A0A061IJR2_CRIGR Loading...

E3 ubiquitin-protein ligase RNF125

E3 ubiquitin-protein ligase that mediates ubiquitination and subsequent proteasomal degradation of target proteins, such as RIGI, MAVS/IPS1, IFIH1/MDA5, JAK1 and p53/TP53. Acts as a negative regulator of type I interferon production by mediating ubiquitination of RIGI at 'Lys-181', leading to RIGI degradation. Mediates ubiquitination and subsequent degradation of p53/TP53. Mediates ubiquitination and subsequent degradation of JAK1. Acts as a positive regulator of T-cell activation.

AlphaFold DB , UniProt , Accession A0A061IJR2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Rnf125, Length 232 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	38.7	Very low	247 Å²	247	131.5 Å²	131.5	100%	1.217	78%	0.776	S	S	*	*				0	97.1	0	-59.4	173.5	175	0	0	105.1
2	G	33.6	Very low	38.5	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	78%	0.776	S	S	*	*				84.3	101.4	109.6	0	0	0	0	0	108.3
3	S	37.1	Very low	38.3	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	78%	0.783	S	S	*	*				83.7	134.2	97.7	-69.1	0	0	0	0	110.4
4	L	37.7	Very low	38.1	Very low	136 Å²	136	127.1 Å²	127.1	71%	0.712	79%	0.786	S	S	*	*			cis	173.7	151.6	15.8	-113.5	175.4	0	0	0	106.5
5	L	39.4	Very low	38.1	Very low	141 Å²	141	125.6 Å²	125.6	74%	0.738	79%	0.791	S	S	*	*			trans	78.4	139.3	145.1	-58.2	163.5	0	0	0	117.8
6	S	39.4	Very low	38.2	Very low	85 Å²	85	125.1 Å²	125.1	59%	0.594	79%	0.792	S	S	*	*			cis	-166.3	139	3.2	-88.9	0	0	0	0	106.8
7	S	39.8	Very low	38.3	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	80%	0.798	S	S	*	*				59.5	125	100.2	-36	0	0	0	0	113
8	D	35.1	Very low	38.5	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	79%	0.794	S	S	*	*				-161.2	131.2	55.7	-96.7	-47.6	0	0	0	111.4
9	S	44.2	Very low	38.5	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	80%	0.795	S	S	*	*				84.6	98.6	96.5	-64.8	0	0	0	0	116.4
10	S	39.3	Very low	38.6	Very low	115 Å²	115	127.8 Å²	127.8	80%	0.804	80%	0.8	S	S	*	*				67.7	106.2	119.5	-46.9	0	0	0	0	120.2
11	K	38.8	Very low	38.4	Very low	209 Å²	209	127.3 Å²	127.3	91%	0.909	80%	0.798	S	S	*	*				-155	113.1	118.2	-137.3	172	179.8	-173.8	0	112.6
12	S	36.7	Very low	38.5	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	78%	0.781	S	S	*	*			trans	-74.9	138.7	170.4	42.1	0	0	0	0	112.3
13	A	35.6	Very low	38.5	Very low	104 Å²	104	129.6 Å²	129.6	86%	0.86	79%	0.793	S	S	*	*			trans	-153.2	111	142	0	0	0	0	0	108.6
14	S	36.5	Very low	38.4	Very low	118 Å²	118	135 Å²	135	83%	0.825	80%	0.796	S	S	*	*			trans	-70.6	140.5	176.8	-51.4	0	0	0	0	111.2
15	A	37.1	Very low	38.6	Very low	104 Å²	104	133.9 Å²	133.9	86%	0.86	80%	0.8	S	S	*	*			trans	-136.3	107.3	155.3	0	0	0	0	0	108.2
16	S	39.4	Very low	38.8	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	80%	0.795	S	S	*	*			trans	-65.8	143.5	-177	-64.6	0	0	0	0	112.5	A18	S16-A18 PolarHBondContact O-N 3Å
17	A	41.1	Very low	38.6	Very low	108 Å²	108	133.7 Å²	133.7	89%	0.893	81%	0.807	S	S	*	*			trans	-58	129.8	164.8	0	0	0	0	0	110.8
18	A	40.7	Very low	38.7	Very low	88 Å²	88	134.5 Å²	134.5	73%	0.727	81%	0.808	S	S	*	*			trans	-122.5	139.1	162.5	0	0	0	0	0	108.8	S16	S16-A18 PolarHBondContact O-N 3Å
19	P	38.4	Very low	38.9	Very low	124 Å²	124	136 Å²	136	81%	0.805	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.4	142.4	-179.5	-1.3	17.1	0	0	0	110.1
20	R	41.9	Very low	38.7	Very low	235 Å²	235	138.1 Å²	138.1	89%	0.887	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-57.8	129.6	172.1	-71.7	178.3	153.1	-131.1	-4.5	109.9	L22	R20-L22 PolarHBondContact O-N 3.13Å
21	P	34	Very low	38.7	Very low	117 Å²	117	137.6 Å²	137.6	76%	0.76	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.8	129.1	170.5	-23.1	33.9	0	0	0	110.5	E23	P21-E23 PolarHBondContact O-N 3.3Å
22	L	42	Very low	39.1	Very low	166 Å²	166	132.3 Å²	132.3	87%	0.869	79%	0.788	S	S	*	*			trans	-60.5	114.3	163.4	-69	153.2	0	0	0	107.6	R20 R24	R20-L22 PolarHBondContact O-N 3.13Å; L22-R24 PolarHBondContact O-N 3.24Å
23	E	33.6	Very low	40.1	Very low	192 Å²	192	128.8 Å²	128.8	90%	0.897	76%	0.762	S	S	*	*			trans	-63.3	107.3	166	-71.1	-84.3	107.9	0	0	107.1	P21	P21-E23 PolarHBondContact O-N 3.3Å
24	R	36.1	Very low	42	Very low	226 Å²	226	127 Å²	127	85%	0.853	74%	0.744	S	S	*	*			trans	-85.5	122.3	-175.9	173.9	170.9	174.6	-144.7	-1.8	109.1	L22	L22-R24 PolarHBondContact O-N 3.24Å
25	S	40.8	Very low	44.7	Very low	113 Å²	113	121.5 Å²	121.5	79%	0.79	71%	0.705	S	S	*	*			trans	34.5	126.7	138.4	-52.6	0	0	0	0	118.9
26	G	44.1	Very low	47.3	Very low	61 Å²	61	118.5 Å²	118.5	63%	0.629	67%	0.674	S	S	*	*				138.1	48	118.3	0	0	0	0	0	117.4
27	D	36.6	Very low	49.9	Very low	161 Å²	161	112.9 Å²	112.9	86%	0.861	64%	0.635	S	S	*	*			trans	-102.1	67	152.4	-60.4	-34.7	0	0	0	107.8	E29	D27-E29 PolarHBondContact O-N 3.44Å
28	T	41.5	Very low	52.3	Low	116 Å²	116	109.6 Å²	109.6	71%	0.712	61%	0.605	S	S	*	*			trans	-68.2	85.3	147.3	-54.5	0	0	0	0	103.9	L30	T28-L30 HydrophobicContact CG2-CD2 4.4Å; T28-L30 PolarHBondContact O-N 3.43Å
29	E	39.3	Very low	54.7	Low	175 Å²	175	108 Å²	108	82%	0.818	59%	0.586	S	S	*	*			trans	-51.8	98.7	154.2	-82.2	-171.3	150.8	0	0	104.3	D27 P31	D27-E29 PolarHBondContact O-N 3.44Å; E29-P31 VanDerWaalsContact O-CD 3.26Å; E29-P31 WeakPolarHBondContact O-CD 3.38Å
30	L	39.8	Very low	57.2	Low	140 Å²	140	104 Å²	104	73%	0.733	56%	0.561	S	S	*	*			trans	-52.3	118.3	165.7	-69.7	170.1	0	0	0	103.5	T28 I32	T28-L30 HydrophobicContact CG2-CD2 4.4Å; T28-L30 PolarHBondContact O-N 3.43Å; L30-I32 PolarHBondContact O-N 2.83Å
31	P	39.5	Very low	59.5	Low	104 Å²	104	99.3 Å²	99.3	68%	0.675	55%	0.553	S	S	*	*			trans	-68.3	92.1	176	27.4	-28.6	0	0	0	104.2	E29 T33	E29-P31 VanDerWaalsContact O-CD 3.26Å; E29-P31 WeakPolarHBondContact O-CD 3.38Å; P31-T33 HydrophobicContact CB-CG2 4.48Å; P31-T33 PolarHBondContact O-N 3.17Å
32	I	46.2	Very low	62.2	Low	99 Å²	99	95.7 Å²	95.7	51%	0.508	53%	0.526	S	S	.	.			trans	-56.5	96.9	143.5	-56.4	176.3	0	0	0	100.6	L30 D36 Y74	L30-I32 PolarHBondContact O-N 2.83Å; I32-D36 HydrophobicContact CG2-CB 4.05Å; I32-Y74 HydrophobicContact CD1-CE2 4.28Å
33	T	57.8	Low	64.7	Low	36 Å²	36	88.2 Å²	88.2	22%	0.221	49%	0.487	C	S	.	.			trans	-57	153.3	177.6	72.6	0	0	0	0	105.1	P31 F35 D36	P31-T33 HydrophobicContact CB-CG2 4.48Å; P31-T33 PolarHBondContact O-N 3.17Å; T33-F35 PolarHBondContact O-N 2.88Å; T33-D36 WeakPolarHBondContact CB-OD2 3.28Å; T33-D36 PolarHBondContact N-OD2 3.14Å; T33-D36 PolarHBondContact O-N 2.77Å; T33-D36 VanDerWaalsContact O-N 3.08Å; T33-D36 PolarHBondContact OG1-OD1 3.41Å; T33-D36 PolarHBondContact OG1-OD2 3.47Å
34	S	75.1	Confident	67.5	Low	68 Å²	68	79.3 Å²	79.3	48%	0.476	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	4.6	-176.6	54.4	0	0	0	0	114.7	R92	S34-R92 PolarHBondContact OG-NH2 2.93Å
35	F	93.1	Very high	70.2	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.009	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	6.4	-174.9	-54.5	-73.8	0	0	0	114.7	T33 V43 L44 I89 R92 M93 E96 L109	T33-F35 PolarHBondContact O-N 2.88Å; F35-V43 CarbonylContact O-C 3.54Å; F35-V43 WeakPolarHBondContact O-CA 3.24Å; F35-L44 WeakPolarHBondContact O-CB 3.22Å; F35-L44 WeakPolarHBondContact O-CG 3.33Å; F35-L44 PolarHBondContact O-N 3.1Å; F35-I89 HydrophobicContact CD1-CG2 3.75Å; F35-I89 HydrophobicContact CE1-CG2 3.9Å; F35-R92 HydrophobicContact CE1-CB 4.04Å; F35-R92 HydrophobicContact CZ-CB 4.08Å; F35-M93 HydrophobicContact CD1-CG 3.27Å; F35-M93 HydrophobicContact CD1-SD 4.05Å; F35-M93 HydrophobicContact CE1-CG 3.56Å; F35-M93 HydrophobicContact CG-CG 4.17Å; F35-E96 WeakPolarHBondContact CE2-OE2 3.2Å; F35-E96 VanDerWaalsContact CZ-CD 3.47Å; F35-E96 WeakPolarHBondContact CZ-OE1 3.26Å; F35-E96 VanDerWaalsContact CZ-OE2 3.31Å; F35-E96 WeakPolarHBondContact CZ-OE2 3.39Å; F35-L109 HydrophobicContact CB-CD1 4.06Å; F35-L109 HydrophobicContact CD1-CD1 4.21Å; F35-L109 HydrophobicContact CD2-CD1 3.34Å; F35-L109 HydrophobicContact CE2-CD1 3.71Å; F35-L109 HydrophobicContact CG-CD1 3.59Å; F35-L109 HydrophobicContact CZ-CD1 4.25Å
36	D	92.9	Very high	72.5	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.214	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-95.1	138.5	178.2	-60.6	-41.5	0	0	0	111.7	I32 T33	I32-D36 HydrophobicContact CG2-CB 4.05Å; T33-D36 WeakPolarHBondContact CB-OD2 3.28Å; T33-D36 PolarHBondContact N-OD2 3.14Å; T33-D36 PolarHBondContact O-N 2.77Å; T33-D36 VanDerWaalsContact O-N 3.08Å; T33-D36 PolarHBondContact OG1-OD1 3.41Å; T33-D36 PolarHBondContact OG1-OD2 3.47Å
37	C	93.5	Very high	74.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.36	C	S	.	.			trans	-83.8	120.9	176.1	-176.4	0	0	0	0	110.6	V39 C40 L41 E42 L44 C57	C37-V39 PolarHBondContact O-N 3.16Å; C37-C40 VanDerWaalsContact CB-SG 3.57Å; C37-L41 WeakPolarHBondContact O-CA 3.48Å; C37-L41 PolarHBondContact O-N 3.08Å; C37-E42 WeakPolarHBondContact CB-O 3.49Å; C37-E42 PolarHBondContact N-O 2.91Å; C37-L44 HydrophobicContact CB-CD2 3.81Å; C37-L44 HydrophobicContact CB-CG 4.48Å; C37-C57 WeakPolarHBondContact CB-SG 3.48Å; C37-C57 PolarHBondContact SG-N 3.03Å; C37-C57 VanDerWaalsContact SG-N 3.38Å
38	S	91.5	Very high	77.6	Confident	38 Å²	38	57.9 Å²	57.9	27%	0.266	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	2.8	179.6	79.7	0	0	0	0	115.1	F56	S38-F56 VanDerWaalsContact OG-CE1 3.25Å; S38-F56 WeakPolarHBondContact OG-CE1 3.47Å
39	V	90.9	Very high	80.1	Confident	54 Å²	54	55.4 Å²	55.4	33%	0.327	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-53.9	177.8	174.4	0	0	0	0	110.7	C37 F56 C60 P73	C37-V39 PolarHBondContact O-N 3.16Å; V39-F56 HydrophobicContact CG2-CD1 3.64Å; V39-F56 HydrophobicContact CG2-CE1 4.02Å; V39-C60 HydrophobicContact CB-CB 3.79Å; V39-C60 HydrophobicContact CG1-CB 3.75Å; V39-C60 HydrophobicContact CG2-CB 4.31Å; V39-P73 HydrophobicContact CG2-CB 3.75Å; V39-P73 HydrophobicContact CG2-CG 3.95Å
40	C	90.3	Very high	82.5	Confident	41 Å²	41	47.4 Å²	47.4	28%	0.277	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-8.7	177.3	65.3	0	0	0	0	113.6	C37 E42 R113	C37-C40 VanDerWaalsContact CB-SG 3.57Å; C40-E42 PolarHBondContact O-N 3.42Å; C40-R113 PolarHBondContact SG-NH2 2.84Å; C40-R113 VanDerWaalsContact SG-NH2 3.42Å
41	L	90.3	Very high	84.9	Confident	136 Å²	136	50.4 Å²	50.4	71%	0.712	27%	0.265	S	S	*	.	S	Bend	trans	60.9	17.7	-177.6	-51	179.9	0	0	0	114.7	C37	C37-L41 WeakPolarHBondContact O-CA 3.48Å; C37-L41 PolarHBondContact O-N 3.08Å
42	E	91.3	Very high	87.3	Confident	41 Å²	41	47.5 Å²	47.5	19%	0.192	25%	0.246	C	C	.	.	S	Bend	trans	-110.4	164.4	177	-64.6	-60.7	152.1	0	0	110.5	C37 C40 L44 Y122 L129	C37-E42 WeakPolarHBondContact CB-O 3.49Å; C37-E42 PolarHBondContact N-O 2.91Å; C40-E42 PolarHBondContact O-N 3.42Å; E42-L44 PolarHBondContact O-N 3.02Å; E42-Y122 VanDerWaalsContact CD-OH 3.24Å; E42-Y122 PolarHBondContact OE1-OH 2.98Å; E42-L129 HydrophobicContact CG-CD1 4.12Å
43	V	93.8	Very high	89.5	Confident	9 Å²	9	44.8 Å²	44.8	6%	0.055	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-49.9	135.6	171.2	178.2	0	0	0	0	109.9	F35 H45 M93 L109 M112 R113	F35-V43 CarbonylContact O-C 3.54Å; F35-V43 WeakPolarHBondContact O-CA 3.24Å; V43-H45 PolarHBondContact O-N 3.18Å; V43-M93 HydrophobicContact CG1-CE 3.6Å; V43-L109 HydrophobicContact CG1-CD2 4.09Å; V43-L109 HydrophobicContact CG2-CD2 4.25Å; V43-M112 HydrophobicContact CB-CB 4.33Å; V43-M112 HydrophobicContact CB-CG 4.24Å; V43-M112 HydrophobicContact CG1-CB 4.29Å; V43-M112 HydrophobicContact CG2-CB 4.22Å; V43-M112 HydrophobicContact CG2-CG 3.75Å; V43-R113 PolarHBondContact O-NE 3.41Å; V43-R113 PolarHBondContact O-NH2 2.9Å
44	L	94.3	Very high	91.2	Very high	6 Å²	6	45.6 Å²	45.6	3%	0.031	24%	0.244	C	C	.	.			trans	-53.6	133.8	-177.4	-75.1	164.8	0	0	0	110.7	F35 C37 E42 P47 V55 I89 M93	F35-L44 WeakPolarHBondContact O-CB 3.22Å; F35-L44 WeakPolarHBondContact O-CG 3.33Å; F35-L44 PolarHBondContact O-N 3.1Å; C37-L44 HydrophobicContact CB-CD2 3.81Å; C37-L44 HydrophobicContact CB-CG 4.48Å; E42-L44 PolarHBondContact O-N 3.02Å; L44-P47 HydrophobicContact CB-CB 4.12Å; L44-P47 HydrophobicContact CD1-CB 4.05Å; L44-P47 HydrophobicContact CD2-CB 4.39Å; L44-P47 HydrophobicContact CG-CB 4.43Å; L44-V55 HydrophobicContact CD1-CG1 3.78Å; L44-V55 HydrophobicContact CD2-CG1 4.08Å; L44-I89 HydrophobicContact CD1-CG2 4.07Å; L44-M93 HydrophobicContact CB-CE 4.26Å; L44-M93 HydrophobicContact CB-SD 4.32Å; L44-M93 WeakPolarHBondContact O-CE 3.3Å
45	H	92.1	Very high	92.2	Very high	46 Å²	46	43.7 Å²	43.7	21%	0.213	23%	0.23	C	C	.	.	S	Bend	trans	-117.9	125.8	169.2	-170.3	57.9	0	0	0	109.1	V43 C57 R58 R113 E134	V43-H45 PolarHBondContact O-N 3.18Å; H45-C57 PolarHBondContact N-SG 2.93Å; H45-C57 WeakPolarHBondContact O-CA 3.39Å; H45-C57 VanDerWaalsContact O-CB 3.28Å; H45-C57 WeakPolarHBondContact O-CB 3.44Å; H45-R58 PolarHBondContact O-N 3.47Å; H45-R113 HydrophobicContact CB-CG 4.06Å; H45-R113 VanDerWaalsContact CB-NH1 3.31Å; H45-E134 IonicContact CD2-OE1 3.27Å; H45-E134 PolarHBondContact CD2-OE1 2.82Å; H45-E134 VanDerWaalsContact CD2-OE1 3.27Å; H45-E134 IonicContact NE2-OE1 3.59Å
46	Q	89.4	Confident	92.2	Very high	40 Å²	40	43.6 Å²	43.6	19%	0.187	23%	0.229	C	C	.	.	S	Bend	trans	47.1	66.8	-173.2	-64.9	-177.3	-36.7	0	0	111.2	V48 R58 D151 F199	Q46-V48 PolarHBondContact O-N 3.32Å; Q46-R58 HydrophobicContact CB-CB 3.96Å; Q46-R58 WeakPolarHBondContact O-CB 3.31Å; Q46-R58 PolarHBondContact O-N 2.98Å; Q46-R58 VanDerWaalsContact O-N 3.12Å; Q46-D151 PolarHBondContact NE2-OD2 2.82Å; Q46-F199 HydrophobicContact CB-CZ 4.06Å; Q46-F199 HydrophobicContact CG-CZ 4.01Å
47	P	94.2	Very high	92.3	Very high	11 Å²	11	41.7 Å²	41.7	7%	0.071	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.2	-169.1	26.9	-35.7	0	0	0	111.8	L44 V55 F56 A86 I89 A90 M93	L44-P47 HydrophobicContact CB-CB 4.12Å; L44-P47 HydrophobicContact CD1-CB 4.05Å; L44-P47 HydrophobicContact CD2-CB 4.39Å; L44-P47 HydrophobicContact CG-CB 4.43Å; P47-V55 HydrophobicContact CB-CG1 3.78Å; P47-F56 CarbonylContact C-O 3.21Å; P47-F56 WeakPolarHBondContact CA-O 3.01Å; P47-A86 HydrophobicContact CB-CB 4.09Å; P47-A86 HydrophobicContact CG-CB 4.37Å; P47-A86 PolarHBondContact O-N 2.7Å; P47-I89 HydrophobicContact CB-CG2 4.25Å; P47-I89 HydrophobicContact CG-CB 4.4Å; P47-I89 HydrophobicContact CG-CG2 4.18Å; P47-A90 HydrophobicContact CG-CB 3.95Å; P47-M93 HydrophobicContact CG-SD 4.39Å
48	V	93.3	Very high	92.1	Very high	13 Å²	13	44.5 Å²	44.5	8%	0.079	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.5	177.5	175.5	0	0	0	0	109	Q46 V55 F56 R58 I61 E82 V84	Q46-V48 PolarHBondContact O-N 3.32Å; V48-V55 VanDerWaalsContact O-CA 3.3Å; V48-V55 WeakPolarHBondContact O-CA 3.3Å; V48-F56 PolarHBondContact N-O 2.86Å; V48-F56 PolarHBondContact O-N 3.26Å; V48-R58 HydrophobicContact CG2-CB 3.89Å; V48-R58 HydrophobicContact CG2-CG 4.33Å; V48-I61 HydrophobicContact CB-CG2 4.14Å; V48-I61 HydrophobicContact CG1-CG2 4.16Å; V48-E82 WeakPolarHBondContact CG1-O 3.39Å; V48-V84 CarbonylContact C-O 3.59Å; V48-V84 WeakPolarHBondContact CA-O 3.42Å
49	R	93	Very high	91.9	Very high	65 Å²	65	43.3 Å²	43.3	25%	0.245	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.8	174.6	-174.3	173.7	-67.1	108.8	-8	110.4	V55 G83 V84 A86 D88	R49-V55 HydrophobicContact CB-CG2 4.14Å; R49-V55 HydrophobicContact CG-CG2 4.15Å; R49-G83 CarbonylContact O-C 3.45Å; R49-G83 VanDerWaalsContact O-CA 3.26Å; R49-G83 WeakPolarHBondContact O-CA 3.47Å; R49-V84 PolarHBondContact N-O 2.91Å; R49-V84 PolarHBondContact O-N 3.23Å; R49-A86 HydrophobicContact CB-CB 4.05Å; R49-D88 IonicContact CZ-OD1 2.86Å; R49-D88 IonicContact CZ-OD2 3.37Å; R49-D88 IonicContact NH1-OD1 2.86Å; R49-D88 PolarHBondContact NH1-OD1 3.14Å; R49-D88 IonicContact NH1-OD2 2.73Å; R49-D88 VanDerWaalsContact NH2-CG 3.31Å; R49-D88 IonicContact NH2-OD1 2.96Å; R49-D88 PolarHBondContact NH2-OD1 2.88Å; R49-D88 VanDerWaalsContact NH2-OD1 3.09Å; R49-D88 IonicContact NH2-OD2 3.09Å; R49-D88 PolarHBondContact NH2-OD2 3.28Å
50	T	91.4	Very high	91.9	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.037	21%	0.207	C	C	.	.			trans	-77.8	164.6	175.2	59	0	0	0	0	111.8	C52 G53 H54 F56 I61 L79	T50-C52 PolarHBondContact O-N 3.04Å; T50-C52 PolarHBondContact OG1-SG 3.48Å; T50-G53 PolarHBondContact O-N 3.33Å; T50-H54 PolarHBondContact N-O 2.97Å; T50-H54 PolarHBondContact OG1-N 3.41Å; T50-H54 PolarHBondContact OG1-O 3.48Å; T50-F56 HydrophobicContact CG2-CD2 3.81Å; T50-F56 HydrophobicContact CG2-CE2 3.7Å; T50-I61 HydrophobicContact CG2-CD1 3.99Å; T50-I61 HydrophobicContact CG2-CG1 3.99Å; T50-L79 HydrophobicContact CG2-CD1 3.77Å; T50-L79 HydrophobicContact CG2-CD2 4.23Å
51	R	88.4	Confident	91.9	Very high	203 Å²	203	39 Å²	39	77%	0.766	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.2	178	-78.4	-76.4	-176.3	174.2	-0.9	113.8	G53 P80	R51-G53 VanDerWaalsContact C-N 3.25Å; R51-G53 PolarHBondContact O-N 3.18Å; R51-P80 HydrophobicContact CG-CG 3.9Å
52	C	90.9	Very high	91.7	Very high	43 Å²	43	33.7 Å²	33.7	29%	0.291	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	3.4	175.8	63.3	0	0	0	0	113.7	T50 H54 C72 A77	T50-C52 PolarHBondContact O-N 3.04Å; T50-C52 PolarHBondContact OG1-SG 3.48Å; C52-H54 PolarHBondContact SG-ND1 2.89Å; C52-H54 VanDerWaalsContact SG-ND1 3.39Å; C52-C72 PolarHBondContact SG-SG 3.5Å; C52-A77 HydrophobicContact CB-CB 3.92Å
53	G	91.2	Very high	91.5	Very high	42 Å²	42	33.7 Å²	33.7	43%	0.433	17%	0.173	S	C	.	.	S	Bend	trans	93	-12.2	174.5	0	0	0	0	0	115.5	T50 R51	T50-G53 PolarHBondContact O-N 3.33Å; R51-G53 VanDerWaalsContact C-N 3.25Å; R51-G53 PolarHBondContact O-N 3.18Å
54	H	94.7	Very high	91.2	Very high	53 Å²	53	34.2 Å²	34.2	25%	0.245	18%	0.177	C	C	.	.			trans	-76.1	147.6	178.8	-62.3	98.3	0	0	0	112.1	T50 C52 F56 Y74 C75	T50-H54 PolarHBondContact N-O 2.97Å; T50-H54 PolarHBondContact OG1-N 3.41Å; T50-H54 PolarHBondContact OG1-O 3.48Å; C52-H54 PolarHBondContact SG-ND1 2.89Å; C52-H54 VanDerWaalsContact SG-ND1 3.39Å; H54-F56 HydrophobicContact CB-CE2 3.57Å; H54-F56 HydrophobicContact CB-CZ 3.63Å; H54-Y74 AromaticContact CD2-CD1 3.26Å; H54-Y74 WeakPolarHBondContact CD2-CD1 3.49Å; H54-Y74 AromaticContact CD2-CE1 3.72Å; H54-Y74 AromaticContact CD2-CG 3.73Å; H54-Y74 AromaticContact CE1-CD1 3.64Å; H54-Y74 AromaticContact CG-CD1 3.91Å; H54-Y74 AromaticContact NE2-CD1 3.07Å; H54-Y74 WeakPolarHBondContact NE2-CD1 3.35Å; H54-Y74 AromaticContact NE2-CE1 3.34Å; H54-Y74 VanDerWaalsContact NE2-CE1 3.34Å; H54-Y74 WeakPolarHBondContact NE2-CE1 3.27Å; H54-C75 VanDerWaalsContact CE1-SG 3.53Å; H54-C75 PolarHBondContact ND1-SG 3.27Å; H54-C75 VanDerWaalsContact ND1-SG 3.44Å
55	V	95.1	Very high	90.7	Very high	29 Å²	29	34.2 Å²	34.2	18%	0.176	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.6	-172.5	-172.8	0	0	0	0	110.1	L44 P47 V48 R49 A86 I89	L44-V55 HydrophobicContact CD1-CG1 3.78Å; L44-V55 HydrophobicContact CD2-CG1 4.08Å; P47-V55 HydrophobicContact CB-CG1 3.78Å; V48-V55 VanDerWaalsContact O-CA 3.3Å; V48-V55 WeakPolarHBondContact O-CA 3.3Å; R49-V55 HydrophobicContact CB-CG2 4.14Å; R49-V55 HydrophobicContact CG-CG2 4.15Å; V55-A86 HydrophobicContact CG1-CB 4.14Å; V55-I89 HydrophobicContact CB-CD1 4.13Å; V55-I89 HydrophobicContact CG1-CD1 3.82Å; V55-I89 HydrophobicContact CG2-CD1 3.59Å
56	F	94.5	Very high	90.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	168.9	-177.8	-51.7	-85.4	0	0	0	110.1	S38 V39 P47 V48 T50 H54 I61 P73	S38-F56 VanDerWaalsContact OG-CE1 3.25Å; S38-F56 WeakPolarHBondContact OG-CE1 3.47Å; V39-F56 HydrophobicContact CG2-CD1 3.64Å; V39-F56 HydrophobicContact CG2-CE1 4.02Å; P47-F56 CarbonylContact C-O 3.21Å; P47-F56 WeakPolarHBondContact CA-O 3.01Å; V48-F56 PolarHBondContact N-O 2.86Å; V48-F56 PolarHBondContact O-N 3.26Å; T50-F56 HydrophobicContact CG2-CD2 3.81Å; T50-F56 HydrophobicContact CG2-CE2 3.7Å; H54-F56 HydrophobicContact CB-CE2 3.57Å; H54-F56 HydrophobicContact CB-CZ 3.63Å; F56-I61 HydrophobicContact CB-CB 4.02Å; F56-I61 HydrophobicContact CD2-CB 4.32Å; F56-I61 HydrophobicContact CD2-CD1 3.96Å; F56-I61 HydrophobicContact CD2-CG1 4.26Å; F56-I61 HydrophobicContact CE2-CD1 4.21Å; F56-I61 HydrophobicContact CG-CB 4.39Å; F56-I61 HydrophobicContact CG-CD1 4.5Å; F56-P73 HydrophobicContact CD1-CG 4.49Å; F56-P73 HydrophobicContact CE1-CB 3.99Å; F56-P73 HydrophobicContact CE1-CG 4.02Å; F56-P73 HydrophobicContact CZ-CB 4.3Å; F56-P73 HydrophobicContact CZ-CG 4.13Å
57	C	93.7	Very high	89.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	146.8	164.7	-48.1	0	0	0	0	109.8	C37 H45 S59 C60 I61 R113	C37-C57 WeakPolarHBondContact CB-SG 3.48Å; C37-C57 PolarHBondContact SG-N 3.03Å; C37-C57 VanDerWaalsContact SG-N 3.38Å; H45-C57 PolarHBondContact N-SG 2.93Å; H45-C57 WeakPolarHBondContact O-CA 3.39Å; H45-C57 VanDerWaalsContact O-CB 3.28Å; H45-C57 WeakPolarHBondContact O-CB 3.44Å; C57-S59 PolarHBondContact O-N 2.9Å; C57-C60 HydrophobicContact CB-CB 3.96Å; C57-C60 WeakPolarHBondContact O-CB 3.28Å; C57-C60 PolarHBondContact O-N 3.25Å; C57-C60 VanDerWaalsContact O-N 3.15Å; C57-I61 PolarHBondContact O-N 3.2Å; C57-R113 PolarHBondContact SG-NH2 3.12Å
58	R	90.2	Very high	88.5	Confident	58 Å²	58	48.4 Å²	48.4	22%	0.219	25%	0.246	C	C	.	.	H	α-helix	trans	-50.2	-53.5	175.2	179.2	-176.4	163.6	80.1	-3.3	112.1	H45 Q46 V48 C60 I61 A62	H45-R58 PolarHBondContact O-N 3.47Å; Q46-R58 HydrophobicContact CB-CB 3.96Å; Q46-R58 WeakPolarHBondContact O-CB 3.31Å; Q46-R58 PolarHBondContact O-N 2.98Å; Q46-R58 VanDerWaalsContact O-N 3.12Å; V48-R58 HydrophobicContact CG2-CB 3.89Å; V48-R58 HydrophobicContact CG2-CG 4.33Å; R58-C60 VanDerWaalsContact C-N 3.33Å; R58-C60 PolarHBondContact O-N 3.34Å; R58-I61 WeakPolarHBondContact O-CG2 3.44Å; R58-I61 PolarHBondContact O-N 3.24Å; R58-A62 VanDerWaalsContact O-CB 3.3Å; R58-A62 WeakPolarHBondContact O-CB 3.39Å; R58-A62 PolarHBondContact O-N 2.93Å
59	S	86.3	Confident	87.7	Confident	13 Å²	13	56.8 Å²	56.8	9%	0.091	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-37.6	179.9	54.8	0	0	0	0	113.1	C57 T63	C57-S59 PolarHBondContact O-N 2.9Å; S59-T63 WeakPolarHBondContact O-CB 3.38Å; S59-T63 PolarHBondContact O-N 2.86Å; S59-T63 PolarHBondContact O-OG1 3.08Å
60	C	90.7	Very high	87.4	Confident	4 Å²	4	59.3 Å²	59.3	3%	0.027	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-48.7	178.5	-69.9	0	0	0	0	112.5	V39 C57 R58 S64	V39-C60 HydrophobicContact CB-CB 3.79Å; V39-C60 HydrophobicContact CG1-CB 3.75Å; V39-C60 HydrophobicContact CG2-CB 4.31Å; C57-C60 HydrophobicContact CB-CB 3.96Å; C57-C60 WeakPolarHBondContact O-CB 3.28Å; C57-C60 PolarHBondContact O-N 3.25Å; C57-C60 VanDerWaalsContact O-N 3.15Å; R58-C60 VanDerWaalsContact C-N 3.33Å; R58-C60 PolarHBondContact O-N 3.34Å; C60-S64 WeakPolarHBondContact O-CB 3.37Å; C60-S64 PolarHBondContact O-N 2.94Å
61	I	90.9	Very high	87.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-71.6	-39.8	-178.7	-169.7	57.2	0	0	0	111.8	V48 T50 F56 C57 R58 T63 S64 I65 P73 L79 E82	V48-I61 HydrophobicContact CB-CG2 4.14Å; V48-I61 HydrophobicContact CG1-CG2 4.16Å; T50-I61 HydrophobicContact CG2-CD1 3.99Å; T50-I61 HydrophobicContact CG2-CG1 3.99Å; F56-I61 HydrophobicContact CB-CB 4.02Å; F56-I61 HydrophobicContact CD2-CB 4.32Å; F56-I61 HydrophobicContact CD2-CD1 3.96Å; F56-I61 HydrophobicContact CD2-CG1 4.26Å; F56-I61 HydrophobicContact CE2-CD1 4.21Å; F56-I61 HydrophobicContact CG-CB 4.39Å; F56-I61 HydrophobicContact CG-CD1 4.5Å; C57-I61 PolarHBondContact O-N 3.2Å; R58-I61 WeakPolarHBondContact O-CG2 3.44Å; R58-I61 PolarHBondContact O-N 3.24Å; I61-T63 PolarHBondContact O-N 3.47Å; I61-S64 PolarHBondContact O-N 3.26Å; I61-I65 HydrophobicContact CD1-CD1 3.87Å; I61-I65 HydrophobicContact CD1-CG1 4.08Å; I61-I65 HydrophobicContact CG1-CD1 3.76Å; I61-I65 HydrophobicContact CG1-CG1 4.39Å; I61-I65 WeakPolarHBondContact O-CB 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.37Å; I61-I65 PolarHBondContact O-N 3.07Å; I61-P73 HydrophobicContact CD1-CG 3.89Å; I61-L79 HydrophobicContact CD1-CD1 3.91Å; I61-E82 WeakPolarHBondContact CG1-O 3.41Å; I61-E82 HydrophobicContact CG2-CB 4.49Å
62	A	86.7	Confident	87.7	Confident	25 Å²	25	51.6 Å²	51.6	21%	0.207	27%	0.267	C	S	.	.	H	α-helix	trans	-58.4	-48.6	175.7	0	0	0	0	0	111.3	R58 S64 I65 K66 E82	R58-A62 VanDerWaalsContact O-CB 3.3Å; R58-A62 WeakPolarHBondContact O-CB 3.39Å; R58-A62 PolarHBondContact O-N 2.93Å; A62-S64 PolarHBondContact O-N 3.24Å; A62-I65 PolarHBondContact O-N 2.73Å; A62-K66 WeakPolarHBondContact O-CB 3.46Å; A62-K66 PolarHBondContact O-N 3.29Å; A62-K66 VanDerWaalsContact O-N 3.1Å; A62-E82 WeakPolarHBondContact CB-OE1 3.37Å
63	T	85.9	Confident	87.7	Confident	41 Å²	41	51.8 Å²	51.8	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-40.9	177.8	-54.3	0	0	0	0	111.8	S59 I61 K66 N67 L132	S59-T63 WeakPolarHBondContact O-CB 3.38Å; S59-T63 PolarHBondContact O-N 2.86Å; S59-T63 PolarHBondContact O-OG1 3.08Å; I61-T63 PolarHBondContact O-N 3.47Å; T63-K66 PolarHBondContact O-N 3.06Å; T63-N67 PolarHBondContact O-N 3.43Å; T63-N67 PolarHBondContact O-ND2 3.25Å; T63-L132 HydrophobicContact CG2-CD2 3.73Å
64	S	87.8	Confident	87.8	Confident	21 Å²	21	55.8 Å²	55.8	15%	0.147	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-44.6	-179.6	-165.2	0	0	0	0	112	C60 I61 A62 K66 N67 N68 P73	C60-S64 WeakPolarHBondContact O-CB 3.37Å; C60-S64 PolarHBondContact O-N 2.94Å; I61-S64 PolarHBondContact O-N 3.26Å; A62-S64 PolarHBondContact O-N 3.24Å; S64-K66 PolarHBondContact O-N 2.64Å; S64-N67 PolarHBondContact O-N 3.41Å; S64-N68 WeakPolarHBondContact O-CA 3.5Å; S64-N68 WeakPolarHBondContact O-CB 3.18Å; S64-N68 PolarHBondContact O-N 3.29Å; S64-P73 WeakPolarHBondContact OG-CG 3.43Å
65	I	85.1	Confident	87.7	Confident	5 Å²	5	56 Å²	56	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-40.8	179.7	-74.8	169.5	0	0	0	111.6	I61 A62 N67 N68 W70 L79 E82	I61-I65 HydrophobicContact CD1-CD1 3.87Å; I61-I65 HydrophobicContact CD1-CG1 4.08Å; I61-I65 HydrophobicContact CG1-CD1 3.76Å; I61-I65 HydrophobicContact CG1-CG1 4.39Å; I61-I65 WeakPolarHBondContact O-CB 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.37Å; I61-I65 PolarHBondContact O-N 3.07Å; A62-I65 PolarHBondContact O-N 2.73Å; I65-N67 PolarHBondContact O-N 2.85Å; I65-N68 PolarHBondContact O-N 3.42Å; I65-W70 HydrophobicContact CG2-CD2 3.41Å; I65-W70 VanDerWaalsContact CG2-CD2 3.41Å; I65-W70 HydrophobicContact CG2-CE3 3.31Å; I65-W70 HydrophobicContact CG2-CG 3.97Å; I65-W70 HydrophobicContact CG2-CH2 3.99Å; I65-W70 HydrophobicContact CG2-CZ2 4.08Å; I65-W70 HydrophobicContact CG2-CZ3 3.59Å; I65-L79 HydrophobicContact CD1-CB 4.42Å; I65-L79 HydrophobicContact CD1-CD1 3.89Å; I65-L79 HydrophobicContact CG1-CD1 4.29Å; I65-E82 HydrophobicContact CD1-CB 4.21Å; I65-E82 HydrophobicContact CD1-CG 4.01Å
66	K	81.4	Confident	87.5	Confident	183 Å²	183	64.6 Å²	64.6	80%	0.796	31%	0.306	S	S	*	.	H	α-helix	trans	-56.8	-36.2	175.1	-172.9	175.9	-178.6	177.2	0	112.2	A62 T63 S64	A62-K66 WeakPolarHBondContact O-CB 3.46Å; A62-K66 PolarHBondContact O-N 3.29Å; A62-K66 VanDerWaalsContact O-N 3.1Å; T63-K66 PolarHBondContact O-N 3.06Å; S64-K66 PolarHBondContact O-N 2.64Å
67	N	77.2	Confident	87.4	Confident	116 Å²	116	66.4 Å²	66.4	62%	0.62	32%	0.322	S	S	*	.	H	α-helix	trans	-94.5	-24.9	-175.9	-64.9	-15.8	0	0	0	113.8	T63 S64 I65	T63-N67 PolarHBondContact O-N 3.43Å; T63-N67 PolarHBondContact O-ND2 3.25Å; S64-N67 PolarHBondContact O-N 3.41Å; I65-N67 PolarHBondContact O-N 2.85Å
68	N	70.5	Confident	87.3	Confident	97 Å²	97	74 Å²	74	52%	0.519	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	43.2	-159.6	-119.7	19.4	0	0	0	114.8	S64 I65 W70 T71	S64-N68 WeakPolarHBondContact O-CA 3.5Å; S64-N68 WeakPolarHBondContact O-CB 3.18Å; S64-N68 PolarHBondContact O-N 3.29Å; I65-N68 PolarHBondContact O-N 3.42Å; N68-W70 VanDerWaalsContact C-N 3.34Å; N68-W70 PolarHBondContact O-N 3.4Å; N68-T71 PolarHBondContact O-N 2.67Å; N68-T71 PolarHBondContact O-OG1 3.23Å
69	K	76.8	Confident	87.1	Confident	189 Å²	189	71.3 Å²	71.3	82%	0.822	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	39	166.3	-56	-180	179.4	178.6	0	114.8	T71	K69-T71 PolarHBondContact O-N 3.1Å
70	W	86.6	Confident	86.7	Confident	118 Å²	118	74.2 Å²	74.2	45%	0.447	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	44.5	174.3	-63.4	88.7	0	0	0	113.5	I65 N68 Y78 L79	I65-W70 HydrophobicContact CG2-CD2 3.41Å; I65-W70 VanDerWaalsContact CG2-CD2 3.41Å; I65-W70 HydrophobicContact CG2-CE3 3.31Å; I65-W70 HydrophobicContact CG2-CG 3.97Å; I65-W70 HydrophobicContact CG2-CH2 3.99Å; I65-W70 HydrophobicContact CG2-CZ2 4.08Å; I65-W70 HydrophobicContact CG2-CZ3 3.59Å; N68-W70 VanDerWaalsContact C-N 3.34Å; N68-W70 PolarHBondContact O-N 3.4Å; W70-Y78 HydrophobicContact CB-CD2 4.31Å; W70-Y78 HydrophobicContact CB-CE2 3.84Å; W70-Y78 WeakPolarHBondContact O-CD2 3.04Å; W70-L79 WeakPolarHBondContact CB-O 3.41Å; W70-L79 PolarHBondContact O-N 2.96Å
71	T	92.5	Very high	86.4	Confident	45 Å²	45	76.1 Å²	76.1	28%	0.276	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-119.5	148.9	176.2	57.5	0	0	0	0	111.6	N68 K69 A77	N68-T71 PolarHBondContact O-N 2.67Å; N68-T71 PolarHBondContact O-OG1 3.23Å; K69-T71 PolarHBondContact O-N 3.1Å; T71-A77 CarbonylContact C-O 3.56Å; T71-A77 WeakPolarHBondContact CA-O 3.48Å
72	C	92.2	Very high	85.8	Confident	2 Å²	2	79.8 Å²	79.8	1%	0.014	39%	0.39	C	S	.	.			trans	-66.3	127.3	177.3	179.3	0	0	0	0	110.4	C52 Y74 C75 R76 A77 L79	C52-C72 PolarHBondContact SG-SG 3.5Å; C72-Y74 PolarHBondContact O-N 3.21Å; C72-Y74 VanDerWaalsContact O-N 3.15Å; C72-C75 VanDerWaalsContact SG-SG 3.63Å; C72-R76 WeakPolarHBondContact O-CA 3.27Å; C72-R76 PolarHBondContact O-N 3.5Å; C72-A77 PolarHBondContact N-O 2.87Å; C72-L79 HydrophobicContact CB-CD1 4.07Å; C72-L79 HydrophobicContact CB-CD2 4.19Å; C72-L79 HydrophobicContact CB-CG 4.13Å
73	P	92.3	Very high	85.9	Confident	46 Å²	46	79.5 Å²	79.5	30%	0.299	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27	179.2	-22.6	31.2	0	0	0	113.8	V39 F56 I61 S64	V39-P73 HydrophobicContact CG2-CB 3.75Å; V39-P73 HydrophobicContact CG2-CG 3.95Å; F56-P73 HydrophobicContact CD1-CG 4.49Å; F56-P73 HydrophobicContact CE1-CB 3.99Å; F56-P73 HydrophobicContact CE1-CG 4.02Å; F56-P73 HydrophobicContact CZ-CB 4.3Å; F56-P73 HydrophobicContact CZ-CG 4.13Å; I61-P73 HydrophobicContact CD1-CG 3.89Å; S64-P73 WeakPolarHBondContact OG-CG 3.43Å
74	Y	92.1	Very high	85.8	Confident	126 Å²	126	81.8 Å²	81.8	49%	0.494	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-62.7	-176	-171.3	-88.2	0	0	0	112.1	I32 H54 C72	I32-Y74 HydrophobicContact CD1-CE2 4.28Å; H54-Y74 AromaticContact CD2-CD1 3.26Å; H54-Y74 WeakPolarHBondContact CD2-CD1 3.49Å; H54-Y74 AromaticContact CD2-CE1 3.72Å; H54-Y74 AromaticContact CD2-CG 3.73Å; H54-Y74 AromaticContact CE1-CD1 3.64Å; H54-Y74 AromaticContact CG-CD1 3.91Å; H54-Y74 AromaticContact NE2-CD1 3.07Å; H54-Y74 WeakPolarHBondContact NE2-CD1 3.35Å; H54-Y74 AromaticContact NE2-CE1 3.34Å; H54-Y74 VanDerWaalsContact NE2-CE1 3.34Å; H54-Y74 WeakPolarHBondContact NE2-CE1 3.27Å; C72-Y74 PolarHBondContact O-N 3.21Å; C72-Y74 VanDerWaalsContact O-N 3.15Å
75	C	92.9	Very high	85.7	Confident	57 Å²	57	82.3 Å²	82.3	39%	0.385	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-1.5	-173.8	69.4	0	0	0	0	114.8	H54 C72 A77	H54-C75 VanDerWaalsContact CE1-SG 3.53Å; H54-C75 PolarHBondContact ND1-SG 3.27Å; H54-C75 VanDerWaalsContact ND1-SG 3.44Å; C72-C75 VanDerWaalsContact SG-SG 3.63Å; C75-A77 PolarHBondContact O-N 3.3Å; C75-A77 VanDerWaalsContact O-N 3.09Å; C75-A77 VanDerWaalsContact SG-CB 3.55Å
76	R	92.3	Very high	85.9	Confident	210 Å²	210	82.1 Å²	82.1	79%	0.792	41%	0.405	S	S	*	.			trans	63.8	7.4	-179.3	-50.1	177.9	-179	-176.6	-0.7	115.7	C72	C72-R76 WeakPolarHBondContact O-CA 3.27Å; C72-R76 PolarHBondContact O-N 3.5Å
77	A	91.7	Very high	86.1	Confident	39 Å²	39	76 Å²	76	32%	0.322	38%	0.383	S	S	.	.			trans	-59.7	146.4	172.2	0	0	0	0	0	111.3	C52 T71 C72 C75	C52-A77 HydrophobicContact CB-CB 3.92Å; T71-A77 CarbonylContact C-O 3.56Å; T71-A77 WeakPolarHBondContact CA-O 3.48Å; C72-A77 PolarHBondContact N-O 2.87Å; C75-A77 PolarHBondContact O-N 3.3Å; C75-A77 VanDerWaalsContact O-N 3.09Å; C75-A77 VanDerWaalsContact SG-CB 3.55Å
78	Y	90.8	Very high	86.6	Confident	160 Å²	160	74 Å²	74	63%	0.627	37%	0.373	S	S	*	.	B	Isolated β-bridge	trans	-63.3	138	173.3	176.4	-105.6	0	0	0	111.1	W70 P80	W70-Y78 HydrophobicContact CB-CD2 4.31Å; W70-Y78 HydrophobicContact CB-CE2 3.84Å; W70-Y78 WeakPolarHBondContact O-CD2 3.04Å; Y78-P80 HydrophobicContact CE1-CB 4.25Å
79	L	85.4	Confident	87.5	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.351	C	S	.	.			trans	-117.4	117	179.8	-64.5	-175	0	0	0	109.6	T50 I61 I65 W70 C72 S81	T50-L79 HydrophobicContact CG2-CD1 3.77Å; T50-L79 HydrophobicContact CG2-CD2 4.23Å; I61-L79 HydrophobicContact CD1-CD1 3.91Å; I65-L79 HydrophobicContact CD1-CB 4.42Å; I65-L79 HydrophobicContact CD1-CD1 3.89Å; I65-L79 HydrophobicContact CG1-CD1 4.29Å; W70-L79 WeakPolarHBondContact CB-O 3.41Å; W70-L79 PolarHBondContact O-N 2.96Å; C72-L79 HydrophobicContact CB-CD1 4.07Å; C72-L79 HydrophobicContact CB-CD2 4.19Å; C72-L79 HydrophobicContact CB-CG 4.13Å; L79-S81 PolarHBondContact O-N 2.73Å
80	P	79.3	Confident	88.1	Confident	75 Å²	75	62.5 Å²	62.5	49%	0.487	33%	0.325	S	S	.	.	S	Bend	trans	-76.3	-10.9	177.5	31.6	-35.7	0	0	0	113.2	R51 Y78	R51-P80 HydrophobicContact CG-CG 3.9Å; Y78-P80 HydrophobicContact CE1-CB 4.25Å
81	S	83.5	Confident	88.1	Confident	44 Å²	44	62.4 Å²	62.4	31%	0.308	33%	0.327	S	S	.	.	S	Bend	trans	-157.7	167.1	-176.8	62.9	0	0	0	0	109.4	L79 G83	L79-S81 PolarHBondContact O-N 2.73Å; S81-G83 PolarHBondContact O-N 2.96Å
82	E	79.2	Confident	88.1	Confident	76 Å²	76	65 Å²	65	36%	0.355	33%	0.332	S	S	.	.	S	Bend	trans	-60.5	-26.7	172.7	-61.9	-177.7	176.1	0	0	113.4	V48 I61 A62 I65	V48-E82 WeakPolarHBondContact CG1-O 3.39Å; I61-E82 WeakPolarHBondContact CG1-O 3.41Å; I61-E82 HydrophobicContact CG2-CB 4.49Å; A62-E82 WeakPolarHBondContact CB-OE1 3.37Å; I65-E82 HydrophobicContact CD1-CB 4.21Å; I65-E82 HydrophobicContact CD1-CG 4.01Å
83	G	87.4	Confident	88.2	Confident	19 Å²	19	65.3 Å²	65.3	20%	0.196	33%	0.334	C	S	.	.			trans	126.4	-165.7	177.6	0	0	0	0	0	110.9	R49 S81	R49-G83 CarbonylContact O-C 3.45Å; R49-G83 VanDerWaalsContact O-CA 3.26Å; R49-G83 WeakPolarHBondContact O-CA 3.47Å; S81-G83 PolarHBondContact O-N 2.96Å
84	V	84.1	Confident	88.3	Confident	89 Å²	89	70.2 Å²	70.2	54%	0.539	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	148.5	174	-63.8	0	0	0	0	109.5	V48 R49 A86	V48-V84 CarbonylContact C-O 3.59Å; V48-V84 WeakPolarHBondContact CA-O 3.42Å; R49-V84 PolarHBondContact N-O 2.91Å; R49-V84 PolarHBondContact O-N 3.23Å; V84-A86 PolarHBondContact O-N 3.36Å
85	P	86.3	Confident	88.3	Confident	32 Å²	32	68.2 Å²	68.2	21%	0.208	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	132.5	173.7	-25.1	33.7	0	0	0	111.6	T87 L198	P85-T87 VanDerWaalsContact C-N 3.3Å; P85-T87 HydrophobicContact CB-CG2 4.22Å; P85-T87 PolarHBondContact O-N 3.13Å; P85-T87 VanDerWaalsContact O-N 3.14Å; P85-L198 HydrophobicContact CG-CB 4.34Å; P85-L198 HydrophobicContact CG-CD2 3.72Å; P85-L198 WeakPolarHBondContact CG-O 3.39Å
86	A	89.3	Confident	88.4	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.008	35%	0.35	C	S	.	.			trans	-87.5	69.9	176	0	0	0	0	0	109.7	P47 R49 V55 V84 D88 I89 A90	P47-A86 HydrophobicContact CB-CB 4.09Å; P47-A86 HydrophobicContact CG-CB 4.37Å; P47-A86 PolarHBondContact O-N 2.7Å; R49-A86 HydrophobicContact CB-CB 4.05Å; V55-A86 HydrophobicContact CG1-CB 4.14Å; V84-A86 PolarHBondContact O-N 3.36Å; A86-D88 PolarHBondContact O-N 3.32Å; A86-I89 HydrophobicContact CB-CB 4.08Å; A86-I89 HydrophobicContact CB-CD1 4.02Å; A86-I89 HydrophobicContact CB-CG1 4.23Å; A86-I89 PolarHBondContact O-N 3.17Å; A86-A90 PolarHBondContact O-N 2.87Å
87	T	86.2	Confident	88.6	Confident	54 Å²	54	65.1 Å²	65.1	33%	0.331	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-32.2	-173.6	58.3	0	0	0	0	112.8	P85 A90 K91 D201	P85-T87 VanDerWaalsContact C-N 3.3Å; P85-T87 HydrophobicContact CB-CG2 4.22Å; P85-T87 PolarHBondContact O-N 3.13Å; P85-T87 VanDerWaalsContact O-N 3.14Å; T87-A90 PolarHBondContact O-N 3.43Å; T87-K91 WeakPolarHBondContact O-CB 3.4Å; T87-K91 VanDerWaalsContact O-CG 3.22Å; T87-K91 WeakPolarHBondContact O-CG 3.41Å; T87-K91 PolarHBondContact O-N 3.16Å; T87-D201 PolarHBondContact OG1-OD2 3.25Å
88	D	86.6	Confident	88.7	Confident	74 Å²	74	65.9 Å²	65.9	40%	0.396	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-42.9	172.5	61.5	-55.7	0	0	0	112.2	R49 A86 R92	R49-D88 IonicContact CZ-OD1 2.86Å; R49-D88 IonicContact CZ-OD2 3.37Å; R49-D88 IonicContact NH1-OD1 2.86Å; R49-D88 PolarHBondContact NH1-OD1 3.14Å; R49-D88 IonicContact NH1-OD2 2.73Å; R49-D88 VanDerWaalsContact NH2-CG 3.31Å; R49-D88 IonicContact NH2-OD1 2.96Å; R49-D88 PolarHBondContact NH2-OD1 2.88Å; R49-D88 VanDerWaalsContact NH2-OD1 3.09Å; R49-D88 IonicContact NH2-OD2 3.09Å; R49-D88 PolarHBondContact NH2-OD2 3.28Å; A86-D88 PolarHBondContact O-N 3.32Å; D88-R92 WeakPolarHBondContact O-CG 3.42Å; D88-R92 PolarHBondContact O-N 3.28Å; D88-R92 VanDerWaalsContact O-N 3.08Å
89	I	90.2	Very high	89	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.062	33%	0.332	C	S	.	.	H	α-helix	trans	-70.4	-46.7	176.7	-66.1	178.6	0	0	0	109.9	F35 L44 P47 V55 A86 K91 R92 M93	F35-I89 HydrophobicContact CD1-CG2 3.75Å; F35-I89 HydrophobicContact CE1-CG2 3.9Å; L44-I89 HydrophobicContact CD1-CG2 4.07Å; P47-I89 HydrophobicContact CB-CG2 4.25Å; P47-I89 HydrophobicContact CG-CB 4.4Å; P47-I89 HydrophobicContact CG-CG2 4.18Å; V55-I89 HydrophobicContact CB-CD1 4.13Å; V55-I89 HydrophobicContact CG1-CD1 3.82Å; V55-I89 HydrophobicContact CG2-CD1 3.59Å; A86-I89 HydrophobicContact CB-CB 4.08Å; A86-I89 HydrophobicContact CB-CD1 4.02Å; A86-I89 HydrophobicContact CB-CG1 4.23Å; A86-I89 PolarHBondContact O-N 3.17Å; I89-K91 VanDerWaalsContact C-N 3.25Å; I89-K91 PolarHBondContact O-N 2.93Å; I89-R92 PolarHBondContact O-N 3.04Å; I89-R92 VanDerWaalsContact O-N 3.14Å; I89-M93 HydrophobicContact CG2-CG 4.31Å; I89-M93 HydrophobicContact CG2-SD 4.04Å; I89-M93 VanDerWaalsContact O-CG 3.27Å; I89-M93 WeakPolarHBondContact O-CG 3.24Å; I89-M93 PolarHBondContact O-N 3.48Å
90	A	88.9	Confident	89.4	Confident	33 Å²	33	63.4 Å²	63.4	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-37.1	177.6	0	0	0	0	0	112.3	P47 A86 T87	P47-A90 HydrophobicContact CG-CB 3.95Å; A86-A90 PolarHBondContact O-N 2.87Å; T87-A90 PolarHBondContact O-N 3.43Å
91	K	86.6	Confident	90	Very high	116 Å²	116	65.5 Å²	65.5	50%	0.504	35%	0.345	S	S	.	.	H	α-helix	trans	-65.8	-46.9	174.4	-76.9	171.6	-170.9	171.1	0	111.2	T87 I89 M93 K94 D201	T87-K91 WeakPolarHBondContact O-CB 3.4Å; T87-K91 VanDerWaalsContact O-CG 3.22Å; T87-K91 WeakPolarHBondContact O-CG 3.41Å; T87-K91 PolarHBondContact O-N 3.16Å; I89-K91 VanDerWaalsContact C-N 3.25Å; I89-K91 PolarHBondContact O-N 2.93Å; K91-M93 VanDerWaalsContact C-N 3.33Å; K91-M93 PolarHBondContact O-N 2.88Å; K91-K94 WeakPolarHBondContact O-CB 3.22Å; K91-K94 PolarHBondContact O-N 3.39Å; K91-K94 VanDerWaalsContact O-N 3.16Å; K91-D201 IonicContact NZ-OD2 2.77Å; K91-D201 PolarHBondContact NZ-OD2 3.07Å
92	R	93.5	Very high	90.5	Very high	101 Å²	101	65.4 Å²	65.4	38%	0.381	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-40.9	176.6	-76.4	178.8	58.8	-151.5	-5.4	112.9	S34 F35 D88 I89 K94 S95 E96	S34-R92 PolarHBondContact OG-NH2 2.93Å; F35-R92 HydrophobicContact CE1-CB 4.04Å; F35-R92 HydrophobicContact CZ-CB 4.08Å; D88-R92 WeakPolarHBondContact O-CG 3.42Å; D88-R92 PolarHBondContact O-N 3.28Å; D88-R92 VanDerWaalsContact O-N 3.08Å; I89-R92 PolarHBondContact O-N 3.04Å; I89-R92 VanDerWaalsContact O-N 3.14Å; R92-K94 PolarHBondContact O-N 3.02Å; R92-K94 VanDerWaalsContact O-N 3.1Å; R92-S95 PolarHBondContact O-N 3.17Å; R92-S95 PolarHBondContact O-OG 2.81Å; R92-E96 IonicContact CZ-OE1 3.62Å; R92-E96 VanDerWaalsContact CZ-OE1 3.29Å; R92-E96 IonicContact NE-OE1 2.88Å; R92-E96 PolarHBondContact NE-OE1 3.2Å; R92-E96 IonicContact NH2-OE1 3.7Å; R92-E96 PolarHBondContact NH2-OE1 2.96Å; R92-E96 IonicContact NH2-OE2 2.73Å; R92-E96 WeakPolarHBondContact O-CG 3.26Å; R92-E96 PolarHBondContact O-N 3.23Å; R92-E96 VanDerWaalsContact O-N 3.13Å
93	M	94.4	Very high	91.3	Very high	8 Å²	8	63.2 Å²	63.2	4%	0.039	33%	0.332	C	S	.	.	H	α-helix	trans	-59.1	-22.6	177.7	-71.4	174.6	78.1	0	0	113.7	F35 V43 L44 P47 I89 K91 S95 C108 L109 S110	F35-M93 HydrophobicContact CD1-CG 3.27Å; F35-M93 HydrophobicContact CD1-SD 4.05Å; F35-M93 HydrophobicContact CE1-CG 3.56Å; F35-M93 HydrophobicContact CG-CG 4.17Å; V43-M93 HydrophobicContact CG1-CE 3.6Å; L44-M93 HydrophobicContact CB-CE 4.26Å; L44-M93 HydrophobicContact CB-SD 4.32Å; L44-M93 WeakPolarHBondContact O-CE 3.3Å; P47-M93 HydrophobicContact CG-SD 4.39Å; I89-M93 HydrophobicContact CG2-CG 4.31Å; I89-M93 HydrophobicContact CG2-SD 4.04Å; I89-M93 VanDerWaalsContact O-CG 3.27Å; I89-M93 WeakPolarHBondContact O-CG 3.24Å; I89-M93 PolarHBondContact O-N 3.48Å; K91-M93 VanDerWaalsContact C-N 3.33Å; K91-M93 PolarHBondContact O-N 2.88Å; M93-S95 VanDerWaalsContact C-N 3.29Å; M93-C108 PolarHBondContact O-SG 3.24Å; M93-L109 HydrophobicContact CB-CB 3.96Å; M93-L109 HydrophobicContact CE-CB 4.27Å; M93-L109 WeakPolarHBondContact CE-O 3.39Å; M93-L109 HydrophobicContact CG-CB 4.13Å; M93-L109 WeakPolarHBondContact O-CB 3.48Å; M93-L109 PolarHBondContact O-N 3.13Å; M93-S110 PolarHBondContact O-N 3.14Å
94	K	93.4	Very high	91.7	Very high	148 Å²	148	64.5 Å²	64.5	64%	0.643	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-10.9	176.4	-66	176.5	178.9	-175.9	0	113.9	K91 R92	K91-K94 WeakPolarHBondContact O-CB 3.22Å; K91-K94 PolarHBondContact O-N 3.39Å; K91-K94 VanDerWaalsContact O-N 3.16Å; R92-K94 PolarHBondContact O-N 3.02Å; R92-K94 VanDerWaalsContact O-N 3.1Å
95	S	93.2	Very high	92.4	Very high	84 Å²	84	63.8 Å²	63.8	59%	0.587	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-4.8	-177.6	54.1	0	0	0	0	113.6	R92 M93	R92-S95 PolarHBondContact O-N 3.17Å; R92-S95 PolarHBondContact O-OG 2.81Å; M93-S95 VanDerWaalsContact C-N 3.29Å
96	E	95.1	Very high	92.9	Very high	61 Å²	61	67.4 Å²	67.4	29%	0.285	36%	0.359	S	S	.	.			trans	-109	140.5	-179	-69.1	-171.2	-138	0	0	109.9	F35 R92 L109	F35-E96 WeakPolarHBondContact CE2-OE2 3.2Å; F35-E96 VanDerWaalsContact CZ-CD 3.47Å; F35-E96 WeakPolarHBondContact CZ-OE1 3.26Å; F35-E96 VanDerWaalsContact CZ-OE2 3.31Å; F35-E96 WeakPolarHBondContact CZ-OE2 3.39Å; R92-E96 IonicContact CZ-OE1 3.62Å; R92-E96 VanDerWaalsContact CZ-OE1 3.29Å; R92-E96 IonicContact NE-OE1 2.88Å; R92-E96 PolarHBondContact NE-OE1 3.2Å; R92-E96 IonicContact NH2-OE1 3.7Å; R92-E96 PolarHBondContact NH2-OE1 2.96Å; R92-E96 IonicContact NH2-OE2 2.73Å; R92-E96 WeakPolarHBondContact O-CG 3.26Å; R92-E96 PolarHBondContact O-N 3.23Å; R92-E96 VanDerWaalsContact O-N 3.13Å; E96-L109 HydrophobicContact CB-CD1 3.8Å; E96-L109 PolarHBondContact O-N 3.35Å
97	Y	95.5	Very high	93.3	Very high	142 Å²	142	68.1 Å²	68.1	56%	0.557	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.9	-174.3	-64.7	-100.9	0	0	0	110	V107 C108	Y97-V107 WeakPolarHBondContact CA-O 3.18Å; Y97-C108 HydrophobicContact CD1-CB 4Å; Y97-C108 HydrophobicContact CE1-CB 3.7Å
98	Q	94.7	Very high	93.7	Very high	55 Å²	55	66.1 Å²	66.1	26%	0.257	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152.8	173.7	-71.9	-174.7	-8.9	0	0	110.3	V107 L109 M112	Q98-V107 PolarHBondContact N-O 3.08Å; Q98-V107 PolarHBondContact O-N 3.39Å; Q98-L109 HydrophobicContact CB-CD2 3.92Å; Q98-L109 HydrophobicContact CG-CD1 4.37Å; Q98-L109 HydrophobicContact CG-CD2 3.8Å; Q98-L109 HydrophobicContact CG-CG 4.23Å; Q98-M112 HydrophobicContact CB-CE 4.21Å; Q98-M112 VanDerWaalsContact O-CE 3.27Å; Q98-M112 WeakPolarHBondContact O-CE 3.4Å
99	N	95.9	Very high	94.1	Very high	103 Å²	103	62.7 Å²	62.7	55%	0.551	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	134.5	173.3	-62	-44.3	0	0	0	109.1	T101 T105 L106	N99-T101 PolarHBondContact O-N 3.23Å; N99-T105 CarbonylContact C-O 3.56Å; N99-T105 WeakPolarHBondContact CA-O 3.44Å; N99-L106 WeakPolarHBondContact OD1-CA 3.2Å; N99-L106 WeakPolarHBondContact OD1-CB 3.48Å; N99-L106 VanDerWaalsContact OD1-CD1 3.28Å; N99-L106 WeakPolarHBondContact OD1-CD1 3.07Å
100	C	94.6	Very high	94.2	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.034	35%	0.346	C	S	.	.			trans	-56.6	129.8	165.8	173.3	0	0	0	0	109	E102 C103 G104 T105 M112 H115	C100-E102 PolarHBondContact O-N 3.24Å; C100-C103 VanDerWaalsContact CB-SG 3.52Å; C100-C103 PolarHBondContact SG-N 2.87Å; C100-C103 VanDerWaalsContact SG-SG 3.64Å; C100-G104 VanDerWaalsContact O-CA 3.24Å; C100-G104 WeakPolarHBondContact O-CA 3.5Å; C100-G104 PolarHBondContact O-N 2.93Å; C100-T105 PolarHBondContact N-O 2.77Å; C100-M112 HydrophobicContact CB-SD 4.29Å; C100-H115 VanDerWaalsContact CB-NE2 3.3Å; C100-H115 WeakPolarHBondContact CB-NE2 3.42Å; C100-H115 PolarHBondContact SG-NE2 3.46Å
101	T	91.8	Very high	94.5	Very high	118 Å²	118	66.9 Å²	66.9	72%	0.724	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.3	-176.9	58.3	0	0	0	0	113.1	N99	N99-T101 PolarHBondContact O-N 3.23Å
102	E	94.4	Very high	94.8	Very high	42 Å²	42	61.6 Å²	61.6	20%	0.196	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-47.4	-174.4	-54.2	-50.2	136.1	0	0	112.6	C100 K121 Y122 K125 Y126	C100-E102 PolarHBondContact O-N 3.24Å; E102-K121 HydrophobicContact CB-CB 4.16Å; E102-K121 WeakPolarHBondContact O-CD 3.23Å; E102-Y122 HydrophobicContact CG-CD2 3.79Å; E102-Y122 HydrophobicContact CG-CG 4.29Å; E102-K125 IonicContact OE1-NZ 3.9Å; E102-K125 PolarHBondContact OE1-NZ 3.37Å; E102-K125 WeakPolarHBondContact OE2-CD 3.35Å; E102-K125 WeakPolarHBondContact OE2-CE 3.47Å; E102-K125 IonicContact OE2-NZ 3.29Å; E102-K125 PolarHBondContact OE2-NZ 2.82Å; E102-Y126 HydrophobicContact CG-CE2 3.98Å
103	C	96.3	Very high	94.7	Very high	30 Å²	30	57.3 Å²	57.3	20%	0.203	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-17.8	-178.8	78	0	0	0	0	115.1	C100 T105 H115 K121	C100-C103 VanDerWaalsContact CB-SG 3.52Å; C100-C103 PolarHBondContact SG-N 2.87Å; C100-C103 VanDerWaalsContact SG-SG 3.64Å; C103-T105 PolarHBondContact O-N 3.09Å; C103-T105 WeakPolarHBondContact SG-CB 3.28Å; C103-T105 PolarHBondContact SG-N 2.7Å; C103-T105 PolarHBondContact SG-OG1 3.35Å; C103-H115 PolarHBondContact SG-CE1 2.84Å; C103-H115 PolarHBondContact SG-NE2 2.57Å; C103-K121 HydrophobicContact CB-CB 4.43Å; C103-K121 HydrophobicContact CB-CD 4.17Å; C103-K121 HydrophobicContact CB-CG 4.42Å
104	G	95.8	Very high	94.5	Very high	47 Å²	47	61.2 Å²	61.2	49%	0.485	34%	0.34	S	S	.	.			trans	77.8	-2.3	-177.8	0	0	0	0	0	114.7	C100 L106	C100-G104 VanDerWaalsContact O-CA 3.24Å; C100-G104 WeakPolarHBondContact O-CA 3.5Å; C100-G104 PolarHBondContact O-N 2.93Å; G104-L106 PolarHBondContact O-N 2.96Å
105	T	97.4	Very high	94.6	Very high	73 Å²	73	55.8 Å²	55.8	45%	0.448	32%	0.317	S	S	.	.			trans	-62.9	131	176.8	-58.4	0	0	0	0	110	N99 C100 C103 V107	N99-T105 CarbonylContact C-O 3.56Å; N99-T105 WeakPolarHBondContact CA-O 3.44Å; C100-T105 PolarHBondContact N-O 2.77Å; C103-T105 PolarHBondContact O-N 3.09Å; C103-T105 WeakPolarHBondContact SG-CB 3.28Å; C103-T105 PolarHBondContact SG-N 2.7Å; C103-T105 PolarHBondContact SG-OG1 3.35Å; T105-V107 HydrophobicContact CG2-CG2 3.91Å; T105-V107 PolarHBondContact O-N 3.2Å
106	L	97.3	Very high	94.5	Very high	108 Å²	108	52.2 Å²	52.2	57%	0.565	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	119.2	172	-173.3	69.9	0	0	0	109.3	N99 G104	N99-L106 WeakPolarHBondContact OD1-CA 3.2Å; N99-L106 WeakPolarHBondContact OD1-CB 3.48Å; N99-L106 VanDerWaalsContact OD1-CD1 3.28Å; N99-L106 WeakPolarHBondContact OD1-CD1 3.07Å; G104-L106 PolarHBondContact O-N 2.96Å
107	V	96.6	Very high	94.3	Very high	17 Å²	17	54.7 Å²	54.7	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142	-175.7	-171.6	0	0	0	0	109.6	Y97 Q98 T105 D111 M112 H115	Y97-V107 WeakPolarHBondContact CA-O 3.18Å; Q98-V107 PolarHBondContact N-O 3.08Å; Q98-V107 PolarHBondContact O-N 3.39Å; T105-V107 HydrophobicContact CG2-CG2 3.91Å; T105-V107 PolarHBondContact O-N 3.2Å; V107-D111 HydrophobicContact CG1-CB 4.19Å; V107-M112 HydrophobicContact CB-CE 3.77Å; V107-M112 HydrophobicContact CB-SD 3.99Å; V107-M112 HydrophobicContact CG1-SD 4.38Å; V107-M112 HydrophobicContact CG2-CE 4.38Å; V107-M112 HydrophobicContact CG2-SD 4.29Å; V107-H115 HydrophobicContact CG1-CB 3.94Å; V107-H115 HydrophobicContact CG2-CB 4.15Å
108	C	96.6	Very high	94.2	Very high	12 Å²	12	52.9 Å²	52.9	8%	0.081	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	135.3	170.4	-173	0	0	0	0	109.2	M93 Y97 S110 D111 M112	M93-C108 PolarHBondContact O-SG 3.24Å; Y97-C108 HydrophobicContact CD1-CB 4Å; Y97-C108 HydrophobicContact CE1-CB 3.7Å; C108-S110 PolarHBondContact O-N 2.73Å; C108-S110 PolarHBondContact SG-OG 3.4Å; C108-D111 HydrophobicContact CB-CB 4.43Å; C108-D111 CarbonylContact O-C 3.57Å; C108-D111 PolarHBondContact O-N 2.97Å; C108-M112 PolarHBondContact O-N 2.83Å
109	L	95.1	Very high	94.2	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.3	-176.7	-76.6	177.7	0	0	0	113	F35 V43 M93 E96 Q98 D111 M112	F35-L109 HydrophobicContact CB-CD1 4.06Å; F35-L109 HydrophobicContact CD1-CD1 4.21Å; F35-L109 HydrophobicContact CD2-CD1 3.34Å; F35-L109 HydrophobicContact CE2-CD1 3.71Å; F35-L109 HydrophobicContact CG-CD1 3.59Å; F35-L109 HydrophobicContact CZ-CD1 4.25Å; V43-L109 HydrophobicContact CG1-CD2 4.09Å; V43-L109 HydrophobicContact CG2-CD2 4.25Å; M93-L109 HydrophobicContact CB-CB 3.96Å; M93-L109 HydrophobicContact CE-CB 4.27Å; M93-L109 WeakPolarHBondContact CE-O 3.39Å; M93-L109 HydrophobicContact CG-CB 4.13Å; M93-L109 WeakPolarHBondContact O-CB 3.48Å; M93-L109 PolarHBondContact O-N 3.13Å; E96-L109 HydrophobicContact CB-CD1 3.8Å; E96-L109 PolarHBondContact O-N 3.35Å; Q98-L109 HydrophobicContact CB-CD2 3.92Å; Q98-L109 HydrophobicContact CG-CD1 4.37Å; Q98-L109 HydrophobicContact CG-CD2 3.8Å; Q98-L109 HydrophobicContact CG-CG 4.23Å; L109-D111 PolarHBondContact O-N 3.08Å; L109-M112 PolarHBondContact O-N 2.82Å
110	S	92.1	Very high	94.2	Very high	48 Å²	48	53 Å²	53	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.1	173.7	63.1	0	0	0	0	113.7	M93 C108	M93-S110 PolarHBondContact O-N 3.14Å; C108-S110 PolarHBondContact O-N 2.73Å; C108-S110 PolarHBondContact SG-OG 3.4Å
111	D	94.1	Very high	94.2	Very high	86 Å²	86	58.7 Å²	58.7	46%	0.46	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-6.8	-172.1	-52.8	-24.9	0	0	0	112.2	V107 C108 L109 R113 T114 H115	V107-D111 HydrophobicContact CG1-CB 4.19Å; C108-D111 HydrophobicContact CB-CB 4.43Å; C108-D111 CarbonylContact O-C 3.57Å; C108-D111 PolarHBondContact O-N 2.97Å; L109-D111 PolarHBondContact O-N 3.08Å; D111-R113 VanDerWaalsContact C-N 3.25Å; D111-R113 PolarHBondContact O-N 3.2Å; D111-T114 WeakPolarHBondContact O-CB 3.2Å; D111-T114 PolarHBondContact O-N 2.99Å; D111-H115 PolarHBondContact O-N 3.32Å
112	M	93.8	Very high	94.3	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-56.7	-37.9	-175.7	-174.7	63.2	80.8	0	0	112.4	V43 Q98 C100 V107 C108 L109 T114 H115 I116	V43-M112 HydrophobicContact CB-CB 4.33Å; V43-M112 HydrophobicContact CB-CG 4.24Å; V43-M112 HydrophobicContact CG1-CB 4.29Å; V43-M112 HydrophobicContact CG2-CB 4.22Å; V43-M112 HydrophobicContact CG2-CG 3.75Å; Q98-M112 HydrophobicContact CB-CE 4.21Å; Q98-M112 VanDerWaalsContact O-CE 3.27Å; Q98-M112 WeakPolarHBondContact O-CE 3.4Å; C100-M112 HydrophobicContact CB-SD 4.29Å; V107-M112 HydrophobicContact CB-CE 3.77Å; V107-M112 HydrophobicContact CB-SD 3.99Å; V107-M112 HydrophobicContact CG1-SD 4.38Å; V107-M112 HydrophobicContact CG2-CE 4.38Å; V107-M112 HydrophobicContact CG2-SD 4.29Å; C108-M112 PolarHBondContact O-N 2.83Å; L109-M112 PolarHBondContact O-N 2.82Å; M112-T114 PolarHBondContact O-N 3.36Å; M112-H115 WeakPolarHBondContact O-CB 3.38Å; M112-H115 PolarHBondContact O-N 2.75Å; M112-I116 HydrophobicContact CG-CD1 3.81Å; M112-I116 HydrophobicContact CG-CG1 4.32Å; M112-I116 VanDerWaalsContact O-CG1 3.27Å; M112-I116 WeakPolarHBondContact O-CG1 3.18Å; M112-I116 PolarHBondContact O-N 2.83Å; M112-I116 HydrophobicContact SD-CD1 4.3Å; M112-I116 HydrophobicContact SD-CG1 4.3Å
113	R	91.8	Very high	94.2	Very high	10 Å²	10	54.2 Å²	54.2	4%	0.038	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-48	174.6	-80.1	-80.3	-175.6	120.3	0.4	112.5	C40 V43 H45 C57 D111 H115 I116 R117 E131	C40-R113 PolarHBondContact SG-NH2 2.84Å; C40-R113 VanDerWaalsContact SG-NH2 3.42Å; V43-R113 PolarHBondContact O-NE 3.41Å; V43-R113 PolarHBondContact O-NH2 2.9Å; H45-R113 HydrophobicContact CB-CG 4.06Å; H45-R113 VanDerWaalsContact CB-NH1 3.31Å; C57-R113 PolarHBondContact SG-NH2 3.12Å; D111-R113 VanDerWaalsContact C-N 3.25Å; D111-R113 PolarHBondContact O-N 3.2Å; R113-H115 VanDerWaalsContact C-N 3.3Å; R113-H115 PolarHBondContact O-N 3.43Å; R113-I116 PolarHBondContact O-N 2.6Å; R113-R117 WeakPolarHBondContact O-CG 3.26Å; R113-R117 PolarHBondContact O-N 3.45Å; R113-R117 VanDerWaalsContact O-N 3.16Å; R113-E131 IonicContact CZ-OE1 2.73Å; R113-E131 IonicContact NH1-OE1 3.69Å; R113-E131 PolarHBondContact NH1-OE1 3.34Å
114	T	89.9	Confident	94.1	Very high	90 Å²	90	59.3 Å²	59.3	55%	0.552	32%	0.321	S	S	*	.	H	α-helix	trans	-63.9	-39.9	178.6	-52	0	0	0	0	110.8	D111 M112 T118	D111-T114 WeakPolarHBondContact O-CB 3.2Å; D111-T114 PolarHBondContact O-N 2.99Å; M112-T114 PolarHBondContact O-N 3.36Å; T114-T118 PolarHBondContact O-OG1 3.41Å
115	H	94.5	Very high	93.9	Very high	35 Å²	35	62.6 Å²	62.6	16%	0.162	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-51.9	173.2	168.8	71	0	0	0	111.9	C100 C103 V107 D111 M112 R113 R117 T118 C119	C100-H115 VanDerWaalsContact CB-NE2 3.3Å; C100-H115 WeakPolarHBondContact CB-NE2 3.42Å; C100-H115 PolarHBondContact SG-NE2 3.46Å; C103-H115 PolarHBondContact SG-CE1 2.84Å; C103-H115 PolarHBondContact SG-NE2 2.57Å; V107-H115 HydrophobicContact CG1-CB 3.94Å; V107-H115 HydrophobicContact CG2-CB 4.15Å; D111-H115 PolarHBondContact O-N 3.32Å; M112-H115 WeakPolarHBondContact O-CB 3.38Å; M112-H115 PolarHBondContact O-N 2.75Å; R113-H115 VanDerWaalsContact C-N 3.3Å; R113-H115 PolarHBondContact O-N 3.43Å; H115-R117 PolarHBondContact O-N 2.94Å; H115-T118 CarbonylContact O-C 3.55Å; H115-T118 PolarHBondContact O-N 3.42Å; H115-T118 PolarHBondContact O-OG1 2.97Å; H115-T118 VanDerWaalsContact O-OG1 3.08Å; H115-C119 WeakPolarHBondContact O-CB 3.44Å; H115-C119 PolarHBondContact O-N 2.86Å
116	I	92.4	Very high	93.6	Very high	9 Å²	9	65.3 Å²	65.3	5%	0.046	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-36.8	-176.8	-69.5	167.1	0	0	0	111.6	M112 R113 T118 C119 Y122 L129	M112-I116 HydrophobicContact CG-CD1 3.81Å; M112-I116 HydrophobicContact CG-CG1 4.32Å; M112-I116 VanDerWaalsContact O-CG1 3.27Å; M112-I116 WeakPolarHBondContact O-CG1 3.18Å; M112-I116 PolarHBondContact O-N 2.83Å; M112-I116 HydrophobicContact SD-CD1 4.3Å; M112-I116 HydrophobicContact SD-CG1 4.3Å; R113-I116 PolarHBondContact O-N 2.6Å; I116-T118 PolarHBondContact O-N 3.44Å; I116-T118 VanDerWaalsContact O-N 3.14Å; I116-C119 PolarHBondContact O-N 3.49Å; I116-Y122 HydrophobicContact CG1-CD2 4.48Å; I116-Y122 HydrophobicContact CG2-CD1 3.42Å; I116-Y122 VanDerWaalsContact CG2-CD1 3.42Å; I116-Y122 HydrophobicContact CG2-CD2 3.7Å; I116-Y122 HydrophobicContact CG2-CE1 3.41Å; I116-Y122 VanDerWaalsContact CG2-CE1 3.41Å; I116-Y122 HydrophobicContact CG2-CE2 3.66Å; I116-Y122 HydrophobicContact CG2-CG 3.59Å; I116-L129 HydrophobicContact CB-CD1 4.15Å; I116-L129 HydrophobicContact CG2-CB 4.37Å; I116-L129 HydrophobicContact CG2-CD1 3.42Å; I116-L129 VanDerWaalsContact CG2-CD1 3.42Å
117	R	90.2	Very high	93.2	Very high	112 Å²	112	61.3 Å²	61.3	42%	0.423	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.5	175.1	-68.8	179.1	-158.6	-176.2	6.6	114.5	R113 H115 I123 E131	R113-R117 WeakPolarHBondContact O-CG 3.26Å; R113-R117 PolarHBondContact O-N 3.45Å; R113-R117 VanDerWaalsContact O-N 3.16Å; H115-R117 PolarHBondContact O-N 2.94Å; R117-I123 WeakPolarHBondContact O-CD1 3.5Å; R117-E131 IonicContact CZ-OE1 3.61Å; R117-E131 IonicContact CZ-OE2 3.52Å; R117-E131 IonicContact NE-OE1 3.56Å; R117-E131 IonicContact NH2-OE1 2.82Å; R117-E131 PolarHBondContact NH2-OE1 3.48Å; R117-E131 IonicContact NH2-OE2 2.78Å; R117-E131 PolarHBondContact NH2-OE2 2.81Å
118	T	92.8	Very high	92.6	Very high	105 Å²	105	65.2 Å²	65.2	64%	0.644	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	1.6	-178.7	55.1	0	0	0	0	112.7	T114 H115 I116 E120	T114-T118 PolarHBondContact O-OG1 3.41Å; H115-T118 CarbonylContact O-C 3.55Å; H115-T118 PolarHBondContact O-N 3.42Å; H115-T118 PolarHBondContact O-OG1 2.97Å; H115-T118 VanDerWaalsContact O-OG1 3.08Å; I116-T118 PolarHBondContact O-N 3.44Å; I116-T118 VanDerWaalsContact O-N 3.14Å; T118-E120 PolarHBondContact O-N 2.95Å
119	C	94.3	Very high	92	Very high	7 Å²	7	66.1 Å²	66.1	5%	0.047	34%	0.339	C	S	.	.			trans	-81.7	101.8	-178	179.8	0	0	0	0	109.9	H115 I116 K121 Y122 I123	H115-C119 WeakPolarHBondContact O-CB 3.44Å; H115-C119 PolarHBondContact O-N 2.86Å; I116-C119 PolarHBondContact O-N 3.49Å; C119-K121 VanDerWaalsContact C-N 3.29Å; C119-K121 PolarHBondContact O-N 3.3Å; C119-Y122 PolarHBondContact O-N 3.41Å; C119-I123 VanDerWaalsContact O-CG1 3.3Å; C119-I123 WeakPolarHBondContact O-CG1 3.48Å; C119-I123 PolarHBondContact O-N 3.07Å
120	E	96.2	Very high	90.7	Very high	154 Å²	154	74.5 Å²	74.5	72%	0.72	38%	0.378	S	S	*	.	H	α-helix	trans	-50.2	-47.6	179.8	-66.3	178.9	170.6	0	0	112.2	T118 Y122 I123 D124	T118-E120 PolarHBondContact O-N 2.95Å; E120-Y122 VanDerWaalsContact C-N 3.3Å; E120-Y122 PolarHBondContact O-N 3.1Å; E120-I123 PolarHBondContact O-N 3.21Å; E120-D124 WeakPolarHBondContact O-CB 3.32Å; E120-D124 PolarHBondContact O-N 3.27Å
121	K	95.6	Very high	89.4	Confident	123 Å²	123	73.9 Å²	73.9	54%	0.535	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-34.3	-179.5	-60.4	-163.6	-161.5	165.4	0	113.8	E102 C103 C119	E102-K121 HydrophobicContact CB-CB 4.16Å; E102-K121 WeakPolarHBondContact O-CD 3.23Å; C103-K121 HydrophobicContact CB-CB 4.43Å; C103-K121 HydrophobicContact CB-CD 4.17Å; C103-K121 HydrophobicContact CB-CG 4.42Å; C119-K121 VanDerWaalsContact C-N 3.29Å; C119-K121 PolarHBondContact O-N 3.3Å
122	Y	93.2	Very high	87.8	Confident	16 Å²	16	73.6 Å²	73.6	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-72.3	-47.3	175.4	-179.4	-76.1	0	0	0	110.1	E42 E102 I116 C119 E120 D124 K125 Y126	E42-Y122 VanDerWaalsContact CD-OH 3.24Å; E42-Y122 PolarHBondContact OE1-OH 2.98Å; E102-Y122 HydrophobicContact CG-CD2 3.79Å; E102-Y122 HydrophobicContact CG-CG 4.29Å; I116-Y122 HydrophobicContact CG1-CD2 4.48Å; I116-Y122 HydrophobicContact CG2-CD1 3.42Å; I116-Y122 VanDerWaalsContact CG2-CD1 3.42Å; I116-Y122 HydrophobicContact CG2-CD2 3.7Å; I116-Y122 HydrophobicContact CG2-CE1 3.41Å; I116-Y122 VanDerWaalsContact CG2-CE1 3.41Å; I116-Y122 HydrophobicContact CG2-CE2 3.66Å; I116-Y122 HydrophobicContact CG2-CG 3.59Å; C119-Y122 PolarHBondContact O-N 3.41Å; E120-Y122 VanDerWaalsContact C-N 3.3Å; E120-Y122 PolarHBondContact O-N 3.1Å; Y122-D124 VanDerWaalsContact C-N 3.3Å; Y122-D124 PolarHBondContact O-N 3.43Å; Y122-K125 PolarHBondContact O-N 3.32Å; Y122-K125 VanDerWaalsContact O-N 3.07Å; Y122-Y126 HydrophobicContact CD1-CD2 4.22Å; Y122-Y126 AromaticContact CD2-CD2 3.77Å; Y122-Y126 HydrophobicContact CD2-CD2 3.77Å; Y122-Y126 HydrophobicContact CD2-CE2 4.17Å; Y122-Y126 HydrophobicContact CE1-CD2 4.12Å; Y122-Y126 HydrophobicContact CE1-CG 4.4Å; Y122-Y126 AromaticContact CE2-CD2 3.69Å; Y122-Y126 HydrophobicContact CE2-CD2 3.69Å; Y122-Y126 HydrophobicContact CE2-CE2 4.13Å; Y122-Y126 HydrophobicContact CE2-CG 4.49Å; Y122-Y126 HydrophobicContact CG-CD2 4.04Å; Y122-Y126 AromaticContact CZ-CD2 3.86Å; Y122-Y126 PolarHBondContact O-N 3.25Å
123	I	92.8	Very high	85.8	Confident	50 Å²	50	76.2 Å²	76.2	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-41	-178.8	-65	165.3	0	0	0	110.8	R117 C119 E120 K125 G127	R117-I123 WeakPolarHBondContact O-CD1 3.5Å; C119-I123 VanDerWaalsContact O-CG1 3.3Å; C119-I123 WeakPolarHBondContact O-CG1 3.48Å; C119-I123 PolarHBondContact O-N 3.07Å; E120-I123 PolarHBondContact O-N 3.21Å; I123-K125 PolarHBondContact O-N 2.78Å; I123-G127 WeakPolarHBondContact O-CA 3.26Å; I123-G127 PolarHBondContact O-N 3.28Å
124	D	93.9	Very high	83.9	Confident	138 Å²	138	79.1 Å²	79.1	74%	0.738	41%	0.41	S	S	*	.	H	α-helix	trans	-61.9	-31.2	177.6	-72.7	-16.6	0	0	0	112.3	E120 Y122	E120-D124 WeakPolarHBondContact O-CB 3.32Å; E120-D124 PolarHBondContact O-N 3.27Å; Y122-D124 VanDerWaalsContact C-N 3.3Å; Y122-D124 PolarHBondContact O-N 3.43Å
125	K	92.6	Very high	81.7	Confident	115 Å²	115	80.5 Å²	80.5	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-91.1	-43.4	-175.4	-173.9	178.8	176.6	-163.5	0	113.4	E102 Y122 I123	E102-K125 IonicContact OE1-NZ 3.9Å; E102-K125 PolarHBondContact OE1-NZ 3.37Å; E102-K125 WeakPolarHBondContact OE2-CD 3.35Å; E102-K125 WeakPolarHBondContact OE2-CE 3.47Å; E102-K125 IonicContact OE2-NZ 3.29Å; E102-K125 PolarHBondContact OE2-NZ 2.82Å; Y122-K125 PolarHBondContact O-N 3.32Å; Y122-K125 VanDerWaalsContact O-N 3.07Å; I123-K125 PolarHBondContact O-N 2.78Å
126	Y	89.9	Confident	79.7	Confident	131 Å²	131	81.6 Å²	81.6	51%	0.514	43%	0.427	S	S	.	.	H	α-helix	trans	-113.1	-9.8	-172.1	-60.6	-69.7	0	0	0	113.4	E102 Y122	E102-Y126 HydrophobicContact CG-CE2 3.98Å; Y122-Y126 HydrophobicContact CD1-CD2 4.22Å; Y122-Y126 AromaticContact CD2-CD2 3.77Å; Y122-Y126 HydrophobicContact CD2-CD2 3.77Å; Y122-Y126 HydrophobicContact CD2-CE2 4.17Å; Y122-Y126 HydrophobicContact CE1-CD2 4.12Å; Y122-Y126 HydrophobicContact CE1-CG 4.4Å; Y122-Y126 AromaticContact CE2-CD2 3.69Å; Y122-Y126 HydrophobicContact CE2-CD2 3.69Å; Y122-Y126 HydrophobicContact CE2-CE2 4.13Å; Y122-Y126 HydrophobicContact CE2-CG 4.49Å; Y122-Y126 HydrophobicContact CG-CD2 4.04Å; Y122-Y126 AromaticContact CZ-CD2 3.86Å; Y122-Y126 PolarHBondContact O-N 3.25Å
127	G	88.5	Confident	78.2	Confident	23 Å²	23	83.4 Å²	83.4	24%	0.237	44%	0.439	C	S	.	.			trans	83	177.6	-167.5	0	0	0	0	0	112.6	I123 L129	I123-G127 WeakPolarHBondContact O-CA 3.26Å; I123-G127 PolarHBondContact O-N 3.28Å; G127-L129 PolarHBondContact O-N 3.29Å
128	P	85.6	Confident	77.6	Confident	99 Å²	99	86.3 Å²	86.3	64%	0.643	45%	0.45	S	S	*	.	S	Bend	trans	-61.6	137.6	174	27.3	-33.7	0	0	0	110	Q130	P128-Q130 PolarHBondContact O-N 3.28Å
129	L	82.2	Confident	77	Confident	32 Å²	32	81.7 Å²	81.7	17%	0.168	42%	0.422	C	S	.	.			trans	-61.6	110.9	-178.9	-167.1	148.1	0	0	0	109.8	E42 I116 G127 E131	E42-L129 HydrophobicContact CG-CD1 4.12Å; I116-L129 HydrophobicContact CB-CD1 4.15Å; I116-L129 HydrophobicContact CG2-CB 4.37Å; I116-L129 HydrophobicContact CG2-CD1 3.42Å; I116-L129 VanDerWaalsContact CG2-CD1 3.42Å; G127-L129 PolarHBondContact O-N 3.29Å; L129-E131 HydrophobicContact CD2-CG 3.3Å; L129-E131 PolarHBondContact O-N 3.24Å
130	Q	69.1	Low	76.5	Confident	177 Å²	177	85 Å²	85	83%	0.827	44%	0.441	S	S	*	.			trans	-85.3	95.5	179.5	-167	87.7	64.4	0	0	108.7	P128 L132	P128-Q130 PolarHBondContact O-N 3.28Å; Q130-L132 PolarHBondContact O-N 3.48Å
131	E	64	Low	76.1	Confident	35 Å²	35	77.6 Å²	77.6	16%	0.164	41%	0.407	C	S	.	.			trans	-71.8	127.4	170.1	-63.7	-168.5	156.7	0	0	108.9	R113 R117 L129 G133	R113-E131 IonicContact CZ-OE1 2.73Å; R113-E131 IonicContact NH1-OE1 3.69Å; R113-E131 PolarHBondContact NH1-OE1 3.34Å; R117-E131 IonicContact CZ-OE1 3.61Å; R117-E131 IonicContact CZ-OE2 3.52Å; R117-E131 IonicContact NE-OE1 3.56Å; R117-E131 IonicContact NH2-OE1 2.82Å; R117-E131 PolarHBondContact NH2-OE1 3.48Å; R117-E131 IonicContact NH2-OE2 2.78Å; R117-E131 PolarHBondContact NH2-OE2 2.81Å; L129-E131 HydrophobicContact CD2-CG 3.3Å; L129-E131 PolarHBondContact O-N 3.24Å; E131-G133 PolarHBondContact O-N 2.95Å
132	L	61.4	Low	75.7	Confident	79 Å²	79	73.6 Å²	73.6	41%	0.414	39%	0.394	S	S	.	.	S	Bend	trans	-54.9	107.3	168.6	-83.7	128.4	0	0	0	106.6	T63 Q130 E134	T63-L132 HydrophobicContact CG2-CD2 3.73Å; Q130-L132 PolarHBondContact O-N 3.48Å; L132-E134 PolarHBondContact O-N 3.17Å
133	G	51.2	Low	75.4	Confident	60 Å²	60	74 Å²	74	62%	0.619	40%	0.396	S	S	*	.			trans	-35.4	108.8	-158	0	0	0	0	0	113.3	E131 T135	E131-G133 PolarHBondContact O-N 2.95Å; G133-T135 PolarHBondContact O-N 2.89Å
134	E	51.3	Low	75.2	Confident	72 Å²	72	74.4 Å²	74.4	34%	0.336	40%	0.402	S	S	.	.			trans	-60.9	84.4	141.4	-79.7	168.2	-161.5	0	0	105.5	H45 L132 T136	H45-E134 IonicContact CD2-OE1 3.27Å; H45-E134 PolarHBondContact CD2-OE1 2.82Å; H45-E134 VanDerWaalsContact CD2-OE1 3.27Å; H45-E134 IonicContact NE2-OE1 3.59Å; L132-E134 PolarHBondContact O-N 3.17Å; E134-T136 PolarHBondContact O-N 2.82Å
135	T	43.2	Very low	75	Confident	118 Å²	118	75.5 Å²	75.5	72%	0.724	40%	0.403	S	S	*	.			trans	-64.8	78.1	146.3	46.1	0	0	0	0	104.8	G133 T137	G133-T135 PolarHBondContact O-N 2.89Å; T135-T137 PolarHBondContact O-N 2.85Å
136	T	53.6	Low	74.8	Confident	58 Å²	58	75.8 Å²	75.8	36%	0.356	40%	0.401	S	S	.	.			trans	-59.9	96.1	165.5	-48.8	0	0	0	0	104.1	E134 R138 D149	E134-T136 PolarHBondContact O-N 2.82Å; T136-R138 PolarHBondContact O-N 2.85Å; T136-D149 HydrophobicContact CG2-CB 3.63Å; T136-D149 WeakPolarHBondContact CG2-OD1 3.3Å
137	T	61.7	Low	74.7	Confident	48 Å²	48	75.2 Å²	75.2	29%	0.294	40%	0.403	S	S	.	.			trans	-65.7	106.2	-176.4	14.2	0	0	0	0	106	T135 C139 E150 L175	T135-T137 PolarHBondContact O-N 2.85Å; T137-C139 PolarHBondContact O-N 3.18Å; T137-E150 VanDerWaalsContact CB-OE1 3.3Å; T137-E150 WeakPolarHBondContact CB-OE1 3.41Å; T137-E150 WeakPolarHBondContact O-CG 3.13Å; T137-E150 PolarHBondContact OG1-OE1 2.75Å; T137-E150 PolarHBondContact OG1-OE2 2.88Å; T137-L175 HydrophobicContact CG2-CD1 3.86Å; T137-L175 HydrophobicContact CG2-CD2 4.11Å
138	R	75.8	Confident	74.5	Confident	173 Å²	173	75 Å²	75	65%	0.653	40%	0.396	S	S	*	.			trans	-62.6	124.1	178.6	-61.5	176.4	81.9	90.2	-4.6	107.3	T136 E147	T136-R138 PolarHBondContact O-N 2.85Å; R138-E147 IonicContact CZ-OE2 3.47Å; R138-E147 IonicContact NE-OE2 3.18Å; R138-E147 PolarHBondContact NE-OE2 2.91Å; R138-E147 IonicContact NH2-OE2 2.85Å; R138-E147 PolarHBondContact NH2-OE2 3.3Å
139	C	80.3	Confident	74.3	Confident	8 Å²	8	73.5 Å²	73.5	5%	0.054	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	148.2	178.2	68.3	0	0	0	0	109.5	T137 L148 P171 L172	T137-C139 PolarHBondContact O-N 3.18Å; C139-L148 PolarHBondContact N-O 2.96Å; C139-L148 PolarHBondContact O-N 3.3Å; C139-L148 VanDerWaalsContact O-O 3.13Å; C139-L148 PolarHBondContact SG-O 3.18Å; C139-P171 HydrophobicContact CB-CB 4.05Å; C139-P171 HydrophobicContact CB-CG 4.19Å; C139-L172 HydrophobicContact CB-CD2 4.06Å
140	V	85.4	Confident	74	Confident	75 Å²	75	74 Å²	74	46%	0.455	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.4	177.9	178.4	0	0	0	0	107.9	P142 Q145	V140-P142 WeakPolarHBondContact O-CD 3.41Å; V140-Q145 HydrophobicContact CG1-CB 4.18Å
141	C	87.6	Confident	74.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	36%	0.361	C	S	.	.			trans	-60.4	122.9	175.3	176.2	0	0	0	0	109.6	F143 Q145 R146 L148 L153 H156	C141-F143 PolarHBondContact O-N 3.34Å; C141-F143 PolarHBondContact SG-N 3.03Å; C141-Q145 WeakPolarHBondContact O-CA 3.34Å; C141-Q145 PolarHBondContact O-N 3.29Å; C141-R146 HydrophobicContact CB-CB 4.47Å; C141-R146 PolarHBondContact N-O 3.48Å; C141-L148 HydrophobicContact CB-CD1 3.95Å; C141-L153 HydrophobicContact CB-CD1 4.34Å; C141-H156 PolarHBondContact SG-NE2 3.39Å
142	P	86.1	Confident	75.1	Confident	39 Å²	39	69.4 Å²	69.4	25%	0.253	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.9	-176.6	29.8	-36.4	0	0	0	113.8	V140 V168 L188	V140-P142 WeakPolarHBondContact O-CD 3.41Å; P142-V168 HydrophobicContact CB-CB 3.77Å; P142-V168 HydrophobicContact CB-CG1 3.98Å; P142-V168 HydrophobicContact CB-CG2 4.15Å; P142-V168 HydrophobicContact CG-CB 3.94Å; P142-V168 HydrophobicContact CG-CG1 4.39Å; P142-V168 HydrophobicContact CG-CG2 3.74Å; P142-L188 HydrophobicContact CG-CD2 3.48Å; P142-L188 VanDerWaalsContact CG-CD2 3.48Å
143	F	86.4	Confident	76.3	Confident	25 Å²	25	65.7 Å²	65.7	11%	0.11	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-42	178.6	-59.1	-58.4	0	0	0	113.1	C141 H161 E164 V168 L188	C141-F143 PolarHBondContact O-N 3.34Å; C141-F143 PolarHBondContact SG-N 3.03Å; F143-H161 HydrophobicContact CD2-CB 3.79Å; F143-H161 AromaticContact CD2-CD2 4Å; F143-H161 AromaticContact CD2-CG 3.82Å; F143-H161 HydrophobicContact CE2-CB 4.27Å; F143-H161 HydrophobicContact CG-CB 4.35Å; F143-E164 HydrophobicContact CD1-CB 4.39Å; F143-E164 HydrophobicContact CD1-CG 3.34Å; F143-E164 HydrophobicContact CE1-CB 4.27Å; F143-E164 HydrophobicContact CE1-CG 3.36Å; F143-E164 HydrophobicContact CG-CG 3.95Å; F143-E164 HydrophobicContact CZ-CB 4.44Å; F143-E164 HydrophobicContact CZ-CG 3.99Å; F143-V168 HydrophobicContact CD1-CG1 3.89Å; F143-V168 HydrophobicContact CD1-CG2 4.48Å; F143-V168 HydrophobicContact CE1-CB 4.23Å; F143-V168 HydrophobicContact CE1-CG1 3.53Å; F143-V168 HydrophobicContact CE1-CG2 3.6Å; F143-V168 HydrophobicContact CE2-CG2 4.26Å; F143-V168 HydrophobicContact CZ-CG1 4.3Å; F143-V168 HydrophobicContact CZ-CG2 3.48Å; F143-V168 VanDerWaalsContact CZ-CG2 3.48Å; F143-L188 HydrophobicContact CD2-CD2 4.34Å; F143-L188 HydrophobicContact CE2-CB 4.03Å; F143-L188 HydrophobicContact CE2-CD2 3.59Å; F143-L188 HydrophobicContact CE2-CG 4.41Å; F143-L188 HydrophobicContact CZ-CB 3.91Å; F143-L188 HydrophobicContact CZ-CD2 4.08Å
144	C	90.3	Very high	77.8	Confident	57 Å²	57	63.4 Å²	63.4	39%	0.385	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	0.9	-173.3	66.5	0	0	0	0	114.6	R146 H156 H161	C144-R146 PolarHBondContact O-N 3.34Å; C144-H156 VanDerWaalsContact SG-CE1 3.57Å; C144-H156 PolarHBondContact SG-NE2 3.06Å; C144-H161 PolarHBondContact SG-NE2 3.26Å; C144-H161 VanDerWaalsContact SG-NE2 3.35Å
145	Q	88.3	Confident	79.2	Confident	162 Å²	162	62.7 Å²	62.7	76%	0.757	32%	0.323	S	S	*	.			trans	61.9	17.3	180	-52.6	179.7	28.9	0	0	115	V140 C141	V140-Q145 HydrophobicContact CG1-CB 4.18Å; C141-Q145 WeakPolarHBondContact O-CA 3.34Å; C141-Q145 PolarHBondContact O-N 3.29Å
146	R	88.3	Confident	81.4	Confident	120 Å²	120	57.3 Å²	57.3	45%	0.453	29%	0.29	S	S	.	.			trans	-70.2	132.1	174.6	-169.2	165.6	79.5	135.9	6.1	110.7	C141 C144 L148 H156	C141-R146 HydrophobicContact CB-CB 4.47Å; C141-R146 PolarHBondContact N-O 3.48Å; C144-R146 PolarHBondContact O-N 3.34Å; R146-L148 HydrophobicContact CG-CD2 4.4Å; R146-L148 HydrophobicContact CG-CG 4.44Å; R146-H156 PolarHBondContact NE-CE1 2.84Å; R146-H156 PolarHBondContact NE-ND1 2.87Å; R146-H156 PolarHBondContact NH2-ND1 2.85Å
147	E	88.5	Confident	83	Confident	120 Å²	120	54.6 Å²	54.6	56%	0.561	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	130.7	170.2	-70.6	-173.8	-162.6	0	0	110.7	R138	R138-E147 IonicContact CZ-OE2 3.47Å; R138-E147 IonicContact NE-OE2 3.18Å; R138-E147 PolarHBondContact NE-OE2 2.91Å; R138-E147 IonicContact NH2-OE2 2.85Å; R138-E147 PolarHBondContact NH2-OE2 3.3Å
148	L	84.1	Confident	84	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.089	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	149.8	-175.5	-65.6	165.3	0	0	0	110.7	C139 C141 R146 L153 H156	C139-L148 PolarHBondContact N-O 2.96Å; C139-L148 PolarHBondContact O-N 3.3Å; C139-L148 VanDerWaalsContact O-O 3.13Å; C139-L148 PolarHBondContact SG-O 3.18Å; C141-L148 HydrophobicContact CB-CD1 3.95Å; R146-L148 HydrophobicContact CG-CD2 4.4Å; R146-L148 HydrophobicContact CG-CG 4.44Å; L148-L153 HydrophobicContact CD1-CD1 3.77Å; L148-H156 HydrophobicContact CD1-CB 3.77Å; L148-H156 WeakPolarHBondContact CD1-CD2 3.3Å; L148-H156 VanDerWaalsContact CD1-CG 3.49Å; L148-H156 HydrophobicContact CD2-CB 4.4Å
149	D	80.9	Confident	84.5	Confident	69 Å²	69	48.6 Å²	48.6	37%	0.369	26%	0.255	S	S	.	.			trans	-70.5	148.5	163.4	-57.3	-39.2	0	0	0	109.3	T136 D151 S152 L153	T136-D149 HydrophobicContact CG2-CB 3.63Å; T136-D149 WeakPolarHBondContact CG2-OD1 3.3Å; D149-D151 PolarHBondContact O-N 2.88Å; D149-S152 PolarHBondContact O-N 3.19Å; D149-L153 PolarHBondContact O-N 3.01Å
150	E	76.9	Confident	84.8	Confident	43 Å²	43	54 Å²	54	20%	0.201	28%	0.279	C	S	.	.	H	α-helix	trans	-54.1	-41.5	-178.9	-54.4	-165.2	138	0	0	112.4	T137 S152 L153 L172 L175	T137-E150 VanDerWaalsContact CB-OE1 3.3Å; T137-E150 WeakPolarHBondContact CB-OE1 3.41Å; T137-E150 WeakPolarHBondContact O-CG 3.13Å; T137-E150 PolarHBondContact OG1-OE1 2.75Å; T137-E150 PolarHBondContact OG1-OE2 2.88Å; E150-S152 PolarHBondContact O-N 3.29Å; E150-L153 PolarHBondContact O-N 3.33Å; E150-L172 HydrophobicContact CB-CD2 3.62Å; E150-L172 HydrophobicContact CG-CD2 3.5Å; E150-L172 VanDerWaalsContact CG-CD2 3.5Å; E150-L175 WeakPolarHBondContact OE1-CD1 3.49Å
151	D	73.9	Confident	85	Confident	61 Å²	61	51.9 Å²	51.9	33%	0.326	26%	0.264	S	S	.	.	H	α-helix	trans	-66.6	-20.4	-179.5	-66.7	-25.8	0	0	0	112.7	Q46 D149	Q46-D151 PolarHBondContact NE2-OD2 2.82Å; D149-D151 PolarHBondContact O-N 2.88Å
152	S	82.6	Confident	84.8	Confident	54 Å²	54	60 Å²	60	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-99.3	-11.9	-179.1	-64.8	0	0	0	0	113.9	D149 E150 L154 H156	D149-S152 PolarHBondContact O-N 3.19Å; E150-S152 PolarHBondContact O-N 3.29Å; S152-L154 PolarHBondContact O-N 3.38Å; S152-H156 WeakPolarHBondContact O-CB 3.39Å; S152-H156 PolarHBondContact O-N 3.29Å; S152-H156 VanDerWaalsContact O-N 3.13Å
153	L	84.9	Confident	84.7	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-42.8	-173.7	-179.3	65.2	0	0	0	112.4	C141 L148 D149 E150 H156 C157 P171 L172 L192	C141-L153 HydrophobicContact CB-CD1 4.34Å; L148-L153 HydrophobicContact CD1-CD1 3.77Å; D149-L153 PolarHBondContact O-N 3.01Å; E150-L153 PolarHBondContact O-N 3.33Å; L153-H156 PolarHBondContact O-N 3.44Å; L153-C157 PolarHBondContact O-N 3.44Å; L153-C157 PolarHBondContact O-SG 3.4Å; L153-P171 HydrophobicContact CD2-CG 3.42Å; L153-P171 VanDerWaalsContact CD2-CG 3.42Å; L153-L172 HydrophobicContact CD2-CD1 4.04Å; L153-L172 HydrophobicContact CD2-CD2 4.28Å; L153-L172 HydrophobicContact CD2-CG 3.89Å; L153-L192 HydrophobicContact CD2-CD1 4.11Å; L153-L192 HydrophobicContact CD2-CD2 4.06Å; L153-L192 HydrophobicContact CG-CD1 4.08Å
154	L	83.3	Confident	84.5	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.063	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-50.2	-177.8	175.5	64.7	0	0	0	112	S152 H156 C157 I158 I189 L192 Q193 T197 Y200	S152-L154 PolarHBondContact O-N 3.38Å; L154-H156 VanDerWaalsContact C-N 3.31Å; L154-H156 PolarHBondContact O-N 2.81Å; L154-C157 PolarHBondContact O-N 3.38Å; L154-C157 VanDerWaalsContact O-N 3.13Å; L154-I158 HydrophobicContact CD1-CD1 3.81Å; L154-I158 HydrophobicContact CD1-CG1 4.13Å; L154-I158 HydrophobicContact CG-CD1 3.87Å; L154-I158 WeakPolarHBondContact O-CG1 3.26Å; L154-I158 PolarHBondContact O-N 3.15Å; L154-I189 HydrophobicContact CD1-CG2 4.44Å; L154-L192 HydrophobicContact CD1-CB 3.68Å; L154-L192 HydrophobicContact CD1-CD1 4.38Å; L154-Q193 HydrophobicContact CD1-CG 3.81Å; L154-Q193 HydrophobicContact CD2-CG 4.4Å; L154-T197 HydrophobicContact CD2-CG2 3.23Å; L154-Y200 HydrophobicContact CD2-CD2 4.27Å
155	D	81.7	Confident	83.7	Confident	57 Å²	57	71 Å²	71	31%	0.305	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-45.6	178.7	-179.2	60.1	0	0	0	110.9	C157 I158 T159 Y200	D155-C157 VanDerWaalsContact C-N 3.33Å; D155-C157 PolarHBondContact O-N 2.98Å; D155-I158 PolarHBondContact O-N 3.03Å; D155-T159 WeakPolarHBondContact O-CB 3.32Å; D155-T159 VanDerWaalsContact O-CG2 3.28Å; D155-T159 WeakPolarHBondContact O-CG2 3.45Å; D155-T159 PolarHBondContact O-N 2.78Å; D155-T159 PolarHBondContact O-OG1 3.17Å; D155-Y200 HydrophobicContact CB-CE2 3.68Å; D155-Y200 WeakPolarHBondContact CB-OH 3.28Å; D155-Y200 PolarHBondContact OD1-OH 3.15Å
156	H	88.9	Confident	83.4	Confident	6 Å²	6	69.6 Å²	69.6	3%	0.028	33%	0.329	C	S	.	.	H	α-helix	trans	-56.8	-44.7	174.6	168.7	68.5	0	0	0	112.5	C141 C144 R146 L148 S152 L153 L154 T159 H160 H161	C141-H156 PolarHBondContact SG-NE2 3.39Å; C144-H156 VanDerWaalsContact SG-CE1 3.57Å; C144-H156 PolarHBondContact SG-NE2 3.06Å; R146-H156 PolarHBondContact NE-CE1 2.84Å; R146-H156 PolarHBondContact NE-ND1 2.87Å; R146-H156 PolarHBondContact NH2-ND1 2.85Å; L148-H156 HydrophobicContact CD1-CB 3.77Å; L148-H156 WeakPolarHBondContact CD1-CD2 3.3Å; L148-H156 VanDerWaalsContact CD1-CG 3.49Å; L148-H156 HydrophobicContact CD2-CB 4.4Å; S152-H156 WeakPolarHBondContact O-CB 3.39Å; S152-H156 PolarHBondContact O-N 3.29Å; S152-H156 VanDerWaalsContact O-N 3.13Å; L153-H156 PolarHBondContact O-N 3.44Å; L154-H156 VanDerWaalsContact C-N 3.31Å; L154-H156 PolarHBondContact O-N 2.81Å; H156-T159 WeakPolarHBondContact CA-OG1 3.42Å; H156-T159 PolarHBondContact O-OG1 3.33Å; H156-T159 VanDerWaalsContact O-OG1 3.07Å; H156-H160 AromaticContact CE1-CD2 3.86Å; H156-H160 AromaticContact ND1-CD2 3.26Å; H156-H160 PolarHBondContact ND1-CD2 2.84Å; H156-H160 VanDerWaalsContact ND1-CD2 3.26Å; H156-H160 AromaticContact ND1-CG 3.98Å; H156-H160 WeakPolarHBondContact O-CB 3.28Å; H156-H160 PolarHBondContact O-CD2 2.89Å; H156-H160 PolarHBondContact O-N 3.13Å; H156-H161 AromaticContact CD2-CD2 3.99Å; H156-H161 AromaticContact CE1-CD2 3.9Å; H156-H161 AromaticContact CE1-NE2 3.55Å; H156-H161 AromaticContact NE2-CD2 3.39Å; H156-H161 PolarHBondContact NE2-CD2 3.33Å; H156-H161 AromaticContact NE2-NE2 3.23Å; H156-H161 PolarHBondContact NE2-NE2 3.04Å
157	C	86.3	Confident	82.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-67.6	-39.3	178.9	-70.5	0	0	0	0	112.2	L153 L154 D155 H161 R162 I189	L153-C157 PolarHBondContact O-N 3.44Å; L153-C157 PolarHBondContact O-SG 3.4Å; L154-C157 PolarHBondContact O-N 3.38Å; L154-C157 VanDerWaalsContact O-N 3.13Å; D155-C157 VanDerWaalsContact C-N 3.33Å; D155-C157 PolarHBondContact O-N 2.98Å; C157-H161 CarbonylContact O-C 3.56Å; C157-H161 WeakPolarHBondContact O-CA 3.3Å; C157-H161 WeakPolarHBondContact O-CB 3.07Å; C157-H161 PolarHBondContact O-N 3.23Å; C157-R162 PolarHBondContact O-N 3.43Å; C157-I189 HydrophobicContact CB-CD1 4.45Å; C157-I189 HydrophobicContact CB-CG1 3.83Å; C157-I189 WeakPolarHBondContact O-CD1 3.38Å
158	I	84.6	Confident	82.3	Confident	20 Å²	20	64 Å²	64	10%	0.103	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-41.2	176.6	-69.3	171.9	0	0	0	111.3	L154 D155 R162 I189	L154-I158 HydrophobicContact CD1-CD1 3.81Å; L154-I158 HydrophobicContact CD1-CG1 4.13Å; L154-I158 HydrophobicContact CG-CD1 3.87Å; L154-I158 WeakPolarHBondContact O-CG1 3.26Å; L154-I158 PolarHBondContact O-N 3.15Å; D155-I158 PolarHBondContact O-N 3.03Å; I158-R162 WeakPolarHBondContact O-CB 3.46Å; I158-I189 HydrophobicContact CD1-CG2 4.42Å; I158-I189 HydrophobicContact CG1-CG2 3.71Å
159	T	85.7	Confident	82.1	Confident	75 Å²	75	68 Å²	68	46%	0.46	34%	0.335	S	S	.	.	H	α-helix	trans	-77.2	-42.9	-175.1	49.2	0	0	0	0	112.5	D155 H156	D155-T159 WeakPolarHBondContact O-CB 3.32Å; D155-T159 VanDerWaalsContact O-CG2 3.28Å; D155-T159 WeakPolarHBondContact O-CG2 3.45Å; D155-T159 PolarHBondContact O-N 2.78Å; D155-T159 PolarHBondContact O-OG1 3.17Å; H156-T159 WeakPolarHBondContact CA-OG1 3.42Å; H156-T159 PolarHBondContact O-OG1 3.33Å; H156-T159 VanDerWaalsContact O-OG1 3.07Å
160	H	85.6	Confident	82	Confident	122 Å²	122	64.9 Å²	64.9	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-107.4	-17.5	-171.2	-60	-71.8	0	0	0	114.2	H156	H156-H160 AromaticContact CE1-CD2 3.86Å; H156-H160 AromaticContact ND1-CD2 3.26Å; H156-H160 PolarHBondContact ND1-CD2 2.84Å; H156-H160 VanDerWaalsContact ND1-CD2 3.26Å; H156-H160 AromaticContact ND1-CG 3.98Å; H156-H160 WeakPolarHBondContact O-CB 3.28Å; H156-H160 PolarHBondContact O-CD2 2.89Å; H156-H160 PolarHBondContact O-N 3.13Å
161	H	89.4	Confident	82.1	Confident	30 Å²	30	64.3 Å²	64.3	14%	0.139	32%	0.318	C	S	.	.			trans	-132	22.1	-171.5	-57.6	-57.8	0	0	0	113.8	F143 C144 H156 C157 S163 E164	F143-H161 HydrophobicContact CD2-CB 3.79Å; F143-H161 AromaticContact CD2-CD2 4Å; F143-H161 AromaticContact CD2-CG 3.82Å; F143-H161 HydrophobicContact CE2-CB 4.27Å; F143-H161 HydrophobicContact CG-CB 4.35Å; C144-H161 PolarHBondContact SG-NE2 3.26Å; C144-H161 VanDerWaalsContact SG-NE2 3.35Å; H156-H161 AromaticContact CD2-CD2 3.99Å; H156-H161 AromaticContact CE1-CD2 3.9Å; H156-H161 AromaticContact CE1-NE2 3.55Å; H156-H161 AromaticContact NE2-CD2 3.39Å; H156-H161 PolarHBondContact NE2-CD2 3.33Å; H156-H161 AromaticContact NE2-NE2 3.23Å; H156-H161 PolarHBondContact NE2-NE2 3.04Å; C157-H161 CarbonylContact O-C 3.56Å; C157-H161 WeakPolarHBondContact O-CA 3.3Å; C157-H161 WeakPolarHBondContact O-CB 3.07Å; C157-H161 PolarHBondContact O-N 3.23Å; H161-S163 VanDerWaalsContact C-N 3.27Å; H161-S163 PolarHBondContact O-N 3.3Å; H161-S163 VanDerWaalsContact O-N 3.17Å; H161-E164 HydrophobicContact CB-CB 4.12Å; H161-E164 VanDerWaalsContact O-CB 3.24Å; H161-E164 WeakPolarHBondContact O-CB 3.06Å; H161-E164 PolarHBondContact O-N 2.99Å
162	R	85	Confident	82.1	Confident	171 Å²	171	62.2 Å²	62.2	65%	0.645	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-41	-177.8	-162.7	177	179.7	124.4	0.1	114.7	C157 I158 R165	C157-R162 PolarHBondContact O-N 3.43Å; I158-R162 WeakPolarHBondContact O-CB 3.46Å; R162-R165 PolarHBondContact O-NH1 3.47Å
163	S	83.6	Confident	81.6	Confident	102 Å²	102	61.7 Å²	61.7	71%	0.713	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-2.7	-175.9	-57.4	0	0	0	0	113	H161	H161-S163 VanDerWaalsContact C-N 3.27Å; H161-S163 PolarHBondContact O-N 3.3Å; H161-S163 VanDerWaalsContact O-N 3.17Å
164	E	80.8	Confident	80.5	Confident	72 Å²	72	66.8 Å²	66.8	34%	0.336	33%	0.326	S	S	.	.			trans	-68.8	135.8	179.1	-167.5	54.7	-107.6	0	0	109.7	F143 H161 R166	F143-E164 HydrophobicContact CD1-CB 4.39Å; F143-E164 HydrophobicContact CD1-CG 3.34Å; F143-E164 HydrophobicContact CE1-CB 4.27Å; F143-E164 HydrophobicContact CE1-CG 3.36Å; F143-E164 HydrophobicContact CG-CG 3.95Å; F143-E164 HydrophobicContact CZ-CB 4.44Å; F143-E164 HydrophobicContact CZ-CG 3.99Å; H161-E164 HydrophobicContact CB-CB 4.12Å; H161-E164 VanDerWaalsContact O-CB 3.24Å; H161-E164 WeakPolarHBondContact O-CB 3.06Å; H161-E164 PolarHBondContact O-N 2.99Å; E164-R166 WeakPolarHBondContact OE1-CB 3.41Å; E164-R166 PolarHBondContact OE1-N 3.5Å
165	R	74.2	Confident	79.1	Confident	178 Å²	178	70.9 Å²	70.9	67%	0.672	35%	0.348	S	S	*	.			trans	-127.1	-3.1	-176	-64	-67.1	-179.6	-96.9	1.4	112.3	R162	R162-R165 PolarHBondContact O-NH1 3.47Å
166	R	81.6	Confident	77.4	Confident	133 Å²	133	74 Å²	74	50%	0.502	36%	0.364	S	S	.	.			trans	-61.2	130.2	177.3	-174	169.1	63.2	-171.7	-0.8	110.3	E164 V168	E164-R166 WeakPolarHBondContact OE1-CB 3.41Å; E164-R166 PolarHBondContact OE1-N 3.5Å; R166-V168 PolarHBondContact O-N 3.21Å
167	P	74	Confident	74.9	Confident	98 Å²	98	79.7 Å²	79.7	64%	0.636	40%	0.401	S	S	*	.			trans	-65.4	133.8	174.1	26.8	-33.6	0	0	0	109.8
168	V	79.8	Confident	72.8	Confident	24 Å²	24	87.3 Å²	87.3	15%	0.145	44%	0.442	C	S	.	.			trans	-144.4	156.1	-179.4	-67.4	0	0	0	0	109.7	P142 F143 R166 L188	P142-V168 HydrophobicContact CB-CB 3.77Å; P142-V168 HydrophobicContact CB-CG1 3.98Å; P142-V168 HydrophobicContact CB-CG2 4.15Å; P142-V168 HydrophobicContact CG-CB 3.94Å; P142-V168 HydrophobicContact CG-CG1 4.39Å; P142-V168 HydrophobicContact CG-CG2 3.74Å; F143-V168 HydrophobicContact CD1-CG1 3.89Å; F143-V168 HydrophobicContact CD1-CG2 4.48Å; F143-V168 HydrophobicContact CE1-CB 4.23Å; F143-V168 HydrophobicContact CE1-CG1 3.53Å; F143-V168 HydrophobicContact CE1-CG2 3.6Å; F143-V168 HydrophobicContact CE2-CG2 4.26Å; F143-V168 HydrophobicContact CZ-CG1 4.3Å; F143-V168 HydrophobicContact CZ-CG2 3.48Å; F143-V168 VanDerWaalsContact CZ-CG2 3.48Å; R166-V168 PolarHBondContact O-N 3.21Å; V168-L188 HydrophobicContact CG2-CB 3.81Å; V168-L188 HydrophobicContact CG2-CD1 4.43Å; V168-L188 HydrophobicContact CG2-CD2 3.85Å; V168-L188 HydrophobicContact CG2-CG 4.23Å
169	F	79.6	Confident	70.7	Confident	102 Å²	102	94.2 Å²	94.2	45%	0.447	47%	0.474	S	S	.	.			trans	-77.4	144.9	171.8	-63.9	-80.5	0	0	0	110.9	P171 P181	F169-P171 WeakPolarHBondContact O-CD 3.49Å; F169-P181 HydrophobicContact CD1-CB 4.32Å; F169-P181 HydrophobicContact CE1-CB 4.31Å
170	C	80.3	Confident	68.6	Low	3 Å²	3	95.5 Å²	95.5	2%	0.02	49%	0.486	C	S	.	.			trans	-74.7	119.7	171.2	-179	0	0	0	0	109.3	L172 C173 H174 L188 H191	C170-L172 PolarHBondContact O-N 2.78Å; C170-L172 PolarHBondContact SG-N 3.21Å; C170-C173 HydrophobicContact CB-CB 4.05Å; C170-C173 PolarHBondContact O-N 2.83Å; C170-H174 PolarHBondContact O-ND1 2.57Å; C170-H174 VanDerWaalsContact O-ND1 3.17Å; C170-L188 HydrophobicContact CB-CD1 3.89Å; C170-H191 WeakPolarHBondContact CB-NE2 3.47Å; C170-H191 VanDerWaalsContact SG-CD2 3.52Å; C170-H191 PolarHBondContact SG-NE2 3.48Å
171	P	77.8	Confident	66.7	Low	30 Å²	30	93.7 Å²	93.7	20%	0.195	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.4	-179.7	30.7	-36.7	0	0	0	112.6	C139 L153 F169	C139-P171 HydrophobicContact CB-CB 4.05Å; C139-P171 HydrophobicContact CB-CG 4.19Å; L153-P171 HydrophobicContact CD2-CG 3.42Å; L153-P171 VanDerWaalsContact CD2-CG 3.42Å; F169-P171 WeakPolarHBondContact O-CD 3.49Å
172	L	75.5	Confident	64.8	Low	18 Å²	18	95.7 Å²	95.7	9%	0.094	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-23.2	179	-53.9	-178.4	0	0	0	113.4	C139 E150 L153 C170 L192 H196	C139-L172 HydrophobicContact CB-CD2 4.06Å; E150-L172 HydrophobicContact CB-CD2 3.62Å; E150-L172 HydrophobicContact CG-CD2 3.5Å; E150-L172 VanDerWaalsContact CG-CD2 3.5Å; L153-L172 HydrophobicContact CD2-CD1 4.04Å; L153-L172 HydrophobicContact CD2-CD2 4.28Å; L153-L172 HydrophobicContact CD2-CG 3.89Å; C170-L172 PolarHBondContact O-N 2.78Å; C170-L172 PolarHBondContact SG-N 3.21Å; L172-L192 HydrophobicContact CD1-CD2 3.73Å; L172-L192 HydrophobicContact CG-CD2 4.38Å; L172-H196 HydrophobicContact CD1-CB 3.76Å
173	C	72.1	Confident	63.1	Low	42 Å²	42	91.6 Å²	91.6	28%	0.284	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-77	-19.1	-179.6	-79.8	0	0	0	0	113.9	C170 L175 H191 H196	C170-C173 HydrophobicContact CB-CB 4.05Å; C170-C173 PolarHBondContact O-N 2.83Å; C173-L175 PolarHBondContact O-N 2.84Å; C173-H191 PolarHBondContact SG-CE1 3.25Å; C173-H191 PolarHBondContact SG-NE2 3.01Å; C173-H196 PolarHBondContact SG-NE2 3.36Å
174	H	61.1	Low	61.7	Low	107 Å²	107	90.1 Å²	90.1	50%	0.495	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-74.2	-3.4	-178.9	-66.8	112.2	0	0	0	114.3	C170 L176	C170-H174 PolarHBondContact O-ND1 2.57Å; C170-H174 VanDerWaalsContact O-ND1 3.17Å; H174-L176 VanDerWaalsContact C-N 3.33Å
175	L	54.6	Low	60.2	Low	98 Å²	98	95.3 Å²	95.3	51%	0.513	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-88	4.1	-178.9	-64.5	173.2	0	0	0	113.8	T137 E150 C173	T137-L175 HydrophobicContact CG2-CD1 3.86Å; T137-L175 HydrophobicContact CG2-CD2 4.11Å; E150-L175 WeakPolarHBondContact OE1-CD1 3.49Å; C173-L175 PolarHBondContact O-N 2.84Å
176	L	45	Very low	59.6	Low	124 Å²	124	89 Å²	89	65%	0.649	50%	0.498	S	S	*	.	S	Bend	trans	-95.4	128.8	173.7	-65.5	178	0	0	0	110.8	H174 N178	H174-L176 VanDerWaalsContact C-N 3.33Å; L176-N178 PolarHBondContact O-N 2.89Å
177	P	37.1	Very low	59.2	Low	124 Å²	124	84.6 Å²	84.6	81%	0.805	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-9	-166.3	-20.2	31	0	0	0	116.9
178	N	41	Very low	59.4	Low	160 Å²	160	80.3 Å²	80.3	86%	0.856	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.9	16.3	-160	-100.1	3.7	0	0	0	117.4	L176	L176-N178 PolarHBondContact O-N 2.89Å
179	E	40	Very low	59.4	Low	165 Å²	165	79.9 Å²	79.9	77%	0.771	46%	0.456	S	S	*	.			trans	-117.4	128.8	177.1	-58	-118.1	132.7	0	0	109.9
180	S	41.9	Very low	59.2	Low	103 Å²	103	79.7 Å²	79.7	72%	0.72	45%	0.452	S	S	*	.			trans	-59.2	135.2	175.5	46.6	0	0	0	0	109.5	S182	S180-S182 PolarHBondContact O-N 2.95Å
181	P	47	Very low	59.3	Low	83 Å²	83	80.4 Å²	80.4	54%	0.539	46%	0.455	S	S	.	.			trans	-66.1	96.2	-173.5	22.7	-29.1	0	0	0	109.3	F169 T183	F169-P181 HydrophobicContact CD1-CB 4.32Å; F169-P181 HydrophobicContact CE1-CB 4.31Å; P181-T183 PolarHBondContact O-N 3.48Å; P181-T183 VanDerWaalsContact O-N 3.17Å
182	S	48.5	Very low	59.3	Low	73 Å²	73	79 Å²	79	51%	0.51	45%	0.446	S	S	.	.			trans	-72.6	109.7	178.4	28.6	0	0	0	0	107.5	S180 F184	S180-S182 PolarHBondContact O-N 2.95Å; S182-F184 VanDerWaalsContact O-CD2 3.26Å; S182-F184 WeakPolarHBondContact O-CD2 3.34Å; S182-F184 WeakPolarHBondContact O-CE2 3.07Å; S182-F184 PolarHBondContact O-N 2.93Å
183	T	49.7	Very low	59.3	Low	85 Å²	85	80.2 Å²	80.2	52%	0.521	45%	0.451	S	S	.	.			trans	-54.7	109.4	170	-47.4	0	0	0	0	108.2	P181 N185	P181-T183 PolarHBondContact O-N 3.48Å; P181-T183 VanDerWaalsContact O-N 3.17Å; T183-N185 PolarHBondContact O-N 3.17Å
184	F	53.8	Low	59.3	Low	70 Å²	70	80.1 Å²	80.1	31%	0.307	45%	0.449	S	S	.	.			trans	-72.6	124.6	178.4	-63	-83.9	0	0	0	108.8	S182 G186 H191	S182-F184 VanDerWaalsContact O-CD2 3.26Å; S182-F184 WeakPolarHBondContact O-CD2 3.34Å; S182-F184 WeakPolarHBondContact O-CE2 3.07Å; S182-F184 PolarHBondContact O-N 2.93Å; F184-G186 PolarHBondContact O-N 3.45Å; F184-H191 AromaticContact CD1-ND1 3.58Å; F184-H191 AromaticContact CD2-CE1 3.9Å; F184-H191 AromaticContact CD2-ND1 3.75Å; F184-H191 AromaticContact CE1-CE1 3.69Å; F184-H191 AromaticContact CE1-ND1 3.51Å; F184-H191 AromaticContact CE2-CE1 3.4Å; F184-H191 VanDerWaalsContact CE2-CE1 3.4Å; F184-H191 WeakPolarHBondContact CE2-CE1 3.37Å; F184-H191 AromaticContact CE2-ND1 3.69Å; F184-H191 AromaticContact CG-ND1 3.71Å; F184-H191 AromaticContact CZ-CE1 3.29Å; F184-H191 WeakPolarHBondContact CZ-CE1 3.43Å; F184-H191 AromaticContact CZ-ND1 3.58Å
185	N	49.7	Very low	59.8	Low	182 Å²	182	77 Å²	77	97%	0.973	44%	0.439	S	S	*	.	S	Bend	trans	-75.8	31.1	-177	-119.3	-21.2	0	0	0	113.2	T183	T183-N185 PolarHBondContact O-N 3.17Å
186	G	60.9	Low	60.8	Low	46 Å²	46	74.9 Å²	74.9	47%	0.474	43%	0.427	S	S	.	.	S	Bend	trans	-154.4	170.9	-171.8	0	0	0	0	0	114.2	F184 L188	F184-G186 PolarHBondContact O-N 3.45Å; G186-L188 PolarHBondContact O-N 3.44Å
187	S	74.2	Confident	61.7	Low	40 Å²	40	70.8 Å²	70.8	28%	0.28	41%	0.407	S	S	.	.			trans	-54.6	127.5	179.7	177.1	0	0	0	0	111.3	I189 R190 H191	S187-I189 PolarHBondContact O-N 2.91Å; S187-I189 VanDerWaalsContact O-N 3.1Å; S187-I189 PolarHBondContact OG-N 3.2Å; S187-R190 WeakPolarHBondContact O-CB 3.25Å; S187-R190 PolarHBondContact O-N 3.15Å; S187-H191 PolarHBondContact O-N 3.39Å; S187-H191 VanDerWaalsContact O-N 3.13Å
188	L	77.3	Confident	62.5	Low	7 Å²	7	68.1 Å²	68.1	4%	0.037	39%	0.385	C	S	.	.	H	α-helix	trans	-49.7	-37.4	174.9	178.5	66.4	0	0	0	111.6	P142 F143 V168 C170 G186 R190 H191 L192	P142-L188 HydrophobicContact CG-CD2 3.48Å; P142-L188 VanDerWaalsContact CG-CD2 3.48Å; F143-L188 HydrophobicContact CD2-CD2 4.34Å; F143-L188 HydrophobicContact CE2-CB 4.03Å; F143-L188 HydrophobicContact CE2-CD2 3.59Å; F143-L188 HydrophobicContact CE2-CG 4.41Å; F143-L188 HydrophobicContact CZ-CB 3.91Å; F143-L188 HydrophobicContact CZ-CD2 4.08Å; V168-L188 HydrophobicContact CG2-CB 3.81Å; V168-L188 HydrophobicContact CG2-CD1 4.43Å; V168-L188 HydrophobicContact CG2-CD2 3.85Å; V168-L188 HydrophobicContact CG2-CG 4.23Å; C170-L188 HydrophobicContact CB-CD1 3.89Å; G186-L188 PolarHBondContact O-N 3.44Å; L188-R190 PolarHBondContact O-N 3.08Å; L188-H191 PolarHBondContact O-N 3.22Å; L188-L192 HydrophobicContact CD1-CD1 4.3Å; L188-L192 HydrophobicContact CD1-CG 4.11Å; L188-L192 HydrophobicContact CD2-CD1 4.29Å; L188-L192 HydrophobicContact CG-CD1 3.86Å; L188-L192 HydrophobicContact CG-CG 4.12Å; L188-L192 WeakPolarHBondContact O-CB 3.44Å; L188-L192 VanDerWaalsContact O-CG 3.26Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 3Å
189	I	80.4	Confident	63.1	Low	15 Å²	15	64.3 Å²	64.3	8%	0.077	36%	0.361	C	S	.	.	H	α-helix	trans	-59.7	-48.1	177.9	-63.7	168.7	0	0	0	110.6	L154 C157 I158 S187 H191 L192 Q193	L154-I189 HydrophobicContact CD1-CG2 4.44Å; C157-I189 HydrophobicContact CB-CD1 4.45Å; C157-I189 HydrophobicContact CB-CG1 3.83Å; C157-I189 WeakPolarHBondContact O-CD1 3.38Å; I158-I189 HydrophobicContact CD1-CG2 4.42Å; I158-I189 HydrophobicContact CG1-CG2 3.71Å; S187-I189 PolarHBondContact O-N 2.91Å; S187-I189 VanDerWaalsContact O-N 3.1Å; S187-I189 PolarHBondContact OG-N 3.2Å; I189-H191 VanDerWaalsContact C-N 3.31Å; I189-H191 PolarHBondContact O-N 3.07Å; I189-L192 PolarHBondContact O-N 3.32Å; I189-Q193 HydrophobicContact CG2-CG 4.35Å; I189-Q193 WeakPolarHBondContact O-CB 3.34Å; I189-Q193 VanDerWaalsContact O-CG 3.23Å; I189-Q193 WeakPolarHBondContact O-CG 3.29Å; I189-Q193 PolarHBondContact O-N 2.8Å
190	R	76.1	Confident	63.5	Low	99 Å²	99	60.3 Å²	60.3	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-41.1	177.5	-178.2	175.6	-179.7	156.7	4.5	111.3	S187 L188 Q193 V194 E211	S187-R190 WeakPolarHBondContact O-CB 3.25Å; S187-R190 PolarHBondContact O-N 3.15Å; L188-R190 PolarHBondContact O-N 3.08Å; R190-Q193 PolarHBondContact O-N 3.38Å; R190-V194 WeakPolarHBondContact O-CG2 3.4Å; R190-V194 PolarHBondContact O-N 3.39Å; R190-V194 VanDerWaalsContact O-N 3.15Å; R190-E211 IonicContact NH2-OE2 3.74Å
191	H	81.8	Confident	63.6	Low	17 Å²	17	59 Å²	59	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-48.2	177	166.4	82.8	0	0	0	111.5	C170 C173 F184 S187 L188 I189 Q193 V194 S195 H196	C170-H191 WeakPolarHBondContact CB-NE2 3.47Å; C170-H191 VanDerWaalsContact SG-CD2 3.52Å; C170-H191 PolarHBondContact SG-NE2 3.48Å; C173-H191 PolarHBondContact SG-CE1 3.25Å; C173-H191 PolarHBondContact SG-NE2 3.01Å; F184-H191 AromaticContact CD1-ND1 3.58Å; F184-H191 AromaticContact CD2-CE1 3.9Å; F184-H191 AromaticContact CD2-ND1 3.75Å; F184-H191 AromaticContact CE1-CE1 3.69Å; F184-H191 AromaticContact CE1-ND1 3.51Å; F184-H191 AromaticContact CE2-CE1 3.4Å; F184-H191 VanDerWaalsContact CE2-CE1 3.4Å; F184-H191 WeakPolarHBondContact CE2-CE1 3.37Å; F184-H191 AromaticContact CE2-ND1 3.69Å; F184-H191 AromaticContact CG-ND1 3.71Å; F184-H191 AromaticContact CZ-CE1 3.29Å; F184-H191 WeakPolarHBondContact CZ-CE1 3.43Å; F184-H191 AromaticContact CZ-ND1 3.58Å; S187-H191 PolarHBondContact O-N 3.39Å; S187-H191 VanDerWaalsContact O-N 3.13Å; L188-H191 PolarHBondContact O-N 3.22Å; I189-H191 VanDerWaalsContact C-N 3.31Å; I189-H191 PolarHBondContact O-N 3.07Å; H191-Q193 VanDerWaalsContact C-N 3.29Å; H191-Q193 PolarHBondContact O-N 2.98Å; H191-V194 PolarHBondContact O-N 3.27Å; H191-V194 VanDerWaalsContact O-N 3.17Å; H191-S195 WeakPolarHBondContact O-CB 3.46Å; H191-S195 PolarHBondContact O-N 2.96Å; H191-S195 PolarHBondContact O-OG 2.92Å; H191-H196 AromaticContact CD2-CD2 3.88Å; H191-H196 AromaticContact CE1-NE2 3.99Å; H191-H196 AromaticContact NE2-CD2 3.33Å; H191-H196 PolarHBondContact NE2-CD2 3.24Å; H191-H196 VanDerWaalsContact NE2-CD2 3.33Å; H191-H196 AromaticContact NE2-NE2 3.27Å; H191-H196 PolarHBondContact NE2-NE2 3.26Å
192	L	78.1	Confident	63.5	Low	2 Å²	2	61.6 Å²	61.6	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-39.5	176	-68.2	173.4	0	0	0	110.9	L153 L154 L172 L188 I189 V194 H196 T197	L153-L192 HydrophobicContact CD2-CD1 4.11Å; L153-L192 HydrophobicContact CD2-CD2 4.06Å; L153-L192 HydrophobicContact CG-CD1 4.08Å; L154-L192 HydrophobicContact CD1-CB 3.68Å; L154-L192 HydrophobicContact CD1-CD1 4.38Å; L172-L192 HydrophobicContact CD1-CD2 3.73Å; L172-L192 HydrophobicContact CG-CD2 4.38Å; L188-L192 HydrophobicContact CD1-CD1 4.3Å; L188-L192 HydrophobicContact CD1-CG 4.11Å; L188-L192 HydrophobicContact CD2-CD1 4.29Å; L188-L192 HydrophobicContact CG-CD1 3.86Å; L188-L192 HydrophobicContact CG-CG 4.12Å; L188-L192 WeakPolarHBondContact O-CB 3.44Å; L188-L192 VanDerWaalsContact O-CG 3.26Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 3Å; I189-L192 PolarHBondContact O-N 3.32Å; L192-V194 VanDerWaalsContact C-N 3.25Å; L192-V194 PolarHBondContact O-N 3.26Å; L192-H196 HydrophobicContact CD2-CB 3.96Å; L192-H196 CarbonylContact O-C 3.12Å; L192-H196 VanDerWaalsContact O-CA 3.28Å; L192-H196 WeakPolarHBondContact O-CA 3.37Å; L192-H196 PolarHBondContact O-N 3.27Å; L192-T197 PolarHBondContact O-N 3.17Å; L192-T197 PolarHBondContact O-OG1 3.09Å
193	Q	75.9	Confident	63.6	Low	42 Å²	42	63.3 Å²	63.3	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-16.6	176.4	-75.1	176.7	-43	0	0	116	L154 I189 R190 H191 T197	L154-Q193 HydrophobicContact CD1-CG 3.81Å; L154-Q193 HydrophobicContact CD2-CG 4.4Å; I189-Q193 HydrophobicContact CG2-CG 4.35Å; I189-Q193 WeakPolarHBondContact O-CB 3.34Å; I189-Q193 VanDerWaalsContact O-CG 3.23Å; I189-Q193 WeakPolarHBondContact O-CG 3.29Å; I189-Q193 PolarHBondContact O-N 2.8Å; R190-Q193 PolarHBondContact O-N 3.38Å; H191-Q193 VanDerWaalsContact C-N 3.29Å; H191-Q193 PolarHBondContact O-N 2.98Å; Q193-T197 WeakPolarHBondContact CA-OG1 3.26Å; Q193-T197 HydrophobicContact CB-CG2 4.32Å; Q193-T197 HydrophobicContact CG-CG2 4.29Å; Q193-T197 PolarHBondContact O-OG1 2.91Å
194	V	70.7	Confident	63.5	Low	41 Å²	41	61.8 Å²	61.8	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-108.8	-29.6	-179	167.2	0	0	0	0	111.6	R190 H191 L192 I208 A212	R190-V194 WeakPolarHBondContact O-CG2 3.4Å; R190-V194 PolarHBondContact O-N 3.39Å; R190-V194 VanDerWaalsContact O-N 3.15Å; H191-V194 PolarHBondContact O-N 3.27Å; H191-V194 VanDerWaalsContact O-N 3.17Å; L192-V194 VanDerWaalsContact C-N 3.25Å; L192-V194 PolarHBondContact O-N 3.26Å; V194-I208 HydrophobicContact CG2-CG2 4.39Å; V194-A212 HydrophobicContact CB-CB 4.32Å; V194-A212 HydrophobicContact CG1-CB 3.51Å; V194-A212 HydrophobicContact CG2-CB 3.76Å
195	S	72.4	Confident	63.4	Low	40 Å²	40	63.1 Å²	63.1	28%	0.28	33%	0.331	S	S	.	.	H	α-helix	trans	-116.9	-17.3	-170.6	-52	0	0	0	0	113.7	H191 R216	H191-S195 WeakPolarHBondContact O-CB 3.46Å; H191-S195 PolarHBondContact O-N 2.96Å; H191-S195 PolarHBondContact O-OG 2.92Å; S195-R216 PolarHBondContact OG-NH2 3.21Å
196	H	74.4	Confident	63.6	Low	54 Å²	54	62.2 Å²	62.2	25%	0.25	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	4.5	-172	-60.6	-73.2	0	0	0	114.6	L172 C173 H191 L192 L198	L172-H196 HydrophobicContact CD1-CB 3.76Å; C173-H196 PolarHBondContact SG-NE2 3.36Å; H191-H196 AromaticContact CD2-CD2 3.88Å; H191-H196 AromaticContact CE1-NE2 3.99Å; H191-H196 AromaticContact NE2-CD2 3.33Å; H191-H196 PolarHBondContact NE2-CD2 3.24Å; H191-H196 VanDerWaalsContact NE2-CD2 3.33Å; H191-H196 AromaticContact NE2-NE2 3.27Å; H191-H196 PolarHBondContact NE2-NE2 3.26Å; L192-H196 HydrophobicContact CD2-CB 3.96Å; L192-H196 CarbonylContact O-C 3.12Å; L192-H196 VanDerWaalsContact O-CA 3.28Å; L192-H196 WeakPolarHBondContact O-CA 3.37Å; L192-H196 PolarHBondContact O-N 3.27Å; H196-L198 VanDerWaalsContact C-N 3.26Å; H196-L198 PolarHBondContact O-N 2.92Å
197	T	65.8	Low	63.2	Low	39 Å²	39	65.3 Å²	65.3	24%	0.239	32%	0.324	C	S	.	.			trans	-72.4	79.8	170.8	21.5	0	0	0	0	109.9	L154 L192 Q193 L204	L154-T197 HydrophobicContact CD2-CG2 3.23Å; L192-T197 PolarHBondContact O-N 3.17Å; L192-T197 PolarHBondContact O-OG1 3.09Å; Q193-T197 WeakPolarHBondContact CA-OG1 3.26Å; Q193-T197 HydrophobicContact CB-CG2 4.32Å; Q193-T197 HydrophobicContact CG-CG2 4.29Å; Q193-T197 PolarHBondContact O-OG1 2.91Å; T197-L204 HydrophobicContact CG2-CD2 4.31Å
198	L	53	Low	62.3	Low	67 Å²	67	66 Å²	66	35%	0.351	33%	0.325	S	S	.	.	S	Bend	trans	-93.4	-5.7	165	-72.8	166.3	0	0	0	112.3	P85 H196	P85-L198 HydrophobicContact CG-CB 4.34Å; P85-L198 HydrophobicContact CG-CD2 3.72Å; P85-L198 WeakPolarHBondContact CG-O 3.39Å; H196-L198 VanDerWaalsContact C-N 3.26Å; H196-L198 PolarHBondContact O-N 2.92Å
199	F	52.7	Low	61.2	Low	80 Å²	80	68.4 Å²	68.4	35%	0.351	34%	0.337	S	S	.	.	S	Bend	trans	-147.2	124.3	170.6	-62.7	-80.5	0	0	0	107.8	Q46	Q46-F199 HydrophobicContact CB-CZ 4.06Å; Q46-F199 HydrophobicContact CG-CZ 4.01Å
200	Y	49.1	Very low	60.3	Low	81 Å²	81	73.5 Å²	73.5	32%	0.318	36%	0.361	S	S	.	.			trans	148.6	75.4	160.8	-89.1	-74.6	0	0	0	107.8	L154 D155 D202 F203 L204	L154-Y200 HydrophobicContact CD2-CD2 4.27Å; D155-Y200 HydrophobicContact CB-CE2 3.68Å; D155-Y200 WeakPolarHBondContact CB-OH 3.28Å; D155-Y200 PolarHBondContact OD1-OH 3.15Å; Y200-D202 PolarHBondContact O-N 3.41Å; Y200-F203 HydrophobicContact CD1-CD2 4.18Å; Y200-F203 HydrophobicContact CD1-CE2 4.5Å; Y200-L204 WeakPolarHBondContact O-CG 3.35Å
201	D	43.9	Very low	59.3	Low	77 Å²	77	73.7 Å²	73.7	41%	0.412	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.8	174.7	-143.7	5.4	0	0	0	111.8	T87 K91	T87-D201 PolarHBondContact OG1-OD2 3.25Å; K91-D201 IonicContact NZ-OD2 2.77Å; K91-D201 PolarHBondContact NZ-OD2 3.07Å
202	D	46	Very low	58.1	Low	136 Å²	136	73.5 Å²	73.5	73%	0.727	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-8	-173.6	-65.8	-27.4	0	0	0	114.5	Y200	Y200-D202 PolarHBondContact O-N 3.41Å
203	F	50	Low	57.3	Low	110 Å²	110	78.2 Å²	78.2	48%	0.482	39%	0.391	S	S	.	.	S	Bend	trans	-129.8	14	-178.1	-67.1	-75.7	0	0	0	114.2	Y200 D205	Y200-F203 HydrophobicContact CD1-CD2 4.18Å; Y200-F203 HydrophobicContact CD1-CE2 4.5Å; F203-D205 PolarHBondContact O-N 3.42Å; F203-D205 VanDerWaalsContact O-N 3.1Å
204	L	47.8	Very low	56.9	Low	53 Å²	53	80.2 Å²	80.2	28%	0.277	40%	0.402	S	S	.	.			trans	-78.4	96.9	176.4	-58.5	-175.8	0	0	0	109.5	T197 Y200 F206 I209	T197-L204 HydrophobicContact CG2-CD2 4.31Å; Y200-L204 WeakPolarHBondContact O-CG 3.35Å; L204-F206 PolarHBondContact O-N 3.21Å; L204-I209 HydrophobicContact CB-CD1 4.03Å; L204-I209 HydrophobicContact CD1-CD1 3.99Å; L204-I209 HydrophobicContact CD2-CD1 4.08Å; L204-I209 HydrophobicContact CG-CD1 4.23Å
205	D	51.3	Low	56.4	Low	97 Å²	97	85 Å²	85	52%	0.519	42%	0.416	S	S	.	.			trans	-70.1	106.8	160.6	-144.3	-16.6	0	0	0	106.8	F203 D207 I208	F203-D205 PolarHBondContact O-N 3.42Å; F203-D205 VanDerWaalsContact O-N 3.1Å; D205-D207 PolarHBondContact O-N 2.79Å; D205-D207 VanDerWaalsContact O-N 3.08Å; D205-I208 HydrophobicContact CB-CD1 3.73Å; D205-I208 HydrophobicContact CB-CG1 4.01Å; D205-I208 PolarHBondContact O-N 3.13Å
206	F	54.7	Low	55.9	Low	164 Å²	164	89.2 Å²	89.2	72%	0.719	43%	0.426	S	S	*	.	H	α-helix	trans	-54.3	-30.8	-172.9	-72.5	-82.3	0	0	0	112.4	L204 I208 I209 E210	L204-F206 PolarHBondContact O-N 3.21Å; F206-I208 VanDerWaalsContact C-N 3.3Å; F206-I208 PolarHBondContact O-N 3.1Å; F206-I209 PolarHBondContact O-N 3.36Å; F206-E210 PolarHBondContact O-N 2.78Å
207	D	51.5	Low	55.4	Low	110 Å²	110	91.1 Å²	91.1	59%	0.588	44%	0.441	S	S	*	.	H	α-helix	trans	-63.7	-31.3	178.5	-62.6	-22.2	0	0	0	112.8	D205 E211	D205-D207 PolarHBondContact O-N 2.79Å; D205-D207 VanDerWaalsContact O-N 3.08Å; D207-E211 PolarHBondContact O-N 2.85Å
208	I	55.2	Low	55.4	Low	56 Å²	56	93.9 Å²	93.9	29%	0.287	45%	0.454	S	S	.	.	H	α-helix	trans	-77.3	-34.9	-177.1	-61.2	174.8	0	0	0	111.4	V194 D205 F206 A212	V194-I208 HydrophobicContact CG2-CG2 4.39Å; D205-I208 HydrophobicContact CB-CD1 3.73Å; D205-I208 HydrophobicContact CB-CG1 4.01Å; D205-I208 PolarHBondContact O-N 3.13Å; F206-I208 VanDerWaalsContact C-N 3.3Å; F206-I208 PolarHBondContact O-N 3.1Å; I208-A212 WeakPolarHBondContact O-CB 3.33Å; I208-A212 PolarHBondContact O-N 3.2Å
209	I	55	Low	56.1	Low	57 Å²	57	95.2 Å²	95.2	29%	0.292	46%	0.461	S	S	.	.	H	α-helix	trans	-71.1	-44.9	178.4	-62.9	170.8	0	0	0	109.7	L204 F206 A212 L213	L204-I209 HydrophobicContact CB-CD1 4.03Å; L204-I209 HydrophobicContact CD1-CD1 3.99Å; L204-I209 HydrophobicContact CD2-CD1 4.08Å; L204-I209 HydrophobicContact CG-CD1 4.23Å; F206-I209 PolarHBondContact O-N 3.36Å; I209-A212 PolarHBondContact O-N 3.48Å; I209-L213 HydrophobicContact CG2-CD1 3.83Å; I209-L213 HydrophobicContact CG2-CG 4.34Å; I209-L213 WeakPolarHBondContact O-CB 3.45Å; I209-L213 WeakPolarHBondContact O-CG 3.4Å; I209-L213 PolarHBondContact O-N 3.48Å
210	E	60	Low	56.7	Low	122 Å²	122	100 Å²	100	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-60.9	-48.9	178.8	-173.6	171.1	-171.6	0	0	111.1	F206 A212 L213 I214	F206-E210 PolarHBondContact O-N 2.78Å; E210-A212 VanDerWaalsContact C-N 3.3Å; E210-A212 PolarHBondContact O-N 3.48Å; E210-L213 PolarHBondContact O-N 3.46Å; E210-I214 HydrophobicContact CG-CD1 3.73Å; E210-I214 HydrophobicContact CG-CG1 4.45Å; E210-I214 WeakPolarHBondContact O-CB 3.17Å; E210-I214 WeakPolarHBondContact O-CD1 3.41Å; E210-I214 WeakPolarHBondContact O-CG1 3.46Å; E210-I214 PolarHBondContact O-N 2.81Å
211	E	56.2	Low	57.7	Low	103 Å²	103	99 Å²	99	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-59.4	-39.2	176.5	-82.4	-146.9	147.2	0	0	113.3	R190 D207 R215	R190-E211 IonicContact NH2-OE2 3.74Å; D207-E211 PolarHBondContact O-N 2.85Å; E211-R215 WeakPolarHBondContact O-CB 3.47Å; E211-R215 WeakPolarHBondContact O-CG 3.5Å; E211-R215 PolarHBondContact O-N 2.87Å
212	A	57.2	Low	59	Low	12 Å²	12	100.2 Å²	100.2	10%	0.099	49%	0.488	C	S	.	.	H	α-helix	trans	-72.4	-36.4	-178.3	0	0	0	0	0	112.6	V194 I208 I209 E210 R216	V194-A212 HydrophobicContact CB-CB 4.32Å; V194-A212 HydrophobicContact CG1-CB 3.51Å; V194-A212 HydrophobicContact CG2-CB 3.76Å; I208-A212 WeakPolarHBondContact O-CB 3.33Å; I208-A212 PolarHBondContact O-N 3.2Å; I209-A212 PolarHBondContact O-N 3.48Å; E210-A212 VanDerWaalsContact C-N 3.3Å; E210-A212 PolarHBondContact O-N 3.48Å; A212-R216 PolarHBondContact O-N 3.19Å; A212-R216 VanDerWaalsContact O-N 3.08Å
213	L	59.6	Low	60	Low	101 Å²	101	98.9 Å²	98.9	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-67.1	-43.1	172.7	-71.6	172.5	0	0	0	110.8	I209 E210 R216 V217	I209-L213 HydrophobicContact CG2-CD1 3.83Å; I209-L213 HydrophobicContact CG2-CG 4.34Å; I209-L213 WeakPolarHBondContact O-CB 3.45Å; I209-L213 WeakPolarHBondContact O-CG 3.4Å; I209-L213 PolarHBondContact O-N 3.48Å; E210-L213 PolarHBondContact O-N 3.46Å; L213-R216 PolarHBondContact O-N 3.38Å; L213-V217 WeakPolarHBondContact O-CG2 3.42Å; L213-V217 PolarHBondContact O-N 3.17Å; L213-V217 VanDerWaalsContact O-N 3.07Å
214	I	68.4	Low	60.9	Low	84 Å²	84	98.4 Å²	98.4	43%	0.431	48%	0.48	S	S	.	.	H	α-helix	trans	-60	-48.1	175.5	-69.2	166.5	0	0	0	110.3	E210 R216 V217 L218	E210-I214 HydrophobicContact CG-CD1 3.73Å; E210-I214 HydrophobicContact CG-CG1 4.45Å; E210-I214 WeakPolarHBondContact O-CB 3.17Å; E210-I214 WeakPolarHBondContact O-CD1 3.41Å; E210-I214 WeakPolarHBondContact O-CG1 3.46Å; E210-I214 PolarHBondContact O-N 2.81Å; I214-R216 PolarHBondContact O-N 2.78Å; I214-V217 PolarHBondContact O-N 3.24Å; I214-L218 HydrophobicContact CG2-CD1 3.75Å; I214-L218 HydrophobicContact CG2-CG 4.24Å; I214-L218 VanDerWaalsContact O-CG 3.28Å; I214-L218 WeakPolarHBondContact O-CG 3.39Å; I214-L218 PolarHBondContact O-N 3.33Å
215	R	60.6	Low	61.9	Low	141 Å²	141	104 Å²	104	53%	0.532	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-42.8	177.5	-81.7	-179.4	175.4	169.2	3	113	E211 V217 L218 D219	E211-R215 WeakPolarHBondContact O-CB 3.47Å; E211-R215 WeakPolarHBondContact O-CG 3.5Å; E211-R215 PolarHBondContact O-N 2.87Å; R215-V217 VanDerWaalsContact C-N 3.32Å; R215-V217 PolarHBondContact O-N 3.34Å; R215-L218 PolarHBondContact O-N 2.97Å; R215-D219 WeakPolarHBondContact O-CB 3.36Å; R215-D219 PolarHBondContact O-N 3.39Å
216	R	60.8	Low	62.8	Low	130 Å²	130	102.4 Å²	102.4	49%	0.491	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-39	176.7	-84.5	-178	160.2	140	-0.2	112.7	S195 A212 L213 I214 R220	S195-R216 PolarHBondContact OG-NH2 3.21Å; A212-R216 PolarHBondContact O-N 3.19Å; A212-R216 VanDerWaalsContact O-N 3.08Å; L213-R216 PolarHBondContact O-N 3.38Å; I214-R216 PolarHBondContact O-N 2.78Å; R216-R220 WeakPolarHBondContact O-CB 3.47Å; R216-R220 PolarHBondContact O-N 3.4Å; R216-R220 VanDerWaalsContact O-N 3.13Å
217	V	65.2	Low	63.4	Low	93 Å²	93	99.2 Å²	99.2	56%	0.564	48%	0.482	S	S	*	.	H	α-helix	trans	-67.1	-44.9	175.5	173.4	0	0	0	0	110.4	L213 I214 R215 R220 S221	L213-V217 WeakPolarHBondContact O-CG2 3.42Å; L213-V217 PolarHBondContact O-N 3.17Å; L213-V217 VanDerWaalsContact O-N 3.07Å; I214-V217 PolarHBondContact O-N 3.24Å; R215-V217 VanDerWaalsContact C-N 3.32Å; R215-V217 PolarHBondContact O-N 3.34Å; V217-R220 PolarHBondContact O-N 2.96Å; V217-S221 PolarHBondContact O-N 3.45Å; V217-S221 PolarHBondContact O-OG 3.27Å
218	L	65.6	Low	63.8	Low	97 Å²	97	100.2 Å²	100.2	51%	0.508	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-42.9	178.9	-68.3	173.5	0	0	0	112.5	I214 R215 S221 L222	I214-L218 HydrophobicContact CG2-CD1 3.75Å; I214-L218 HydrophobicContact CG2-CG 4.24Å; I214-L218 VanDerWaalsContact O-CG 3.28Å; I214-L218 WeakPolarHBondContact O-CG 3.39Å; I214-L218 PolarHBondContact O-N 3.33Å; R215-L218 PolarHBondContact O-N 2.97Å; L218-S221 PolarHBondContact O-N 3.22Å; L218-L222 WeakPolarHBondContact O-CB 3.36Å; L218-L222 PolarHBondContact O-N 3.02Å
219	D	67	Low	63.9	Low	96 Å²	96	100.1 Å²	100.1	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-39.1	177.3	-74.1	-18.4	0	0	0	111.6	R215 L222 L223	R215-D219 WeakPolarHBondContact O-CB 3.36Å; R215-D219 PolarHBondContact O-N 3.39Å; D219-L222 PolarHBondContact O-N 2.9Å; D219-L223 WeakPolarHBondContact O-CB 3.45Å; D219-L223 WeakPolarHBondContact O-CG 3.39Å; D219-L223 PolarHBondContact O-N 2.9Å
220	R	64.6	Low	63.8	Low	179 Å²	179	103.2 Å²	103.2	68%	0.675	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-46.5	174.6	-166.2	92.1	179.7	-160	3.2	111	R216 V217 L222 L223 E224	R216-R220 WeakPolarHBondContact O-CB 3.47Å; R216-R220 PolarHBondContact O-N 3.4Å; R216-R220 VanDerWaalsContact O-N 3.13Å; V217-R220 PolarHBondContact O-N 2.96Å; R220-L222 VanDerWaalsContact C-N 3.35Å; R220-L223 PolarHBondContact O-N 2.96Å; R220-E224 WeakPolarHBondContact O-CG 3.16Å; R220-E224 PolarHBondContact O-N 3.36Å
221	S	70.4	Confident	63.4	Low	61 Å²	61	103 Å²	103	43%	0.427	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-35.1	177.8	-65	0	0	0	0	112.7	V217 L218 E224 Y225	V217-S221 PolarHBondContact O-N 3.45Å; V217-S221 PolarHBondContact O-OG 3.27Å; L218-S221 PolarHBondContact O-N 3.22Å; S221-E224 PolarHBondContact O-N 3.43Å; S221-Y225 WeakPolarHBondContact O-CB 3.26Å; S221-Y225 PolarHBondContact O-N 3.01Å
222	L	71.1	Confident	63	Low	102 Å²	102	106.4 Å²	106.4	53%	0.534	54%	0.54	S	S	.	.	H	α-helix	trans	-66.4	-44.5	174.2	-95.8	164.3	0	0	0	111.9	L218 D219 R220 E224 Y225 V226	L218-L222 WeakPolarHBondContact O-CB 3.36Å; L218-L222 PolarHBondContact O-N 3.02Å; D219-L222 PolarHBondContact O-N 2.9Å; R220-L222 VanDerWaalsContact C-N 3.35Å; L222-E224 VanDerWaalsContact C-N 3.32Å; L222-E224 PolarHBondContact O-N 2.91Å; L222-Y225 PolarHBondContact O-N 3.21Å; L222-V226 WeakPolarHBondContact O-CB 3.47Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.28Å; L222-V226 PolarHBondContact O-N 3.4Å
223	L	67.3	Low	63.3	Low	109 Å²	109	111.2 Å²	111.2	57%	0.571	56%	0.562	S	S	*	*	H	α-helix	trans	-62.6	-40.3	175.4	-79.9	162.8	0	0	0	111.7	D219 R220 N227	D219-L223 WeakPolarHBondContact O-CB 3.45Å; D219-L223 WeakPolarHBondContact O-CG 3.39Å; D219-L223 PolarHBondContact O-N 2.9Å; R220-L223 PolarHBondContact O-N 2.96Å; L223-N227 WeakPolarHBondContact O-CB 3.44Å; L223-N227 PolarHBondContact O-N 3.31Å; L223-N227 PolarHBondContact O-ND2 3.48Å
224	E	70	Confident	63.4	Low	100 Å²	100	111.7 Å²	111.7	47%	0.467	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-45.5	174.5	-75	172.8	-175.3	0	0	111.4	R220 S221 L222 N227 H228	R220-E224 WeakPolarHBondContact O-CG 3.16Å; R220-E224 PolarHBondContact O-N 3.36Å; S221-E224 PolarHBondContact O-N 3.43Å; L222-E224 VanDerWaalsContact C-N 3.32Å; L222-E224 PolarHBondContact O-N 2.91Å; E224-N227 PolarHBondContact O-N 3.49Å; E224-H228 PolarHBondContact O-N 2.72Å; E224-H228 PolarHBondContact O-ND1 3.01Å
225	Y	68.8	Low	63.2	Low	170 Å²	170	113.2 Å²	113.2	67%	0.667	57%	0.571	S	S	*	*	H	α-helix	trans	-60.1	-48.3	176.6	-176.9	-96.6	0	0	0	112.1	S221 L222 N227 H228 S229	S221-Y225 WeakPolarHBondContact O-CB 3.26Å; S221-Y225 PolarHBondContact O-N 3.01Å; L222-Y225 PolarHBondContact O-N 3.21Å; Y225-N227 VanDerWaalsContact C-N 3.32Å; Y225-N227 PolarHBondContact O-N 2.93Å; Y225-H228 PolarHBondContact O-N 3.36Å; Y225-H228 VanDerWaalsContact O-N 3.17Å; Y225-S229 PolarHBondContact O-N 3.38Å; Y225-S229 PolarHBondContact O-OG 2.97Å
226	V	70.1	Confident	63.3	Low	63 Å²	63	111.6 Å²	111.6	38%	0.382	57%	0.574	S	S	.	*	H	α-helix	trans	-61	-41.5	179.6	170.9	0	0	0	0	111.3	L222 S229 N230	L222-V226 WeakPolarHBondContact O-CB 3.47Å; L222-V226 VanDerWaalsContact O-CG2 3.26Å; L222-V226 WeakPolarHBondContact O-CG2 3.28Å; L222-V226 PolarHBondContact O-N 3.4Å; V226-S229 VanDerWaalsContact CA-OG 3.28Å; V226-S229 WeakPolarHBondContact CA-OG 3.49Å; V226-S229 PolarHBondContact O-N 3.14Å; V226-S229 PolarHBondContact O-OG 2.93Å; V226-N230 WeakPolarHBondContact CG1-ND2 3.33Å; V226-N230 WeakPolarHBondContact O-CB 3.45Å; V226-N230 PolarHBondContact O-N 3.17Å; V226-N230 PolarHBondContact O-ND2 3.06Å; V226-N230 VanDerWaalsContact O-ND2 3.14Å
227	N	67.7	Low	63.5	Low	98 Å²	98	110.4 Å²	110.4	52%	0.524	58%	0.579	S	S	.	*	H	α-helix	trans	-67.2	-35.6	177.1	-73.9	-21.4	0	0	0	112.7	L223 E224 Y225 T231	L223-N227 WeakPolarHBondContact O-CB 3.44Å; L223-N227 PolarHBondContact O-N 3.31Å; L223-N227 PolarHBondContact O-ND2 3.48Å; E224-N227 PolarHBondContact O-N 3.49Å; Y225-N227 VanDerWaalsContact C-N 3.32Å; Y225-N227 PolarHBondContact O-N 2.93Å; N227-T231 WeakPolarHBondContact O-CG2 3.46Å; N227-T231 PolarHBondContact O-OG1 3.14Å
228	H	59.9	Low	63.4	Low	131 Å²	131	111.6 Å²	111.6	61%	0.606	58%	0.58	S	S	*	*	H	α-helix	trans	-71	-35.5	174.2	-74.9	79	0	0	0	112.4	E224 Y225 T231	E224-H228 PolarHBondContact O-N 2.72Å; E224-H228 PolarHBondContact O-ND1 3.01Å; Y225-H228 PolarHBondContact O-N 3.36Å; Y225-H228 VanDerWaalsContact O-N 3.17Å; H228-T231 PolarHBondContact O-OG1 2.88Å; H228-T231 VanDerWaalsContact O-OG1 3.14Å
229	S	56.6	Low	63.2	Low	54 Å²	54	112.6 Å²	112.6	38%	0.378	59%	0.585	S	S	.	*	H	α-helix	trans	-74.9	-20.9	176.4	45.6	0	0	0	0	114.4	Y225 V226	Y225-S229 PolarHBondContact O-N 3.38Å; Y225-S229 PolarHBondContact O-OG 2.97Å; V226-S229 VanDerWaalsContact CA-OG 3.28Å; V226-S229 WeakPolarHBondContact CA-OG 3.49Å; V226-S229 PolarHBondContact O-N 3.14Å; V226-S229 PolarHBondContact O-OG 2.93Å
230	N	53.5	Low	62.9	Low	122 Å²	122	113.9 Å²	113.9	65%	0.652	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-3	176.8	-69.6	-26.7	0	0	0	113.3	V226	V226-N230 WeakPolarHBondContact CG1-ND2 3.33Å; V226-N230 WeakPolarHBondContact O-CB 3.45Å; V226-N230 PolarHBondContact O-N 3.17Å; V226-N230 PolarHBondContact O-ND2 3.06Å; V226-N230 VanDerWaalsContact O-ND2 3.14Å
231	T	52	Low	62.8	Low	116 Å²	116	108.5 Å²	108.5	71%	0.712	58%	0.583	S	S	*	*			trans	-110	8	-178.5	43.8	0	0	0	0	113.8	N227 H228	N227-T231 WeakPolarHBondContact O-CG2 3.46Å; N227-T231 PolarHBondContact O-OG1 3.14Å; H228-T231 PolarHBondContact O-OG1 2.88Å; H228-T231 VanDerWaalsContact O-OG1 3.14Å
232	T	46	Very low	62.1	Low	176 Å²	176	112.8 Å²	112.8	100%	1.08	60%	0.597	S	S	*	*			trans	-117.1	0	170.6	51	0	0	0	0	110.6

Retrieved 232 of 232 residues in 102.1 ms (Link to these results)

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