A0A2K5ZUA8_MANLE Loading...

Leucine rich adaptor protein 1

AlphaFold DB , UniProt , Accession A0A2K5ZUA8, Species MANLE (Mandrillus leucophaeus, Drill), Gene LURAP1, Length 239 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	34.4	Very low	46.2	Very low	253 Å²	253	132.7 Å²	132.7	100%	1.246	74%	0.738	S	S	*	*				0	81.2	0	-155.6	168.8	-177.9	0	0	104.8
2	E	33.9	Very low	49.2	Very low	193 Å²	193	124.4 Å²	124.4	90%	0.902	69%	0.691	S	S	*	*			trans	-113.4	98.7	-172.9	-154.3	161.5	-161	0	0	105.1	T4	E2-T4 PolarHBondContact O-N 3.28Å
3	G	35.8	Very low	51.8	Low	69 Å²	69	126.7 Å²	126.7	71%	0.711	68%	0.682	S	S	*	*			trans	-80.1	99.4	-179.7	0	0	0	0	0	108.4	V5	G3-V5 PolarHBondContact O-N 3.05Å
4	T	31.4	Very low	54	Low	122 Å²	122	127.3 Å²	127.3	75%	0.748	69%	0.685	S	S	*	*			trans	-61.2	107.2	164.8	-43.3	0	0	0	0	106.8	E2 E6	E2-T4 PolarHBondContact O-N 3.28Å; T4-E6 HydrophobicContact CG2-CG 4.47Å; T4-E6 PolarHBondContact O-N 2.83Å
5	V	40.2	Very low	55.9	Low	138 Å²	138	122.2 Å²	122.2	84%	0.836	66%	0.66	S	S	*	*			trans	-69.7	82.7	168.6	-176	0	0	0	0	105.5	G3 S7	G3-V5 PolarHBondContact O-N 3.05Å; V5-S7 PolarHBondContact O-N 3.46Å
6	E	40.5	Very low	57.8	Low	165 Å²	165	117.2 Å²	117.2	77%	0.771	63%	0.631	S	S	*	*			trans	-58.1	108.5	163.7	-70.2	-161.1	158.5	0	0	105.8	T4 Q8	T4-E6 HydrophobicContact CG2-CG 4.47Å; T4-E6 PolarHBondContact O-N 2.83Å; E6-Q8 PolarHBondContact O-N 3.26Å
7	S	43.9	Very low	59.3	Low	77 Å²	77	114.1 Å²	114.1	54%	0.538	63%	0.633	S	S	.	*			trans	-47	110	165.2	52	0	0	0	0	106.5	V5 T9	V5-S7 PolarHBondContact O-N 3.46Å; S7-T9 PolarHBondContact O-N 3.38Å
8	Q	52.8	Low	60.5	Low	191 Å²	191	117.1 Å²	117.1	89%	0.893	64%	0.639	S	S	*	*			trans	-64.6	79.2	-174.1	-168.8	176.6	18.7	0	0	108.7	E6 P10	E6-Q8 PolarHBondContact O-N 3.26Å; Q8-P10 WeakPolarHBondContact O-CD 3.29Å
9	T	55.2	Low	61.4	Low	68 Å²	68	111.8 Å²	111.8	42%	0.417	61%	0.611	S	S	.	*			trans	-69.1	119.8	174.7	46.5	0	0	0	0	106.7	S7 D11	S7-T9 PolarHBondContact O-N 3.38Å; T9-D11 PolarHBondContact O-N 2.9Å
10	P	63.6	Low	62.5	Low	61 Å²	61	109.7 Å²	109.7	40%	0.396	62%	0.615	S	S	.	*			trans	-62.3	113.5	175.4	-13.3	27.2	0	0	0	107.6	Q8 L12 L31	Q8-P10 WeakPolarHBondContact O-CD 3.29Å; P10-L12 PolarHBondContact O-N 3.42Å; P10-L31 HydrophobicContact CB-CD1 4.13Å; P10-L31 HydrophobicContact CG-CB 4.07Å; P10-L31 HydrophobicContact CG-CD1 4.06Å; P10-L31 HydrophobicContact CG-CD2 4.21Å; P10-L31 HydrophobicContact CG-CG 4.34Å
11	D	76.4	Confident	63.5	Low	123 Å²	123	111.3 Å²	111.3	66%	0.658	61%	0.612	S	S	*	*			trans	-74.9	122	177.3	-170.8	17.8	0	0	0	109	T9 R13	T9-D11 PolarHBondContact O-N 2.9Å; D11-R13 WeakPolarHBondContact OD1-CG 3.1Å; D11-R13 PolarHBondContact OD1-N 3.1Å; D11-R13 VanDerWaalsContact OD2-CG 3.29Å; D11-R13 WeakPolarHBondContact OD2-CG 3.23Å
12	L	82.1	Confident	66.1	Low	33 Å²	33	107.5 Å²	107.5	17%	0.173	59%	0.588	C	S	.	*			trans	-100	14.4	-176.4	-68.4	177.5	0	0	0	112.7	P10 D14 V15 E16 T23 L28 L31 W92	P10-L12 PolarHBondContact O-N 3.42Å; L12-D14 VanDerWaalsContact C-N 3.3Å; L12-D14 PolarHBondContact O-N 2.89Å; L12-V15 HydrophobicContact CD2-CG2 4.25Å; L12-V15 CarbonylContact O-C 3.58Å; L12-V15 WeakPolarHBondContact O-CA 3.5Å; L12-V15 PolarHBondContact O-N 2.85Å; L12-E16 PolarHBondContact O-N 3.46Å; L12-T23 HydrophobicContact CB-CG2 4.36Å; L12-T23 HydrophobicContact CD1-CG2 3.6Å; L12-L28 HydrophobicContact CD1-CD2 4.31Å; L12-L31 HydrophobicContact CD1-CD1 3.64Å; L12-L31 HydrophobicContact CD2-CD1 4.49Å; L12-L31 HydrophobicContact CG-CD1 4.14Å; L12-W92 HydrophobicContact CD1-CH2 4.34Å
13	R	83.4	Confident	68.7	Low	154 Å²	154	99.2 Å²	99.2	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-52.2	-41.9	-179.9	-74.6	-78.1	-177.2	-151.6	4.8	114.2	D11 V15 E16 G17	D11-R13 WeakPolarHBondContact OD1-CG 3.1Å; D11-R13 PolarHBondContact OD1-N 3.1Å; D11-R13 VanDerWaalsContact OD2-CG 3.29Å; D11-R13 WeakPolarHBondContact OD2-CG 3.23Å; R13-V15 VanDerWaalsContact C-N 3.28Å; R13-V15 PolarHBondContact O-N 3.15Å; R13-E16 IonicContact CZ-OE2 3.81Å; R13-E16 IonicContact NH1-OE1 3.91Å; R13-E16 IonicContact NH1-OE2 3.88Å; R13-E16 PolarHBondContact NH1-OE2 2.84Å; R13-E16 PolarHBondContact O-N 3.43Å; R13-G17 PolarHBondContact O-N 2.98Å
14	D	82.1	Confident	71.2	Confident	135 Å²	135	97 Å²	97	72%	0.722	52%	0.524	S	S	*	.	H	α-helix	trans	-65	-35.6	177.9	-67.6	-26.4	0	0	0	111.7	L12 K18	L12-D14 VanDerWaalsContact C-N 3.3Å; L12-D14 PolarHBondContact O-N 2.89Å; D14-K18 WeakPolarHBondContact O-CB 3.44Å; D14-K18 VanDerWaalsContact O-CG 3.23Å; D14-K18 WeakPolarHBondContact O-CG 3.36Å; D14-K18 PolarHBondContact O-N 2.7Å; D14-K18 VanDerWaalsContact O-N 3.1Å
15	V	82.3	Confident	73.8	Confident	51 Å²	51	98.2 Å²	98.2	31%	0.309	52%	0.521	S	S	.	.	H	α-helix	trans	-77.3	-38.2	178.3	-170.2	0	0	0	0	110.6	L12 R13 G17 K18 V19 W92	L12-V15 HydrophobicContact CD2-CG2 4.25Å; L12-V15 CarbonylContact O-C 3.58Å; L12-V15 WeakPolarHBondContact O-CA 3.5Å; L12-V15 PolarHBondContact O-N 2.85Å; R13-V15 VanDerWaalsContact C-N 3.28Å; R13-V15 PolarHBondContact O-N 3.15Å; V15-G17 VanDerWaalsContact C-N 3.32Å; V15-G17 PolarHBondContact O-N 2.96Å; V15-K18 PolarHBondContact O-N 3.48Å; V15-K18 VanDerWaalsContact O-N 3.15Å; V15-V19 HydrophobicContact CG1-CG2 3.99Å; V15-V19 WeakPolarHBondContact O-CB 3.42Å; V15-V19 VanDerWaalsContact O-CG2 3.3Å; V15-V19 WeakPolarHBondContact O-CG2 3.3Å; V15-V19 PolarHBondContact O-N 2.82Å; V15-W92 HydrophobicContact CB-CH2 3.7Å; V15-W92 HydrophobicContact CB-CZ2 4.24Å; V15-W92 HydrophobicContact CG1-CH2 3.21Å; V15-W92 HydrophobicContact CG1-CZ2 3.78Å; V15-W92 HydrophobicContact CG1-CZ3 3.85Å
16	E	87.1	Confident	76	Confident	42 Å²	42	92.3 Å²	92.3	20%	0.196	49%	0.489	C	S	.	.	H	α-helix	trans	-56.4	-45.7	169.8	176.8	178.3	-160.6	0	0	111	L12 R13 K18 V19 G20 K22	L12-E16 PolarHBondContact O-N 3.46Å; R13-E16 IonicContact CZ-OE2 3.81Å; R13-E16 IonicContact NH1-OE1 3.91Å; R13-E16 IonicContact NH1-OE2 3.88Å; R13-E16 PolarHBondContact NH1-OE2 2.84Å; R13-E16 PolarHBondContact O-N 3.43Å; E16-K18 VanDerWaalsContact C-N 3.31Å; E16-K18 PolarHBondContact O-N 3.42Å; E16-V19 PolarHBondContact O-N 3.01Å; E16-G20 WeakPolarHBondContact O-CA 3.47Å; E16-G20 PolarHBondContact O-N 3.44Å; E16-K22 WeakPolarHBondContact OE1-CG 3.47Å
17	G	82.6	Confident	78.3	Confident	65 Å²	65	86.1 Å²	86.1	67%	0.67	46%	0.46	S	S	*	.	H	α-helix	trans	-65.1	-31.5	175.9	0	0	0	0	0	113.8	R13 V15	R13-G17 PolarHBondContact O-N 2.98Å; V15-G17 VanDerWaalsContact C-N 3.32Å; V15-G17 PolarHBondContact O-N 2.96Å
18	K	81.8	Confident	80.4	Confident	168 Å²	168	86 Å²	86	73%	0.73	45%	0.454	S	S	*	.	H	α-helix	trans	-79.6	-37.4	176.9	-75.1	171.4	65.8	172.7	0	113.6	D14 V15 E16	D14-K18 WeakPolarHBondContact O-CB 3.44Å; D14-K18 VanDerWaalsContact O-CG 3.23Å; D14-K18 WeakPolarHBondContact O-CG 3.36Å; D14-K18 PolarHBondContact O-N 2.7Å; D14-K18 VanDerWaalsContact O-N 3.1Å; V15-K18 PolarHBondContact O-N 3.48Å; V15-K18 VanDerWaalsContact O-N 3.15Å; E16-K18 VanDerWaalsContact C-N 3.31Å; E16-K18 PolarHBondContact O-N 3.42Å
19	V	77.9	Confident	82	Confident	17 Å²	17	82 Å²	82	10%	0.103	43%	0.43	C	S	.	.	H	α-helix	trans	-83	-20.6	179	174.9	0	0	0	0	110.9	V15 E16 R21 W92	V15-V19 HydrophobicContact CG1-CG2 3.99Å; V15-V19 WeakPolarHBondContact O-CB 3.42Å; V15-V19 VanDerWaalsContact O-CG2 3.3Å; V15-V19 WeakPolarHBondContact O-CG2 3.3Å; V15-V19 PolarHBondContact O-N 2.82Å; E16-V19 PolarHBondContact O-N 3.01Å; V19-R21 HydrophobicContact CG1-CB 4.2Å; V19-R21 HydrophobicContact CG1-CG 4.26Å; V19-R21 PolarHBondContact O-N 3.49Å; V19-W92 HydrophobicContact CG2-CZ2 4.37Å
20	G	81.8	Confident	83.3	Confident	68 Å²	68	80.4 Å²	80.4	70%	0.701	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	14.1	-179.3	0	0	0	0	0	113.8	E16	E16-G20 WeakPolarHBondContact O-CA 3.47Å; E16-G20 PolarHBondContact O-N 3.44Å
21	R	84.5	Confident	84.1	Confident	144 Å²	144	81.5 Å²	81.5	54%	0.543	43%	0.429	S	S	.	.	S	Bend	trans	-139.7	145.5	-178.2	-47.5	-177	-155.1	-83.9	-1.9	110.1	V19 W92 E95	V19-R21 HydrophobicContact CG1-CB 4.2Å; V19-R21 HydrophobicContact CG1-CG 4.26Å; V19-R21 PolarHBondContact O-N 3.49Å; R21-W92 PolarHBondContact O-NE1 2.8Å; R21-E95 IonicContact NE-OE2 3.7Å
22	K	88.3	Confident	84.5	Confident	173 Å²	173	81.7 Å²	81.7	75%	0.752	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-56.4	139.4	177.4	-69	-176.5	174.5	176.6	0	111.2	E16 W92	E16-K22 WeakPolarHBondContact OE1-CG 3.47Å; K22-W92 PolarHBondContact O-NE1 3.38Å
23	T	88.9	Confident	84.1	Confident	19 Å²	19	83.1 Å²	83.1	12%	0.117	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-63.7	130.9	173.9	-54.2	0	0	0	0	110.2	L12 L27 L28 W92	L12-T23 HydrophobicContact CB-CG2 4.36Å; L12-T23 HydrophobicContact CD1-CG2 3.6Å; T23-L27 HydrophobicContact CG2-CB 4.12Å; T23-L27 HydrophobicContact CG2-CD1 4.36Å; T23-L28 HydrophobicContact CG2-CD2 4.02Å; T23-L28 HydrophobicContact CG2-CG 3.97Å; T23-W92 HydrophobicContact CG2-CH2 4.23Å; T23-W92 HydrophobicContact CG2-CZ2 4.24Å; T23-W92 WeakPolarHBondContact OG1-CZ2 3.36Å
24	P	87.7	Confident	83.2	Confident	23 Å²	23	80.3 Å²	80.3	15%	0.149	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-64.1	141.7	177.2	23.9	-32	0	0	0	111.5	G26 L27 L28 W92	P24-G26 VanDerWaalsContact C-N 3.26Å; P24-G26 PolarHBondContact O-N 3.1Å; P24-L27 HydrophobicContact CG-CB 4.27Å; P24-L27 HydrophobicContact CG-CD1 3.69Å; P24-L27 HydrophobicContact CG-CG 3.96Å; P24-L27 WeakPolarHBondContact O-CB 3.14Å; P24-L27 PolarHBondContact O-N 3.36Å; P24-L27 VanDerWaalsContact O-N 3.08Å; P24-L28 PolarHBondContact O-N 3.42Å; P24-W92 HydrophobicContact CG-CB 4.04Å; P24-W92 HydrophobicContact CG-CG 4.14Å
25	E	86.6	Confident	82.1	Confident	147 Å²	147	78.1 Å²	78.1	69%	0.687	43%	0.431	S	S	*	.	H	α-helix	trans	-61.6	-33.8	-175.6	-64.6	-174.5	175.8	0	0	112.6	L27 L28 R29	E25-L27 VanDerWaalsContact C-N 3.27Å; E25-L27 PolarHBondContact O-N 3.29Å; E25-L28 PolarHBondContact O-N 3.17Å; E25-R29 WeakPolarHBondContact O-CB 3.41Å; E25-R29 PolarHBondContact O-N 3.01Å
26	G	87	Confident	81.1	Confident	15 Å²	15	81.4 Å²	81.4	16%	0.155	45%	0.447	C	S	.	.	H	α-helix	trans	-58.7	-35.1	175.4	0	0	0	0	0	113.3	P24 G30	P24-G26 VanDerWaalsContact C-N 3.26Å; P24-G26 PolarHBondContact O-N 3.1Å; G26-G30 PolarHBondContact O-N 2.89Å
27	L	88.1	Confident	79.6	Confident	34 Å²	34	84.7 Å²	84.7	18%	0.178	47%	0.465	C	S	.	.	H	α-helix	trans	-69.5	-45.8	174.5	-83.2	179.8	0	0	0	111.9	T23 P24 E25 R29 G30 L31 A89 W92	T23-L27 HydrophobicContact CG2-CB 4.12Å; T23-L27 HydrophobicContact CG2-CD1 4.36Å; P24-L27 HydrophobicContact CG-CB 4.27Å; P24-L27 HydrophobicContact CG-CD1 3.69Å; P24-L27 HydrophobicContact CG-CG 3.96Å; P24-L27 WeakPolarHBondContact O-CB 3.14Å; P24-L27 PolarHBondContact O-N 3.36Å; P24-L27 VanDerWaalsContact O-N 3.08Å; E25-L27 VanDerWaalsContact C-N 3.27Å; E25-L27 PolarHBondContact O-N 3.29Å; L27-R29 VanDerWaalsContact C-N 3.3Å; L27-R29 PolarHBondContact O-N 3.47Å; L27-G30 PolarHBondContact O-N 3.25Å; L27-L31 WeakPolarHBondContact O-CB 3.47Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.31Å; L27-L31 PolarHBondContact O-N 3.04Å; L27-A89 HydrophobicContact CD1-CB 3.99Å; L27-A89 HydrophobicContact CD2-CB 3.36Å; L27-A89 HydrophobicContact CG-CB 3.39Å; L27-W92 HydrophobicContact CD1-CD2 4.15Å; L27-W92 HydrophobicContact CD1-CE3 3.42Å; L27-W92 VanDerWaalsContact CD1-CE3 3.42Å; L27-W92 HydrophobicContact CD1-CZ3 3.81Å
28	L	87.8	Confident	78.1	Confident	76 Å²	76	83.6 Å²	83.6	40%	0.398	45%	0.454	S	S	.	.	H	α-helix	trans	-63.1	-40.4	178.9	-65	174.9	0	0	0	111.1	L12 T23 P24 E25 L31 R32	L12-L28 HydrophobicContact CD1-CD2 4.31Å; T23-L28 HydrophobicContact CG2-CD2 4.02Å; T23-L28 HydrophobicContact CG2-CG 3.97Å; P24-L28 PolarHBondContact O-N 3.42Å; E25-L28 PolarHBondContact O-N 3.17Å; L28-L31 PolarHBondContact O-N 2.87Å; L28-R32 WeakPolarHBondContact O-CB 3.47Å; L28-R32 PolarHBondContact O-N 3.47Å
29	R	86.3	Confident	76.7	Confident	106 Å²	106	82 Å²	82	40%	0.4	46%	0.458	S	S	.	.	H	α-helix	trans	-63.9	-45.5	174.1	-168.9	-168.8	-50	-127.9	4	111.7	E25 L27 L31 R32 G33 E34	E25-R29 WeakPolarHBondContact O-CB 3.41Å; E25-R29 PolarHBondContact O-N 3.01Å; L27-R29 VanDerWaalsContact C-N 3.3Å; L27-R29 PolarHBondContact O-N 3.47Å; R29-L31 PolarHBondContact O-N 3.45Å; R29-R32 WeakPolarHBondContact O-CB 3.34Å; R29-R32 PolarHBondContact O-N 3.33Å; R29-G33 PolarHBondContact O-N 3.46Å; R29-E34 HydrophobicContact CG-CB 3.87Å; R29-E34 PolarHBondContact O-N 3.47Å
30	G	82.6	Confident	75.3	Confident	34 Å²	34	87 Å²	87	35%	0.351	49%	0.494	S	S	.	.	H	α-helix	trans	-60.8	-41.6	175.9	0	0	0	0	0	112.9	G26 L27 R32 G33	G26-G30 PolarHBondContact O-N 2.89Å; L27-G30 PolarHBondContact O-N 3.25Å; G30-R32 VanDerWaalsContact C-N 3.31Å; G30-R32 PolarHBondContact O-N 3.08Å; G30-G33 PolarHBondContact O-N 3.27Å
31	L	81.2	Confident	73.5	Confident	85 Å²	85	86.6 Å²	86.6	45%	0.445	49%	0.49	S	S	.	.	H	α-helix	trans	-69.7	-26.8	175.8	-70.1	176.9	0	0	0	113.4	P10 L12 L27 L28 R29 G33	P10-L31 HydrophobicContact CB-CD1 4.13Å; P10-L31 HydrophobicContact CG-CB 4.07Å; P10-L31 HydrophobicContact CG-CD1 4.06Å; P10-L31 HydrophobicContact CG-CD2 4.21Å; P10-L31 HydrophobicContact CG-CG 4.34Å; L12-L31 HydrophobicContact CD1-CD1 3.64Å; L12-L31 HydrophobicContact CD2-CD1 4.49Å; L12-L31 HydrophobicContact CG-CD1 4.14Å; L27-L31 WeakPolarHBondContact O-CB 3.47Å; L27-L31 VanDerWaalsContact O-CG 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.31Å; L27-L31 PolarHBondContact O-N 3.04Å; L28-L31 PolarHBondContact O-N 2.87Å; R29-L31 PolarHBondContact O-N 3.45Å; L31-G33 PolarHBondContact O-N 3.2Å
32	R	85.6	Confident	71.7	Confident	127 Å²	127	84.3 Å²	84.3	48%	0.479	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.7	169.6	-167.2	-179.6	-64.7	-76.2	-1.7	112.2	L28 R29 G30 E34	L28-R32 WeakPolarHBondContact O-CB 3.47Å; L28-R32 PolarHBondContact O-N 3.47Å; R29-R32 WeakPolarHBondContact O-CB 3.34Å; R29-R32 PolarHBondContact O-N 3.33Å; G30-R32 VanDerWaalsContact C-N 3.31Å; G30-R32 PolarHBondContact O-N 3.08Å; R32-E34 HydrophobicContact CB-CB 4.25Å; R32-E34 WeakPolarHBondContact CD-OE2 3.46Å; R32-E34 HydrophobicContact CG-CB 4.32Å; R32-E34 IonicContact NE-OE2 2.85Å
33	G	71.9	Confident	69.9	Low	62 Å²	62	82 Å²	82	64%	0.639	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	16.5	-174	0	0	0	0	0	112.9	R29 G30 L31 C35	R29-G33 PolarHBondContact O-N 3.46Å; G30-G33 PolarHBondContact O-N 3.27Å; L31-G33 PolarHBondContact O-N 3.2Å; G33-C35 PolarHBondContact O-N 3.33Å
34	E	65.8	Low	68.1	Low	95 Å²	95	88.4 Å²	88.4	44%	0.444	53%	0.53	S	S	.	.			trans	-93.1	33.8	-171.8	-152.1	163.4	-126.7	0	0	111.3	R29 R32 D36	R29-E34 HydrophobicContact CG-CB 3.87Å; R29-E34 PolarHBondContact O-N 3.47Å; R32-E34 HydrophobicContact CB-CB 4.25Å; R32-E34 WeakPolarHBondContact CD-OE2 3.46Å; R32-E34 HydrophobicContact CG-CB 4.32Å; R32-E34 IonicContact NE-OE2 2.85Å; E34-D36 PolarHBondContact O-N 3.46Å
35	C	58.1	Low	66.5	Low	90 Å²	90	95.1 Å²	95.1	61%	0.608	56%	0.563	S	S	*	*			trans	-73.6	67	169.6	-64.7	0	0	0	0	108.9	G33 L37	G33-C35 PolarHBondContact O-N 3.33Å; C35-L37 PolarHBondContact O-N 3.05Å
36	D	61	Low	64.9	Low	120 Å²	120	94 Å²	94	64%	0.642	57%	0.569	S	S	*	*			trans	-73.4	79.5	175.3	-80.8	-33.5	0	0	0	109.2	E34 G38 Q78	E34-D36 PolarHBondContact O-N 3.46Å; D36-G38 PolarHBondContact O-N 3.09Å; D36-Q78 PolarHBondContact O-NE2 3.33Å
37	L	55.7	Low	63.3	Low	111 Å²	111	96.6 Å²	96.6	58%	0.581	60%	0.596	S	S	*	*			trans	-73.1	67.2	159.9	-162.6	75.5	0	0	0	108.3	C35 Q78 Q79	C35-L37 PolarHBondContact O-N 3.05Å; L37-Q78 HydrophobicContact CD1-CG 4.49Å; L37-Q79 HydrophobicContact CD1-CG 4.34Å
38	G	52.7	Low	61.6	Low	41 Å²	41	101.7 Å²	101.7	42%	0.423	63%	0.628	S	S	.	*			trans	45.2	85	157.4	0	0	0	0	0	115.8	D36 S40	D36-G38 PolarHBondContact O-N 3.09Å; G38-S40 PolarHBondContact O-N 3.21Å
39	T	51.2	Low	60.1	Low	135 Å²	135	102.1 Å²	102.1	83%	0.828	64%	0.636	S	S	*	*			trans	-57.7	87	149.2	-57.8	0	0	0	0	109.6
40	S	47.9	Very low	58.7	Low	121 Å²	121	102.2 Å²	102.2	85%	0.846	65%	0.653	S	S	*	*			trans	166.9	136.2	156.4	-89.9	0	0	0	0	110.1	G38	G38-S40 PolarHBondContact O-N 3.21Å
41	G	45.2	Very low	57.6	Low	60 Å²	60	107.8 Å²	107.8	62%	0.619	68%	0.68	S	S	*	*			cis	-151.9	146.2	2.7	0	0	0	0	0	107.9	L43	G41-L43 PolarHBondContact O-N 3.36Å
42	A	47.3	Very low	56.7	Low	96 Å²	96	106.9 Å²	106.9	79%	0.793	69%	0.691	S	S	*	*			trans	-58	92.6	163.6	0	0	0	0	0	108.2	L44	A42-L44 PolarHBondContact O-N 3.5Å
43	L	50.5	Low	55.7	Low	124 Å²	124	105.3 Å²	105.3	65%	0.649	69%	0.689	S	S	*	*			trans	-71.3	89.1	165.2	-81.7	173.1	0	0	0	106.6	G41 L45 Y68	G41-L43 PolarHBondContact O-N 3.36Å; L43-L45 PolarHBondContact O-N 2.86Å; L43-L45 VanDerWaalsContact O-N 3.09Å; L43-Y68 HydrophobicContact CD1-CD2 4.28Å
44	L	50.3	Low	56.3	Low	155 Å²	155	107.5 Å²	107.5	81%	0.812	69%	0.686	S	S	*	*			trans	-57.5	110.2	168.1	-66.7	175.7	0	0	0	108.3	A42 P46	A42-L44 PolarHBondContact O-N 3.5Å; L44-P46 VanDerWaalsContact O-CD 3.29Å; L44-P46 WeakPolarHBondContact O-CD 3.35Å
45	L	54.4	Low	57.7	Low	163 Å²	163	108.5 Å²	108.5	85%	0.853	69%	0.694	S	S	*	*			trans	-72	120.6	166.8	-79.3	151.9	0	0	0	109.1	L43	L43-L45 PolarHBondContact O-N 2.86Å; L43-L45 VanDerWaalsContact O-N 3.09Å
46	P	53.1	Low	59.4	Low	123 Å²	123	105.6 Å²	105.6	80%	0.799	68%	0.68	S	S	*	*			trans	-92.1	121.7	167.7	-1.6	22.7	0	0	0	110.5	L44	L44-P46 VanDerWaalsContact O-CD 3.29Å; L44-P46 WeakPolarHBondContact O-CD 3.35Å
47	G	53.6	Low	61	Low	70 Å²	70	103.7 Å²	103.7	72%	0.722	67%	0.67	S	S	*	*			trans	52.6	117	131.2	0	0	0	0	0	119.6	P49	G47-P49 WeakPolarHBondContact O-CD 3.49Å
48	T	52.3	Low	62.8	Low	141 Å²	141	104 Å²	104	87%	0.865	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-48.1	122.6	169.7	50.2	0	0	0	0	113.6
49	P	55.8	Low	64.9	Low	86 Å²	86	105.8 Å²	105.8	56%	0.558	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-83	130.5	168.1	29.4	-31	0	0	0	111.6	G47 H53	G47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-H53 WeakPolarHBondContact CG-CE1 3.46Å
50	S	56.8	Low	67	Low	107 Å²	107	104.6 Å²	104.6	75%	0.748	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-75.5	139.5	175.8	56.2	0	0	0	0	112.2
51	T	60.2	Low	69.2	Low	151 Å²	151	101.1 Å²	101.1	93%	0.926	63%	0.63	S	S	*	*	S	Bend	trans	24	94.8	153.9	-47.8	0	0	0	0	117.3
52	G	60.5	Low	71.7	Confident	66 Å²	66	103.6 Å²	103.6	68%	0.68	63%	0.628	S	S	*	*			trans	120.7	64.3	165.7	0	0	0	0	0	113.8	D54	G52-D54 PolarHBondContact O-N 3.18Å; G52-D54 VanDerWaalsContact O-N 3.09Å
53	H	65.3	Low	74	Confident	95 Å²	95	105.2 Å²	105.2	44%	0.44	62%	0.618	S	S	.	*			trans	-68.1	107.3	178.9	-82.1	-79.5	0	0	0	111.7	P49 K58	P49-H53 WeakPolarHBondContact CG-CE1 3.46Å; H53-K58 HydrophobicContact CB-CG 4.25Å
54	D	85.7	Confident	76.1	Confident	107 Å²	107	105.4 Å²	105.4	57%	0.572	62%	0.616	S	S	*	*			trans	-61.6	155.7	167.2	-179.9	46.8	0	0	0	110	G52 G56 D57 K58	G52-D54 PolarHBondContact O-N 3.18Å; G52-D54 VanDerWaalsContact O-N 3.09Å; D54-G56 PolarHBondContact O-N 2.84Å; D54-G56 PolarHBondContact OD2-N 3.01Å; D54-G56 VanDerWaalsContact OD2-N 3.08Å; D54-D57 PolarHBondContact N-OD2 2.88Å; D54-D57 WeakPolarHBondContact O-CB 3.45Å; D54-D57 PolarHBondContact O-N 3.46Å; D54-K58 PolarHBondContact O-N 3.22Å
55	L	93.7	Very high	78.4	Confident	116 Å²	116	104 Å²	104	61%	0.607	61%	0.606	S	S	*	*	H	α-helix	trans	-56.6	-34.3	175.7	177.6	62.4	0	0	0	111	D57 K58 I59	L55-D57 VanDerWaalsContact C-N 3.35Å; L55-D57 PolarHBondContact O-N 3.47Å; L55-K58 PolarHBondContact O-N 3.39Å; L55-I59 HydrophobicContact CD1-CD1 4.32Å; L55-I59 HydrophobicContact CD1-CG1 4.4Å; L55-I59 HydrophobicContact CG-CD1 3.94Å; L55-I59 HydrophobicContact CG-CG1 4.47Å; L55-I59 VanDerWaalsContact O-CG1 3.31Å; L55-I59 WeakPolarHBondContact O-CG1 3.37Å; L55-I59 PolarHBondContact O-N 3.19Å
56	G	94.1	Very high	80.4	Confident	30 Å²	30	102.2 Å²	102.2	31%	0.309	60%	0.596	S	S	.	*	H	α-helix	trans	-57.8	-43.6	173.9	0	0	0	0	0	113.2	D54 K58 I59 M60	D54-G56 PolarHBondContact O-N 2.84Å; D54-G56 PolarHBondContact OD2-N 3.01Å; D54-G56 VanDerWaalsContact OD2-N 3.08Å; G56-K58 VanDerWaalsContact C-N 3.34Å; G56-K58 PolarHBondContact O-N 2.9Å; G56-I59 PolarHBondContact O-N 3.28Å; G56-M60 WeakPolarHBondContact O-CG 3.4Å; G56-M60 PolarHBondContact O-N 2.95Å
57	D	94.5	Very high	82.5	Confident	80 Å²	80	99.1 Å²	99.1	43%	0.428	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-38.9	178.9	-61.4	-34.2	0	0	0	111.6	D54 L55 M60 A61	D54-D57 PolarHBondContact N-OD2 2.88Å; D54-D57 WeakPolarHBondContact O-CB 3.45Å; D54-D57 PolarHBondContact O-N 3.46Å; L55-D57 VanDerWaalsContact C-N 3.35Å; L55-D57 PolarHBondContact O-N 3.47Å; D57-M60 PolarHBondContact O-N 3.11Å; D57-A61 WeakPolarHBondContact O-CB 3.43Å; D57-A61 PolarHBondContact O-N 3.41Å
58	K	94.8	Very high	84.5	Confident	116 Å²	116	102.4 Å²	102.4	50%	0.504	57%	0.573	S	S	.	*	H	α-helix	trans	-66.8	-41	177.2	-63.6	177.6	-175.4	177.2	0	111.6	H53 D54 L55 G56 M60 A61 L62	H53-K58 HydrophobicContact CB-CG 4.25Å; D54-K58 PolarHBondContact O-N 3.22Å; L55-K58 PolarHBondContact O-N 3.39Å; G56-K58 VanDerWaalsContact C-N 3.34Å; G56-K58 PolarHBondContact O-N 2.9Å; K58-M60 VanDerWaalsContact C-N 3.33Å; K58-A61 PolarHBondContact O-N 2.82Å; K58-L62 WeakPolarHBondContact O-CG 3.36Å; K58-L62 PolarHBondContact O-N 3.44Å
59	I	95.3	Very high	86.7	Confident	79 Å²	79	100.2 Å²	100.2	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-63.1	-42.6	174.9	-68.5	166.5	0	0	0	110.3	L55 G56 K63	L55-I59 HydrophobicContact CD1-CD1 4.32Å; L55-I59 HydrophobicContact CD1-CG1 4.4Å; L55-I59 HydrophobicContact CG-CD1 3.94Å; L55-I59 HydrophobicContact CG-CG1 4.47Å; L55-I59 VanDerWaalsContact O-CG1 3.31Å; L55-I59 WeakPolarHBondContact O-CG1 3.37Å; L55-I59 PolarHBondContact O-N 3.19Å; G56-I59 PolarHBondContact O-N 3.28Å; I59-K63 HydrophobicContact CG2-CD 4.25Å; I59-K63 VanDerWaalsContact O-CG 3.32Å; I59-K63 WeakPolarHBondContact O-CG 3.39Å; I59-K63 PolarHBondContact O-N 2.97Å
60	M	95.3	Very high	88.6	Confident	111 Å²	111	104.7 Å²	104.7	55%	0.547	56%	0.561	S	S	.	*	H	α-helix	trans	-66	-40.1	177	-74.5	-63	-66.9	0	0	112.4	G56 D57 K58 K63 M64	G56-M60 WeakPolarHBondContact O-CG 3.4Å; G56-M60 PolarHBondContact O-N 2.95Å; D57-M60 PolarHBondContact O-N 3.11Å; K58-M60 VanDerWaalsContact C-N 3.33Å; M60-K63 PolarHBondContact O-N 3.3Å; M60-K63 HydrophobicContact SD-CD 4.34Å; M60-M64 PolarHBondContact O-N 3.5Å
61	A	94.6	Very high	90.5	Very high	47 Å²	47	101.5 Å²	101.5	39%	0.388	54%	0.541	S	S	.	.	H	α-helix	trans	-60.3	-49.5	174.6	0	0	0	0	0	111.7	D57 K58 K63 M64 E65	D57-A61 WeakPolarHBondContact O-CB 3.43Å; D57-A61 PolarHBondContact O-N 3.41Å; K58-A61 PolarHBondContact O-N 2.82Å; A61-K63 VanDerWaalsContact C-N 3.32Å; A61-K63 PolarHBondContact O-N 3.28Å; A61-M64 WeakPolarHBondContact O-CB 3.01Å; A61-M64 PolarHBondContact O-N 3.07Å; A61-M64 VanDerWaalsContact O-N 3.07Å; A61-E65 PolarHBondContact O-N 3.47Å
62	L	97.6	Very high	92.1	Very high	112 Å²	112	96.8 Å²	96.8	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-60.4	-40	176.9	-75	173.3	0	0	0	112.7	K58 M64 E65 L66	K58-L62 WeakPolarHBondContact O-CG 3.36Å; K58-L62 PolarHBondContact O-N 3.44Å; L62-M64 VanDerWaalsContact C-N 3.28Å; L62-M64 PolarHBondContact O-N 3.37Å; L62-E65 PolarHBondContact O-N 2.98Å; L62-L66 WeakPolarHBondContact O-CB 3.32Å; L62-L66 PolarHBondContact O-N 2.82Å
63	K	95.6	Very high	93.9	Very high	131 Å²	131	96.8 Å²	96.8	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-61.2	-39.5	174.7	-76.7	175.6	175.6	178.9	0	111.8	I59 M60 A61 A67	I59-K63 HydrophobicContact CG2-CD 4.25Å; I59-K63 VanDerWaalsContact O-CG 3.32Å; I59-K63 WeakPolarHBondContact O-CG 3.39Å; I59-K63 PolarHBondContact O-N 2.97Å; M60-K63 PolarHBondContact O-N 3.3Å; M60-K63 HydrophobicContact SD-CD 4.34Å; A61-K63 VanDerWaalsContact C-N 3.32Å; A61-K63 PolarHBondContact O-N 3.28Å; K63-A67 WeakPolarHBondContact O-CB 3.48Å; K63-A67 PolarHBondContact O-N 3.04Å
64	M	95.7	Very high	95.4	Very high	127 Å²	127	96.2 Å²	96.2	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-68.7	-42.7	177.4	-159.1	66.9	67.9	0	0	111.6	M60 A61 L62 A67 Y68	M60-M64 PolarHBondContact O-N 3.5Å; A61-M64 WeakPolarHBondContact O-CB 3.01Å; A61-M64 PolarHBondContact O-N 3.07Å; A61-M64 VanDerWaalsContact O-N 3.07Å; L62-M64 VanDerWaalsContact C-N 3.28Å; L62-M64 PolarHBondContact O-N 3.37Å; M64-A67 PolarHBondContact O-N 2.94Å; M64-Y68 WeakPolarHBondContact O-CB 3.08Å; M64-Y68 PolarHBondContact O-N 3.26Å
65	E	96.7	Very high	95.8	Very high	126 Å²	126	97.4 Å²	97.4	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-62	-42.6	175.4	-72.2	-179.4	176.1	0	0	111.8	A61 L62 Y68 L69	A61-E65 PolarHBondContact O-N 3.47Å; L62-E65 PolarHBondContact O-N 2.98Å; E65-Y68 WeakPolarHBondContact O-CB 3.39Å; E65-Y68 PolarHBondContact O-N 2.92Å; E65-L69 PolarHBondContact O-N 3.45Å
66	L	97.8	Very high	95.9	Very high	125 Å²	125	95.6 Å²	95.6	65%	0.654	49%	0.487	S	S	*	.	H	α-helix	trans	-63.1	-42.6	175.3	-170.9	78.9	0	0	0	111.6	L62 Y68 L69 R70	L62-L66 WeakPolarHBondContact O-CB 3.32Å; L62-L66 PolarHBondContact O-N 2.82Å; L66-Y68 VanDerWaalsContact C-N 3.32Å; L66-Y68 PolarHBondContact O-N 3.03Å; L66-L69 PolarHBondContact O-N 2.85Å; L66-R70 WeakPolarHBondContact O-CB 3.37Å; L66-R70 PolarHBondContact O-N 2.83Å
67	A	96.4	Very high	96	Very high	58 Å²	58	99.3 Å²	99.3	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-63.4	-39.7	176	0	0	0	0	0	111.7	K63 M64 R70 A71	K63-A67 WeakPolarHBondContact O-CB 3.48Å; K63-A67 PolarHBondContact O-N 3.04Å; M64-A67 PolarHBondContact O-N 2.94Å; A67-R70 WeakPolarHBondContact O-CB 3.01Å; A67-R70 PolarHBondContact O-N 2.93Å; A67-A71 PolarHBondContact O-N 3.42Å
68	Y	96	Very high	96	Very high	140 Å²	140	99 Å²	99	55%	0.549	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-44.4	174.9	176.6	-106.3	0	0	0	112.1	L43 M64 E65 L66 R70 A71 I72	L43-Y68 HydrophobicContact CD1-CD2 4.28Å; M64-Y68 WeakPolarHBondContact O-CB 3.08Å; M64-Y68 PolarHBondContact O-N 3.26Å; E65-Y68 WeakPolarHBondContact O-CB 3.39Å; E65-Y68 PolarHBondContact O-N 2.92Å; L66-Y68 VanDerWaalsContact C-N 3.32Å; L66-Y68 PolarHBondContact O-N 3.03Å; Y68-R70 VanDerWaalsContact C-N 3.34Å; Y68-R70 PolarHBondContact O-N 3.18Å; Y68-A71 WeakPolarHBondContact O-CB 3.48Å; Y68-A71 PolarHBondContact O-N 2.79Å; Y68-A71 VanDerWaalsContact O-N 3.16Å; Y68-I72 HydrophobicContact CD1-CD1 3.76Å; Y68-I72 HydrophobicContact CE1-CD1 3.23Å; Y68-I72 HydrophobicContact CE1-CG1 4.25Å; Y68-I72 HydrophobicContact CE2-CD1 4.26Å; Y68-I72 HydrophobicContact CE2-CG1 4.49Å; Y68-I72 HydrophobicContact CG-CD1 4.47Å; Y68-I72 PolarHBondContact O-N 3.34Å
69	L	97.7	Very high	96.1	Very high	94 Å²	94	98.6 Å²	98.6	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-44.2	175.8	-172	64.3	0	0	0	111.2	E65 L66 A71 I72 D73	E65-L69 PolarHBondContact O-N 3.45Å; L66-L69 PolarHBondContact O-N 2.85Å; L69-A71 VanDerWaalsContact C-N 3.27Å; L69-A71 PolarHBondContact O-N 3.02Å; L69-I72 WeakPolarHBondContact O-CB 3.29Å; L69-I72 PolarHBondContact O-N 3.48Å; L69-I72 VanDerWaalsContact O-N 3.08Å; L69-D73 PolarHBondContact O-N 2.96Å
70	R	97.1	Very high	96.1	Very high	180 Å²	180	98.9 Å²	98.9	68%	0.679	50%	0.497	S	S	*	.	H	α-helix	trans	-58.2	-39.6	174.6	-166	76.5	173.1	144.6	0.3	112.1	L66 A67 Y68 D73 V74	L66-R70 WeakPolarHBondContact O-CB 3.37Å; L66-R70 PolarHBondContact O-N 2.83Å; A67-R70 WeakPolarHBondContact O-CB 3.01Å; A67-R70 PolarHBondContact O-N 2.93Å; Y68-R70 VanDerWaalsContact C-N 3.34Å; Y68-R70 PolarHBondContact O-N 3.18Å; R70-D73 PolarHBondContact O-N 2.98Å; R70-V74 WeakPolarHBondContact O-CG2 3.35Å; R70-V74 PolarHBondContact O-N 3.18Å
71	A	94.9	Very high	96	Very high	41 Å²	41	97.4 Å²	97.4	34%	0.339	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-38.4	176.3	0	0	0	0	0	111.9	A67 Y68 L69 K75	A67-A71 PolarHBondContact O-N 3.42Å; Y68-A71 WeakPolarHBondContact O-CB 3.48Å; Y68-A71 PolarHBondContact O-N 2.79Å; Y68-A71 VanDerWaalsContact O-N 3.16Å; L69-A71 VanDerWaalsContact C-N 3.27Å; L69-A71 PolarHBondContact O-N 3.02Å; A71-K75 WeakPolarHBondContact O-CG 3.4Å; A71-K75 PolarHBondContact O-N 2.87Å
72	I	95.6	Very high	95.8	Very high	52 Å²	52	98.3 Å²	98.3	27%	0.267	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-45.7	173.1	-68.8	165.5	0	0	0	110.8	Y68 L69 V74 K75 I76	Y68-I72 HydrophobicContact CD1-CD1 3.76Å; Y68-I72 HydrophobicContact CE1-CD1 3.23Å; Y68-I72 HydrophobicContact CE1-CG1 4.25Å; Y68-I72 HydrophobicContact CE2-CD1 4.26Å; Y68-I72 HydrophobicContact CE2-CG1 4.49Å; Y68-I72 HydrophobicContact CG-CD1 4.47Å; Y68-I72 PolarHBondContact O-N 3.34Å; L69-I72 WeakPolarHBondContact O-CB 3.29Å; L69-I72 PolarHBondContact O-N 3.48Å; L69-I72 VanDerWaalsContact O-N 3.08Å; I72-V74 VanDerWaalsContact C-N 3.29Å; I72-V74 PolarHBondContact O-N 2.88Å; I72-K75 WeakPolarHBondContact O-CA 3.46Å; I72-K75 WeakPolarHBondContact O-CB 3.43Å; I72-K75 PolarHBondContact O-N 3.14Å; I72-I76 HydrophobicContact CG2-CD1 3.69Å; I72-I76 HydrophobicContact CG2-CG1 4.15Å; I72-I76 WeakPolarHBondContact O-CG1 3.49Å; I72-I76 PolarHBondContact O-N 2.85Å
73	D	97	Very high	95.6	Very high	65 Å²	65	97.9 Å²	97.9	35%	0.348	49%	0.493	S	S	.	.	H	α-helix	trans	-57	-44.3	179.9	-67	-19	0	0	0	111.5	L69 R70 K75 I76 L77	L69-D73 PolarHBondContact O-N 2.96Å; R70-D73 PolarHBondContact O-N 2.98Å; D73-K75 VanDerWaalsContact C-N 3.29Å; D73-K75 PolarHBondContact O-N 3.38Å; D73-I76 PolarHBondContact O-N 3.01Å; D73-L77 WeakPolarHBondContact O-CB 3.47Å; D73-L77 VanDerWaalsContact O-CG 3.29Å; D73-L77 WeakPolarHBondContact O-CG 3.45Å; D73-L77 PolarHBondContact O-N 3.11Å
74	V	96.4	Very high	95.6	Very high	83 Å²	83	95.3 Å²	95.3	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-60	-40.9	176.2	173.6	0	0	0	0	111.1	R70 I72 L77 Q78	R70-V74 WeakPolarHBondContact O-CG2 3.35Å; R70-V74 PolarHBondContact O-N 3.18Å; I72-V74 VanDerWaalsContact C-N 3.29Å; I72-V74 PolarHBondContact O-N 2.88Å; V74-L77 PolarHBondContact O-N 3.33Å; V74-Q78 WeakPolarHBondContact O-CB 3.38Å; V74-Q78 PolarHBondContact O-N 3.12Å
75	K	95.3	Very high	95.4	Very high	132 Å²	132	91.6 Å²	91.6	57%	0.574	47%	0.467	S	S	*	.	H	α-helix	trans	-66.2	-42.1	176.9	-69.4	-179.3	67.3	172.2	0	112.2	A71 I72 D73 L77 Q78 Q79	A71-K75 WeakPolarHBondContact O-CG 3.4Å; A71-K75 PolarHBondContact O-N 2.87Å; I72-K75 WeakPolarHBondContact O-CA 3.46Å; I72-K75 WeakPolarHBondContact O-CB 3.43Å; I72-K75 PolarHBondContact O-N 3.14Å; D73-K75 VanDerWaalsContact C-N 3.29Å; D73-K75 PolarHBondContact O-N 3.38Å; K75-L77 VanDerWaalsContact C-N 3.34Å; K75-Q78 PolarHBondContact O-N 2.89Å; K75-Q79 WeakPolarHBondContact O-CB 3.3Å; K75-Q79 VanDerWaalsContact O-CG 3.3Å; K75-Q79 WeakPolarHBondContact O-CG 3.48Å; K75-Q79 PolarHBondContact O-N 3.32Å
76	I	95	Very high	95.2	Very high	78 Å²	78	87.2 Å²	87.2	40%	0.4	46%	0.456	S	S	.	.	H	α-helix	trans	-61.4	-46.7	176.2	-67.2	170.1	0	0	0	109.6	I72 D73 Q78 Q79 L80	I72-I76 HydrophobicContact CG2-CD1 3.69Å; I72-I76 HydrophobicContact CG2-CG1 4.15Å; I72-I76 WeakPolarHBondContact O-CG1 3.49Å; I72-I76 PolarHBondContact O-N 2.85Å; D73-I76 PolarHBondContact O-N 3.01Å; I76-Q78 VanDerWaalsContact C-N 3.34Å; I76-Q78 PolarHBondContact O-N 3.19Å; I76-Q79 WeakPolarHBondContact O-CB 3.38Å; I76-Q79 PolarHBondContact O-N 3.35Å; I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.41Å; I76-L80 WeakPolarHBondContact O-CG 3.43Å; I76-L80 PolarHBondContact O-N 3.43Å
77	L	97.1	Very high	94.9	Very high	108 Å²	108	85.1 Å²	85.1	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-60.6	-43.3	177.7	-70.4	171	0	0	0	111.7	D73 V74 K75 Q79 L80 V81	D73-L77 WeakPolarHBondContact O-CB 3.47Å; D73-L77 VanDerWaalsContact O-CG 3.29Å; D73-L77 WeakPolarHBondContact O-CG 3.45Å; D73-L77 PolarHBondContact O-N 3.11Å; V74-L77 PolarHBondContact O-N 3.33Å; K75-L77 VanDerWaalsContact C-N 3.34Å; L77-Q79 VanDerWaalsContact C-N 3.33Å; L77-Q79 PolarHBondContact O-N 2.93Å; L77-L80 PolarHBondContact O-N 3.42Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 2.89Å
78	Q	95	Very high	94.5	Very high	74 Å²	74	85.9 Å²	85.9	35%	0.346	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-39.5	176.1	-173.1	172.8	-2.1	0	0	112.2	D36 L37 V74 K75 I76 V81 T82	D36-Q78 PolarHBondContact O-NE2 3.33Å; L37-Q78 HydrophobicContact CD1-CG 4.49Å; V74-Q78 WeakPolarHBondContact O-CB 3.38Å; V74-Q78 PolarHBondContact O-N 3.12Å; K75-Q78 PolarHBondContact O-N 2.89Å; I76-Q78 VanDerWaalsContact C-N 3.34Å; I76-Q78 PolarHBondContact O-N 3.19Å; Q78-V81 PolarHBondContact O-N 2.92Å; Q78-T82 PolarHBondContact O-N 3.01Å; Q78-T82 PolarHBondContact O-OG1 3.23Å
79	Q	95.2	Very high	94.3	Very high	108 Å²	108	79.7 Å²	79.7	51%	0.505	42%	0.415	S	S	.	.	H	α-helix	trans	-63.7	-41.5	173.9	-74.7	177.6	-30.2	0	0	111.9	L37 K75 I76 L77 T82 L83	L37-Q79 HydrophobicContact CD1-CG 4.34Å; K75-Q79 WeakPolarHBondContact O-CB 3.3Å; K75-Q79 VanDerWaalsContact O-CG 3.3Å; K75-Q79 WeakPolarHBondContact O-CG 3.48Å; K75-Q79 PolarHBondContact O-N 3.32Å; I76-Q79 WeakPolarHBondContact O-CB 3.38Å; I76-Q79 PolarHBondContact O-N 3.35Å; L77-Q79 VanDerWaalsContact C-N 3.33Å; L77-Q79 PolarHBondContact O-N 2.93Å; Q79-T82 PolarHBondContact O-N 3.38Å; Q79-L83 WeakPolarHBondContact O-CB 3.29Å; Q79-L83 PolarHBondContact O-N 2.88Å
80	L	96.1	Very high	93.9	Very high	84 Å²	84	78.9 Å²	78.9	44%	0.44	41%	0.414	S	S	.	.	H	α-helix	trans	-64.9	-41.3	177.4	-72.9	172.2	0	0	0	112.2	I76 L77 L83 N84	I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.41Å; I76-L80 WeakPolarHBondContact O-CG 3.43Å; I76-L80 PolarHBondContact O-N 3.43Å; L77-L80 PolarHBondContact O-N 3.42Å; L80-L83 PolarHBondContact O-N 3.45Å; L80-N84 WeakPolarHBondContact O-CB 3.5Å; L80-N84 PolarHBondContact O-N 2.81Å
81	V	92.8	Very high	93.4	Very high	81 Å²	81	75.5 Å²	75.5	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-61.2	-47.2	174	172.3	0	0	0	0	110.4	L77 Q78 L83 N84 E85	L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 2.89Å; Q78-V81 PolarHBondContact O-N 2.92Å; V81-L83 VanDerWaalsContact C-N 3.31Å; V81-L83 PolarHBondContact O-N 3.19Å; V81-N84 PolarHBondContact O-N 2.93Å; V81-E85 WeakPolarHBondContact O-CG 3.43Å; V81-E85 PolarHBondContact O-N 2.99Å
82	T	90.9	Very high	93.2	Very high	65 Å²	65	74.3 Å²	74.3	40%	0.399	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-40.3	177.8	-51.3	0	0	0	0	111.6	Q78 Q79 G86	Q78-T82 PolarHBondContact O-N 3.01Å; Q78-T82 PolarHBondContact O-OG1 3.23Å; Q79-T82 PolarHBondContact O-N 3.38Å; T82-G86 PolarHBondContact O-N 3.23Å
83	L	94.3	Very high	92.6	Very high	103 Å²	103	76.4 Å²	76.4	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-44	175.9	-179.4	68.3	0	0	0	111.4	Q79 L80 V81 G86 I87	Q79-L83 WeakPolarHBondContact O-CB 3.29Å; Q79-L83 PolarHBondContact O-N 2.88Å; L80-L83 PolarHBondContact O-N 3.45Å; V81-L83 VanDerWaalsContact C-N 3.31Å; V81-L83 PolarHBondContact O-N 3.19Å; L83-G86 CarbonylContact O-C 3.57Å; L83-G86 WeakPolarHBondContact O-CA 3.4Å; L83-G86 PolarHBondContact O-N 3.45Å; L83-G86 VanDerWaalsContact O-N 3.14Å; L83-I87 HydrophobicContact CG-CD1 4.1Å; L83-I87 WeakPolarHBondContact O-CG1 3.42Å; L83-I87 PolarHBondContact O-N 3.16Å
84	N	93.9	Very high	92.1	Very high	78 Å²	78	78.2 Å²	78.2	42%	0.417	41%	0.409	S	S	.	.	H	α-helix	trans	-60.3	-46.9	177.8	-178.2	64.8	0	0	0	111.4	L80 V81 G86 I87 E88	L80-N84 WeakPolarHBondContact O-CB 3.5Å; L80-N84 PolarHBondContact O-N 2.81Å; V81-N84 PolarHBondContact O-N 2.93Å; N84-G86 VanDerWaalsContact C-N 3.25Å; N84-G86 PolarHBondContact O-N 3.42Å; N84-I87 PolarHBondContact O-N 2.92Å; N84-I87 VanDerWaalsContact O-N 3.11Å; N84-E88 PolarHBondContact ND2-OE1 3.16Å; N84-E88 WeakPolarHBondContact O-CG 3.39Å; N84-E88 PolarHBondContact O-N 3.08Å
85	E	92.7	Very high	91	Very high	49 Å²	49	78.4 Å²	78.4	23%	0.229	40%	0.404	C	S	.	.	H	α-helix	trans	-57.2	-40.4	173.8	-70.9	178.6	-174.2	0	0	111.6	V81 E88 A89	V81-E85 WeakPolarHBondContact O-CG 3.43Å; V81-E85 PolarHBondContact O-N 2.99Å; E85-E88 PolarHBondContact O-N 3.44Å; E85-A89 WeakPolarHBondContact O-CB 3.29Å; E85-A89 PolarHBondContact O-N 3.47Å
86	G	91.1	Very high	89.3	Confident	34 Å²	34	75.6 Å²	75.6	35%	0.351	39%	0.393	S	S	.	.	H	α-helix	trans	-66	-37	174.9	0	0	0	0	0	114	T82 L83 N84 A89 V90	T82-G86 PolarHBondContact O-N 3.23Å; L83-G86 CarbonylContact O-C 3.57Å; L83-G86 WeakPolarHBondContact O-CA 3.4Å; L83-G86 PolarHBondContact O-N 3.45Å; L83-G86 VanDerWaalsContact O-N 3.14Å; N84-G86 VanDerWaalsContact C-N 3.25Å; N84-G86 PolarHBondContact O-N 3.42Å; G86-A89 WeakPolarHBondContact O-CB 2.9Å; G86-A89 PolarHBondContact O-N 2.93Å; G86-V90 WeakPolarHBondContact O-CG2 3.43Å; G86-V90 PolarHBondContact O-N 3.23Å
87	I	91.6	Very high	87.5	Confident	81 Å²	81	80.5 Å²	80.5	42%	0.415	41%	0.407	S	S	.	.	H	α-helix	trans	-68.6	-42.6	175.5	-67.3	166.3	0	0	0	110	L83 N84 A89 V90 R91	L83-I87 HydrophobicContact CG-CD1 4.1Å; L83-I87 WeakPolarHBondContact O-CG1 3.42Å; L83-I87 PolarHBondContact O-N 3.16Å; N84-I87 PolarHBondContact O-N 2.92Å; N84-I87 VanDerWaalsContact O-N 3.11Å; I87-A89 VanDerWaalsContact C-N 3.31Å; I87-A89 PolarHBondContact O-N 2.89Å; I87-V90 PolarHBondContact O-N 3.34Å; I87-R91 VanDerWaalsContact O-CB 3.29Å; I87-R91 WeakPolarHBondContact O-CB 3.45Å; I87-R91 PolarHBondContact O-N 3.09Å
88	E	89.9	Confident	85.5	Confident	73 Å²	73	78.1 Å²	78.1	34%	0.341	41%	0.408	S	S	.	.	H	α-helix	trans	-60.4	-41.8	174.9	-72.9	172.3	-165.2	0	0	112.2	N84 E85 R91 W92	N84-E88 PolarHBondContact ND2-OE1 3.16Å; N84-E88 WeakPolarHBondContact O-CG 3.39Å; N84-E88 PolarHBondContact O-N 3.08Å; E85-E88 PolarHBondContact O-N 3.44Å; E88-R91 PolarHBondContact O-N 2.99Å; E88-W92 WeakPolarHBondContact O-CB 3.39Å; E88-W92 PolarHBondContact O-N 3.32Å
89	A	90.1	Very high	83.4	Confident	10 Å²	10	78.5 Å²	78.5	8%	0.083	42%	0.415	C	S	.	.	H	α-helix	trans	-57.2	-50.2	172.6	0	0	0	0	0	112.7	L27 E85 G86 I87 W92 L93	L27-A89 HydrophobicContact CD1-CB 3.99Å; L27-A89 HydrophobicContact CD2-CB 3.36Å; L27-A89 HydrophobicContact CG-CB 3.39Å; E85-A89 WeakPolarHBondContact O-CB 3.29Å; E85-A89 PolarHBondContact O-N 3.47Å; G86-A89 WeakPolarHBondContact O-CB 2.9Å; G86-A89 PolarHBondContact O-N 2.93Å; I87-A89 VanDerWaalsContact C-N 3.31Å; I87-A89 PolarHBondContact O-N 2.89Å; A89-W92 PolarHBondContact O-N 3.36Å; A89-L93 WeakPolarHBondContact O-CG 3.43Å; A89-L93 PolarHBondContact O-N 3.35Å; A89-L93 VanDerWaalsContact O-N 3.11Å
90	V	89.9	Confident	81.2	Confident	78 Å²	78	78.1 Å²	78.1	47%	0.473	42%	0.416	S	S	.	.	H	α-helix	trans	-64.7	-42.7	178.7	169.5	0	0	0	0	111	G86 I87 W92 L93 L94	G86-V90 WeakPolarHBondContact O-CG2 3.43Å; G86-V90 PolarHBondContact O-N 3.23Å; I87-V90 PolarHBondContact O-N 3.34Å; V90-W92 PolarHBondContact O-N 2.9Å; V90-L93 PolarHBondContact O-N 3.07Å; V90-L94 HydrophobicContact CG1-CD1 3.53Å; V90-L94 HydrophobicContact CG1-CG 4.17Å; V90-L94 WeakPolarHBondContact O-CB 3.3Å; V90-L94 WeakPolarHBondContact O-CG 2.92Å; V90-L94 PolarHBondContact O-N 2.99Å
91	R	87.3	Confident	78.6	Confident	108 Å²	108	79.4 Å²	79.4	41%	0.408	43%	0.428	S	S	.	.	H	α-helix	trans	-59.6	-47.3	176.8	-167.9	-170.5	-54.8	104.9	-1.1	111	I87 E88 L93 L94 E95	I87-R91 VanDerWaalsContact O-CB 3.29Å; I87-R91 WeakPolarHBondContact O-CB 3.45Å; I87-R91 PolarHBondContact O-N 3.09Å; E88-R91 PolarHBondContact O-N 2.99Å; R91-L93 VanDerWaalsContact C-N 3.26Å; R91-L93 PolarHBondContact O-N 3.43Å; R91-L94 PolarHBondContact O-N 3.02Å; R91-L94 VanDerWaalsContact O-N 3.07Å; R91-E95 WeakPolarHBondContact CD-OE1 3.29Å; R91-E95 HydrophobicContact CG-CG 3.89Å; R91-E95 WeakPolarHBondContact CG-OE1 3.48Å; R91-E95 WeakPolarHBondContact O-CG 3.04Å; R91-E95 PolarHBondContact O-N 3.03Å
92	W	89.2	Confident	76.5	Confident	17 Å²	17	79 Å²	79	6%	0.064	43%	0.429	C	S	.	.	H	α-helix	trans	-58.7	-35.8	176.3	-178.4	85.8	0	0	0	112.6	L12 V15 V19 R21 K22 T23 P24 L27 E88 A89 V90	L12-W92 HydrophobicContact CD1-CH2 4.34Å; V15-W92 HydrophobicContact CB-CH2 3.7Å; V15-W92 HydrophobicContact CB-CZ2 4.24Å; V15-W92 HydrophobicContact CG1-CH2 3.21Å; V15-W92 HydrophobicContact CG1-CZ2 3.78Å; V15-W92 HydrophobicContact CG1-CZ3 3.85Å; V19-W92 HydrophobicContact CG2-CZ2 4.37Å; R21-W92 PolarHBondContact O-NE1 2.8Å; K22-W92 PolarHBondContact O-NE1 3.38Å; T23-W92 HydrophobicContact CG2-CH2 4.23Å; T23-W92 HydrophobicContact CG2-CZ2 4.24Å; T23-W92 WeakPolarHBondContact OG1-CZ2 3.36Å; P24-W92 HydrophobicContact CG-CB 4.04Å; P24-W92 HydrophobicContact CG-CG 4.14Å; L27-W92 HydrophobicContact CD1-CD2 4.15Å; L27-W92 HydrophobicContact CD1-CE3 3.42Å; L27-W92 VanDerWaalsContact CD1-CE3 3.42Å; L27-W92 HydrophobicContact CD1-CZ3 3.81Å; E88-W92 WeakPolarHBondContact O-CB 3.39Å; E88-W92 PolarHBondContact O-N 3.32Å; A89-W92 PolarHBondContact O-N 3.36Å; V90-W92 PolarHBondContact O-N 2.9Å
93	L	84.6	Confident	74.4	Confident	96 Å²	96	82.3 Å²	82.3	50%	0.503	44%	0.439	S	S	.	.	H	α-helix	trans	-74.4	-29.9	175.4	-71	171.1	0	0	0	113.8	A89 V90 R91	A89-L93 WeakPolarHBondContact O-CG 3.43Å; A89-L93 PolarHBondContact O-N 3.35Å; A89-L93 VanDerWaalsContact O-N 3.11Å; V90-L93 PolarHBondContact O-N 3.07Å; R91-L93 VanDerWaalsContact C-N 3.26Å; R91-L93 PolarHBondContact O-N 3.43Å
94	L	84.8	Confident	71.9	Confident	103 Å²	103	83.3 Å²	83.3	54%	0.539	45%	0.453	S	S	.	.	H	α-helix	trans	-98.6	-29.1	-170	-71.5	-180	0	0	0	114.8	V90 R91 E96 R97 G98	V90-L94 HydrophobicContact CG1-CD1 3.53Å; V90-L94 HydrophobicContact CG1-CG 4.17Å; V90-L94 WeakPolarHBondContact O-CB 3.3Å; V90-L94 WeakPolarHBondContact O-CG 2.92Å; V90-L94 PolarHBondContact O-N 2.99Å; R91-L94 PolarHBondContact O-N 3.02Å; R91-L94 VanDerWaalsContact O-N 3.07Å; L94-E96 PolarHBondContact O-N 3.03Å; L94-E96 VanDerWaalsContact O-N 3.09Å; L94-R97 PolarHBondContact O-N 2.87Å; L94-G98 PolarHBondContact O-N 3.38Å
95	E	74.6	Confident	69.8	Low	87 Å²	87	83.8 Å²	83.8	41%	0.407	46%	0.463	S	S	.	.	H	α-helix	trans	-55.2	-31	-175.4	-84.6	175.6	177	0	0	113.6	R21 R91	R21-E95 IonicContact NE-OE2 3.7Å; R91-E95 WeakPolarHBondContact CD-OE1 3.29Å; R91-E95 HydrophobicContact CG-CG 3.89Å; R91-E95 WeakPolarHBondContact CG-OE1 3.48Å; R91-E95 WeakPolarHBondContact O-CG 3.04Å; R91-E95 PolarHBondContact O-N 3.03Å
96	E	60.1	Low	67.5	Low	72 Å²	72	85.9 Å²	85.9	34%	0.336	48%	0.483	S	S	.	.	H	α-helix	trans	-85.8	-20.4	179.2	-159	60.1	-149	0	0	113.6	L94 T99 L100	L94-E96 PolarHBondContact O-N 3.03Å; L94-E96 VanDerWaalsContact O-N 3.09Å; E96-T99 PolarHBondContact O-OG1 3.29Å; E96-L100 HydrophobicContact CG-CD1 4.41Å; E96-L100 WeakPolarHBondContact O-CD1 3.44Å; E96-L100 WeakPolarHBondContact O-CG 3.5Å
97	R	57.2	Low	65.3	Low	182 Å²	182	93 Å²	93	69%	0.687	51%	0.512	S	S	*	.	H	α-helix	trans	-84.7	-25.7	-177.7	-65.7	-167.1	71.3	165	0.7	112.7	L94 L100 T101	L94-R97 PolarHBondContact O-N 2.87Å; R97-L100 PolarHBondContact O-N 3.37Å; R97-T101 WeakPolarHBondContact O-CG2 3.4Å; R97-T101 PolarHBondContact O-N 3.27Å
98	G	55.2	Low	63.2	Low	57 Å²	57	94.5 Å²	94.5	59%	0.588	53%	0.525	S	S	*	.	H	α-helix	trans	-66.2	-34	178.1	0	0	0	0	0	113.8	L94	L94-G98 PolarHBondContact O-N 3.38Å
99	T	50.6	Low	61.1	Low	82 Å²	82	95.9 Å²	95.9	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-81.7	-23.5	178.7	52.4	0	0	0	0	113.2	E96 S102 H103	E96-T99 PolarHBondContact O-OG1 3.29Å; T99-S102 PolarHBondContact O-OG 2.89Å; T99-H103 PolarHBondContact O-CD2 3.49Å
100	L	47.4	Very low	59	Low	100 Å²	100	101.7 Å²	101.7	52%	0.524	58%	0.583	S	S	.	*	H	α-helix	trans	-92.4	-13.4	-177.8	-66.7	174.4	0	0	0	114.5	E96 R97 S102 H103	E96-L100 HydrophobicContact CG-CD1 4.41Å; E96-L100 WeakPolarHBondContact O-CD1 3.44Å; E96-L100 WeakPolarHBondContact O-CG 3.5Å; R97-L100 PolarHBondContact O-N 3.37Å; L100-S102 VanDerWaalsContact C-N 3.26Å; L100-S102 PolarHBondContact O-N 2.9Å; L100-H103 PolarHBondContact O-N 3.33Å
101	T	43	Very low	57.1	Low	112 Å²	112	105.3 Å²	105.3	69%	0.687	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-18.2	179	80.4	0	0	0	0	114.1	R97	R97-T101 WeakPolarHBondContact O-CG2 3.4Å; R97-T101 PolarHBondContact O-N 3.27Å
102	S	47.3	Very low	54.9	Low	73 Å²	73	109.6 Å²	109.6	51%	0.51	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-13.6	179	59.5	0	0	0	0	114.1	T99 L100	T99-S102 PolarHBondContact O-OG 2.89Å; L100-S102 VanDerWaalsContact C-N 3.26Å; L100-S102 PolarHBondContact O-N 2.9Å
103	H	47.5	Very low	53	Low	134 Å²	134	114.1 Å²	114.1	62%	0.62	65%	0.646	S	S	*	*			trans	-100.7	11.6	-174.4	-69.9	-65.5	0	0	0	114.6	T99 L100 S105	T99-H103 PolarHBondContact O-CD2 3.49Å; L100-H103 PolarHBondContact O-N 3.33Å; H103-S105 PolarHBondContact O-N 3.33Å
104	C	42.5	Very low	50.9	Low	123 Å²	123	117.3 Å²	117.3	83%	0.831	66%	0.663	S	S	*	*			trans	-75.9	29.6	160.3	-68	0	0	0	0	112.6
105	S	49	Very low	49	Very low	89 Å²	89	119.5 Å²	119.5	62%	0.622	68%	0.681	S	S	*	*	S	Bend	trans	-106.9	59.3	154.9	52	0	0	0	0	108.8	H103 L107	H103-S105 PolarHBondContact O-N 3.33Å; S105-L107 PolarHBondContact O-N 3.4Å; S105-L107 VanDerWaalsContact O-N 3.1Å
106	S	44.9	Very low	47.6	Very low	92 Å²	92	119.1 Å²	119.1	64%	0.643	70%	0.701	S	S	*	*			trans	-50.8	115.7	162.2	-59.5	0	0	0	0	107.3	T108	S106-T108 PolarHBondContact O-N 3.09Å
107	L	45.3	Very low	46.6	Very low	184 Å²	184	119.5 Å²	119.5	96%	0.963	72%	0.723	S	S	*	*				46	36.6	56.1	-73.4	170	0	0	0	112.8	S105	S105-L107 PolarHBondContact O-N 3.4Å; S105-L107 VanDerWaalsContact O-N 3.1Å
108	T	45.8	Very low	45.7	Very low	113 Å²	113	116.5 Å²	116.5	69%	0.693	73%	0.731	S	S	*	*			trans	-136.7	126.2	152.9	-176.6	0	0	0	0	109.4	S106	S106-T108 PolarHBondContact O-N 3.09Å
109	S	45.9	Very low	45.7	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	74%	0.742	S	S	*	*			trans	57.2	88.1	173.9	70.3	0	0	0	0	118
110	S	45.9	Very low	45.1	Very low	132 Å²	132	119.5 Å²	119.5	92%	0.923	76%	0.755	S	S	*	*			trans	-147.5	71.4	133.3	-76.7	0	0	0	0	107.7
111	Q	51.6	Low	44.8	Very low	154 Å²	154	126.1 Å²	126.1	72%	0.72	77%	0.773	S	S	*	*			trans	-76.4	135.4	161.8	-62.4	-168.5	-46.2	0	0	108.4
112	Y	41.3	Very low	44.7	Very low	197 Å²	197	126 Å²	126	77%	0.773	78%	0.776	S	S	*	*			trans	74.3	102.4	166.9	-43.6	-74.1	0	0	0	118
113	S	49.2	Very low	44.8	Very low	113 Å²	113	133.5 Å²	133.5	79%	0.79	79%	0.793	S	S	*	*				-163	115	123.7	-85.5	0	0	0	0	112.7
114	L	39.4	Very low	44.6	Very low	162 Å²	162	137.9 Å²	137.9	85%	0.848	81%	0.805	S	S	*	*			trans	71.2	99.6	142.2	-51.7	179.6	0	0	0	119.4
115	T	45.4	Very low	44.7	Very low	149 Å²	149	135.5 Å²	135.5	91%	0.914	80%	0.801	S	S	*	*			trans	-8.3	127.6	132.3	-39.8	0	0	0	0	116
116	G	45.6	Very low	44.3	Very low	80 Å²	80	136.4 Å²	136.4	83%	0.825	81%	0.807	S	S	*	*			trans	117.4	106.4	149.2	0	0	0	0	0	115.3
117	G	38.9	Very low	44.3	Very low	79 Å²	79	144.5 Å²	144.5	81%	0.814	82%	0.824	S	S	*	*			trans	165.1	94	166.5	0	0	0	0	0	114.6
118	S	38.8	Very low	44.3	Very low	120 Å²	120	142 Å²	142	84%	0.839	81%	0.812	S	S	*	*			trans	-48.3	165.1	178.3	-132.5	0	0	0	0	117.1
119	P	54.2	Low	44.3	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	82%	0.818	S	S	*	*			trans	-85.2	139.8	-175.7	34.4	-27.1	0	0	0	112.1
120	G	37.3	Very low	44.2	Very low	75 Å²	75	145 Å²	145	77%	0.773	82%	0.823	S	S	*	*			trans	-164.7	103.6	-179.3	0	0	0	0	0	113.4	S122	G120-S122 PolarHBondContact O-N 3.46Å
121	R	42.7	Very low	44.4	Very low	239 Å²	239	143.8 Å²	143.8	90%	0.902	81%	0.813	S	S	*	*			trans	-24.6	122.1	159.7	-178.1	178.6	-173.1	-101.6	5.8	114.3
122	S	39.9	Very low	43.8	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	82%	0.818	S	S	*	*			trans	-147.1	101.8	151.3	-168.1	0	0	0	0	112.2	G120	G120-S122 PolarHBondContact O-N 3.46Å
123	R	49.2	Very low	44.4	Very low	230 Å²	230	141 Å²	141	87%	0.868	82%	0.821	S	S	*	*			trans	-87.4	92.6	164.7	-177.9	-167	-133.7	-97.4	4.4	106.4
124	R	44.3	Very low	44.2	Very low	227 Å²	227	139.9 Å²	139.9	86%	0.857	81%	0.813	S	S	*	*			trans	-166.1	126.6	166.3	-163.5	162.9	-75	-90.1	2.1	110.4
125	G	43.9	Very low	45	Very low	72 Å²	72	139 Å²	139	74%	0.742	82%	0.815	S	S	*	*			trans	-67.1	160.6	-175.7	0	0	0	0	0	114.3
126	S	40.6	Very low	45.3	Very low	109 Å²	109	138.5 Å²	138.5	76%	0.762	81%	0.812	S	S	*	*			trans	-160.5	83.1	158	-171.9	0	0	0	0	106.6
127	W	45	Very low	45.4	Very low	261 Å²	261	139.6 Å²	139.6	99%	0.989	80%	0.799	S	S	*	*			trans	-88.8	94.5	156.4	-74.1	102.7	0	0	0	105.3
128	D	45.6	Very low	46.2	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	80%	0.802	S	S	*	*			trans	-161.2	109.9	161.6	-128.6	-13.9	0	0	0	110.6
129	S	46	Very low	47	Very low	119 Å²	119	148.4 Å²	148.4	83%	0.832	80%	0.799	S	S	*	*			trans	-165	81.2	149	-77.9	0	0	0	0	109.1
130	L	42.5	Very low	47	Very low	157 Å²	157	149 Å²	149	82%	0.822	80%	0.796	S	S	*	*			trans	47.4	144.8	140	-69.1	166.1	0	0	0	122.3
131	P	50.5	Low	47.9	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	80%	0.795	S	S	*	*			trans	-85.7	121.9	-175.6	34.4	-29.4	0	0	0	111	T133	P131-T133 PolarHBondContact O-N 3.08Å
132	D	39.8	Very low	48.5	Very low	157 Å²	157	145 Å²	145	84%	0.84	79%	0.787	S	S	*	*			trans	-81.2	118.7	163.3	-106.1	-17.8	0	0	0	109.4	S134	D132-S134 PolarHBondContact O-N 3.07Å
133	T	52.8	Low	49.2	Very low	136 Å²	136	143.7 Å²	143.7	83%	0.834	78%	0.778	S	S	*	*			trans	-73	76.5	178.9	53.6	0	0	0	0	110	P131	P131-T133 PolarHBondContact O-N 3.08Å
134	S	46.1	Very low	49.4	Very low	89 Å²	89	138.6 Å²	138.6	62%	0.622	77%	0.766	S	S	*	*			trans	-127.2	87.4	164.2	66.8	0	0	0	0	109.8	D132 T136	D132-S134 PolarHBondContact O-N 3.07Å; S134-T136 PolarHBondContact O-N 3.26Å
135	T	56.2	Low	49.8	Very low	144 Å²	144	130.2 Å²	130.2	88%	0.883	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.5	85.6	168.8	27.3	0	0	0	0	112.3
136	T	51.4	Low	50.4	Low	139 Å²	139	131.1 Å²	131.1	85%	0.853	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.3	-5.1	153.1	45.4	0	0	0	0	114.9	S134	S134-T136 PolarHBondContact O-N 3.26Å
137	D	48.7	Very low	51.1	Low	102 Å²	102	132 Å²	132	55%	0.545	73%	0.733	S	S	.	*			trans	-109.9	93.1	-178.1	-151.1	-15	0	0	0	112.3	L139	D137-L139 PolarHBondContact OD1-N 3.19Å
138	R	54	Low	51.7	Low	237 Å²	237	125 Å²	125	89%	0.894	72%	0.715	S	S	*	*			trans	-109.5	30.5	169.5	-77.7	-163.9	87.6	-176.9	7.9	111.6
139	L	55.4	Low	52.2	Low	147 Å²	147	125.3 Å²	125.3	77%	0.77	72%	0.716	S	S	*	*	S	Bend	trans	-112.2	-12.4	177.5	-66.6	175.8	0	0	0	114.1	D137 S141	D137-L139 PolarHBondContact OD1-N 3.19Å; L139-S141 VanDerWaalsContact C-N 3.34Å; L139-S141 PolarHBondContact O-N 2.99Å
140	D	55.8	Low	52.7	Low	140 Å²	140	125.4 Å²	125.4	75%	0.749	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	1.2	-176.9	-81.7	-7.3	0	0	0	116.2
141	S	54.5	Low	53	Low	109 Å²	109	122.9 Å²	122.9	76%	0.762	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-0.2	179.8	66.6	0	0	0	0	114.9	L139 S143	L139-S141 VanDerWaalsContact C-N 3.34Å; L139-S141 PolarHBondContact O-N 2.99Å; S141-S143 VanDerWaalsContact C-N 3.3Å; S141-S143 PolarHBondContact O-N 3.14Å; S141-S143 VanDerWaalsContact O-N 3.09Å
142	V	56.2	Low	53	Low	121 Å²	121	121.2 Å²	121.2	73%	0.733	70%	0.698	S	S	*	*			trans	-87.6	75.8	175.9	-169.9	0	0	0	0	109.2	I144	V142-I144 PolarHBondContact O-N 2.98Å
143	S	54.4	Low	53.2	Low	82 Å²	82	118.7 Å²	118.7	57%	0.573	69%	0.69	S	S	*	*			trans	-69.6	124.2	170.6	-177.9	0	0	0	0	109.9	S141 G145 S146	S141-S143 VanDerWaalsContact C-N 3.3Å; S141-S143 PolarHBondContact O-N 3.14Å; S141-S143 VanDerWaalsContact O-N 3.09Å; S143-G145 PolarHBondContact O-N 2.85Å; S143-S146 PolarHBondContact O-N 3.27Å; S143-S146 VanDerWaalsContact O-N 3.08Å
144	I	53.7	Low	52.7	Low	122 Å²	122	117.8 Å²	117.8	63%	0.626	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-15.4	177.4	-86.9	162.9	0	0	0	112.8	V142 Y147	V142-I144 PolarHBondContact O-N 2.98Å; I144-Y147 HydrophobicContact CB-CE1 3.83Å; I144-Y147 VanDerWaalsContact CB-OH 3.3Å; I144-Y147 WeakPolarHBondContact CB-OH 3.48Å; I144-Y147 HydrophobicContact CG1-CE1 3.73Å; I144-Y147 VanDerWaalsContact CG1-OH 3.29Å; I144-Y147 WeakPolarHBondContact CG1-OH 3.28Å; I144-Y147 HydrophobicContact CG2-CE1 4.25Å; I144-Y147 HydrophobicContact CG2-CE2 4.48Å; I144-Y147 WeakPolarHBondContact CG2-OH 3.4Å; I144-Y147 WeakPolarHBondContact O-CD1 3.32Å; I144-Y147 WeakPolarHBondContact O-CD2 3.42Å; I144-Y147 WeakPolarHBondContact O-CE1 3.29Å; I144-Y147 WeakPolarHBondContact O-CE2 3.4Å; I144-Y147 PolarHBondContact O-OH 3.46Å
145	G	52.2	Low	52.6	Low	51 Å²	51	120.8 Å²	120.8	53%	0.526	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-21.2	174.9	0	0	0	0	0	115.6	S143 Y147	S143-G145 PolarHBondContact O-N 2.85Å; G145-Y147 PolarHBondContact O-N 2.87Å
146	S	56.7	Low	52.4	Low	91 Å²	91	121.4 Å²	121.4	64%	0.636	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-75.9	-23	-169.2	-175.4	0	0	0	0	114.4	S143 L148	S143-S146 PolarHBondContact O-N 3.27Å; S143-S146 VanDerWaalsContact O-N 3.08Å; S146-L148 VanDerWaalsContact C-N 3.33Å
147	Y	56.6	Low	51.9	Low	127 Å²	127	121.6 Å²	121.6	50%	0.498	69%	0.686	S	S	.	*	G	3₁₀ helix	trans	-83.3	-8.4	-176.1	45.4	-114.2	0	0	0	114	I144 G145 T150	I144-Y147 HydrophobicContact CB-CE1 3.83Å; I144-Y147 VanDerWaalsContact CB-OH 3.3Å; I144-Y147 WeakPolarHBondContact CB-OH 3.48Å; I144-Y147 HydrophobicContact CG1-CE1 3.73Å; I144-Y147 VanDerWaalsContact CG1-OH 3.29Å; I144-Y147 WeakPolarHBondContact CG1-OH 3.28Å; I144-Y147 HydrophobicContact CG2-CE1 4.25Å; I144-Y147 HydrophobicContact CG2-CE2 4.48Å; I144-Y147 WeakPolarHBondContact CG2-OH 3.4Å; I144-Y147 WeakPolarHBondContact O-CD1 3.32Å; I144-Y147 WeakPolarHBondContact O-CD2 3.42Å; I144-Y147 WeakPolarHBondContact O-CE1 3.29Å; I144-Y147 WeakPolarHBondContact O-CE2 3.4Å; I144-Y147 PolarHBondContact O-OH 3.46Å; G145-Y147 PolarHBondContact O-N 2.87Å; Y147-T150 PolarHBondContact O-OG1 3.05Å
148	L	57.2	Low	51.8	Low	115 Å²	115	123.8 Å²	123.8	60%	0.602	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-89.3	-11.3	175.9	-62.9	-178.1	0	0	0	113.1	S146 T150 V151	S146-L148 VanDerWaalsContact C-N 3.33Å; L148-T150 VanDerWaalsContact C-N 3.26Å; L148-T150 PolarHBondContact O-N 3.46Å; L148-V151 HydrophobicContact CD2-CG2 4.45Å; L148-V151 VanDerWaalsContact O-CG2 3.29Å; L148-V151 WeakPolarHBondContact O-CG2 3.31Å
149	D	55	Low	50.9	Low	139 Å²	139	120.6 Å²	120.6	74%	0.743	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-12.8	179	-160.9	43.1	0	0	0	112.9
150	T	57.8	Low	49.8	Very low	122 Å²	122	117.2 Å²	117.2	75%	0.748	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-4.8	178.2	51.9	0	0	0	0	114.4	Y147 L148	Y147-T150 PolarHBondContact O-OG1 3.05Å; L148-T150 VanDerWaalsContact C-N 3.26Å; L148-T150 PolarHBondContact O-N 3.46Å
151	V	47	Very low	48.9	Very low	104 Å²	104	116.6 Å²	116.6	63%	0.63	69%	0.693	S	S	*	*	S	Bend	trans	-113.6	3.4	-177.4	-68.1	0	0	0	0	113.7	L148 P153	L148-V151 HydrophobicContact CD2-CG2 4.45Å; L148-V151 VanDerWaalsContact O-CG2 3.29Å; L148-V151 WeakPolarHBondContact O-CG2 3.31Å; V151-P153 VanDerWaalsContact O-CD 3.28Å; V151-P153 WeakPolarHBondContact O-CD 3.36Å
152	A	51.6	Low	48.6	Very low	71 Å²	71	117.9 Å²	117.9	59%	0.587	70%	0.699	S	S	*	*	S	Bend	trans	-72.9	118.3	168	0	0	0	0	0	109.1	S154	A152-S154 PolarHBondContact O-N 2.95Å
153	P	43.9	Very low	48.1	Very low	105 Å²	105	115.6 Å²	115.6	68%	0.682	70%	0.7	S	S	*	*			trans	-71.2	102.5	171.7	28.2	-29.5	0	0	0	108	V151 E155	V151-P153 VanDerWaalsContact O-CD 3.28Å; V151-P153 WeakPolarHBondContact O-CD 3.36Å; P153-E155 VanDerWaalsContact C-N 3.33Å; P153-E155 PolarHBondContact O-N 3.33Å
154	S	42.1	Very low	47.5	Very low	117 Å²	117	118 Å²	118	82%	0.818	71%	0.711	S	S	*	*			trans	-75.4	93.3	167.8	72.5	0	0	0	0	108.5	A152	A152-S154 PolarHBondContact O-N 2.95Å
155	E	45.2	Very low	47	Very low	151 Å²	151	118 Å²	118	71%	0.706	72%	0.718	S	S	*	*			trans	-60.3	132.4	162.9	-57.3	-72.4	160.2	0	0	109.4	P153	P153-E155 VanDerWaalsContact C-N 3.33Å; P153-E155 PolarHBondContact O-N 3.33Å
156	L	51.5	Low	46.5	Very low	157 Å²	157	126.9 Å²	126.9	82%	0.822	74%	0.736	S	S	*	*			trans	61.8	107	166.9	-70.9	124	0	0	0	118.3
157	D	40.5	Very low	46.3	Very low	143 Å²	143	128.2 Å²	128.2	77%	0.765	75%	0.746	S	S	*	*				175.6	142.2	93.9	-158.1	28.9	0	0	0	113.4
158	E	46.2	Very low	46.1	Very low	148 Å²	148	130.4 Å²	130.4	69%	0.692	76%	0.761	S	S	*	*			trans	34.5	121.7	155.9	-65.3	-111.7	100.8	0	0	124.6
159	Q	36.3	Very low	46.1	Very low	170 Å²	170	131.3 Å²	131.3	79%	0.794	76%	0.763	S	S	*	*			trans	68	94.2	130.4	-64.5	-81.2	-32.8	0	0	123
160	G	31.4	Very low	46	Very low	77 Å²	77	128.8 Å²	128.8	79%	0.794	75%	0.75	S	S	*	*			trans	72.4	159.1	136.9	0	0	0	0	0	120.9
161	P	37.2	Very low	45.7	Very low	127 Å²	127	132.1 Å²	132.1	83%	0.825	75%	0.749	S	S	*	*			cis	-119.5	177	8.7	42.1	-27.1	0	0	0	114.5
162	P	48	Very low	46	Very low	136 Å²	136	130.3 Å²	130.3	88%	0.883	75%	0.745	S	S	*	*			trans	-93.7	141.6	-162.3	35.8	-29.8	0	0	0	113.1
163	G	45.9	Very low	46.1	Very low	72 Å²	72	134.6 Å²	134.6	74%	0.742	75%	0.75	S	S	*	*			trans	134.2	64.5	158.1	0	0	0	0	0	115.7
164	V	42.1	Very low	46.3	Very low	133 Å²	133	134.1 Å²	134.1	81%	0.806	75%	0.745	S	S	*	*			trans	-141.4	119.2	147.3	-173.3	0	0	0	0	106.7	R166	V164-R166 PolarHBondContact O-N 3.38Å
165	P	42	Very low	46.7	Very low	121 Å²	121	135.5 Å²	135.5	79%	0.786	74%	0.742	S	S	*	*			trans	-62	123.8	175.2	21.3	-25.8	0	0	0	108.7	S167	P165-S167 PolarHBondContact O-N 2.86Å
166	R	41.9	Very low	46.8	Very low	238 Å²	238	132.5 Å²	132.5	90%	0.898	74%	0.743	S	S	*	*			trans	-37.4	123.5	162.5	-100.5	178.7	165.9	-154.5	-2.7	108.1	V164 E168	V164-R166 PolarHBondContact O-N 3.38Å; R166-E168 PolarHBondContact O-N 3.35Å
167	S	53.5	Low	46.2	Very low	120 Å²	120	128.3 Å²	128.3	84%	0.839	74%	0.738	S	S	*	*			trans	-68.5	77.4	167.9	177.8	0	0	0	0	108.2	P165 M169	P165-S167 PolarHBondContact O-N 2.86Å; S167-M169 PolarHBondContact O-N 3.01Å
168	E	52.4	Low	46	Very low	173 Å²	173	124.7 Å²	124.7	81%	0.808	73%	0.734	S	S	*	*			trans	-62.7	113.5	165.5	-168.6	170.3	-176.9	0	0	106.5	R166 D170	R166-E168 PolarHBondContact O-N 3.35Å; E168-D170 PolarHBondContact O-N 3.49Å
169	M	56.5	Low	46.1	Very low	133 Å²	133	127.2 Å²	127.2	66%	0.655	75%	0.746	S	S	*	*			trans	-60.3	101	-179.5	-170	80.2	84.9	0	0	108.3	S167 W171	S167-M169 PolarHBondContact O-N 3.01Å; M169-W171 PolarHBondContact O-N 2.99Å
170	D	52.8	Low	46.1	Very low	87 Å²	87	130.4 Å²	130.4	47%	0.465	75%	0.751	S	S	.	*			trans	-74.2	90.5	-179.6	-178.3	11.9	0	0	0	109.5	E168 A172 K173	E168-D170 PolarHBondContact O-N 3.49Å; D170-A172 PolarHBondContact O-N 2.82Å; D170-A172 VanDerWaalsContact OD1-CB 3.22Å; D170-A172 WeakPolarHBondContact OD1-CB 3.46Å; D170-A172 PolarHBondContact OD1-N 3.04Å; D170-K173 PolarHBondContact O-N 3.05Å
171	W	52.5	Low	46.4	Very low	191 Å²	191	130.8 Å²	130.8	72%	0.723	75%	0.746	S	S	*	*	H	α-helix	trans	-53.3	-23	177.6	-70.8	101.7	0	0	0	112.9	M169 K173 V174 I175	M169-W171 PolarHBondContact O-N 2.99Å; W171-K173 VanDerWaalsContact C-N 3.28Å; W171-K173 PolarHBondContact O-N 3.41Å; W171-V174 PolarHBondContact O-N 2.93Å; W171-I175 WeakPolarHBondContact O-CG1 3.26Å
172	A	52.4	Low	46.9	Very low	66 Å²	66	136.8 Å²	136.8	55%	0.545	75%	0.752	S	S	.	*	H	α-helix	trans	-65.4	-30	176.9	0	0	0	0	0	112.8	D170	D170-A172 PolarHBondContact O-N 2.82Å; D170-A172 VanDerWaalsContact OD1-CB 3.22Å; D170-A172 WeakPolarHBondContact OD1-CB 3.46Å; D170-A172 PolarHBondContact OD1-N 3.04Å
173	K	53	Low	46.7	Very low	162 Å²	162	135.8 Å²	135.8	70%	0.704	74%	0.744	S	S	*	*	H	α-helix	trans	-78.8	-30.8	179.2	-77.5	-176.4	-179.9	-173	0	113.6	D170 W171 I175 A176	D170-K173 PolarHBondContact O-N 3.05Å; W171-K173 VanDerWaalsContact C-N 3.28Å; W171-K173 PolarHBondContact O-N 3.41Å; K173-I175 VanDerWaalsContact C-N 3.29Å; K173-I175 PolarHBondContact O-N 3.43Å; K173-A176 PolarHBondContact O-N 3.42Å
174	V	48.3	Very low	46.6	Very low	94 Å²	94	141.9 Å²	141.9	57%	0.57	75%	0.753	S	S	*	*	H	α-helix	trans	-67.4	-34.4	178.5	178.3	0	0	0	0	110.9	W171	W171-V174 PolarHBondContact O-N 2.93Å
175	I	50.5	Low	47	Very low	146 Å²	146	140.6 Å²	140.6	75%	0.749	75%	0.745	S	S	*	*	H	α-helix	trans	-72.4	-29.8	179.5	-56.5	-79.4	0	0	0	111.7	W171 K173	W171-I175 WeakPolarHBondContact O-CG1 3.26Å; K173-I175 VanDerWaalsContact C-N 3.29Å; K173-I175 PolarHBondContact O-N 3.43Å
176	A	47.4	Very low	46.9	Very low	88 Å²	88	141.4 Å²	141.4	73%	0.727	74%	0.743	S	S	*	*	H	α-helix	trans	-82.9	-15.5	-174.8	0	0	0	0	0	114.6	K173	K173-A176 PolarHBondContact O-N 3.42Å
177	G	38.7	Very low	46.9	Very low	70 Å²	70	134 Å²	134	72%	0.722	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	5.1	-172.5	0	0	0	0	0	116.3
178	G	36.9	Very low	46.5	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	72%	0.722	S	S	*	*			trans	-97.7	81.9	-178.9	0	0	0	0	0	112.4	R180	G178-R180 PolarHBondContact O-N 3.3Å
179	E	47.5	Very low	46	Very low	202 Å²	202	127.8 Å²	127.8	94%	0.944	71%	0.708	S	S	*	*			trans	-71.3	91.7	174.6	-159.7	171.8	-169.6	0	0	110.2
180	R	37.8	Very low	45.5	Very low	237 Å²	237	126.5 Å²	126.5	89%	0.894	71%	0.707	S	S	*	*			trans	-142.7	110.2	163.6	-154.9	172.4	-162.7	-126.3	2.4	111.9	G178	G178-R180 PolarHBondContact O-N 3.3Å
181	A	36.8	Very low	45.2	Very low	84 Å²	84	132 Å²	132	69%	0.694	72%	0.722	S	S	*	*			trans	40.1	99.4	157.5	0	0	0	0	0	117.7	T183	A181-T183 PolarHBondContact O-N 3.24Å; A181-T183 VanDerWaalsContact O-N 3.14Å
182	R	48.8	Very low	44.8	Very low	253 Å²	253	128.7 Å²	128.7	96%	0.955	72%	0.718	S	S	*	*			trans	-45.5	115.1	162.1	-74	179.4	172.6	152.1	-1.1	111.2
183	T	43.3	Very low	44.3	Very low	116 Å²	116	127.8 Å²	127.8	71%	0.712	72%	0.715	S	S	*	*			trans	-140.6	119.3	156.4	46.1	0	0	0	0	108.5	A181 V185	A181-T183 PolarHBondContact O-N 3.24Å; A181-T183 VanDerWaalsContact O-N 3.14Å; T183-V185 PolarHBondContact O-N 3.4Å
184	E	42.6	Very low	44	Very low	200 Å²	200	123.8 Å²	123.8	94%	0.935	71%	0.707	S	S	*	*	S	Bend	trans	43.1	40.5	148.1	-146.6	173.6	173.4	0	0	120.3
185	V	50.8	Low	43.6	Very low	106 Å²	106	125 Å²	125	64%	0.642	71%	0.71	S	S	*	*			trans	-125.3	1	170.2	-169.7	0	0	0	0	113.1	T183 A187 T188	T183-V185 PolarHBondContact O-N 3.4Å; V185-A187 PolarHBondContact O-N 3.37Å; V185-T188 PolarHBondContact O-OG1 3.26Å
186	D	39.7	Very low	43.2	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	71%	0.712	S	S	*	*	H	α-helix	trans	-77.4	-18.8	-174.9	-161.7	45.7	0	0	0	114	T188 T190	D186-T188 VanDerWaalsContact C-N 3.35Å; D186-T188 PolarHBondContact O-N 3.08Å; D186-T190 PolarHBondContact O-OG1 3.48Å
187	A	41.8	Very low	43	Very low	84 Å²	84	127.7 Å²	127.7	69%	0.694	71%	0.709	S	S	*	*	H	α-helix	trans	-75	-20.2	-177.4	0	0	0	0	0	114	V185	V185-A187 PolarHBondContact O-N 3.37Å
188	T	45	Very low	43.4	Very low	100 Å²	100	129.5 Å²	129.5	61%	0.613	71%	0.705	S	S	*	*	H	α-helix	trans	-93.1	-23	179.5	50	0	0	0	0	112.9	V185 D186 R191	V185-T188 PolarHBondContact O-OG1 3.26Å; D186-T188 VanDerWaalsContact C-N 3.35Å; D186-T188 PolarHBondContact O-N 3.08Å; T188-R191 PolarHBondContact O-N 3.22Å
189	A	43.8	Very low	43.2	Very low	61 Å²	61	137.1 Å²	137.1	50%	0.504	71%	0.713	S	S	.	*	H	α-helix	trans	-69.2	-34.3	179.4	0	0	0	0	0	112.5	R191 L192 G193	A189-R191 VanDerWaalsContact C-N 3.31Å; A189-R191 PolarHBondContact O-N 3.29Å; A189-L192 PolarHBondContact O-N 3.42Å; A189-G193 PolarHBondContact O-N 3.37Å
190	T	46	Very low	42.7	Very low	106 Å²	106	136.3 Å²	136.3	65%	0.65	71%	0.707	S	S	*	*	H	α-helix	trans	-69.2	-25.5	179.7	10.6	0	0	0	0	113.2	D186	D186-T190 PolarHBondContact O-OG1 3.48Å
191	R	45.6	Very low	42.6	Very low	202 Å²	202	130.3 Å²	130.3	76%	0.762	70%	0.699	S	S	*	*	H	α-helix	trans	-76.1	-35.9	175.4	-85.7	-174.2	173.3	-171.3	-1.3	113.3	T188 A189 S194	T188-R191 PolarHBondContact O-N 3.22Å; A189-R191 VanDerWaalsContact C-N 3.31Å; A189-R191 PolarHBondContact O-N 3.29Å; R191-S194 PolarHBondContact O-N 3.48Å
192	L	45.1	Very low	42.4	Very low	123 Å²	123	132.9 Å²	132.9	64%	0.644	71%	0.709	S	S	*	*	H	α-helix	trans	-73.3	-31.7	-179.8	-166.5	67.1	0	0	0	112.3	A189 S194 L195	A189-L192 PolarHBondContact O-N 3.42Å; L192-S194 VanDerWaalsContact C-N 3.3Å; L192-S194 PolarHBondContact O-N 2.99Å; L192-L195 PolarHBondContact O-N 3.19Å
193	G	41.9	Very low	41.7	Very low	47 Å²	47	124.1 Å²	124.1	49%	0.485	70%	0.696	S	S	.	*	H	α-helix	trans	-63	-34	172.5	0	0	0	0	0	113.4	A189 L195 R196	A189-G193 PolarHBondContact O-N 3.37Å; G193-L195 VanDerWaalsContact C-N 3.35Å; G193-L195 PolarHBondContact O-N 3.02Å; G193-R196 PolarHBondContact O-N 3.21Å
194	S	45.3	Very low	41.4	Very low	77 Å²	77	128 Å²	128	54%	0.538	71%	0.706	S	S	.	*	H	α-helix	trans	-69.1	-30.3	-179.9	-169.9	0	0	0	0	113.2	R191 L192	R191-S194 PolarHBondContact O-N 3.48Å; L192-S194 VanDerWaalsContact C-N 3.3Å; L192-S194 PolarHBondContact O-N 2.99Å
195	L	39.8	Very low	40.9	Very low	120 Å²	120	129.5 Å²	129.5	63%	0.628	70%	0.704	S	S	*	*	H	α-helix	trans	-73.6	-30.7	178.4	-69.8	168.3	0	0	0	112.1	L192 G193 A197 V198	L192-L195 PolarHBondContact O-N 3.19Å; G193-L195 VanDerWaalsContact C-N 3.35Å; G193-L195 PolarHBondContact O-N 3.02Å; L195-A197 VanDerWaalsContact C-N 3.32Å; L195-A197 PolarHBondContact O-N 2.96Å; L195-V198 PolarHBondContact O-N 2.87Å
196	R	43.5	Very low	40.3	Very low	213 Å²	213	131.2 Å²	131.2	80%	0.804	71%	0.708	S	S	*	*	H	α-helix	trans	-71.1	-26.2	176.5	-164.7	-176.1	-68.1	-111	2.7	112.8	G193	G193-R196 PolarHBondContact O-N 3.21Å
197	A	42.3	Very low	40.2	Very low	78 Å²	78	133.5 Å²	133.5	65%	0.645	72%	0.715	S	S	*	*	H	α-helix	trans	-76.9	-20.3	179.1	0	0	0	0	0	113.8	L195	L195-A197 VanDerWaalsContact C-N 3.32Å; L195-A197 PolarHBondContact O-N 2.96Å
198	V	46	Very low	39.6	Very low	108 Å²	108	133.1 Å²	133.1	66%	0.655	72%	0.719	S	S	*	*	H	α-helix	trans	-78.6	-21.7	-178.8	172.1	0	0	0	0	112	L195 K200	L195-V198 PolarHBondContact O-N 2.87Å; V198-K200 PolarHBondContact O-N 2.79Å
199	W	34.6	Very low	38.8	Very low	225 Å²	225	132.2 Å²	132.2	85%	0.852	73%	0.729	S	S	*	*			trans	-103.2	72.4	-174.8	-70.9	37.7	0	0	0	110.4
200	K	35.8	Very low	38.9	Very low	185 Å²	185	135.2 Å²	135.2	80%	0.804	74%	0.744	S	S	*	*			trans	-100.2	113.9	160.7	-94.1	-92.3	-177	174.2	0	107.6	V198	V198-K200 PolarHBondContact O-N 2.79Å
201	P	35.4	Very low	39.3	Very low	111 Å²	111	135.7 Å²	135.7	72%	0.721	75%	0.749	S	S	*	*			trans	-67.7	138.7	171	27.4	-30.6	0	0	0	109.1	G203	P201-G203 PolarHBondContact O-N 3.09Å; P201-G203 VanDerWaalsContact O-N 3.13Å
202	P	33.6	Very low	38.5	Very low	139 Å²	139	135.4 Å²	135.4	90%	0.903	76%	0.756	S	S	*	*			trans	-71.5	108.9	179.2	-11.8	27	0	0	0	110.1
203	G	34.7	Very low	38.2	Very low	68 Å²	68	134.6 Å²	134.6	70%	0.701	76%	0.761	S	S	*	*			trans	-113.6	111.1	172.1	0	0	0	0	0	111.3	P201	P201-G203 PolarHBondContact O-N 3.09Å; P201-G203 VanDerWaalsContact O-N 3.13Å
204	E	36.9	Very low	38.3	Very low	197 Å²	197	137.3 Å²	137.3	92%	0.921	77%	0.77	S	S	*	*			trans	44.4	114.2	149.6	-76.1	170.7	139.8	0	0	121.2
205	R	31.8	Very low	38.4	Very low	233 Å²	233	142.6 Å²	142.6	88%	0.879	79%	0.786	S	S	*	*			trans	-152.8	106.7	144.1	-160.2	176.6	-102.5	-131.7	1.3	113.3
206	L	37.9	Very low	38.4	Very low	141 Å²	141	143.1 Å²	143.1	74%	0.738	79%	0.79	S	S	*	*			trans	70.1	118	144.2	-62.7	169	0	0	0	123.6
207	Q	36.7	Very low	38.7	Very low	185 Å²	185	142.3 Å²	142.3	86%	0.864	80%	0.795	S	S	*	*			trans	73.5	114.6	132.3	-66.4	-82.1	49.2	0	0	122.1
208	G	29.4	Very low	38.9	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	79%	0.793	S	S	*	*			trans	133.3	97.2	136.8	0	0	0	0	0	119.8
209	G	29.8	Very low	39	Very low	80 Å²	80	141.2 Å²	141.2	83%	0.825	79%	0.792	S	S	*	*			trans	72.4	155.2	146.6	0	0	0	0	0	121.5
210	P	44.4	Very low	39.7	Very low	125 Å²	125	140.8 Å²	140.8	81%	0.812	80%	0.796	S	S	*	*			trans	-120.3	-165.6	-145.4	44	-31.1	0	0	0	115
211	P	55.3	Low	40.2	Very low	115 Å²	115	138.6 Å²	138.6	75%	0.747	79%	0.792	S	S	*	*			cis	-115.1	171.6	-46.8	35.4	-21.1	0	0	0	110.4
212	E	28.2	Very low	40.6	Very low	196 Å²	196	136.7 Å²	136.7	92%	0.916	79%	0.793	S	S	*	*			trans	-175	123.8	136.5	-75.6	-140.2	149.3	0	0	108.6
213	S	39.7	Very low	41.2	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	79%	0.789	S	S	*	*			trans	-93.4	151.6	163.1	65.4	0	0	0	0	107.8
214	P	44	Very low	41.9	Very low	103 Å²	103	143.7 Å²	143.7	67%	0.669	79%	0.793	S	S	*	*				-146.3	151	75.7	33.2	-13.1	0	0	0	114.9
215	E	47.3	Very low	42.8	Very low	188 Å²	188	138.2 Å²	138.2	88%	0.879	78%	0.781	S	S	*	*			trans	38	97.4	134.3	-53.9	174.4	-177.2	0	0	116.7
216	D	38.5	Very low	43.7	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	77%	0.771	S	S	*	*			trans	-127.7	96	147.6	-168.9	36.2	0	0	0	109	S218	D216-S218 PolarHBondContact O-N 3.38Å; D216-S218 WeakPolarHBondContact OD2-CB 3.49Å; D216-S218 PolarHBondContact OD2-OG 3.44Å
217	E	50	Low	44.1	Very low	195 Å²	195	138 Å²	138	91%	0.911	78%	0.777	S	S	*	*			trans	-64.9	71.3	162.1	-69.3	-173.1	136.7	0	0	109.7
218	S	46.7	Very low	44.7	Very low	87 Å²	87	135.6 Å²	135.6	61%	0.608	76%	0.763	S	S	*	*			trans	-103.7	79.9	170.8	49.9	0	0	0	0	110.9	D216	D216-S218 PolarHBondContact O-N 3.38Å; D216-S218 WeakPolarHBondContact OD2-CB 3.49Å; D216-S218 PolarHBondContact OD2-OG 3.44Å
219	A	48.1	Very low	45.8	Very low	76 Å²	76	143.3 Å²	143.3	63%	0.628	77%	0.769	S	S	*	*			trans	37.1	94.2	147.3	0	0	0	0	0	116.8	L221	A219-L221 PolarHBondContact O-N 3.36Å
220	K	48.6	Very low	47	Very low	217 Å²	217	147.2 Å²	147.2	94%	0.943	77%	0.766	S	S	*	*			trans	-56.9	90.9	147.5	-100.1	-179.1	174	-178.1	0	107.7	G222	K220-G222 PolarHBondContact O-N 3.39Å
221	L	47.6	Very low	47.2	Very low	138 Å²	138	150.3 Å²	150.3	72%	0.723	77%	0.769	S	S	*	*			trans	-66.8	84.1	164.6	-77.2	158.4	0	0	0	106.9	A219 F223	A219-L221 PolarHBondContact O-N 3.36Å; L221-F223 VanDerWaalsContact C-N 3.26Å; L221-F223 HydrophobicContact CB-CD2 4.37Å; L221-F223 HydrophobicContact CD2-CE2 4.19Å; L221-F223 PolarHBondContact O-N 3.48Å
222	G	43	Very low	47	Very low	71 Å²	71	149.9 Å²	149.9	73%	0.732	77%	0.768	S	S	*	*			trans	-69.3	84	173.2	0	0	0	0	0	109.6	K220	K220-G222 PolarHBondContact O-N 3.39Å
223	F	45.8	Very low	48	Very low	186 Å²	186	148.2 Å²	148.2	82%	0.816	76%	0.76	S	S	*	*			trans	-98.1	76.7	161.7	-81	-81.7	0	0	0	108.4	L221	L221-F223 VanDerWaalsContact C-N 3.26Å; L221-F223 HydrophobicContact CB-CD2 4.37Å; L221-F223 HydrophobicContact CD2-CE2 4.19Å; L221-F223 PolarHBondContact O-N 3.48Å
224	E	49.7	Very low	48.9	Very low	168 Å²	168	149.8 Å²	149.8	79%	0.785	76%	0.76	S	S	*	*			trans	-99.1	85.1	166.4	-166.8	167.9	-163.4	0	0	108	H226	E224-H226 PolarHBondContact O-N 3.46Å; E224-H226 VanDerWaalsContact O-N 3.07Å; E224-H226 PolarHBondContact O-ND1 3.47Å
225	A	57	Low	49.5	Very low	83 Å²	83	150.5 Å²	150.5	69%	0.686	76%	0.758	S	S	*	*			trans	-73.5	95	170.1	0	0	0	0	0	108.3
226	H	49.1	Very low	49.9	Very low	141 Å²	141	146.6 Å²	146.6	65%	0.653	75%	0.747	S	S	*	*			trans	-85.9	118.8	172.1	50.8	-81.5	0	0	0	108.6	E224	E224-H226 PolarHBondContact O-N 3.46Å; E224-H226 VanDerWaalsContact O-N 3.07Å; E224-H226 PolarHBondContact O-ND1 3.47Å
227	W	47.2	Very low	50.5	Low	228 Å²	228	146 Å²	146	86%	0.864	75%	0.748	S	S	*	*			trans	-98.1	112.7	169.4	-64.6	96.9	0	0	0	107.8
228	F	49.3	Very low	50.3	Low	134 Å²	134	145.8 Å²	145.8	59%	0.588	74%	0.744	S	S	*	*			trans	-100.1	132.4	168.8	55.8	-88.6	0	0	0	108.5	E230	F228-E230 HydrophobicContact CD2-CB 4.39Å; F228-E230 HydrophobicContact CD2-CG 3.83Å; F228-E230 HydrophobicContact CE2-CG 3.86Å; F228-E230 WeakPolarHBondContact CE2-OE1 3.22Å; F228-E230 PolarHBondContact O-N 3.42Å
229	W	51.6	Low	50.4	Low	240 Å²	240	153 Å²	153	91%	0.909	78%	0.775	S	S	*	*			trans	-85.2	104.6	166.3	-65.2	101.7	0	0	0	106.8
230	E	55.3	Low	50.5	Low	162 Å²	162	156.9 Å²	156.9	76%	0.757	78%	0.783	S	S	*	*			trans	-71.8	129.2	169.3	-104	172.6	-168.9	0	0	109.2	F228 C232	F228-E230 HydrophobicContact CD2-CB 4.39Å; F228-E230 HydrophobicContact CD2-CG 3.83Å; F228-E230 HydrophobicContact CE2-CG 3.86Å; F228-E230 WeakPolarHBondContact CE2-OE1 3.22Å; F228-E230 PolarHBondContact O-N 3.42Å; E230-C232 PolarHBondContact O-N 3.38Å; E230-C232 VanDerWaalsContact O-N 3.16Å
231	Q	49.3	Very low	50.6	Low	189 Å²	189	153.7 Å²	153.7	88%	0.883	77%	0.774	S	S	*	*			trans	-72.2	106.1	172.2	-175.6	171.3	9.6	0	0	107.9	Q233	Q231-Q233 PolarHBondContact O-N 2.76Å; Q231-Q233 VanDerWaalsContact O-N 3.12Å
232	C	51.2	Low	50.8	Low	106 Å²	106	154.6 Å²	154.6	72%	0.716	78%	0.777	S	S	*	*			trans	-68.8	110.2	178.3	-154.3	0	0	0	0	109	E230 D234	E230-C232 PolarHBondContact O-N 3.38Å; E230-C232 VanDerWaalsContact O-N 3.16Å; C232-D234 VanDerWaalsContact C-N 3.3Å; C232-D234 PolarHBondContact O-N 3.17Å
233	Q	49.4	Very low	51.2	Low	161 Å²	161	159.5 Å²	159.5	75%	0.752	78%	0.78	S	S	*	*			trans	-90.6	71.8	176.3	-157.4	171.8	9.6	0	0	107.5	Q231 D235	Q231-Q233 PolarHBondContact O-N 2.76Å; Q231-Q233 VanDerWaalsContact O-N 3.12Å; Q233-D235 PolarHBondContact O-N 3.21Å
234	D	57.4	Low	51.6	Low	140 Å²	140	157.9 Å²	157.9	75%	0.749	78%	0.778	S	S	*	*			trans	-69.4	91.5	166.6	-81.6	-30.6	0	0	0	107.4	C232 V236	C232-D234 VanDerWaalsContact C-N 3.3Å; C232-D234 PolarHBondContact O-N 3.17Å; D234-V236 PolarHBondContact O-N 2.78Å
235	D	56.8	Low	51.7	Low	119 Å²	119	157.2 Å²	157.2	64%	0.636	78%	0.777	S	S	*	*			trans	-60.9	106	175.6	-76.5	-29.2	0	0	0	109.3	Q233 T237	Q233-D235 PolarHBondContact O-N 3.21Å; D235-T237 VanDerWaalsContact C-N 3.27Å; D235-T237 PolarHBondContact O-N 2.93Å
236	V	56	Low	51.3	Low	106 Å²	106	162.5 Å²	162.5	64%	0.642	78%	0.784	S	S	*	*			trans	-65	93.2	165.5	-174.1	0	0	0	0	107.2	D234 F238	D234-V236 PolarHBondContact O-N 2.78Å; V236-F238 HydrophobicContact CB-CE2 4.06Å; V236-F238 HydrophobicContact CB-CZ 4.39Å; V236-F238 HydrophobicContact CG1-CD1 4.39Å; V236-F238 HydrophobicContact CG1-CD2 4.04Å; V236-F238 HydrophobicContact CG1-CE1 3.99Å; V236-F238 HydrophobicContact CG1-CE2 3.61Å; V236-F238 HydrophobicContact CG1-CG 4.42Å; V236-F238 HydrophobicContact CG1-CZ 3.58Å; V236-F238 WeakPolarHBondContact O-CD2 3.38Å; V236-F238 PolarHBondContact O-N 3.4Å
237	T	52	Low	51.5	Low	119 Å²	119	164.2 Å²	164.2	73%	0.73	79%	0.794	S	S	*	*			trans	-74.6	103	167.9	42.2	0	0	0	0	108	D235 L239	D235-T237 VanDerWaalsContact C-N 3.27Å; D235-T237 PolarHBondContact O-N 2.93Å; T237-L239 PolarHBondContact O-N 3.13Å
238	F	46.1	Very low	51.9	Low	190 Å²	190	158.8 Å²	158.8	83%	0.833	79%	0.788	S	S	*	*			trans	-73.1	113.9	165.7	-63.1	-86.6	0	0	0	108	V236	V236-F238 HydrophobicContact CB-CE2 4.06Å; V236-F238 HydrophobicContact CB-CZ 4.39Å; V236-F238 HydrophobicContact CG1-CD1 4.39Å; V236-F238 HydrophobicContact CG1-CD2 4.04Å; V236-F238 HydrophobicContact CG1-CE1 3.99Å; V236-F238 HydrophobicContact CG1-CE2 3.61Å; V236-F238 HydrophobicContact CG1-CG 4.42Å; V236-F238 HydrophobicContact CG1-CZ 3.58Å; V236-F238 WeakPolarHBondContact O-CD2 3.38Å; V236-F238 PolarHBondContact O-N 3.4Å
239	L	48	Very low	52.1	Low	240 Å²	240	161.1 Å²	161.1	100%	1.257	81%	0.806	S	S	*	*			trans	-92	0	165.4	-92.9	156.8	0	0	0	110	T237	T237-L239 PolarHBondContact O-N 3.13Å

Retrieved 239 of 239 residues in 46.2 ms (Link to these results)

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