Å; D179-R183 WeakPolarHBondContact O-CB 3.41Å; D179-R183 PolarHBondContact O-N 2.9Å; E180-R183 CarbonylContact O-C 3.59Å; E180-R183 VanDerWaalsContact O-CB 3.3Å; E180-R183 WeakPolarHBondContact O-CB 3.49Å; E180-R183 PolarHBondContact O-N 2.68Å; E181-R183 VanDerWaalsContact C-N 3.27Å; E181-R183 PolarHBondContact O-N 3.46Å; R183-Y186 CarbonylContact O-C 3.4Å; R183-P187 VanDerWaalsContact O-CA 3.24Å; R183-P187 WeakPolarHBondContact O-CA 3.48Å; R183-S188 VanDerWaalsContact NH1-CA 3.32Å; R183-S188 VanDerWaalsContact NH1-CB 3.31Å; R183-S188 PolarHBondContact NH2-OG 3.33Å; R183-E191 IonicContact CZ-OE2 3.42Å; R183-E191 VanDerWaalsContact CZ-OE2 3.26Å; R183-E191 IonicContact NE-OE2 3.67Å; R183-E191 IonicContact NH1-OE2 2.66Å; R183-E191 IonicContact NH2-OE1 3.26Å; R183-E191 IonicContact NH2-OE2 3.66Å; R183-E191 PolarHBondContact NH2-OE2 3.18Å
184	A	73.5	Confident	71.7	Confident	76 Å²	76	91.2 Å²	91.2	63%	0.628	46%	0.461	S	S	*	.	H	α-helix	trans	-71.8	-34.9	179.8	0	0	0	0	0	112.6	E180 E181 K182 Y186 P187	E180-A184 WeakPolarHBondContact O-CB 3.23Å; E180-A184 PolarHBondContact O-N 2.66Å; E181-A184 PolarHBondContact O-N 3.27Å; E181-A184 VanDerWaalsContact O-N 3.16Å; K182-A184 VanDerWaalsContact C-N 3.34Å; A184-Y186 VanDerWaalsContact C-N 3.31Å; A184-Y186 PolarHBondContact O-N 2.68Å; A184-P187 WeakPolarHBondContact O-CD 3.28Å
185	M	73.2	Confident	71.2	Confident	85 Å²	85	91.6 Å²	91.6	42%	0.419	47%	0.474	S	S	.	.	H	α-helix	trans	-62.9	-37.6	174.4	-75.8	-67.1	-57	0	0	112.4	I172 E181 K182	I172-M185 HydrophobicContact CD1-CE 3.12Å; I172-M185 HydrophobicContact CD1-SD 4.07Å; E181-M185 PolarHBondContact O-N 2.75Å; K182-M185 PolarHBondContact O-N 2.9Å
186	Y	62.8	Low	70.4	Confident	161 Å²	161	87.1 Å²	87.1	63%	0.631	45%	0.452	S	S	*	.	S	Bend	trans	-130.9	81.8	173.5	-61.8	-81.4	0	0	0	110	K182 R183 A184 S188	K182-Y186 PolarHBondContact O-N 3.15Å; R183-Y186 CarbonylContact O-C 3.4Å; A184-Y186 VanDerWaalsContact C-N 3.31Å; A184-Y186 PolarHBondContact O-N 2.68Å; Y186-S188 PolarHBondContact O-N 2.82Å
187	P	61.6	Low	69.2	Low	63 Å²	63	86.6 Å²	86.6	41%	0.409	45%	0.447	S	S	.	.			trans	-56.5	145.6	174.9	24.8	-33.9	0	0	0	108.6	R183 A184 L189 T192	R183-P187 VanDerWaalsContact O-CA 3.24Å; R183-P187 WeakPolarHBondContact O-CA 3.48Å; A184-P187 WeakPolarHBondContact O-CD 3.28Å; P187-L189 PolarHBondContact O-N 3.34Å; P187-T192 HydrophobicContact CB-CG2 3.73Å; P187-T192 HydrophobicContact CG-CG2 3.4Å
188	S	63.5	Low	68.2	Low	22 Å²	22	90.5 Å²	90.5	15%	0.154	47%	0.468	C	S	.	.			trans	-59.4	145.4	178.5	50.2	0	0	0	0	108.5	R183 Y186 I190 E191 T192	R183-S188 VanDerWaalsContact NH1-CA 3.32Å; R183-S188 VanDerWaalsContact NH1-CB 3.31Å; R183-S188 PolarHBondContact NH2-OG 3.33Å; Y186-S188 PolarHBondContact O-N 2.82Å; S188-I190 PolarHBondContact O-N 3.43Å; S188-E191 PolarHBondContact N-OE2 3.34Å; S188-E191 VanDerWaalsContact N-OE2 3.14Å; S188-E191 PolarHBondContact O-N 2.86Å; S188-E191 VanDerWaalsContact OG-CD 3.31Å; S188-E191 PolarHBondContact OG-N 3.19Å; S188-E191 PolarHBondContact OG-OE2 2.97Å; S188-T192 PolarHBondContact O-N 2.77Å; S188-T192 PolarHBondContact O-OG1 2.86Å
189	L	61.3	Low	66.3	Low	131 Å²	131	96.6 Å²	96.6	69%	0.686	48%	0.483	S	S	*	.	H	α-helix	trans	-46.7	-33.9	167.6	-166.9	85.5	0	0	0	110.8	P187 T192 L193	P187-L189 PolarHBondContact O-N 3.34Å; L189-T192 WeakPolarHBondContact CA-OG1 2.98Å; L189-T192 PolarHBondContact O-OG1 3.2Å; L189-L193 HydrophobicContact CD2-CD1 4.35Å; L189-L193 HydrophobicContact CG-CD1 4.13Å; L189-L193 VanDerWaalsContact O-CB 3.29Å; L189-L193 WeakPolarHBondContact O-CB 3.25Å; L189-L193 WeakPolarHBondContact O-CD1 3.03Å; L189-L193 WeakPolarHBondContact O-CG 3.32Å; L189-L193 PolarHBondContact O-N 3.01Å
190	I	62.5	Low	64.8	Low	96 Å²	96	96.9 Å²	96.9	49%	0.492	48%	0.484	S	S	.	.	H	α-helix	trans	-68.9	-45.4	177.1	-69.3	129.7	0	0	0	113.3	S188 L193 R194 I227	S188-I190 PolarHBondContact O-N 3.43Å; I190-L193 PolarHBondContact O-N 3.44Å; I190-R194 PolarHBondContact O-N 3.23Å; I190-R194 VanDerWaalsContact O-N 3.11Å; I190-I227 HydrophobicContact CG2-CG2 4.24Å
191	E	64.5	Low	63.7	Low	83 Å²	83	97 Å²	97	39%	0.388	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-48.4	176.4	-88	143.2	172.2	0	0	111.6	R183 S188 L193 R194 T195	R183-E191 IonicContact CZ-OE2 3.42Å; R183-E191 VanDerWaalsContact CZ-OE2 3.26Å; R183-E191 IonicContact NE-OE2 3.67Å; R183-E191 IonicContact NH1-OE2 2.66Å; R183-E191 IonicContact NH2-OE1 3.26Å; R183-E191 IonicContact NH2-OE2 3.66Å; R183-E191 PolarHBondContact NH2-OE2 3.18Å; S188-E191 PolarHBondContact N-OE2 3.34Å; S188-E191 VanDerWaalsContact N-OE2 3.14Å; S188-E191 PolarHBondContact O-N 2.86Å; S188-E191 VanDerWaalsContact OG-CD 3.31Å; S188-E191 PolarHBondContact OG-N 3.19Å; S188-E191 PolarHBondContact OG-OE2 2.97Å; E191-L193 VanDerWaalsContact C-N 3.29Å; E191-L193 PolarHBondContact O-N 3.39Å; E191-R194 PolarHBondContact O-N 3.41Å; E191-T195 PolarHBondContact O-N 2.79Å; E191-T195 PolarHBondContact O-OG1 2.77Å
192	T	66.9	Low	62.7	Low	41 Å²	41	98.7 Å²	98.7	25%	0.252	50%	0.501	S	S	.	.	H	α-helix	trans	-56	-45	176.3	52.4	0	0	0	0	111.1	P187 S188 L189 R194 T195 T196	P187-T192 HydrophobicContact CB-CG2 3.73Å; P187-T192 HydrophobicContact CG-CG2 3.4Å; S188-T192 PolarHBondContact O-N 2.77Å; S188-T192 PolarHBondContact O-OG1 2.86Å; L189-T192 WeakPolarHBondContact CA-OG1 2.98Å; L189-T192 PolarHBondContact O-OG1 3.2Å; T192-R194 VanDerWaalsContact C-N 3.26Å; T192-R194 PolarHBondContact O-N 3.25Å; T192-T195 PolarHBondContact O-N 2.95Å; T192-T196 VanDerWaalsContact O-CB 3.23Å; T192-T196 WeakPolarHBondContact O-CB 3.43Å; T192-T196 PolarHBondContact O-N 2.86Å; T192-T196 PolarHBondContact O-OG1 3.24Å
193	L	61.9	Low	61.3	Low	38 Å²	38	99.4 Å²	99.4	20%	0.199	51%	0.512	C	S	.	.	H	α-helix	trans	-63.6	-28.1	177.1	-73.1	171.5	0	0	0	113.9	L189 I190 E191 L224	L189-L193 HydrophobicContact CD2-CD1 4.35Å; L189-L193 HydrophobicContact CG-CD1 4.13Å; L189-L193 VanDerWaalsContact O-CB 3.29Å; L189-L193 WeakPolarHBondContact O-CB 3.25Å; L189-L193 WeakPolarHBondContact O-CD1 3.03Å; L189-L193 WeakPolarHBondContact O-CG 3.32Å; L189-L193 PolarHBondContact O-N 3.01Å; I190-L193 PolarHBondContact O-N 3.44Å; E191-L193 VanDerWaalsContact C-N 3.29Å; E191-L193 PolarHBondContact O-N 3.39Å; L193-L224 HydrophobicContact CD1-CD2 4.12Å
194	R	64.8	Low	60.3	Low	149 Å²	149	97.5 Å²	97.5	56%	0.562	51%	0.505	S	S	*	.	H	α-helix	trans	-83.3	-38.1	177.2	-97.5	-174.7	68.3	115.2	0.3	113.5	I190 E191 T192	I190-R194 PolarHBondContact O-N 3.23Å; I190-R194 VanDerWaalsContact O-N 3.11Å; E191-R194 PolarHBondContact O-N 3.41Å; T192-R194 VanDerWaalsContact C-N 3.26Å; T192-R194 PolarHBondContact O-N 3.25Å
195	T	63.7	Low	59.5	Low	105 Å²	105	97.9 Å²	97.9	64%	0.644	50%	0.501	S	S	*	.	H	α-helix	trans	-98.2	-26.7	-169.9	59.5	0	0	0	0	113.6	E191 T192 P197	E191-T195 PolarHBondContact O-N 2.79Å; E191-T195 PolarHBondContact O-OG1 2.77Å; T192-T195 PolarHBondContact O-N 2.95Å; T195-P197 WeakPolarHBondContact O-CD 3.47Å
196	T	64.7	Low	58.9	Low	59 Å²	59	103.7 Å²	103.7	36%	0.362	52%	0.52	S	S	.	.			trans	-68	112.4	179.4	-43.6	0	0	0	0	108.8	T192 W199	T192-T196 VanDerWaalsContact O-CB 3.23Å; T192-T196 WeakPolarHBondContact O-CB 3.43Å; T192-T196 PolarHBondContact O-N 2.86Å; T192-T196 PolarHBondContact O-OG1 3.24Å; T196-W199 HydrophobicContact CG2-CE3 3.99Å; T196-W199 HydrophobicContact CG2-CZ3 3.81Å
197	P	57.1	Low	58.6	Low	75 Å²	75	101 Å²	101	49%	0.487	53%	0.525	S	S	.	.			trans	-62.8	146.7	168.7	27.4	-31.1	0	0	0	108.7	T195 W199	T195-P197 WeakPolarHBondContact O-CD 3.47Å; P197-W199 HydrophobicContact CG-CD2 4.39Å; P197-W199 HydrophobicContact CG-CH2 4.41Å; P197-W199 HydrophobicContact CG-CZ2 4.16Å; P197-W199 PolarHBondContact O-N 3.45Å
198	D	58	Low	58.3	Low	110 Å²	110	102.5 Å²	102.5	59%	0.588	53%	0.529	S	S	*	.			trans	-64	89.2	172.7	-74	-40	0	0	0	108	D200 R228	D198-D200 VanDerWaalsContact C-N 3.3Å; D198-D200 PolarHBondContact O-N 2.99Å; D198-R228 VanDerWaalsContact CG-NH1 3.3Å; D198-R228 IonicContact OD1-CZ 3.04Å; D198-R228 IonicContact OD1-NH1 2.71Å; D198-R228 PolarHBondContact OD1-NH1 2.89Å; D198-R228 IonicContact OD1-NH2 2.66Å; D198-R228 PolarHBondContact OD1-NH2 3.23Å; D198-R228 IonicContact OD2-CZ 3.71Å; D198-R228 IonicContact OD2-NH1 3.07Å; D198-R228 PolarHBondContact OD2-NH1 2.87Å
199	W	45	Very low	58.2	Low	183 Å²	183	106.6 Å²	106.6	69%	0.693	54%	0.541	S	S	*	.			trans	-68.2	100	165.3	-79.8	-62.2	0	0	0	106.5	T196 P197 I202	T196-W199 HydrophobicContact CG2-CE3 3.99Å; T196-W199 HydrophobicContact CG2-CZ3 3.81Å; P197-W199 HydrophobicContact CG-CD2 4.39Å; P197-W199 HydrophobicContact CG-CH2 4.41Å; P197-W199 HydrophobicContact CG-CZ2 4.16Å; P197-W199 PolarHBondContact O-N 3.45Å; W199-I202 WeakPolarHBondContact O-CD1 3.47Å; W199-I202 WeakPolarHBondContact O-CG1 3.44Å
200	D	48.1	Very low	58.3	Low	132 Å²	132	103.2 Å²	103.2	71%	0.706	53%	0.527	S	S	*	.	S	Bend	trans	64.2	155.1	-177.1	-54.8	-39.6	0	0	0	112.7	D198 I202	D198-D200 VanDerWaalsContact C-N 3.3Å; D198-D200 PolarHBondContact O-N 2.99Å; D200-I202 HydrophobicContact CB-CG1 4.08Å; D200-I202 PolarHBondContact O-N 3.37Å
201	D	55.1	Low	58.4	Low	166 Å²	166	104.2 Å²	104.2	89%	0.888	53%	0.528	S	S	*	.			trans	-64.1	49.8	171.1	-71.9	-58	0	0	0	111.6	P203	D201-P203 WeakPolarHBondContact O-CD 3.33Å
202	I	57.6	Low	59	Low	123 Å²	123	104.8 Å²	104.8	63%	0.631	55%	0.546	S	S	*	.			trans	-67	107.1	176.6	-57.5	174.8	0	0	0	106.1	W199 D200 Y204	W199-I202 WeakPolarHBondContact O-CD1 3.47Å; W199-I202 WeakPolarHBondContact O-CG1 3.44Å; D200-I202 HydrophobicContact CB-CG1 4.08Å; D200-I202 PolarHBondContact O-N 3.37Å; I202-Y204 PolarHBondContact O-N 2.93Å
203	P	48.4	Very low	59.6	Low	79 Å²	79	104.7 Å²	104.7	51%	0.513	55%	0.554	S	S	.	*			trans	-70.3	126.2	-179.5	31.4	-31.5	0	0	0	106.7	D201 R209	D201-P203 WeakPolarHBondContact O-CD 3.33Å; P203-R209 VanDerWaalsContact CB-CZ 3.47Å; P203-R209 VanDerWaalsContact CG-NH2 3.3Å; P203-R209 PolarHBondContact O-NH2 3.24Å; P203-R209 VanDerWaalsContact O-NH2 3.14Å
204	Y	52.3	Low	60.5	Low	71 Å²	71	108 Å²	108	28%	0.278	58%	0.578	S	S	.	*			trans	-36.1	147.9	-175.3	-64.4	-82.4	0	0	0	112.7	I202 Y206 L208 R209 R228	I202-Y204 PolarHBondContact O-N 2.93Å; Y204-Y206 PolarHBondContact O-N 2.8Å; Y204-L208 HydrophobicContact CD1-CB 4.31Å; Y204-L208 HydrophobicContact CG-CB 4.4Å; Y204-R209 HydrophobicContact CD2-CG 4.44Å; Y204-R209 WeakPolarHBondContact O-CG 3.4Å; Y204-R209 PolarHBondContact O-NE 2.89Å; Y204-R209 PolarHBondContact O-NH2 2.84Å; Y204-R228 PolarHBondContact OH-NH1 2.82Å
205	P	56.8	Low	60.9	Low	84 Å²	84	105.2 Å²	105.2	55%	0.545	57%	0.568	S	S	.	*			trans	-48.2	138.3	166	20.6	-30.7	0	0	0	108.9	S207 L208 R209	P205-S207 PolarHBondContact O-N 3.12Å; P205-L208 HydrophobicContact CG-CD1 4.07Å; P205-L208 HydrophobicContact CG-CG 4.44Å; P205-L208 PolarHBondContact O-N 3.1Å; P205-R209 PolarHBondContact O-N 3.24Å
206	Y	60.8	Low	61.2	Low	206 Å²	206	106 Å²	106	81%	0.808	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	-29.3	-164.8	-177.4	-95.3	0	0	0	113.8	Y204 L208	Y204-Y206 PolarHBondContact O-N 2.8Å; Y206-L208 PolarHBondContact O-N 2.88Å
207	S	55.9	Low	61.4	Low	106 Å²	106	108.4 Å²	108.4	74%	0.741	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-30	175.6	52.3	0	0	0	0	115.1	P205	P205-S207 PolarHBondContact O-N 3.12Å
208	L	55	Low	62.2	Low	93 Å²	93	110.5 Å²	110.5	49%	0.487	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.6	-11.3	-177.4	-66.8	179	0	0	0	113.4	Y204 P205 Y206	Y204-L208 HydrophobicContact CD1-CB 4.31Å; Y204-L208 HydrophobicContact CG-CB 4.4Å; P205-L208 HydrophobicContact CG-CD1 4.07Å; P205-L208 HydrophobicContact CG-CG 4.44Å; P205-L208 PolarHBondContact O-N 3.1Å; Y206-L208 PolarHBondContact O-N 2.88Å
209	R	61.7	Low	62.7	Low	109 Å²	109	111 Å²	111	41%	0.411	57%	0.573	S	S	.	*	S	Bend	trans	-61.9	134.2	174.7	-74	-174	-155.9	169.8	10.2	109.7	P203 Y204 P205 K211	P203-R209 VanDerWaalsContact CB-CZ 3.47Å; P203-R209 VanDerWaalsContact CG-NH2 3.3Å; P203-R209 PolarHBondContact O-NH2 3.24Å; P203-R209 VanDerWaalsContact O-NH2 3.14Å; Y204-R209 HydrophobicContact CD2-CG 4.44Å; Y204-R209 WeakPolarHBondContact O-CG 3.4Å; Y204-R209 PolarHBondContact O-NE 2.89Å; Y204-R209 PolarHBondContact O-NH2 2.84Å; P205-R209 PolarHBondContact O-N 3.24Å; R209-K211 PolarHBondContact O-N 2.86Å
210	P	63	Low	63.5	Low	60 Å²	60	108.7 Å²	108.7	39%	0.39	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-50.1	131	159.5	-25	34.6	0	0	0	109.4	A212 K216 Y221	P210-A212 PolarHBondContact O-N 2.87Å; P210-K216 HydrophobicContact CB-CB 4.46Å; P210-Y221 HydrophobicContact CB-CD1 4.44Å
211	K	65.9	Low	64.4	Low	116 Å²	116	104.6 Å²	104.6	50%	0.504	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-55.3	139.6	171.8	-89.1	-164.3	176.4	-165.3	0	109.4	R209 Y215 K216 Y221	R209-K211 PolarHBondContact O-N 2.86Å; K211-Y215 HydrophobicContact CB-CD1 4.47Å; K211-Y215 HydrophobicContact CD-CD1 3.81Å; K211-Y215 HydrophobicContact CD-CE1 4.36Å; K211-Y215 HydrophobicContact CD-CG 4.21Å; K211-K216 WeakPolarHBondContact O-CA 3.11Å; K211-K216 WeakPolarHBondContact O-CB 3.3Å; K211-K216 PolarHBondContact O-N 3.39Å; K211-Y221 HydrophobicContact CB-CE2 4.43Å
212	A	76.2	Confident	65.2	Low	95 Å²	95	99.5 Å²	99.5	79%	0.785	51%	0.51	S	S	*	.	S	Bend	trans	-65.5	163.8	176.8	0	0	0	0	0	112.8	P210	P210-A212 PolarHBondContact O-N 2.87Å
213	G	80.3	Confident	66	Low	40 Å²	40	96.9 Å²	96.9	41%	0.412	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	73.4	-156.2	175.2	0	0	0	0	0	114.1	Y215 K216	G213-Y215 PolarHBondContact O-N 3.36Å; G213-Y215 VanDerWaalsContact O-N 3.09Å; G213-K216 WeakPolarHBondContact O-CB 3.44Å; G213-K216 WeakPolarHBondContact O-CG 3.46Å; G213-K216 PolarHBondContact O-N 3.26Å
214	P	79.6	Confident	67	Low	108 Å²	108	96.1 Å²	96.1	70%	0.701	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-62.8	-18.9	-176.7	23.7	-32.3	0	0	0	113	K216 L217	P214-K216 VanDerWaalsContact C-N 3.26Å; P214-K216 PolarHBondContact O-N 3.47Å; P214-L217 VanDerWaalsContact O-CB 3.31Å; P214-L217 WeakPolarHBondContact O-CB 3.45Å; P214-L217 PolarHBondContact O-N 2.83Å; P214-L217 VanDerWaalsContact O-N 3.15Å
215	Y	72.8	Confident	67.9	Low	89 Å²	89	95.5 Å²	95.5	35%	0.349	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-63.5	-28.8	174.4	-113.9	-97.2	0	0	0	113.1	K211 G213 L217 R218 Y221	K211-Y215 HydrophobicContact CB-CD1 4.47Å; K211-Y215 HydrophobicContact CD-CD1 3.81Å; K211-Y215 HydrophobicContact CD-CE1 4.36Å; K211-Y215 HydrophobicContact CD-CG 4.21Å; G213-Y215 PolarHBondContact O-N 3.36Å; G213-Y215 VanDerWaalsContact O-N 3.09Å; Y215-L217 PolarHBondContact O-N 3.39Å; Y215-R218 VanDerWaalsContact CE1-CZ 3.46Å; Y215-R218 VanDerWaalsContact CZ-NH2 3.27Å; Y215-R218 WeakPolarHBondContact O-CB 3.38Å; Y215-R218 WeakPolarHBondContact O-CG 3.22Å; Y215-R218 PolarHBondContact O-N 2.98Å; Y215-R218 VanDerWaalsContact O-N 3.16Å; Y215-R218 PolarHBondContact OH-NH2 2.79Å; Y215-R218 VanDerWaalsContact OH-NH2 3.1Å; Y215-Y221 AromaticContact CD1-CE2 3.99Å; Y215-Y221 HydrophobicContact CD1-CE2 3.99Å; Y215-Y221 WeakPolarHBondContact O-CD2 3.33Å
216	K	70.6	Confident	68.9	Low	121 Å²	121	93.8 Å²	93.8	53%	0.526	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-61.9	-23.5	175.3	85.6	-169.8	176	172.1	0	112.9	P210 K211 G213 P214 R218	P210-K216 HydrophobicContact CB-CB 4.46Å; K211-K216 WeakPolarHBondContact O-CA 3.11Å; K211-K216 WeakPolarHBondContact O-CB 3.3Å; K211-K216 PolarHBondContact O-N 3.39Å; G213-K216 WeakPolarHBondContact O-CB 3.44Å; G213-K216 WeakPolarHBondContact O-CG 3.46Å; G213-K216 PolarHBondContact O-N 3.26Å; P214-K216 VanDerWaalsContact C-N 3.26Å; P214-K216 PolarHBondContact O-N 3.47Å; K216-R218 VanDerWaalsContact C-N 3.26Å; K216-R218 PolarHBondContact O-N 3.47Å
217	L	68.8	Low	69.8	Low	110 Å²	110	85.6 Å²	85.6	58%	0.576	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-77.5	-11.1	-179	-55.2	175.4	0	0	0	112.4	P214 Y215 Q222	P214-L217 VanDerWaalsContact O-CB 3.31Å; P214-L217 WeakPolarHBondContact O-CB 3.45Å; P214-L217 PolarHBondContact O-N 2.83Å; P214-L217 VanDerWaalsContact O-N 3.15Å; Y215-L217 PolarHBondContact O-N 3.39Å; L217-Q222 PolarHBondContact O-NE2 3.27Å
218	R	73.2	Confident	70.3	Confident	120 Å²	120	84.2 Å²	84.2	45%	0.453	43%	0.426	S	S	.	.	S	Bend	trans	-66.7	136.9	177	-64.1	-173.4	174.2	-151.3	-1	110.4	Y215 K216 R220 Y221 Q222	Y215-R218 VanDerWaalsContact CE1-CZ 3.46Å; Y215-R218 VanDerWaalsContact CZ-NH2 3.27Å; Y215-R218 WeakPolarHBondContact O-CB 3.38Å; Y215-R218 WeakPolarHBondContact O-CG 3.22Å; Y215-R218 PolarHBondContact O-N 2.98Å; Y215-R218 VanDerWaalsContact O-N 3.16Å; Y215-R218 PolarHBondContact OH-NH2 2.79Å; Y215-R218 VanDerWaalsContact OH-NH2 3.1Å; K216-R218 VanDerWaalsContact C-N 3.26Å; K216-R218 PolarHBondContact O-N 3.47Å; R218-R220 HydrophobicContact CB-CG 4.45Å; R218-R220 PolarHBondContact O-N 2.83Å; R218-Y221 HydrophobicContact CB-CD2 4.03Å; R218-Y221 HydrophobicContact CB-CE2 4.42Å; R218-Y221 PolarHBondContact O-N 3.05Å; R218-Q222 PolarHBondContact O-N 3.21Å
219	N	68.5	Low	71.2	Confident	119 Å²	119	85 Å²	85	64%	0.636	43%	0.428	S	S	*	.	H	α-helix	trans	-45.7	-45	-178	-94.8	-1	0	0	0	113.7	Y221 Q222 I223	N219-Y221 PolarHBondContact O-N 3.36Å; N219-Y221 VanDerWaalsContact O-N 3.14Å; N219-Q222 PolarHBondContact O-N 3.08Å; N219-I223 WeakPolarHBondContact O-CG1 3.34Å; N219-I223 PolarHBondContact O-N 3.35Å
220	R	63.5	Low	71.8	Confident	136 Å²	136	80.3 Å²	80.3	51%	0.513	41%	0.413	S	S	.	.	H	α-helix	trans	-55.2	-33.3	-178.8	70.9	-176.5	-176.7	-172.4	4.6	115	R218	R218-R220 HydrophobicContact CB-CG 4.45Å; R218-R220 PolarHBondContact O-N 2.83Å
221	Y	67.1	Low	72.8	Confident	46 Å²	46	79 Å²	79	18%	0.18	40%	0.403	C	S	.	.	H	α-helix	trans	-85.1	-26.4	178.1	-61.6	-70.3	0	0	0	112.2	P210 K211 Y215 R218 N219 I223	P210-Y221 HydrophobicContact CB-CD1 4.44Å; K211-Y221 HydrophobicContact CB-CE2 4.43Å; Y215-Y221 AromaticContact CD1-CE2 3.99Å; Y215-Y221 HydrophobicContact CD1-CE2 3.99Å; Y215-Y221 WeakPolarHBondContact O-CD2 3.33Å; R218-Y221 HydrophobicContact CB-CD2 4.03Å; R218-Y221 HydrophobicContact CB-CE2 4.42Å; R218-Y221 PolarHBondContact O-N 3.05Å; N219-Y221 PolarHBondContact O-N 3.36Å; N219-Y221 VanDerWaalsContact O-N 3.14Å; Y221-I223 VanDerWaalsContact C-N 3.35Å
222	Q	71.7	Confident	73.6	Confident	58 Å²	58	76.7 Å²	76.7	27%	0.271	40%	0.398	S	S	.	.	H	α-helix	trans	-73.5	-26.6	174.7	-63.8	-172.7	-0.3	0	0	112.5	L217 R218 N219 L224 S225 K226	L217-Q222 PolarHBondContact O-NE2 3.27Å; R218-Q222 PolarHBondContact O-N 3.21Å; N219-Q222 PolarHBondContact O-N 3.08Å; Q222-L224 VanDerWaalsContact C-N 3.34Å; Q222-L224 PolarHBondContact O-N 3.19Å; Q222-S225 PolarHBondContact O-N 2.98Å; Q222-K226 HydrophobicContact CB-CD 4.45Å; Q222-K226 WeakPolarHBondContact O-CB 3.47Å; Q222-K226 VanDerWaalsContact O-CG 3.29Å; Q222-K226 WeakPolarHBondContact O-CG 3.29Å; Q222-K226 PolarHBondContact O-N 2.77Å; Q222-K226 VanDerWaalsContact OE1-CE 3.3Å
223	I	73.5	Confident	73.8	Confident	69 Å²	69	78.4 Å²	78.4	35%	0.354	38%	0.384	S	S	.	.	H	α-helix	trans	-55.1	-48.2	-176.8	-69.4	166.2	0	0	0	111.3	N219 Y221 S225 K226 I227	N219-I223 WeakPolarHBondContact O-CG1 3.34Å; N219-I223 PolarHBondContact O-N 3.35Å; Y221-I223 VanDerWaalsContact C-N 3.35Å; I223-S225 PolarHBondContact O-N 3.11Å; I223-K226 PolarHBondContact O-N 3.25Å; I223-I227 HydrophobicContact CG2-CD1 3.66Å; I223-I227 HydrophobicContact CG2-CG1 4.23Å; I223-I227 WeakPolarHBondContact O-CG1 3.31Å; I223-I227 PolarHBondContact O-N 2.85Å
224	L	68.9	Low	73.8	Confident	62 Å²	62	76.7 Å²	76.7	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-60.8	-44.8	179.5	-67.6	175.2	0	0	0	112.3	L193 Q222 K226 I227 R228	L193-L224 HydrophobicContact CD1-CD2 4.12Å; Q222-L224 VanDerWaalsContact C-N 3.34Å; Q222-L224 PolarHBondContact O-N 3.19Å; L224-K226 VanDerWaalsContact C-N 3.32Å; L224-K226 PolarHBondContact O-N 2.98Å; L224-I227 PolarHBondContact O-N 2.87Å; L224-R228 PolarHBondContact O-N 3.3Å; L224-R228 VanDerWaalsContact O-N 3.1Å
225	S	71.8	Confident	73.8	Confident	58 Å²	58	75.8 Å²	75.8	41%	0.406	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-40	176.5	175	0	0	0	0	111.9	Q222 I223 R228 Q229	Q222-S225 PolarHBondContact O-N 2.98Å; I223-S225 PolarHBondContact O-N 3.11Å; S225-R228 PolarHBondContact O-N 3.45Å; S225-Q229 WeakPolarHBondContact O-CG 3.35Å; S225-Q229 PolarHBondContact O-N 3.08Å
226	K	78.9	Confident	74	Confident	48 Å²	48	78.8 Å²	78.8	21%	0.209	37%	0.371	C	S	.	.	H	α-helix	trans	-70.4	-42.3	178.8	-70.4	-177	-173.8	170.4	0	112.5	Q222 I223 L224 R228 Q229 G230 M231 M240	Q222-K226 HydrophobicContact CB-CD 4.45Å; Q222-K226 WeakPolarHBondContact O-CB 3.47Å; Q222-K226 VanDerWaalsContact O-CG 3.29Å; Q222-K226 WeakPolarHBondContact O-CG 3.29Å; Q222-K226 PolarHBondContact O-N 2.77Å; Q222-K226 VanDerWaalsContact OE1-CE 3.3Å; I223-K226 PolarHBondContact O-N 3.25Å; L224-K226 VanDerWaalsContact C-N 3.32Å; L224-K226 PolarHBondContact O-N 2.98Å; K226-R228 VanDerWaalsContact C-N 3.27Å; K226-R228 PolarHBondContact O-N 2.79Å; K226-Q229 PolarHBondContact O-N 3.12Å; K226-G230 PolarHBondContact O-N 3.2Å; K226-M231 HydrophobicContact CB-CB 4.11Å; K226-M231 HydrophobicContact CB-CG 4.23Å; K226-M231 HydrophobicContact CB-SD 3.66Å; K226-M231 HydrophobicContact CD-SD 3.75Å; K226-M231 HydrophobicContact CG-SD 3.56Å; K226-M231 VanDerWaalsContact CG-SD 3.56Å; K226-M231 VanDerWaalsContact O-CB 3.24Å; K226-M231 WeakPolarHBondContact O-CB 3.18Å; K226-M231 PolarHBondContact O-N 3.23Å; K226-M240 HydrophobicContact CB-CB 4.06Å; K226-M240 HydrophobicContact CB-CE 4.03Å; K226-M240 HydrophobicContact CB-CG 4.12Å; K226-M240 HydrophobicContact CD-CB 3.62Å; K226-M240 HydrophobicContact CD-CG 3.99Å; K226-M240 HydrophobicContact CG-CB 4.43Å
227	I	77.9	Confident	74.5	Confident	34 Å²	34	78.5 Å²	78.5	17%	0.174	37%	0.368	C	S	.	.	H	α-helix	trans	-57.3	-44.5	173.9	-69.9	169.4	0	0	0	109.9	I190 I223 L224 G230 M240	I190-I227 HydrophobicContact CG2-CG2 4.24Å; I223-I227 HydrophobicContact CG2-CD1 3.66Å; I223-I227 HydrophobicContact CG2-CG1 4.23Å; I223-I227 WeakPolarHBondContact O-CG1 3.31Å; I223-I227 PolarHBondContact O-N 2.85Å; L224-I227 PolarHBondContact O-N 2.87Å; I227-G230 WeakPolarHBondContact O-CA 3.03Å; I227-G230 PolarHBondContact O-N 3.05Å; I227-M240 HydrophobicContact CB-CE 4.45Å; I227-M240 HydrophobicContact CG1-CE 3.56Å
228	R	66.6	Low	74.9	Confident	77 Å²	77	77.1 Å²	77.1	29%	0.291	37%	0.367	S	S	.	.	H	α-helix	trans	-65.4	-38.1	177.1	-176.2	178.7	-106.8	-164.2	-10.3	113.2	D198 Y204 L224 S225 K226 G230	D198-R228 VanDerWaalsContact CG-NH1 3.3Å; D198-R228 IonicContact OD1-CZ 3.04Å; D198-R228 IonicContact OD1-NH1 2.71Å; D198-R228 PolarHBondContact OD1-NH1 2.89Å; D198-R228 IonicContact OD1-NH2 2.66Å; D198-R228 PolarHBondContact OD1-NH2 3.23Å; D198-R228 IonicContact OD2-CZ 3.71Å; D198-R228 IonicContact OD2-NH1 3.07Å; D198-R228 PolarHBondContact OD2-NH1 2.87Å; Y204-R228 PolarHBondContact OH-NH1 2.82Å; L224-R228 PolarHBondContact O-N 3.3Å; L224-R228 VanDerWaalsContact O-N 3.1Å; S225-R228 PolarHBondContact O-N 3.45Å; K226-R228 VanDerWaalsContact C-N 3.27Å; K226-R228 PolarHBondContact O-N 2.79Å; R228-G230 PolarHBondContact O-N 3.28Å
229	Q	73.7	Confident	75.3	Confident	110 Å²	110	78.3 Å²	78.3	51%	0.514	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-0.5	170.5	-72.7	172.9	-3.1	0	0	113.5	S225 K226 M231	S225-Q229 WeakPolarHBondContact O-CG 3.35Å; S225-Q229 PolarHBondContact O-N 3.08Å; K226-Q229 PolarHBondContact O-N 3.12Å; Q229-M231 VanDerWaalsContact C-N 3.32Å; Q229-M231 HydrophobicContact CB-CG 4.46Å
230	G	74.5	Confident	75.9	Confident	11 Å²	11	73.8 Å²	73.8	11%	0.113	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	19.3	-177.8	0	0	0	0	0	113.5	K226 I227 R228 P243	K226-G230 PolarHBondContact O-N 3.2Å; I227-G230 WeakPolarHBondContact O-CA 3.03Å; I227-G230 PolarHBondContact O-N 3.05Å; R228-G230 PolarHBondContact O-N 3.28Å; G230-P243 VanDerWaalsContact O-CD 3.26Å; G230-P243 WeakPolarHBondContact O-CD 3.46Å
231	M	84.4	Confident	76.8	Confident	33 Å²	33	68.2 Å²	68.2	16%	0.163	33%	0.328	C	S	.	.			trans	-71.7	146.2	168.5	-60.5	-172.3	175.7	0	0	110.1	K226 Q229 M240 V241 H242	K226-M231 HydrophobicContact CB-CB 4.11Å; K226-M231 HydrophobicContact CB-CG 4.23Å; K226-M231 HydrophobicContact CB-SD 3.66Å; K226-M231 HydrophobicContact CD-SD 3.75Å; K226-M231 HydrophobicContact CG-SD 3.56Å; K226-M231 VanDerWaalsContact CG-SD 3.56Å; K226-M231 VanDerWaalsContact O-CB 3.24Å; K226-M231 WeakPolarHBondContact O-CB 3.18Å; K226-M231 PolarHBondContact O-N 3.23Å; Q229-M231 VanDerWaalsContact C-N 3.32Å; Q229-M231 HydrophobicContact CB-CG 4.46Å; M231-M240 HydrophobicContact CB-CB 4.14Å; M231-M240 HydrophobicContact CB-CE 3.85Å; M231-M240 WeakPolarHBondContact O-CE 3.4Å; M231-M240 HydrophobicContact SD-CB 4.15Å; M231-V241 CarbonylContact C-O 3.31Å; M231-V241 WeakPolarHBondContact CA-O 3.48Å; M231-H242 WeakPolarHBondContact CE-NE2 3.48Å
232	V	82.3	Confident	77.6	Confident	66 Å²	66	69.5 Å²	69.5	40%	0.4	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.9	177.5	-179.1	0	0	0	0	108.3	D234 M240 V241 P243	V232-D234 PolarHBondContact O-N 3.42Å; V232-M240 WeakPolarHBondContact O-CA 3.43Å; V232-V241 PolarHBondContact N-O 3.21Å; V232-V241 PolarHBondContact O-N 2.67Å; V232-P243 HydrophobicContact CG2-CG 4Å
233	W	81.7	Confident	78.1	Confident	131 Å²	131	69.3 Å²	69.3	50%	0.496	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	123.9	172.8	176.4	-104.5	0	0	0	109.7	P235 S238 M240	W233-P235 WeakPolarHBondContact O-CD 3.41Å; W233-S238 WeakPolarHBondContact CH2-O 3.44Å; W233-S238 WeakPolarHBondContact CZ3-O 3.22Å; W233-M240 HydrophobicContact CB-SD 3.98Å; W233-M240 HydrophobicContact CE3-CG 4.34Å; W233-M240 HydrophobicContact CE3-SD 4.01Å
234	D	80.3	Confident	78.5	Confident	5 Å²	5	77.3 Å²	77.3	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112.1	170.7	-172.1	-19.8	0	0	0	109.3	V232 Y236 Y237 S238 R239 V241 Q250	V232-D234 PolarHBondContact O-N 3.42Å; D234-Y236 VanDerWaalsContact C-N 3.28Å; D234-Y236 PolarHBondContact O-N 3.36Å; D234-Y236 VanDerWaalsContact OD1-CB 3.32Å; D234-Y236 WeakPolarHBondContact OD1-CB 3.35Å; D234-Y236 PolarHBondContact OD1-N 3Å; D234-Y237 WeakPolarHBondContact OD2-CD2 3.45Å; D234-S238 VanDerWaalsContact O-CA 3.28Å; D234-S238 WeakPolarHBondContact O-CA 3.18Å; D234-S238 PolarHBondContact O-N 3.04Å; D234-R239 WeakPolarHBondContact CB-O 3.17Å; D234-R239 PolarHBondContact N-O 3.1Å; D234-R239 PolarHBondContact O-N 3.45Å; D234-V241 HydrophobicContact CB-CG2 3.9Å; D234-Q250 PolarHBondContact OD1-NE2 3.18Å; D234-Q250 VanDerWaalsContact OD1-NE2 3.07Å; D234-Q250 PolarHBondContact OD2-NE2 2.95Å; D234-Q250 PolarHBondContact OD2-OE1 2.79Å
235	P	78.1	Confident	79.2	Confident	88 Å²	88	80 Å²	80	57%	0.571	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-34	177.6	-18.9	31.3	0	0	0	112.9	W233	W233-P235 WeakPolarHBondContact O-CD 3.41Å
236	Y	78.3	Confident	79.7	Confident	153 Å²	153	78.6 Å²	78.6	60%	0.6	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-46.5	-173.5	-176.5	-96.1	0	0	0	111.7	D234 W249	D234-Y236 VanDerWaalsContact C-N 3.28Å; D234-Y236 PolarHBondContact O-N 3.36Å; D234-Y236 VanDerWaalsContact OD1-CB 3.32Å; D234-Y236 WeakPolarHBondContact OD1-CB 3.35Å; D234-Y236 PolarHBondContact OD1-N 3Å; Y236-W249 HydrophobicContact CD1-CZ2 4.35Å; Y236-W249 AromaticContact CD2-CH2 3.76Å; Y236-W249 HydrophobicContact CD2-CH2 3.76Å; Y236-W249 HydrophobicContact CD2-CZ2 4.19Å; Y236-W249 HydrophobicContact CE1-CZ2 4.46Å; Y236-W249 HydrophobicContact CE2-CH2 4.11Å; Y236-W249 HydrophobicContact CE2-CZ2 4.29Å; Y236-W249 HydrophobicContact CG-CH2 4.04Å; Y236-W249 HydrophobicContact CG-CZ2 4.22Å
237	Y	80.2	Confident	80	Confident	115 Å²	115	77.7 Å²	77.7	45%	0.451	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-1	177.2	-64	-62.5	0	0	0	113.7	D234 R239	D234-Y237 WeakPolarHBondContact OD2-CD2 3.45Å; Y237-R239 PolarHBondContact O-N 3.22Å
238	S	78	Confident	80.3	Confident	80 Å²	80	84.4 Å²	84.4	56%	0.559	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	44.2	-175.7	-66.6	0	0	0	0	113.1	W233 D234	W233-S238 WeakPolarHBondContact CH2-O 3.44Å; W233-S238 WeakPolarHBondContact CZ3-O 3.22Å; D234-S238 VanDerWaalsContact O-CA 3.28Å; D234-S238 WeakPolarHBondContact O-CA 3.18Å; D234-S238 PolarHBondContact O-N 3.04Å
239	R	80.5	Confident	81.2	Confident	146 Å²	146	86.5 Å²	86.5	55%	0.551	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.5	-179.3	69.6	-173.9	-178.1	170	-1.2	111.5	D234 Y237 V241	D234-R239 WeakPolarHBondContact CB-O 3.17Å; D234-R239 PolarHBondContact N-O 3.1Å; D234-R239 PolarHBondContact O-N 3.45Å; Y237-R239 PolarHBondContact O-N 3.22Å; R239-V241 HydrophobicContact CG-CG2 3.76Å
240	M	81.6	Confident	81.7	Confident	24 Å²	24	81.7 Å²	81.7	12%	0.118	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130.1	172.7	-64.4	-67.2	-68.9	0	0	109.9	K226 I227 M231 V232 W233	K226-M240 HydrophobicContact CB-CB 4.06Å; K226-M240 HydrophobicContact CB-CE 4.03Å; K226-M240 HydrophobicContact CB-CG 4.12Å; K226-M240 HydrophobicContact CD-CB 3.62Å; K226-M240 HydrophobicContact CD-CG 3.99Å; K226-M240 HydrophobicContact CG-CB 4.43Å; I227-M240 HydrophobicContact CB-CE 4.45Å; I227-M240 HydrophobicContact CG1-CE 3.56Å; M231-M240 HydrophobicContact CB-CB 4.14Å; M231-M240 HydrophobicContact CB-CE 3.85Å; M231-M240 WeakPolarHBondContact O-CE 3.4Å; M231-M240 HydrophobicContact SD-CB 4.15Å; V232-M240 WeakPolarHBondContact O-CA 3.43Å; W233-M240 HydrophobicContact CB-SD 3.98Å; W233-M240 HydrophobicContact CE3-CG 4.34Å; W233-M240 HydrophobicContact CE3-SD 4.01Å
241	V	83	Confident	82	Confident	18 Å²	18	84.6 Å²	84.6	11%	0.109	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	145.5	-176.5	-172.8	0	0	0	0	109.4	M231 V232 D234 R239 N245	M231-V241 CarbonylContact C-O 3.31Å; M231-V241 WeakPolarHBondContact CA-O 3.48Å; V232-V241 PolarHBondContact N-O 3.21Å; V232-V241 PolarHBondContact O-N 2.67Å; D234-V241 HydrophobicContact CB-CG2 3.9Å; R239-V241 HydrophobicContact CG-CG2 3.76Å; V241-N245 HydrophobicContact CG1-CB 3.53Å
242	H	83.4	Confident	81.9	Confident	73 Å²	73	87.2 Å²	87.2	34%	0.338	40%	0.4	S	S	.	.			trans	-65.8	141	168.5	-78.4	-63.8	0	0	0	110.1	M231 R244 N245	M231-H242 WeakPolarHBondContact CE-NE2 3.48Å; H242-R244 PolarHBondContact O-N 3.29Å; H242-N245 PolarHBondContact O-N 3.1Å
243	P	83.1	Confident	82.1	Confident	55 Å²	55	90.5 Å²	90.5	36%	0.357	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-51.5	-30.7	179.2	-29.1	34.3	0	0	0	114.7	G230 V232 N245 K246 H251	G230-P243 VanDerWaalsContact O-CD 3.26Å; G230-P243 WeakPolarHBondContact O-CD 3.46Å; V232-P243 HydrophobicContact CG2-CG 4Å; P243-N245 VanDerWaalsContact C-N 3.35Å; P243-K246 VanDerWaalsContact O-CB 3.31Å; P243-K246 WeakPolarHBondContact O-CB 3.11Å; P243-K246 PolarHBondContact O-N 3.2Å; P243-H251 PolarHBondContact O-NE2 2.74Å; P243-H251 VanDerWaalsContact O-NE2 3.1Å
244	R	81	Confident	82.1	Confident	236 Å²	236	88.5 Å²	88.5	89%	0.891	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-68.8	-26.7	176.5	-64.2	-177.3	-179.7	175.1	-0.4	114.5	H242	H242-R244 PolarHBondContact O-N 3.29Å
245	N	83.9	Confident	82.2	Confident	120 Å²	120	93.9 Å²	93.9	64%	0.642	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-94.7	0.1	-178.3	-63.9	-4.2	0	0	0	112.1	V241 H242 P243	V241-N245 HydrophobicContact CG1-CB 3.53Å; H242-N245 PolarHBondContact O-N 3.1Å; P243-N245 VanDerWaalsContact C-N 3.35Å
246	K	83.3	Confident	82.6	Confident	27 Å²	27	95 Å²	95	12%	0.117	43%	0.428	C	S	.	.	S	Bend	trans	-70.7	137.7	175.1	-161.9	175.6	-172.7	164.6	0	108.7	P243 Q250 E254	P243-K246 VanDerWaalsContact O-CB 3.31Å; P243-K246 WeakPolarHBondContact O-CB 3.11Å; P243-K246 PolarHBondContact O-N 3.2Å; K246-Q250 HydrophobicContact CD-CB 4.21Å; K246-Q250 HydrophobicContact CG-CB 3.88Å; K246-Q250 HydrophobicContact CG-CG 4.5Å; K246-E254 IonicContact NZ-OE1 2.58Å; K246-E254 PolarHBondContact NZ-OE1 3.42Å; K246-E254 IonicContact NZ-OE2 2.68Å; K246-E254 PolarHBondContact NZ-OE2 3.05Å
247	A	83.7	Confident	82.9	Confident	30 Å²	30	91.8 Å²	91.8	25%	0.248	42%	0.419	C	S	.	.			trans	-67.3	143.7	-179.3	0	0	0	0	0	110	W249 Q250 H251	A247-W249 VanDerWaalsContact C-N 3.29Å; A247-W249 HydrophobicContact CB-CG 4.43Å; A247-W249 VanDerWaalsContact CB-NE1 3.33Å; A247-W249 PolarHBondContact O-N 3.24Å; A247-Q250 HydrophobicContact CB-CG 4.22Å; A247-Q250 WeakPolarHBondContact O-CB 3.39Å; A247-Q250 PolarHBondContact O-N 3.03Å; A247-H251 PolarHBondContact O-N 3.42Å
248	Y	83.8	Confident	83	Confident	175 Å²	175	92.5 Å²	92.5	69%	0.686	42%	0.424	S	S	*	.	H	α-helix	trans	-52.6	-45	-175.8	-178.5	-101.9	0	0	0	113.1	Q250 H251 E252	Y248-Q250 PolarHBondContact O-N 3.32Å; Y248-H251 WeakPolarHBondContact O-CB 3.48Å; Y248-H251 PolarHBondContact O-N 3.05Å; Y248-E252 HydrophobicContact CD1-CG 4.22Å; Y248-E252 HydrophobicContact CE1-CG 3.84Å; Y248-E252 WeakPolarHBondContact CE1-OE1 3.36Å; Y248-E252 PolarHBondContact O-N 3.47Å; Y248-E252 VanDerWaalsContact O-N 3.13Å
249	W	85.7	Confident	83.3	Confident	120 Å²	120	94.7 Å²	94.7	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-60.9	-27.1	178.2	69.2	-97.4	0	0	0	113.7	Y236 A247 Y253	Y236-W249 HydrophobicContact CD1-CZ2 4.35Å; Y236-W249 AromaticContact CD2-CH2 3.76Å; Y236-W249 HydrophobicContact CD2-CH2 3.76Å; Y236-W249 HydrophobicContact CD2-CZ2 4.19Å; Y236-W249 HydrophobicContact CE1-CZ2 4.46Å; Y236-W249 HydrophobicContact CE2-CH2 4.11Å; Y236-W249 HydrophobicContact CE2-CZ2 4.29Å; Y236-W249 HydrophobicContact CG-CH2 4.04Å; Y236-W249 HydrophobicContact CG-CZ2 4.22Å; A247-W249 VanDerWaalsContact C-N 3.29Å; A247-W249 HydrophobicContact CB-CG 4.43Å; A247-W249 VanDerWaalsContact CB-NE1 3.33Å; A247-W249 PolarHBondContact O-N 3.24Å; W249-Y253 WeakPolarHBondContact O-CB 3.21Å; W249-Y253 PolarHBondContact O-N 3.46Å
250	Q	85.4	Confident	83.5	Confident	9 Å²	9	94 Å²	94	4%	0.042	42%	0.424	C	S	.	.	H	α-helix	trans	-72.8	-35.4	177.1	-63.9	173.8	-44.4	0	0	111	D234 K246 A247 Y248 Y253 E254	D234-Q250 PolarHBondContact OD1-NE2 3.18Å; D234-Q250 VanDerWaalsContact OD1-NE2 3.07Å; D234-Q250 PolarHBondContact OD2-NE2 2.95Å; D234-Q250 PolarHBondContact OD2-OE1 2.79Å; K246-Q250 HydrophobicContact CD-CB 4.21Å; K246-Q250 HydrophobicContact CG-CB 3.88Å; K246-Q250 HydrophobicContact CG-CG 4.5Å; A247-Q250 HydrophobicContact CB-CG 4.22Å; A247-Q250 WeakPolarHBondContact O-CB 3.39Å; A247-Q250 PolarHBondContact O-N 3.03Å; Y248-Q250 PolarHBondContact O-N 3.32Å; Q250-Y253 PolarHBondContact O-N 2.86Å; Q250-E254 PolarHBondContact O-N 3.34Å; Q250-E254 VanDerWaalsContact O-N 3.08Å
251	H	79.5	Confident	83.2	Confident	73 Å²	73	98.8 Å²	98.8	34%	0.338	45%	0.45	S	S	.	.	H	α-helix	trans	-66.5	-46.4	172.7	-77.7	-66.9	0	0	0	110.7	P243 A247 Y248 Y253 E254 E255	P243-H251 PolarHBondContact O-NE2 2.74Å; P243-H251 VanDerWaalsContact O-NE2 3.1Å; A247-H251 PolarHBondContact O-N 3.42Å; Y248-H251 WeakPolarHBondContact O-CB 3.48Å; Y248-H251 PolarHBondContact O-N 3.05Å; H251-Y253 VanDerWaalsContact C-N 3.26Å; H251-Y253 PolarHBondContact O-N 3.11Å; H251-E254 PolarHBondContact O-N 3.22Å; H251-E254 VanDerWaalsContact O-N 3.17Å; H251-E255 WeakPolarHBondContact O-CG 3.4Å; H251-E255 PolarHBondContact O-N 3.42Å
252	E	83.8	Confident	82.9	Confident	88 Å²	88	101.8 Å²	101.8	41%	0.411	46%	0.463	S	S	.	.	H	α-helix	trans	-56.8	-42.2	174.7	-70.2	-173.9	137	0	0	111.8	Y248 E255 L256	Y248-E252 HydrophobicContact CD1-CG 4.22Å; Y248-E252 HydrophobicContact CE1-CG 3.84Å; Y248-E252 WeakPolarHBondContact CE1-OE1 3.36Å; Y248-E252 PolarHBondContact O-N 3.47Å; Y248-E252 VanDerWaalsContact O-N 3.13Å; E252-E255 PolarHBondContact O-N 3.19Å; E252-L256 WeakPolarHBondContact O-CB 3.49Å; E252-L256 VanDerWaalsContact O-CG 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.23Å; E252-L256 PolarHBondContact O-N 3.36Å
253	Y	85.6	Confident	82.5	Confident	135 Å²	135	101.6 Å²	101.6	53%	0.529	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-44.2	177.3	-175.4	-95.7	0	0	0	112.5	W249 Q250 H251 L256 Q257	W249-Y253 WeakPolarHBondContact O-CB 3.21Å; W249-Y253 PolarHBondContact O-N 3.46Å; Q250-Y253 PolarHBondContact O-N 2.86Å; H251-Y253 VanDerWaalsContact C-N 3.26Å; H251-Y253 PolarHBondContact O-N 3.11Å; Y253-L256 PolarHBondContact O-N 3.18Å; Y253-Q257 HydrophobicContact CD1-CG 4.17Å; Y253-Q257 HydrophobicContact CE1-CG 3.81Å; Y253-Q257 WeakPolarHBondContact O-CG 2.99Å; Y253-Q257 PolarHBondContact O-N 3.33Å; Y253-Q257 PolarHBondContact OH-NE2 3.49Å
254	E	81.8	Confident	81.9	Confident	88 Å²	88	104.1 Å²	104.1	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-39.3	176.6	-78	-178.6	168.4	0	0	112.5	K246 Q250 H251 Q257 K258	K246-E254 IonicContact NZ-OE1 2.58Å; K246-E254 PolarHBondContact NZ-OE1 3.42Å; K246-E254 IonicContact NZ-OE2 2.68Å; K246-E254 PolarHBondContact NZ-OE2 3.05Å; Q250-E254 PolarHBondContact O-N 3.34Å; Q250-E254 VanDerWaalsContact O-N 3.08Å; H251-E254 PolarHBondContact O-N 3.22Å; H251-E254 VanDerWaalsContact O-N 3.17Å; E254-Q257 PolarHBondContact O-N 3.43Å; E254-K258 WeakPolarHBondContact O-CB 3.2Å; E254-K258 PolarHBondContact O-N 3.24Å
255	E	82.2	Confident	80.8	Confident	118 Å²	118	94 Å²	94	55%	0.551	45%	0.449	S	S	*	.	H	α-helix	trans	-63.6	-40.7	173.6	-73.7	-172.1	170.4	0	0	112	H251 E252 K258 K259	H251-E255 WeakPolarHBondContact O-CG 3.4Å; H251-E255 PolarHBondContact O-N 3.42Å; E252-E255 PolarHBondContact O-N 3.19Å; E255-K258 PolarHBondContact O-N 3.34Å; E255-K259 WeakPolarHBondContact O-CB 3.48Å; E255-K259 WeakPolarHBondContact O-CG 3.39Å; E255-K259 PolarHBondContact O-N 2.9Å
256	L	87.4	Confident	79.2	Confident	112 Å²	112	93.2 Å²	93.2	59%	0.586	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-42.2	174.6	-74	172.7	0	0	0	111.8	E252 Y253 K259 K260	E252-L256 WeakPolarHBondContact O-CB 3.49Å; E252-L256 VanDerWaalsContact O-CG 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.23Å; E252-L256 PolarHBondContact O-N 3.36Å; Y253-L256 PolarHBondContact O-N 3.18Å; L256-K259 PolarHBondContact O-N 3.39Å; L256-K260 VanDerWaalsContact O-CB 3.31Å; L256-K260 WeakPolarHBondContact O-CB 3.36Å; L256-K260 PolarHBondContact O-N 2.95Å
257	Q	85	Confident	77.8	Confident	86 Å²	86	98.8 Å²	98.8	40%	0.402	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-43.6	174.2	-72.2	-67.9	-26	0	0	111.3	Y253 E254 K260 L261	Y253-Q257 HydrophobicContact CD1-CG 4.17Å; Y253-Q257 HydrophobicContact CE1-CG 3.81Å; Y253-Q257 WeakPolarHBondContact O-CG 2.99Å; Y253-Q257 PolarHBondContact O-N 3.33Å; Y253-Q257 PolarHBondContact OH-NE2 3.49Å; E254-Q257 PolarHBondContact O-N 3.43Å; Q257-K260 WeakPolarHBondContact O-CB 3.02Å; Q257-K260 PolarHBondContact O-N 3.35Å; Q257-L261 WeakPolarHBondContact O-CB 3.33Å; Q257-L261 PolarHBondContact O-N 3.02Å
258	K	81	Confident	76.3	Confident	130 Å²	130	103.8 Å²	103.8	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-63.2	-46.5	177.2	-166.4	-173.8	180	-158	0	111.4	E254 E255 K260 L261 E262	E254-K258 WeakPolarHBondContact O-CB 3.2Å; E254-K258 PolarHBondContact O-N 3.24Å; E255-K258 PolarHBondContact O-N 3.34Å; K258-K260 VanDerWaalsContact C-N 3.3Å; K258-K260 PolarHBondContact O-N 3.48Å; K258-L261 CarbonylContact O-C 3.51Å; K258-L261 WeakPolarHBondContact O-CB 3.35Å; K258-L261 PolarHBondContact O-N 3.13Å; K258-L261 VanDerWaalsContact O-N 3.1Å; K258-E262 WeakPolarHBondContact CE-OE1 3.47Å; K258-E262 IonicContact NZ-OE1 3.56Å; K258-E262 WeakPolarHBondContact O-CB 3.41Å; K258-E262 WeakPolarHBondContact O-CG 3.21Å; K258-E262 PolarHBondContact O-N 3.23Å
259	K	84.8	Confident	74.4	Confident	126 Å²	126	101.9 Å²	101.9	55%	0.548	49%	0.493	S	S	.	.	H	α-helix	trans	-59.1	-39.2	173.9	-78.4	175	178.8	169.2	0	112.5	E255 L256 E262 S263	E255-K259 WeakPolarHBondContact O-CB 3.48Å; E255-K259 WeakPolarHBondContact O-CG 3.39Å; E255-K259 PolarHBondContact O-N 2.9Å; L256-K259 PolarHBondContact O-N 3.39Å; K259-E262 PolarHBondContact O-N 2.83Å; K259-S263 WeakPolarHBondContact O-CB 3.1Å; K259-S263 PolarHBondContact O-N 3Å; K259-S263 PolarHBondContact O-OG 3.29Å
260	K	84.3	Confident	72.5	Confident	130 Å²	130	101.8 Å²	101.8	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-66.3	-37	175.1	-174.3	-179.8	-179	-177.6	0	112.1	L256 Q257 K258 S263 L264	L256-K260 VanDerWaalsContact O-CB 3.31Å; L256-K260 WeakPolarHBondContact O-CB 3.36Å; L256-K260 PolarHBondContact O-N 2.95Å; Q257-K260 WeakPolarHBondContact O-CB 3.02Å; Q257-K260 PolarHBondContact O-N 3.35Å; K258-K260 VanDerWaalsContact C-N 3.3Å; K258-K260 PolarHBondContact O-N 3.48Å; K260-S263 PolarHBondContact O-OG 3.4Å; K260-L264 WeakPolarHBondContact O-CD1 3.39Å; K260-L264 PolarHBondContact O-N 3.45Å
261	L	76.1	Confident	70.5	Confident	126 Å²	126	109.9 Å²	109.9	66%	0.66	55%	0.549	S	S	*	.	H	α-helix	trans	-71.7	-40.4	174.8	-161.2	97	0	0	0	111.4	Q257 K258 L264 G265	Q257-L261 WeakPolarHBondContact O-CB 3.33Å; Q257-L261 PolarHBondContact O-N 3.02Å; K258-L261 CarbonylContact O-C 3.51Å; K258-L261 WeakPolarHBondContact O-CB 3.35Å; K258-L261 PolarHBondContact O-N 3.13Å; K258-L261 VanDerWaalsContact O-N 3.1Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 3.14Å; L261-G265 PolarHBondContact O-N 3.4Å
262	E	75.5	Confident	68.7	Low	80 Å²	80	114.7 Å²	114.7	37%	0.374	57%	0.571	S	S	.	*	H	α-helix	trans	-62.8	-42.6	174.9	-75.5	169.2	178.7	0	0	110.9	K258 K259 L264 G265 D266	K258-E262 WeakPolarHBondContact CE-OE1 3.47Å; K258-E262 IonicContact NZ-OE1 3.56Å; K258-E262 WeakPolarHBondContact O-CB 3.41Å; K258-E262 WeakPolarHBondContact O-CG 3.21Å; K258-E262 PolarHBondContact O-N 3.23Å; K259-E262 PolarHBondContact O-N 2.83Å; E262-L264 VanDerWaalsContact C-N 3.3Å; E262-L264 PolarHBondContact O-N 2.91Å; E262-G265 CarbonylContact O-C 3.59Å; E262-G265 WeakPolarHBondContact O-CA 3.39Å; E262-G265 PolarHBondContact O-N 2.98Å; E262-D266 VanDerWaalsContact O-CG 3.24Å; E262-D266 PolarHBondContact O-N 2.88Å
263	S	76.6	Confident	66.7	Low	70 Å²	70	116.8 Å²	116.8	49%	0.49	59%	0.592	S	S	.	*	H	α-helix	trans	-67.3	-28.7	175.3	69.1	0	0	0	0	113.6	K259 K260	K259-S263 WeakPolarHBondContact O-CB 3.1Å; K259-S263 PolarHBondContact O-N 3Å; K259-S263 PolarHBondContact O-OG 3.29Å; K260-S263 PolarHBondContact O-OG 3.4Å
264	L	70.6	Confident	65.2	Low	107 Å²	107	117 Å²	117	56%	0.56	61%	0.607	S	S	*	*	H	α-helix	trans	-68.4	-36.8	167.1	-89.2	154.2	0	0	0	111.6	K260 L261 E262	K260-L264 WeakPolarHBondContact O-CD1 3.39Å; K260-L264 PolarHBondContact O-N 3.45Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 3.14Å; E262-L264 VanDerWaalsContact C-N 3.3Å; E262-L264 PolarHBondContact O-N 2.91Å
265	G	56.1	Low	63.3	Low	24 Å²	24	121.9 Å²	121.9	25%	0.247	63%	0.627	C	S	.	*	H	α-helix	trans	-76.1	-28.7	179	0	0	0	0	0	114.2	L261 E262 L267 N268	L261-G265 PolarHBondContact O-N 3.4Å; E262-G265 CarbonylContact O-C 3.59Å; E262-G265 WeakPolarHBondContact O-CA 3.39Å; E262-G265 PolarHBondContact O-N 2.98Å; G265-L267 PolarHBondContact O-N 2.95Å; G265-L267 VanDerWaalsContact O-N 3.17Å; G265-N268 WeakPolarHBondContact O-CA 3.48Å; G265-N268 PolarHBondContact O-N 2.89Å
266	D	52.1	Low	62	Low	103 Å²	103	121.9 Å²	121.9	55%	0.551	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-13.6	177.8	-68.3	-18.6	0	0	0	112.6	E262 N268 K269	E262-D266 VanDerWaalsContact O-CG 3.24Å; E262-D266 PolarHBondContact O-N 2.88Å; D266-N268 PolarHBondContact O-N 2.62Å; D266-K269 WeakPolarHBondContact OD1-CD 3.47Å; D266-K269 IonicContact OD1-NZ 3.27Å; D266-K269 PolarHBondContact OD1-NZ 3.48Å
267	L	52.5	Low	60.7	Low	144 Å²	144	124.2 Å²	124.2	75%	0.754	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-17.1	165.5	-71.1	164.6	0	0	0	113.2	G265	G265-L267 PolarHBondContact O-N 2.95Å; G265-L267 VanDerWaalsContact O-N 3.17Å
268	N	51.8	Low	60.1	Low	136 Å²	136	123.5 Å²	123.5	73%	0.727	65%	0.648	S	S	*	*	S	Bend	trans	-115.7	1.1	-174.5	-67.9	-11.9	0	0	0	114.6	G265 D266	G265-N268 WeakPolarHBondContact O-CA 3.48Å; G265-N268 PolarHBondContact O-N 2.89Å; D266-N268 PolarHBondContact O-N 2.62Å
269	K	45	Very low	59.2	Low	134 Å²	134	120.5 Å²	120.5	58%	0.583	64%	0.642	S	S	*	*			trans	-103.7	48	-169.2	-68.1	179.5	-165	155.5	0	115.3	D266 E271	D266-K269 WeakPolarHBondContact OD1-CD 3.47Å; D266-K269 IonicContact OD1-NZ 3.27Å; D266-K269 PolarHBondContact OD1-NZ 3.48Å; K269-E271 VanDerWaalsContact C-N 3.29Å; K269-E271 PolarHBondContact O-N 3.35Å
270	S	45.1	Very low	58.8	Low	118 Å²	118	119.4 Å²	119.4	83%	0.825	65%	0.65	S	S	*	*			trans	-88.7	20	170.8	59	0	0	0	0	114.2
271	E	44.6	Very low	58.3	Low	180 Å²	180	122.1 Å²	122.1	84%	0.841	66%	0.662	S	S	*	*			trans	-116.8	123.5	-175.8	-67.1	-176.9	176.5	0	0	112	K269	K269-E271 VanDerWaalsContact C-N 3.29Å; K269-E271 PolarHBondContact O-N 3.35Å
272	E	40.1	Very low	57.7	Low	173 Å²	173	125.1 Å²	125.1	81%	0.808	67%	0.665	S	S	*	*			trans	-67.8	153.5	-176.7	-68.9	-177.2	162.7	0	0	112.8	V274	E272-V274 PolarHBondContact O-N 2.79Å
273	P	42.3	Very low	57.3	Low	132 Å²	132	126.8 Å²	126.8	86%	0.857	67%	0.673	S	S	*	*			trans	-69.4	112.5	-174.1	27.7	-35	0	0	0	112.5
274	V	53.5	Low	56.5	Low	140 Å²	140	132 Å²	132	85%	0.848	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-83.2	136.5	177.8	-178.1	0	0	0	0	111	E272	E272-V274 PolarHBondContact O-N 2.79Å
275	K	43.2	Very low	55.8	Low	190 Å²	190	139.4 Å²	139.4	83%	0.826	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-70.9	134	-178.8	-72.1	176.7	178.5	174.1	0	111.9	I277	K275-I277 PolarHBondContact O-N 2.57Å
276	T	55.2	Low	55.7	Low	118 Å²	118	145.2 Å²	145.2	72%	0.724	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.8	123.6	177	53.3	0	0	0	0	112.3
277	I	59	Low	55.9	Low	161 Å²	161	147.4 Å²	147.4	83%	0.826	76%	0.763	S	S	*	*			trans	-104.3	109.5	166.6	-85	148.9	0	0	0	108.5	K275 P279	K275-I277 PolarHBondContact O-N 2.57Å; I277-P279 WeakPolarHBondContact O-CD 3.17Å
278	V	73	Confident	56.1	Low	72 Å²	72	147.6 Å²	147.6	44%	0.436	76%	0.764	S	S	.	*			trans	-91.3	118.7	172.3	-179.3	0	0	0	0	108.1	W282 Q283	V278-W282 HydrophobicContact CG1-CB 4.17Å; V278-Q283 HydrophobicContact CB-CG 4.3Å; V278-Q283 HydrophobicContact CG1-CG 3.87Å; V278-Q283 PolarHBondContact O-NE2 3.35Å
279	P	62.4	Low	56.4	Low	66 Å²	66	148.2 Å²	148.2	43%	0.429	77%	0.766	S	S	.	*			trans	-56.9	139.8	174.3	-25.2	33.9	0	0	0	112.2	I277 K281 W282	I277-P279 WeakPolarHBondContact O-CD 3.17Å; P279-K281 PolarHBondContact O-N 3.37Å; P279-W282 HydrophobicContact CB-CE3 4.49Å; P279-W282 HydrophobicContact CG-CE3 4.1Å; P279-W282 HydrophobicContact CG-CZ3 4.13Å; P279-W282 PolarHBondContact O-N 2.92Å
280	S	75.5	Confident	57.1	Low	103 Å²	103	149.1 Å²	149.1	72%	0.72	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-53.2	-28.1	-174.1	52.5	0	0	0	0	114.8	W282 Q283	S280-W282 PolarHBondContact O-N 3.34Å; S280-Q283 PolarHBondContact O-N 3.13Å
281	K	74.1	Confident	57.9	Low	188 Å²	188	151.2 Å²	151.2	82%	0.817	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-64.6	-23.7	177.4	-171.8	177.7	179	-177	0	114	P279	P279-K281 PolarHBondContact O-N 3.37Å
282	W	62.9	Low	58.8	Low	188 Å²	188	149.1 Å²	149.1	71%	0.712	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-107.8	-3.4	-178.3	-64.6	-32.2	0	0	0	113.9	V278 P279 S280 L284	V278-W282 HydrophobicContact CG1-CB 4.17Å; P279-W282 HydrophobicContact CB-CE3 4.49Å; P279-W282 HydrophobicContact CG-CE3 4.1Å; P279-W282 HydrophobicContact CG-CZ3 4.13Å; P279-W282 PolarHBondContact O-N 2.92Å; S280-W282 PolarHBondContact O-N 3.34Å; W282-L284 PolarHBondContact O-N 3.33Å
283	Q	67	Low	60.3	Low	116 Å²	116	147.3 Å²	147.3	54%	0.542	77%	0.767	S	S	.	*	S	Bend	trans	-72.9	120.9	168.4	-64.9	-179.6	-4.9	0	0	107.1	V278 S280 M285	V278-Q283 HydrophobicContact CB-CG 4.3Å; V278-Q283 HydrophobicContact CG1-CG 3.87Å; V278-Q283 PolarHBondContact O-NE2 3.35Å; S280-Q283 PolarHBondContact O-N 3.13Å; Q283-M285 PolarHBondContact O-N 3.33Å
284	L	60	Low	61.8	Low	178 Å²	178	148.6 Å²	148.6	93%	0.932	76%	0.759	S	S	*	*			trans	-57.5	123.3	171.6	-76.4	158.6	0	0	0	107.7	W282	W282-L284 PolarHBondContact O-N 3.33Å
285	M	55.4	Low	62.5	Low	263 Å²	263	149.4 Å²	149.4	100%	1.296	75%	0.751	S	S	*	*			trans	-61.8	0	170	-83.3	-164.6	154.8	0	0	111.3	Q283	Q283-M285 PolarHBondContact O-N 3.33Å

Retrieved 285 of 285 residues in 195.4 ms (Link to these results)

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