A0A077YWW6_TRITR Loading...

Ras protein Rab 14

AlphaFold DB , UniProt , Accession A0A077YWW6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 225 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	41.7	Very low	37.4	Very low	232 Å²	232	141.2 Å²	141.2	100%	1.143	71%	0.713	S	S	*	*				0	120.1	0	-72.5	175.7	-159.6	0	0	106.6
2	N	35.5	Very low	37	Very low	128 Å²	128	140.3 Å²	140.3	68%	0.684	71%	0.711	S	S	*	*			trans	-81.4	145.3	-172	-140.3	-2.4	0	0	0	109.1	G4 D5	N2-G4 PolarHBondContact O-N 3.28Å; N2-D5 PolarHBondContact N-OD2 3.31Å; N2-D5 PolarHBondContact O-N 2.79Å
3	E	37.4	Very low	36.9	Very low	176 Å²	176	137.4 Å²	137.4	82%	0.822	71%	0.705	S	S	*	*	H	α-helix	trans	-56	-22.1	-178.2	-80	-178.1	138.6	0	0	113.4
4	G	41	Very low	36.3	Very low	48 Å²	48	142.4 Å²	142.4	50%	0.495	72%	0.719	S	S	.	*	H	α-helix	trans	-70.5	-22.6	173.9	0	0	0	0	0	115.2	N2 Y7	N2-G4 PolarHBondContact O-N 3.28Å; G4-Y7 VanDerWaalsContact O-CB 3.31Å; G4-Y7 WeakPolarHBondContact O-CB 3.17Å; G4-Y7 PolarHBondContact O-N 3.23Å
5	D	43.5	Very low	36.1	Very low	100 Å²	100	144.5 Å²	144.5	54%	0.535	73%	0.725	S	S	.	*	H	α-helix	trans	-80.5	-28.7	-177.1	-63.9	-37.3	0	0	0	112.2	N2 Y7 K8	N2-D5 PolarHBondContact N-OD2 3.31Å; N2-D5 PolarHBondContact O-N 2.79Å; D5-Y7 PolarHBondContact O-N 2.83Å; D5-K8 PolarHBondContact O-N 3.49Å
6	L	36.7	Very low	35.5	Very low	133 Å²	133	144.3 Å²	144.3	70%	0.696	73%	0.734	S	S	*	*	H	α-helix	trans	-64	-26.1	169.1	-94.6	122.8	0	0	0	112.1
7	Y	33.1	Very low	35.2	Very low	127 Å²	127	141.4 Å²	141.4	50%	0.498	73%	0.73	S	S	.	*	H	α-helix	trans	-75	-26.3	-176.5	-127.9	-86.4	0	0	0	113.5	G4 D5 R94	G4-Y7 VanDerWaalsContact O-CB 3.31Å; G4-Y7 WeakPolarHBondContact O-CB 3.17Å; G4-Y7 PolarHBondContact O-N 3.23Å; D5-Y7 PolarHBondContact O-N 2.83Å; Y7-R94 WeakPolarHBondContact OH-CD 3.04Å; Y7-R94 PolarHBondContact OH-NE 3.23Å; Y7-R94 PolarHBondContact OH-NH1 2.84Å
8	K	36.5	Very low	34.8	Very low	175 Å²	175	141.6 Å²	141.6	76%	0.761	74%	0.738	S	S	*	*	H	α-helix	trans	-88.7	-21.2	-179.2	-95	-179.8	174.3	178.9	0	114.3	D5 C10	D5-K8 PolarHBondContact O-N 3.49Å; K8-C10 VanDerWaalsContact C-N 3.28Å; K8-C10 PolarHBondContact O-N 3.2Å
9	L	37.8	Very low	34.8	Very low	159 Å²	159	139.1 Å²	139.1	83%	0.832	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-17.4	-179.1	-120.5	86.9	0	0	0	113.9
10	C	37.5	Very low	34.7	Very low	103 Å²	103	135.7 Å²	135.7	70%	0.696	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-8.4	-174.9	-65.5	0	0	0	0	114.9	K8	K8-C10 VanDerWaalsContact C-N 3.28Å; K8-C10 PolarHBondContact O-N 3.2Å
11	Y	31.2	Very low	34.6	Very low	172 Å²	172	135.1 Å²	135.1	68%	0.675	71%	0.711	S	S	*	*	S	Bend	trans	-128.6	64.4	-174.3	-72	-84.3	0	0	0	111.4
12	D	31.7	Very low	34.5	Very low	130 Å²	130	131.1 Å²	131.1	70%	0.695	69%	0.694	S	S	*	*			trans	-147.6	141	158.9	-140.2	-15.3	0	0	0	113.5
13	T	36.2	Very low	34.4	Very low	103 Å²	103	132.8 Å²	132.8	63%	0.632	70%	0.697	S	S	*	*			trans	71.2	108.7	164.8	63.7	0	0	0	0	120.3	E15 K65	T13-E15 PolarHBondContact O-N 3.2Å; T13-K65 PolarHBondContact O-NZ 3.01Å
14	K	28.3	Very low	34.4	Very low	208 Å²	208	128.3 Å²	128.3	90%	0.904	68%	0.678	S	S	*	*			trans	-18.7	114.4	146.7	-59.1	175.3	-179.5	179.5	0	113.9
15	E	33.4	Very low	34	Very low	173 Å²	173	128.1 Å²	128.1	81%	0.808	68%	0.676	S	S	*	*			trans	-156.9	118.6	155.4	-116.3	-180	-169.5	0	0	110.3	T13 S17	T13-E15 PolarHBondContact O-N 3.2Å; E15-S17 PolarHBondContact O-N 3.5Å
16	T	27.1	Very low	33.8	Very low	142 Å²	142	129.2 Å²	129.2	87%	0.871	69%	0.689	S	S	*	*			trans	-63.2	102.3	171.5	31.9	0	0	0	0	110.5
17	S	29.5	Very low	34	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	69%	0.692	S	S	*	*			trans	-86.5	114.3	165.3	46.6	0	0	0	0	109.9	E15 V19	E15-S17 PolarHBondContact O-N 3.5Å; S17-V19 PolarHBondContact O-N 3.17Å
18	V	29.2	Very low	34.7	Very low	145 Å²	145	125.7 Å²	125.7	88%	0.879	67%	0.673	S	S	*	*			trans	-60.9	110.7	-179.9	-171.7	0	0	0	0	110
19	V	34.8	Very low	35.9	Very low	93 Å²	93	121.5 Å²	121.5	56%	0.564	66%	0.656	S	S	*	*			trans	-76.6	133.3	168.8	177.3	0	0	0	0	107.2	S17 Q21	S17-V19 PolarHBondContact O-N 3.17Å; V19-Q21 HydrophobicContact CB-CG 4.07Å; V19-Q21 HydrophobicContact CG1-CG 3.94Å; V19-Q21 PolarHBondContact O-N 3.2Å
20	S	33.1	Very low	37.2	Very low	72 Å²	72	122.1 Å²	122.1	50%	0.503	65%	0.652	S	S	.	*			trans	-70.1	87.6	161.2	80.9	0	0	0	0	107.4	L22 R54	S20-L22 PolarHBondContact O-N 2.97Å; S20-L22 VanDerWaalsContact O-N 3.09Å; S20-R54 PolarHBondContact OG-NH1 3.44Å; S20-R54 PolarHBondContact OG-NH2 2.64Å
21	Q	32.8	Very low	39.5	Very low	124 Å²	124	123.4 Å²	123.4	58%	0.579	65%	0.652	S	S	*	*			trans	-71	101.4	173.5	-70.9	171.6	-28.6	0	0	107.2	V19 H23	V19-Q21 HydrophobicContact CB-CG 4.07Å; V19-Q21 HydrophobicContact CG1-CG 3.94Å; V19-Q21 PolarHBondContact O-N 3.2Å; Q21-H23 WeakPolarHBondContact CB-ND1 3.26Å; Q21-H23 PolarHBondContact O-N 2.68Å; Q21-H23 PolarHBondContact O-ND1 2.97Å; Q21-H23 PolarHBondContact OE1-CE1 3.08Å
22	L	37.6	Very low	42.4	Very low	148 Å²	148	116.1 Å²	116.1	78%	0.775	63%	0.627	S	S	*	*			trans	-56.9	103.9	140.5	-90.3	154.9	0	0	0	104.3	S20 L24	S20-L22 PolarHBondContact O-N 2.97Å; S20-L22 VanDerWaalsContact O-N 3.09Å; L22-L24 HydrophobicContact CB-CD1 4.16Å; L22-L24 HydrophobicContact CB-CG 4.49Å; L22-L24 PolarHBondContact O-N 3.46Å
23	H	34.8	Very low	45.3	Very low	163 Å²	163	110.7 Å²	110.7	76%	0.755	60%	0.598	S	S	*	*			trans	-67.6	73	174.3	-77.4	58.4	0	0	0	107.8	Q21 G25	Q21-H23 WeakPolarHBondContact CB-ND1 3.26Å; Q21-H23 PolarHBondContact O-N 2.68Å; Q21-H23 PolarHBondContact O-ND1 2.97Å; Q21-H23 PolarHBondContact OE1-CE1 3.08Å; H23-G25 PolarHBondContact O-N 3.18Å
24	L	37.3	Very low	48.1	Very low	82 Å²	82	106.2 Å²	106.2	43%	0.429	57%	0.572	S	S	.	*			trans	-82.9	110.8	168.3	-85.4	158	0	0	0	105.1	L22 A28 L71	L22-L24 HydrophobicContact CB-CD1 4.16Å; L22-L24 HydrophobicContact CB-CG 4.49Å; L22-L24 PolarHBondContact O-N 3.46Å; L24-A28 HydrophobicContact CB-CB 3.66Å; L24-A28 HydrophobicContact CD2-CB 3.75Å; L24-A28 HydrophobicContact CG-CB 4.24Å; L24-L71 HydrophobicContact CB-CD2 4.16Å; L24-L71 HydrophobicContact CD1-CD2 3.54Å; L24-L71 HydrophobicContact CD1-CG 4.49Å; L24-L71 HydrophobicContact CG-CD2 4.46Å
25	G	32.9	Very low	51.3	Low	43 Å²	43	96.3 Å²	96.3	44%	0.443	53%	0.529	S	S	.	.			trans	-54.2	164.4	-178	0	0	0	0	0	112.4	H23 F27 A28	H23-G25 PolarHBondContact O-N 3.18Å; G25-F27 PolarHBondContact O-N 3.3Å; G25-A28 WeakPolarHBondContact O-CB 3.38Å; G25-A28 PolarHBondContact O-N 3.15Å
26	P	39.4	Very low	54.2	Low	124 Å²	124	88 Å²	88	81%	0.805	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-16	-170.8	19.8	-32.5	0	0	0	115.3
27	F	41.1	Very low	57.4	Low	175 Å²	175	81.3 Å²	81.3	77%	0.768	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-27.6	173.9	-91.9	-92.9	0	0	0	114.7	G25 E29 K30	G25-F27 PolarHBondContact O-N 3.3Å; F27-E29 PolarHBondContact O-N 2.94Å; F27-K30 PolarHBondContact O-N 3.02Å
28	A	47.8	Very low	60.4	Low	11 Å²	11	76.8 Å²	76.8	9%	0.091	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-17.5	-174.2	0	0	0	0	0	114.1	L24 G25	L24-A28 HydrophobicContact CB-CB 3.66Å; L24-A28 HydrophobicContact CD2-CB 3.75Å; L24-A28 HydrophobicContact CG-CB 4.24Å; G25-A28 WeakPolarHBondContact O-CB 3.38Å; G25-A28 PolarHBondContact O-N 3.15Å
29	E	60.3	Low	63.4	Low	87 Å²	87	69.9 Å²	69.9	41%	0.407	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-21.2	178.2	-65.6	-165.5	176.8	0	0	112.9	F27 D31 A32 R69 I85	F27-E29 PolarHBondContact O-N 2.94Å; E29-D31 VanDerWaalsContact C-N 3.28Å; E29-D31 PolarHBondContact O-N 2.93Å; E29-A32 PolarHBondContact O-N 2.75Å; E29-R69 IonicContact OE1-NH2 2.73Å; E29-R69 PolarHBondContact OE1-NH2 2.86Å; E29-R69 IonicContact OE2-CZ 3.76Å; E29-R69 IonicContact OE2-NH1 2.73Å; E29-R69 IonicContact OE2-NH2 2.86Å; E29-R69 PolarHBondContact OE2-NH2 3.42Å; E29-I85 HydrophobicContact CB-CD1 4.12Å; E29-I85 HydrophobicContact CG-CD1 4.28Å
30	K	66.6	Low	66.2	Low	172 Å²	172	66.6 Å²	66.6	75%	0.748	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.9	-169.4	-163.7	177.6	172.9	-177.1	0	113.5	F27	F27-K30 PolarHBondContact O-N 3.02Å
31	D	84.4	Confident	68.9	Low	129 Å²	129	71.1 Å²	71.1	69%	0.69	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	11.7	-177.6	-51	-37.4	0	0	0	112.9	E29	E29-D31 VanDerWaalsContact C-N 3.28Å; E29-D31 PolarHBondContact O-N 2.93Å
32	A	92	Very high	71.6	Confident	19 Å²	19	67.3 Å²	67.3	16%	0.157	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-93.4	134.3	-176.6	0	0	0	0	0	112	E29 G34 L71 K83 I85	E29-A32 PolarHBondContact O-N 2.75Å; A32-G34 PolarHBondContact O-N 3.42Å; A32-L71 HydrophobicContact CB-CD1 4.06Å; A32-K83 CarbonylContact C-O 3.59Å; A32-K83 VanDerWaalsContact CA-O 3.29Å; A32-K83 WeakPolarHBondContact CA-O 3.27Å; A32-K83 HydrophobicContact CB-CB 3.86Å; A32-I85 HydrophobicContact CB-CD1 3.86Å; A32-I85 HydrophobicContact CB-CG1 3.72Å
33	I	93.9	Very high	74.3	Confident	17 Å²	17	60.4 Å²	60.4	9%	0.087	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.6	176.4	-59.3	178.1	0	0	0	109.4	I35 V82 K83 M84 I85 K104 I191 I192	I33-I35 HydrophobicContact CG2-CG1 4.3Å; I33-V82 HydrophobicContact CD1-CG2 3.64Å; I33-V82 HydrophobicContact CG1-CG2 4.04Å; I33-K83 PolarHBondContact N-O 2.68Å; I33-M84 CarbonylContact O-C 3.59Å; I33-M84 VanDerWaalsContact O-CA 3.24Å; I33-M84 WeakPolarHBondContact O-CA 3.42Å; I33-I85 PolarHBondContact O-N 2.99Å; I33-K104 HydrophobicContact CG2-CB 4.34Å; I33-I191 HydrophobicContact CD1-CG2 4.22Å; I33-I191 HydrophobicContact CG2-CB 4.5Å; I33-I191 HydrophobicContact CG2-CD1 3.56Å; I33-I191 HydrophobicContact CG2-CG2 3.96Å; I33-I192 HydrophobicContact CD1-CD1 4.21Å; I33-I192 HydrophobicContact CD1-CG1 3.9Å
34	G	94	Very high	77.1	Confident	8 Å²	8	53.5 Å²	53.5	8%	0.082	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124	174.3	0	0	0	0	0	111.9	A32 C103 K104 G105	A32-G34 PolarHBondContact O-N 3.42Å; G34-C103 CarbonylContact O-C 3.57Å; G34-C103 VanDerWaalsContact O-CA 3.31Å; G34-C103 WeakPolarHBondContact O-CA 3.49Å; G34-C103 WeakPolarHBondContact O-CB 2.98Å; G34-K104 PolarHBondContact O-N 2.82Å; G34-G105 PolarHBondContact O-N 2.92Å
35	I	95.2	Very high	79.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.9	176.6	-64.4	176.9	0	0	0	109.8	I33 M84 I85 I86 Y87 G105 L107 L187 I191	I33-I35 HydrophobicContact CG2-CG1 4.3Å; I35-M84 HydrophobicContact CD1-CB 4.39Å; I35-M84 HydrophobicContact CD1-CG 4.14Å; I35-M84 HydrophobicContact CD1-SD 3.4Å; I35-M84 WeakPolarHBondContact CD1-SD 3.4Å; I35-I85 PolarHBondContact N-O 2.91Å; I35-I86 CarbonylContact O-C 3.4Å; I35-I86 WeakPolarHBondContact O-CA 3.38Å; I35-Y87 PolarHBondContact O-N 3.16Å; I35-G105 WeakPolarHBondContact CA-O 3.42Å; I35-L107 HydrophobicContact CG2-CG 4.31Å; I35-L187 HydrophobicContact CD1-CD2 4.04Å; I35-L187 HydrophobicContact CD1-CG 4.37Å; I35-L187 HydrophobicContact CG1-CD2 4.21Å; I35-L187 HydrophobicContact CG2-CD2 3.68Å; I35-I191 HydrophobicContact CG1-CD1 4.39Å
36	A	93.9	Very high	82.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	142.7	172.2	0	0	0	0	0	111.5	I38 L100 C103 G105 A106 L107 M132	A36-I38 HydrophobicContact CB-CD1 4.13Å; A36-I38 HydrophobicContact CB-CG1 4.16Å; A36-L100 HydrophobicContact CB-CD2 3.12Å; A36-C103 HydrophobicContact CB-CB 4.37Å; A36-G105 PolarHBondContact N-O 3.44Å; A36-A106 CarbonylContact O-C 3.6Å; A36-A106 WeakPolarHBondContact O-CA 3.26Å; A36-L107 PolarHBondContact O-N 3.11Å; A36-M132 HydrophobicContact CB-CE 4.27Å
37	I	94.7	Very high	85.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.4	167.1	-170	169.4	0	0	0	109.9	K45 L48 V49 Y87 D88 T89 L107 V109	I37-K45 HydrophobicContact CD1-CB 3.82Å; I37-K45 HydrophobicContact CD1-CG 4.17Å; I37-K45 HydrophobicContact CG1-CB 3.94Å; I37-K45 HydrophobicContact CG1-CD 4.09Å; I37-K45 HydrophobicContact CG1-CG 3.9Å; I37-K45 HydrophobicContact CG2-CB 4.19Å; I37-L48 HydrophobicContact CD1-CB 4.31Å; I37-L48 HydrophobicContact CD1-CD1 4.04Å; I37-V49 HydrophobicContact CD1-CG2 4.18Å; I37-V49 HydrophobicContact CG2-CG2 4.06Å; I37-Y87 WeakPolarHBondContact CG2-O 3.27Å; I37-Y87 PolarHBondContact N-O 3.43Å; I37-Y87 VanDerWaalsContact N-O 3.14Å; I37-D88 HydrophobicContact CG2-CB 4.22Å; I37-T89 WeakPolarHBondContact O-CB 3.25Å; I37-T89 WeakPolarHBondContact O-CG2 3.46Å; I37-T89 PolarHBondContact O-OG1 2.9Å; I37-L107 WeakPolarHBondContact CA-O 3.21Å; I37-L107 HydrophobicContact CB-CB 4.42Å; I37-L107 HydrophobicContact CG1-CB 4.12Å; I37-V109 HydrophobicContact CD1-CG2 3.91Å; I37-V109 HydrophobicContact CG1-CG2 3.54Å
38	I	92.6	Very high	88	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.5	-166.7	-59	172.6	0	0	0	108.7	A36 L100 L107 I108 V109 H124 V128 M132	A36-I38 HydrophobicContact CB-CD1 4.13Å; A36-I38 HydrophobicContact CB-CG1 4.16Å; I38-L100 HydrophobicContact CD1-CD1 3.91Å; I38-L100 HydrophobicContact CD1-CD2 3.87Å; I38-L100 HydrophobicContact CG1-CD2 4.38Å; I38-L107 PolarHBondContact N-O 3.07Å; I38-I108 CarbonylContact O-C 3.54Å; I38-I108 WeakPolarHBondContact O-CA 3.14Å; I38-V109 PolarHBondContact O-N 3.21Å; I38-H124 HydrophobicContact CG2-CB 3.81Å; I38-V128 HydrophobicContact CD1-CG2 3.38Å; I38-M132 HydrophobicContact CD1-SD 4.48Å
39	G	93.4	Very high	90.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.6	173.3	-178.7	0	0	0	0	0	111.6	K45 G91 V109	G39-K45 PolarHBondContact O-NZ 3.37Å; G39-G91 VanDerWaalsContact O-CA 3.3Å; G39-G91 WeakPolarHBondContact O-CA 3.42Å; G39-V109 WeakPolarHBondContact CA-O 3.4Å
40	D	91.7	Very high	92	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.134	18%	0.178	C	C	.	.			trans	-65.6	169	-176	-77.3	3.1	0	0	0	113.3	V43 K45 N120 H124	D40-V43 HydrophobicContact CB-CG1 3.79Å; D40-V43 VanDerWaalsContact O-CG2 3.26Å; D40-V43 WeakPolarHBondContact O-CG2 3.37Å; D40-K45 PolarHBondContact O-NZ 2.61Å; D40-N120 PolarHBondContact OD2-ND2 2.97Å; D40-H124 IonicContact OD1-CD2 2.72Å; D40-H124 IonicContact OD1-CE1 2.63Å; D40-H124 PolarHBondContact OD1-CE1 3.15Å; D40-H124 VanDerWaalsContact OD1-CE1 3.31Å; D40-H124 IonicContact OD1-NE2 3.88Å; D40-H124 PolarHBondContact OD1-NE2 2.98Å
41	Y	89.9	Confident	93.4	Very high	167 Å²	167	26.7 Å²	26.7	66%	0.655	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	141.6	170.3	-179.9	-92.7	0	0	0	110.8	V43 A63 G91	Y41-V43 PolarHBondContact O-N 3.11Å; Y41-A63 HydrophobicContact CE2-CB 3.91Å; Y41-G91 PolarHBondContact N-O 3.17Å
42	G	90.7	Very high	93.9	Very high	44 Å²	44	21.9 Å²	21.9	45%	0.454	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	-5	173.8	0	0	0	0	0	116.4	G44 K144	G42-G44 PolarHBondContact O-N 3.3Å; G42-K144 PolarHBondContact O-NZ 3.1Å
43	V	94.3	Very high	94.1	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.018	13%	0.127	C	C	.	.	S	Bend	trans	-70.5	-10.6	179.6	-53.8	0	0	0	0	113.9	D40 Y41 K45 V109 D111 T143	D40-V43 HydrophobicContact CB-CG1 3.79Å; D40-V43 VanDerWaalsContact O-CG2 3.26Å; D40-V43 WeakPolarHBondContact O-CG2 3.37Å; Y41-V43 PolarHBondContact O-N 3.11Å; V43-K45 HydrophobicContact CG2-CD 4.4Å; V43-K45 HydrophobicContact CG2-CG 3.71Å; V43-V109 HydrophobicContact CB-CG1 4.37Å; V43-V109 HydrophobicContact CG2-CB 4.12Å; V43-V109 HydrophobicContact CG2-CG1 3.84Å; V43-D111 HydrophobicContact CB-CB 4.25Å; V43-D111 HydrophobicContact CG1-CB 4.26Å; V43-T143 VanDerWaalsContact O-CB 3.31Å; V43-T143 WeakPolarHBondContact O-CB 3.18Å; V43-T143 PolarHBondContact O-OG1 3.33Å
44	G	94	Very high	94	Very high	18 Å²	18	28 Å²	28	19%	0.186	15%	0.146	C	C	.	.	S	Bend	trans	100.9	16.1	174	0	0	0	0	0	116.5	G42 T46 A47 L48	G42-G44 PolarHBondContact O-N 3.3Å; G44-T46 PolarHBondContact O-N 2.88Å; G44-A47 WeakPolarHBondContact O-CB 2.94Å; G44-A47 PolarHBondContact O-N 3.06Å; G44-A47 VanDerWaalsContact O-N 3.13Å; G44-L48 PolarHBondContact O-N 3.43Å
45	K	94.5	Very high	93.9	Very high	9 Å²	9	29.9 Å²	29.9	4%	0.039	17%	0.165	C	C	.	.	H	α-helix	trans	-50	-58.9	176.9	-57.8	-170.3	-63.7	-74.1	0	113.3	I37 G39 D40 V43 A47 L48 V49 T89 G91 V109	I37-K45 HydrophobicContact CD1-CB 3.82Å; I37-K45 HydrophobicContact CD1-CG 4.17Å; I37-K45 HydrophobicContact CG1-CB 3.94Å; I37-K45 HydrophobicContact CG1-CD 4.09Å; I37-K45 HydrophobicContact CG1-CG 3.9Å; I37-K45 HydrophobicContact CG2-CB 4.19Å; G39-K45 PolarHBondContact O-NZ 3.37Å; D40-K45 PolarHBondContact O-NZ 2.61Å; V43-K45 HydrophobicContact CG2-CD 4.4Å; V43-K45 HydrophobicContact CG2-CG 3.71Å; K45-A47 VanDerWaalsContact C-N 3.26Å; K45-A47 PolarHBondContact O-N 3.45Å; K45-L48 WeakPolarHBondContact O-CB 3.31Å; K45-L48 PolarHBondContact O-N 3.23Å; K45-L48 VanDerWaalsContact O-N 3.1Å; K45-V49 WeakPolarHBondContact O-CG2 3.3Å; K45-V49 PolarHBondContact O-N 3.49Å; K45-T89 WeakPolarHBondContact CE-O 3.44Å; K45-G91 VanDerWaalsContact NZ-CA 3.25Å; K45-V109 HydrophobicContact CG-CB 4.33Å; K45-V109 HydrophobicContact CG-CG2 4.47Å
46	T	93.7	Very high	93.7	Very high	32 Å²	32	36 Å²	36	20%	0.196	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-33.6	178.1	-51.1	0	0	0	0	112.9	G44 H50 L58 T64 D88	G44-T46 PolarHBondContact O-N 2.88Å; T46-H50 WeakPolarHBondContact O-CB 3.37Å; T46-H50 PolarHBondContact O-N 2.94Å; T46-L58 HydrophobicContact CG2-CD2 4.15Å; T46-T64 PolarHBondContact OG1-OG1 2.86Å; T46-D88 WeakPolarHBondContact CA-OD2 3.39Å; T46-D88 WeakPolarHBondContact CB-OD2 3.44Å; T46-D88 WeakPolarHBondContact CG2-OD2 3.45Å; T46-D88 PolarHBondContact OG1-OD1 3.33Å; T46-D88 PolarHBondContact OG1-OD2 2.99Å
47	A	95.3	Very high	93.5	Very high	6 Å²	6	39.4 Å²	39.4	5%	0.05	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-38.6	176.7	0	0	0	0	0	111.7	G44 K45 R51 F57 A174	G44-A47 WeakPolarHBondContact O-CB 2.94Å; G44-A47 PolarHBondContact O-N 3.06Å; G44-A47 VanDerWaalsContact O-N 3.13Å; K45-A47 VanDerWaalsContact C-N 3.26Å; K45-A47 PolarHBondContact O-N 3.45Å; A47-R51 WeakPolarHBondContact O-CB 3.43Å; A47-R51 PolarHBondContact O-N 3.39Å; A47-F57 HydrophobicContact CB-CE2 4.36Å; A47-A174 HydrophobicContact CB-CB 3.84Å; A47-A174 WeakPolarHBondContact O-CB 3.45Å
48	L	96.2	Very high	92.9	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-49.8	173.2	-74	172.6	0	0	0	111.5	I37 G44 K45 H50 R51 L52 V109 L141 T143 V172 A174 V180	I37-L48 HydrophobicContact CD1-CB 4.31Å; I37-L48 HydrophobicContact CD1-CD1 4.04Å; G44-L48 PolarHBondContact O-N 3.43Å; K45-L48 WeakPolarHBondContact O-CB 3.31Å; K45-L48 PolarHBondContact O-N 3.23Å; K45-L48 VanDerWaalsContact O-N 3.1Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.37Å; L48-R51 PolarHBondContact O-N 2.83Å; L48-L52 PolarHBondContact O-N 3.05Å; L48-V109 HydrophobicContact CD1-CG1 4.32Å; L48-L141 HydrophobicContact CD1-CD1 4.36Å; L48-T143 HydrophobicContact CD1-CG2 3.57Å; L48-T143 HydrophobicContact CG-CG2 4.19Å; L48-V172 HydrophobicContact CD1-CG2 4.05Å; L48-V172 HydrophobicContact CD2-CB 4.1Å; L48-V172 HydrophobicContact CD2-CG2 3.68Å; L48-V172 HydrophobicContact CG-CG2 4.47Å; L48-A174 HydrophobicContact CD2-CB 4.11Å; L48-A174 HydrophobicContact CG-CB 4.47Å; L48-V180 HydrophobicContact CD2-CG2 3.98Å
49	V	95.5	Very high	92.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-43.6	179.5	-179.2	0	0	0	0	110.7	I37 K45 R51 L52 C53 H70 I86 D88	I37-V49 HydrophobicContact CD1-CG2 4.18Å; I37-V49 HydrophobicContact CG2-CG2 4.06Å; K45-V49 WeakPolarHBondContact O-CG2 3.3Å; K45-V49 PolarHBondContact O-N 3.49Å; V49-R51 PolarHBondContact O-N 2.97Å; V49-L52 PolarHBondContact O-N 3.28Å; V49-C53 WeakPolarHBondContact O-CB 3.39Å; V49-C53 PolarHBondContact O-N 3.43Å; V49-C53 PolarHBondContact O-SG 2.77Å; V49-C53 VanDerWaalsContact O-SG 3.32Å; V49-H70 HydrophobicContact CG1-CB 3.98Å; V49-H70 VanDerWaalsContact CG1-CD2 3.49Å; V49-H70 WeakPolarHBondContact CG1-CD2 3.43Å; V49-I86 HydrophobicContact CG1-CG2 4.13Å; V49-I86 HydrophobicContact CG2-CG2 3.71Å; V49-D88 HydrophobicContact CG2-CB 4.24Å
50	H	94.5	Very high	91.5	Very high	52 Å²	52	54.9 Å²	54.9	24%	0.241	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-44.6	175.3	-174.8	-82.9	0	0	0	111.8	T46 L48 C53 R54 Q56 L58	T46-H50 WeakPolarHBondContact O-CB 3.37Å; T46-H50 PolarHBondContact O-N 2.94Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.37Å; H50-C53 PolarHBondContact O-N 2.91Å; H50-R54 VanDerWaalsContact O-CB 3.26Å; H50-R54 WeakPolarHBondContact O-CB 3.46Å; H50-R54 PolarHBondContact O-N 3.28Å; H50-Q56 PolarHBondContact CE1-O 3.26Å; H50-Q56 PolarHBondContact ND1-O 3.12Å; H50-L58 HydrophobicContact CB-CB 4.37Å
51	R	96.6	Very high	90.6	Very high	29 Å²	29	60.4 Å²	60.4	11%	0.109	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-48.9	177.4	174.6	58	70.3	159.6	22	111	A47 L48 V49 C53 R54 G55 Q56 F57 A174 R175 D177 V180	A47-R51 WeakPolarHBondContact O-CB 3.43Å; A47-R51 PolarHBondContact O-N 3.39Å; L48-R51 PolarHBondContact O-N 2.83Å; V49-R51 PolarHBondContact O-N 2.97Å; R51-C53 PolarHBondContact O-N 3.49Å; R51-R54 PolarHBondContact O-N 2.72Å; R51-G55 VanDerWaalsContact NH1-C 3.3Å; R51-G55 PolarHBondContact NH1-O 3.34Å; R51-G55 VanDerWaalsContact O-CA 3.24Å; R51-G55 WeakPolarHBondContact O-CA 3.28Å; R51-G55 PolarHBondContact O-N 2.82Å; R51-Q56 VanDerWaalsContact CZ-C 3.46Å; R51-F57 VanDerWaalsContact CZ-N 3.26Å; R51-A174 HydrophobicContact CB-CB 4.3Å; R51-A174 VanDerWaalsContact CZ-O 3.3Å; R51-A174 PolarHBondContact NE-O 3.02Å; R51-A174 PolarHBondContact NH2-O 2.87Å; R51-R175 PolarHBondContact NH2-O 3Å; R51-D177 VanDerWaalsContact CD-OD1 3.23Å; R51-D177 WeakPolarHBondContact CD-OD1 3.24Å; R51-D177 HydrophobicContact CG-CB 4.5Å; R51-D177 WeakPolarHBondContact CG-OD1 3.47Å; R51-V180 HydrophobicContact CB-CG1 4.25Å; R51-V180 HydrophobicContact CG-CB 4.2Å; R51-V180 HydrophobicContact CG-CG1 3.94Å; R51-V180 HydrophobicContact CG-CG2 3.97Å
52	L	96.4	Very high	90	Very high	29 Å²	29	61 Å²	61	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-58.4	-47.2	177.6	-177.9	75.7	0	0	0	111.8	L48 V49 V72 V74 M84 I86 V180 F184	L48-L52 PolarHBondContact O-N 3.05Å; V49-L52 PolarHBondContact O-N 3.28Å; L52-V72 HydrophobicContact CD2-CG1 3.95Å; L52-V72 HydrophobicContact CD2-CG2 4.37Å; L52-V72 HydrophobicContact CG-CG2 4.39Å; L52-V74 HydrophobicContact CD1-CG1 4.27Å; L52-M84 HydrophobicContact CD2-CE 4.45Å; L52-I86 HydrophobicContact CD2-CD1 3.36Å; L52-V180 HydrophobicContact CB-CG1 4.13Å; L52-F184 HydrophobicContact CB-CD2 4.3Å; L52-F184 HydrophobicContact CB-CE2 4.09Å; L52-F184 HydrophobicContact CD1-CB 4.31Å; L52-F184 HydrophobicContact CD1-CD2 3.81Å; L52-F184 HydrophobicContact CD1-CE2 4.45Å; L52-F184 HydrophobicContact CD1-CG 4.21Å; L52-F184 HydrophobicContact CD2-CB 4.22Å; L52-F184 HydrophobicContact CD2-CD1 3.77Å; L52-F184 HydrophobicContact CD2-CD2 3.58Å; L52-F184 HydrophobicContact CD2-CE1 3.95Å; L52-F184 HydrophobicContact CD2-CE2 3.79Å; L52-F184 HydrophobicContact CD2-CG 3.59Å; L52-F184 HydrophobicContact CD2-CZ 3.97Å; L52-F184 HydrophobicContact CG-CD2 4.09Å; L52-F184 HydrophobicContact CG-CE2 4.33Å; L52-F184 HydrophobicContact CG-CG 4.46Å
53	C	94.3	Very high	89.6	Confident	39 Å²	39	61.8 Å²	61.8	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-76.5	-27.7	-174.5	-66.4	0	0	0	0	114	V49 H50 R51	V49-C53 WeakPolarHBondContact O-CB 3.39Å; V49-C53 PolarHBondContact O-N 3.43Å; V49-C53 PolarHBondContact O-SG 2.77Å; V49-C53 VanDerWaalsContact O-SG 3.32Å; H50-C53 PolarHBondContact O-N 2.91Å; R51-C53 PolarHBondContact O-N 3.49Å
54	R	92.7	Very high	88.6	Confident	125 Å²	125	62.9 Å²	62.9	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-120.4	-11.8	-170.2	-56.2	-59.7	-175.7	-177.4	-0.8	114.9	S20 H50 R51 Q56	S20-R54 PolarHBondContact OG-NH1 3.44Å; S20-R54 PolarHBondContact OG-NH2 2.64Å; H50-R54 VanDerWaalsContact O-CB 3.26Å; H50-R54 WeakPolarHBondContact O-CB 3.46Å; H50-R54 PolarHBondContact O-N 3.28Å; R51-R54 PolarHBondContact O-N 2.72Å; R54-Q56 HydrophobicContact CB-CB 4.41Å; R54-Q56 PolarHBondContact O-N 3.43Å
55	G	92.8	Very high	87.7	Confident	47 Å²	47	68.7 Å²	68.7	49%	0.485	35%	0.347	S	S	.	.	S	Bend	trans	63.1	16.8	-171.7	0	0	0	0	0	113.6	R51	R51-G55 VanDerWaalsContact NH1-C 3.3Å; R51-G55 PolarHBondContact NH1-O 3.34Å; R51-G55 VanDerWaalsContact O-CA 3.24Å; R51-G55 WeakPolarHBondContact O-CA 3.28Å; R51-G55 PolarHBondContact O-N 2.82Å
56	Q	91	Very high	86.8	Confident	129 Å²	129	69.8 Å²	69.8	60%	0.603	36%	0.361	S	S	*	.	S	Bend	trans	-129.2	144.1	-175	-67.5	178.8	11.6	0	0	111.8	H50 R51 R54	H50-Q56 PolarHBondContact CE1-O 3.26Å; H50-Q56 PolarHBondContact ND1-O 3.12Å; R51-Q56 VanDerWaalsContact CZ-C 3.46Å; R54-Q56 HydrophobicContact CB-CB 4.41Å; R54-Q56 PolarHBondContact O-N 3.43Å
57	F	87.8	Confident	86.3	Confident	72 Å²	72	70.6 Å²	70.6	32%	0.316	37%	0.366	S	S	.	.			trans	-74.3	134.9	173.5	-172.6	-126.1	0	0	0	110.6	A47 R51 T59 A174 R175	A47-F57 HydrophobicContact CB-CE2 4.36Å; R51-F57 VanDerWaalsContact CZ-N 3.26Å; F57-T59 HydrophobicContact CD1-CG2 4.45Å; F57-T59 PolarHBondContact O-N 2.92Å; F57-A174 HydrophobicContact CD2-CB 4.13Å; F57-A174 VanDerWaalsContact CD2-O 3.32Å; F57-A174 WeakPolarHBondContact CD2-O 3.39Å; F57-A174 HydrophobicContact CE2-CB 4.09Å; F57-R175 HydrophobicContact CD1-CG 4.29Å; F57-R175 VanDerWaalsContact CD2-CA 3.47Å; F57-R175 HydrophobicContact CD2-CB 4.09Å; F57-R175 HydrophobicContact CE1-CB 4.49Å; F57-R175 HydrophobicContact CE1-CG 4.24Å; F57-R175 HydrophobicContact CE2-CB 3.92Å; F57-R175 HydrophobicContact CG-CB 4.44Å; F57-R175 HydrophobicContact CG-CG 4.45Å; F57-R175 HydrophobicContact CZ-CB 4.14Å; F57-R175 HydrophobicContact CZ-CG 4.36Å
58	L	83.8	Confident	85.9	Confident	40 Å²	40	73.6 Å²	73.6	21%	0.209	38%	0.379	C	S	.	.			trans	-77.2	103.3	174.9	-174.6	66.6	0	0	0	109.9	T46 H50	T46-L58 HydrophobicContact CG2-CD2 4.15Å; H50-L58 HydrophobicContact CB-CB 4.37Å
59	T	78.4	Confident	85.5	Confident	120 Å²	120	79.2 Å²	79.2	74%	0.736	40%	0.4	S	S	*	.			trans	-79.5	-24.6	-178	54.2	0	0	0	0	113.9	F57	F57-T59 HydrophobicContact CD1-CG2 4.45Å; F57-T59 PolarHBondContact O-N 2.92Å
60	K	77.6	Confident	85.4	Confident	164 Å²	164	81.4 Å²	81.4	71%	0.713	41%	0.41	S	S	*	.	S	Bend	trans	-108.1	108.6	178.3	-67.7	-175.3	-179.2	-179.7	0	109.8	K62	K60-K62 PolarHBondContact O-N 3.41Å
61	H	73.1	Confident	85.3	Confident	141 Å²	141	81.8 Å²	81.8	65%	0.653	41%	0.414	S	S	*	.			trans	-77.2	118.1	173.1	-66.2	-65.5	0	0	0	110.1
62	K	77	Confident	85.2	Confident	180 Å²	180	81.4 Å²	81.4	78%	0.783	42%	0.415	S	S	*	.			trans	-115.8	141.1	163.5	-69.4	-172	176.3	-173	0	107.8	K60 T64	K60-K62 PolarHBondContact O-N 3.41Å; K62-T64 PolarHBondContact O-N 3.07Å
63	A	81.4	Confident	85.1	Confident	60 Å²	60	82.8 Å²	82.8	50%	0.496	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-59.9	128.2	174.5	0	0	0	0	0	109.8	Y41 K65	Y41-A63 HydrophobicContact CE2-CB 3.91Å; A63-K65 PolarHBondContact O-N 3.32Å
64	T	73.8	Confident	85.1	Confident	26 Å²	26	81.3 Å²	81.3	16%	0.16	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-64.9	116.7	175.7	-43.9	0	0	0	0	108.6	T46 K62 Q68 A90	T46-T64 PolarHBondContact OG1-OG1 2.86Å; K62-T64 PolarHBondContact O-N 3.07Å; T64-Q68 HydrophobicContact CG2-CG 4.06Å; T64-A90 VanDerWaalsContact O-CB 3.31Å; T64-A90 WeakPolarHBondContact O-CB 3.45Å
65	K	75	Confident	85.2	Confident	140 Å²	140	82.1 Å²	82.1	61%	0.609	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-83	121.4	173.1	-66.4	-173.7	176.6	-174.7	0	108.3	T13 A63	T13-K65 PolarHBondContact O-NZ 3.01Å; A63-K65 PolarHBondContact O-N 3.32Å
66	G	76.2	Confident	85.4	Confident	32 Å²	32	80.4 Å²	80.4	33%	0.33	40%	0.399	S	S	.	.	S	Bend	trans	61.4	-134.3	177.3	0	0	0	0	0	113.1	A90	G66-A90 VanDerWaalsContact O-CB 3.29Å; G66-A90 WeakPolarHBondContact O-CB 3.26Å; G66-A90 PolarHBondContact O-N 2.94Å
67	V	82.6	Confident	85.6	Confident	50 Å²	50	79 Å²	79	30%	0.303	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.3	-177	-178	0	0	0	0	108.3	Y87 D88 Y99	V67-Y87 HydrophobicContact CG1-CD1 4.22Å; V67-D88 CarbonylContact C-O 3.57Å; V67-D88 VanDerWaalsContact CA-O 3.29Å; V67-D88 WeakPolarHBondContact CA-O 3.41Å; V67-Y99 HydrophobicContact CB-CD1 4.48Å; V67-Y99 HydrophobicContact CB-CE1 4.09Å; V67-Y99 HydrophobicContact CG1-CD1 4.18Å; V67-Y99 HydrophobicContact CG1-CD2 4.09Å; V67-Y99 HydrophobicContact CG1-CE1 3.91Å; V67-Y99 HydrophobicContact CG1-CE2 3.72Å; V67-Y99 HydrophobicContact CG1-CG 4.3Å; V67-Y99 HydrophobicContact CG2-CD1 3.98Å; V67-Y99 HydrophobicContact CG2-CE1 3.22Å; V67-Y99 HydrophobicContact CG2-CE2 4.36Å; V67-Y99 VanDerWaalsContact CG2-CZ 3.42Å; V67-Y99 WeakPolarHBondContact CG2-OH 3.11Å
68	Q	87.4	Confident	85.9	Confident	68 Å²	68	80.4 Å²	80.4	32%	0.318	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.4	177.3	-59.6	-171.4	3.7	0	0	109.9	T64 Y87 D88	T64-Q68 HydrophobicContact CG2-CG 4.06Å; Q68-Y87 CarbonylContact O-C 3.51Å; Q68-D88 HydrophobicContact CB-CB 4.29Å; Q68-D88 PolarHBondContact N-O 2.94Å; Q68-D88 PolarHBondContact O-N 2.86Å
69	R	88.4	Confident	86.4	Confident	120 Å²	120	79.9 Å²	79.9	45%	0.453	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129	178.4	-69.3	174.9	67.2	-149	-2.9	109.5	E29 I85 I86 Y87	E29-R69 IonicContact OE1-NH2 2.73Å; E29-R69 PolarHBondContact OE1-NH2 2.86Å; E29-R69 IonicContact OE2-CZ 3.76Å; E29-R69 IonicContact OE2-NH1 2.73Å; E29-R69 IonicContact OE2-NH2 2.86Å; E29-R69 PolarHBondContact OE2-NH2 3.42Å; R69-I85 HydrophobicContact CB-CG2 4.48Å; R69-I86 WeakPolarHBondContact CA-O 3.37Å; R69-Y87 HydrophobicContact CG-CD1 3.72Å; R69-Y87 HydrophobicContact CG-CE1 3.73Å
70	H	91.8	Very high	87.2	Confident	46 Å²	46	79.7 Å²	79.7	21%	0.213	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120	177.9	-60.1	-95.1	0	0	0	109.9	V49 I85 I86	V49-H70 HydrophobicContact CG1-CB 3.98Å; V49-H70 VanDerWaalsContact CG1-CD2 3.49Å; V49-H70 WeakPolarHBondContact CG1-CD2 3.43Å; H70-I85 WeakPolarHBondContact O-CA 3.41Å; H70-I86 HydrophobicContact CB-CB 4.38Å; H70-I86 PolarHBondContact N-O 3.23Å; H70-I86 PolarHBondContact O-N 3.22Å
71	L	92.6	Very high	88	Confident	61 Å²	61	80.2 Å²	80.2	32%	0.319	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122.8	171.9	-176.8	63.8	0	0	0	109	L24 A32 K83 M84 I85	L24-L71 HydrophobicContact CB-CD2 4.16Å; L24-L71 HydrophobicContact CD1-CD2 3.54Å; L24-L71 HydrophobicContact CD1-CG 4.49Å; L24-L71 HydrophobicContact CG-CD2 4.46Å; A32-L71 HydrophobicContact CB-CD1 4.06Å; L71-K83 HydrophobicContact CD1-CB 4.37Å; L71-M84 WeakPolarHBondContact CA-O 3.38Å; L71-I85 HydrophobicContact CD1-CG1 3.83Å
72	V	94.5	Very high	89	Confident	21 Å²	21	74.3 Å²	74.3	13%	0.127	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.5	179.8	65.3	0	0	0	0	110	L52 V74 K83 M84 I86	L52-V72 HydrophobicContact CD2-CG1 3.95Å; L52-V72 HydrophobicContact CD2-CG2 4.37Å; L52-V72 HydrophobicContact CG-CG2 4.39Å; V72-V74 HydrophobicContact CG2-CG1 4.42Å; V72-K83 CarbonylContact O-C 3.56Å; V72-K83 WeakPolarHBondContact O-CA 3.42Å; V72-M84 HydrophobicContact CG1-CB 4.07Å; V72-M84 HydrophobicContact CG1-CE 3.69Å; V72-M84 PolarHBondContact N-O 2.98Å; V72-M84 PolarHBondContact O-N 2.7Å; V72-I86 HydrophobicContact CG1-CD1 3.6Å; V72-I86 HydrophobicContact CG1-CG1 4.26Å
73	S	94.2	Very high	89.9	Confident	58 Å²	58	69.4 Å²	69.4	41%	0.406	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.7	168.8	-179.2	0	0	0	0	109.7	V82	S73-V82 CarbonylContact C-O 3.5Å; S73-V82 WeakPolarHBondContact CA-O 3.33Å; S73-V82 PolarHBondContact OG-O 2.96Å
74	V	94.6	Very high	90.5	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	152.6	176.1	-63.9	0	0	0	0	110.1	L52 V72 R81 V82 M84 V185	L52-V74 HydrophobicContact CD1-CG1 4.27Å; V72-V74 HydrophobicContact CG2-CG1 4.42Å; V74-R81 WeakPolarHBondContact O-CA 3.28Å; V74-V82 HydrophobicContact CG2-CG1 3.61Å; V74-V82 PolarHBondContact N-O 3.35Å; V74-V82 PolarHBondContact O-N 3Å; V74-M84 HydrophobicContact CB-CE 4.03Å; V74-M84 HydrophobicContact CG1-CE 3.37Å; V74-M84 HydrophobicContact CG2-CE 3.45Å; V74-M84 VanDerWaalsContact CG2-CE 3.45Å; V74-M84 HydrophobicContact CG2-SD 3.88Å; V74-V185 HydrophobicContact CB-CG2 4.24Å; V74-V185 HydrophobicContact CG2-CG2 4.33Å
75	R	96.2	Very high	91.5	Very high	142 Å²	142	65.8 Å²	65.8	54%	0.536	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.9	173	-168.2	176.4	-169.5	176.4	-5.1	108.6	G79 E80 R81	R75-G79 PolarHBondContact NE-O 3.45Å; R75-E80 CarbonylContact C-O 3.56Å; R75-E80 WeakPolarHBondContact CA-O 3.3Å; R75-R81 HydrophobicContact CB-CG 4.46Å; R75-R81 HydrophobicContact CG-CG 4.48Å
76	L	96.3	Very high	92.4	Very high	11 Å²	11	59.1 Å²	59.1	6%	0.058	30%	0.302	C	S	.	.			trans	-74.8	167.1	176.7	-55.3	-177.2	0	0	0	110.6	N78 G79 E80 V82 V185 A188 E189 I192	L76-N78 VanDerWaalsContact C-N 3.27Å; L76-N78 WeakPolarHBondContact CB-OD1 3.44Å; L76-N78 PolarHBondContact O-N 2.96Å; L76-G79 PolarHBondContact O-N 3.04Å; L76-E80 HydrophobicContact CD1-CB 4.41Å; L76-E80 PolarHBondContact N-O 3.37Å; L76-V82 HydrophobicContact CD2-CG1 3.73Å; L76-V82 HydrophobicContact CG-CG1 4.26Å; L76-V185 HydrophobicContact CD2-CG1 4.4Å; L76-A188 HydrophobicContact CD2-CB 4.06Å; L76-E189 HydrophobicContact CB-CG 4.43Å; L76-E189 HydrophobicContact CD2-CG 3.97Å; L76-I192 HydrophobicContact CD1-CD1 3.47Å; L76-I192 VanDerWaalsContact CD1-CD1 3.47Å
77	S	95.5	Very high	93.1	Very high	101 Å²	101	58.4 Å²	58.4	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-34.5	178.1	62.7	0	0	0	0	112.9	G79 E189	S77-G79 PolarHBondContact O-N 3.42Å; S77-E189 WeakPolarHBondContact CA-OE1 3.42Å; S77-E189 WeakPolarHBondContact CB-OE1 3.31Å; S77-E189 PolarHBondContact N-OE1 3.37Å; S77-E189 PolarHBondContact OG-OE1 3.5Å
78	N	94.1	Very high	93.5	Very high	101 Å²	101	56 Å²	56	54%	0.54	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-2.7	174.7	72.5	0.4	0	0	0	113.7	L76 E80	L76-N78 VanDerWaalsContact C-N 3.27Å; L76-N78 WeakPolarHBondContact CB-OD1 3.44Å; L76-N78 PolarHBondContact O-N 2.96Å; N78-E80 VanDerWaalsContact ND2-CD 3.33Å; N78-E80 PolarHBondContact ND2-OE2 3.41Å; N78-E80 VanDerWaalsContact OD1-CB 3.24Å; N78-E80 WeakPolarHBondContact OD1-CB 3.45Å; N78-E80 WeakPolarHBondContact OD1-CG 3.45Å; N78-E80 PolarHBondContact OD1-N 3.28Å
79	G	94.5	Very high	93.3	Very high	28 Å²	28	52.8 Å²	52.8	29%	0.289	26%	0.26	S	S	.	.	S	Bend	trans	90.2	-9.7	178.7	0	0	0	0	0	115.2	R75 L76 S77	R75-G79 PolarHBondContact NE-O 3.45Å; L76-G79 PolarHBondContact O-N 3.04Å; S77-G79 PolarHBondContact O-N 3.42Å
80	E	94.3	Very high	92.7	Very high	117 Å²	117	47.5 Å²	47.5	55%	0.547	24%	0.241	S	C	.	.			trans	-68.2	159.4	175.4	-63.1	179.4	146	0	0	111.4	R75 L76 N78	R75-E80 CarbonylContact C-O 3.56Å; R75-E80 WeakPolarHBondContact CA-O 3.3Å; L76-E80 HydrophobicContact CD1-CB 4.41Å; L76-E80 PolarHBondContact N-O 3.37Å; N78-E80 VanDerWaalsContact ND2-CD 3.33Å; N78-E80 PolarHBondContact ND2-OE2 3.41Å; N78-E80 VanDerWaalsContact OD1-CB 3.24Å; N78-E80 WeakPolarHBondContact OD1-CB 3.45Å; N78-E80 WeakPolarHBondContact OD1-CG 3.45Å; N78-E80 PolarHBondContact OD1-N 3.28Å
81	R	94.3	Very high	91.1	Very high	174 Å²	174	46 Å²	46	66%	0.657	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113	129.9	175.1	-70.9	-176	-176.6	-93.7	2.9	110	V74 R75	V74-R81 WeakPolarHBondContact O-CA 3.28Å; R75-R81 HydrophobicContact CB-CG 4.46Å; R75-R81 HydrophobicContact CG-CG 4.48Å
82	V	94.4	Very high	89.5	Confident	18 Å²	18	46.1 Å²	46.1	11%	0.109	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149.2	173.3	72.2	0	0	0	0	110	I33 S73 V74 L76 M84 A188 I192	I33-V82 HydrophobicContact CD1-CG2 3.64Å; I33-V82 HydrophobicContact CG1-CG2 4.04Å; S73-V82 CarbonylContact C-O 3.5Å; S73-V82 WeakPolarHBondContact CA-O 3.33Å; S73-V82 PolarHBondContact OG-O 2.96Å; V74-V82 HydrophobicContact CG2-CG1 3.61Å; V74-V82 PolarHBondContact N-O 3.35Å; V74-V82 PolarHBondContact O-N 3Å; L76-V82 HydrophobicContact CD2-CG1 3.73Å; L76-V82 HydrophobicContact CG-CG1 4.26Å; V82-M84 HydrophobicContact CG1-CG 4.26Å; V82-A188 HydrophobicContact CG1-CB 4.17Å; V82-I192 HydrophobicContact CG2-CD1 4.41Å
83	K	95.5	Very high	87.6	Confident	76 Å²	76	51.1 Å²	51.1	33%	0.33	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.8	170.3	-67.5	175.7	-176.4	168.4	0	108.8	A32 I33 L71 V72	A32-K83 CarbonylContact C-O 3.59Å; A32-K83 VanDerWaalsContact CA-O 3.29Å; A32-K83 WeakPolarHBondContact CA-O 3.27Å; A32-K83 HydrophobicContact CB-CB 3.86Å; I33-K83 PolarHBondContact N-O 2.68Å; L71-K83 HydrophobicContact CD1-CB 4.37Å; V72-K83 CarbonylContact O-C 3.56Å; V72-K83 WeakPolarHBondContact O-CA 3.42Å
84	M	94.9	Very high	85.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.5	177.2	-58.6	-179.4	-57.1	0	0	110.1	I33 I35 L52 L71 V72 V74 V82 F184 A188	I33-M84 CarbonylContact O-C 3.59Å; I33-M84 VanDerWaalsContact O-CA 3.24Å; I33-M84 WeakPolarHBondContact O-CA 3.42Å; I35-M84 HydrophobicContact CD1-CB 4.39Å; I35-M84 HydrophobicContact CD1-CG 4.14Å; I35-M84 HydrophobicContact CD1-SD 3.4Å; I35-M84 WeakPolarHBondContact CD1-SD 3.4Å; L52-M84 HydrophobicContact CD2-CE 4.45Å; L71-M84 WeakPolarHBondContact CA-O 3.38Å; V72-M84 HydrophobicContact CG1-CB 4.07Å; V72-M84 HydrophobicContact CG1-CE 3.69Å; V72-M84 PolarHBondContact N-O 2.98Å; V72-M84 PolarHBondContact O-N 2.7Å; V74-M84 HydrophobicContact CB-CE 4.03Å; V74-M84 HydrophobicContact CG1-CE 3.37Å; V74-M84 HydrophobicContact CG2-CE 3.45Å; V74-M84 VanDerWaalsContact CG2-CE 3.45Å; V74-M84 HydrophobicContact CG2-SD 3.88Å; V82-M84 HydrophobicContact CG1-CG 4.26Å; M84-F184 HydrophobicContact CE-CB 4.04Å; M84-F184 HydrophobicContact CE-CD1 4.41Å; M84-A188 HydrophobicContact SD-CB 3.93Å
85	I	93.7	Very high	83.6	Confident	10 Å²	10	60 Å²	60	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	109.2	166.9	-62.2	167.3	0	0	0	106.9	E29 A32 I33 I35 R69 H70 L71 Y87	E29-I85 HydrophobicContact CB-CD1 4.12Å; E29-I85 HydrophobicContact CG-CD1 4.28Å; A32-I85 HydrophobicContact CB-CD1 3.86Å; A32-I85 HydrophobicContact CB-CG1 3.72Å; I33-I85 PolarHBondContact O-N 2.99Å; I35-I85 PolarHBondContact N-O 2.91Å; R69-I85 HydrophobicContact CB-CG2 4.48Å; H70-I85 WeakPolarHBondContact O-CA 3.41Å; L71-I85 HydrophobicContact CD1-CG1 3.83Å; I85-Y87 HydrophobicContact CB-CE2 4.18Å; I85-Y87 HydrophobicContact CG2-CD2 4.15Å; I85-Y87 HydrophobicContact CG2-CE1 4.39Å; I85-Y87 HydrophobicContact CG2-CE2 3.59Å
86	I	93.7	Very high	81.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.1	177.8	-57.7	166.1	0	0	0	108.8	I35 V49 L52 R69 H70 V72 F184	I35-I86 CarbonylContact O-C 3.4Å; I35-I86 WeakPolarHBondContact O-CA 3.38Å; V49-I86 HydrophobicContact CG1-CG2 4.13Å; V49-I86 HydrophobicContact CG2-CG2 3.71Å; L52-I86 HydrophobicContact CD2-CD1 3.36Å; R69-I86 WeakPolarHBondContact CA-O 3.37Å; H70-I86 HydrophobicContact CB-CB 4.38Å; H70-I86 PolarHBondContact N-O 3.23Å; H70-I86 PolarHBondContact O-N 3.22Å; V72-I86 HydrophobicContact CG1-CD1 3.6Å; V72-I86 HydrophobicContact CG1-CG1 4.26Å; I86-F184 HydrophobicContact CD1-CD1 3.89Å; I86-F184 HydrophobicContact CD1-CE1 3.52Å; I86-F184 HydrophobicContact CD1-CZ 4.22Å; I86-F184 HydrophobicContact CG1-CD1 4.45Å; I86-F184 HydrophobicContact CG1-CE1 4.08Å; I86-F184 HydrophobicContact CG2-CE1 4.34Å
87	Y	92.2	Very high	80	Confident	17 Å²	17	54.4 Å²	54.4	7%	0.067	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	96.2	174.1	-63.5	-96.5	0	0	0	108.9	I35 I37 V67 Q68 R69 I85 T89 Y99 C103	I35-Y87 PolarHBondContact O-N 3.16Å; I37-Y87 WeakPolarHBondContact CG2-O 3.27Å; I37-Y87 PolarHBondContact N-O 3.43Å; I37-Y87 VanDerWaalsContact N-O 3.14Å; V67-Y87 HydrophobicContact CG1-CD1 4.22Å; Q68-Y87 CarbonylContact O-C 3.51Å; R69-Y87 HydrophobicContact CG-CD1 3.72Å; R69-Y87 HydrophobicContact CG-CE1 3.73Å; I85-Y87 HydrophobicContact CB-CE2 4.18Å; I85-Y87 HydrophobicContact CG2-CD2 4.15Å; I85-Y87 HydrophobicContact CG2-CE1 4.39Å; I85-Y87 HydrophobicContact CG2-CE2 3.59Å; Y87-T89 WeakPolarHBondContact O-CG2 3.49Å; Y87-Y99 AromaticContact CD1-CD2 3.43Å; Y87-Y99 HydrophobicContact CD1-CD2 3.43Å; Y87-Y99 VanDerWaalsContact CD1-CD2 3.43Å; Y87-Y99 HydrophobicContact CD1-CE2 4.25Å; Y87-Y99 AromaticContact CD1-CG 3.92Å; Y87-Y99 HydrophobicContact CD1-CG 3.92Å; Y87-Y99 HydrophobicContact CE1-CD2 4.21Å; Y87-Y99 HydrophobicContact CE1-CG 4.38Å; Y87-Y99 AromaticContact CG-CD2 3.65Å; Y87-Y99 HydrophobicContact CG-CD2 3.65Å; Y87-Y99 HydrophobicContact CG-CE2 4.21Å; Y87-C103 WeakPolarHBondContact CD2-SG 3.04Å; Y87-C103 WeakPolarHBondContact CE2-SG 3.16Å
88	D	90.2	Very high	78.5	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.2	173.4	-176.2	29	0	0	0	110.6	I37 T46 V49 V67 Q68	I37-D88 HydrophobicContact CG2-CB 4.22Å; T46-D88 WeakPolarHBondContact CA-OD2 3.39Å; T46-D88 WeakPolarHBondContact CB-OD2 3.44Å; T46-D88 WeakPolarHBondContact CG2-OD2 3.45Å; T46-D88 PolarHBondContact OG1-OD1 3.33Å; T46-D88 PolarHBondContact OG1-OD2 2.99Å; V49-D88 HydrophobicContact CG2-CB 4.24Å; V67-D88 CarbonylContact C-O 3.57Å; V67-D88 VanDerWaalsContact CA-O 3.29Å; V67-D88 WeakPolarHBondContact CA-O 3.41Å; Q68-D88 HydrophobicContact CB-CB 4.29Å; Q68-D88 PolarHBondContact N-O 2.94Å; Q68-D88 PolarHBondContact O-N 2.86Å
89	T	82.9	Confident	77.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.8	-170.5	72.7	0	0	0	0	110.4	I37 K45 Y87 G91 Y99	I37-T89 WeakPolarHBondContact O-CB 3.25Å; I37-T89 WeakPolarHBondContact O-CG2 3.46Å; I37-T89 PolarHBondContact O-OG1 2.9Å; K45-T89 WeakPolarHBondContact CE-O 3.44Å; Y87-T89 WeakPolarHBondContact O-CG2 3.49Å; T89-G91 PolarHBondContact O-N 3Å; T89-Y99 WeakPolarHBondContact CB-OH 3.5Å; T89-Y99 HydrophobicContact CG2-CE2 3.76Å; T89-Y99 WeakPolarHBondContact CG2-OH 3.37Å
90	A	75.8	Confident	76.7	Confident	9 Å²	9	53.2 Å²	53.2	7%	0.074	25%	0.252	C	S	.	.			trans	-57.4	133.1	160.6	0	0	0	0	0	108.4	T64 G66 C92 L95	T64-A90 VanDerWaalsContact O-CB 3.31Å; T64-A90 WeakPolarHBondContact O-CB 3.45Å; G66-A90 VanDerWaalsContact O-CB 3.29Å; G66-A90 WeakPolarHBondContact O-CB 3.26Å; G66-A90 PolarHBondContact O-N 2.94Å; A90-C92 PolarHBondContact O-N 3.43Å; A90-L95 HydrophobicContact CB-CD1 4.02Å
91	G	59.8	Low	76.1	Confident	14 Å²	14	53.7 Å²	53.7	14%	0.144	25%	0.249	C	C	.	.	S	Bend	trans	-68.7	23.4	177.5	0	0	0	0	0	114.8	G39 Y41 K45 T89	G39-G91 VanDerWaalsContact O-CA 3.3Å; G39-G91 WeakPolarHBondContact O-CA 3.42Å; Y41-G91 PolarHBondContact N-O 3.17Å; K45-G91 VanDerWaalsContact NZ-CA 3.25Å; T89-G91 PolarHBondContact O-N 3Å
92	C	57.5	Low	75.6	Confident	65 Å²	65	53 Å²	53	44%	0.439	25%	0.247	S	C	.	.			trans	-90.3	125.8	174.7	-176.7	0	0	0	0	109	A90 R94 L95	A90-C92 PolarHBondContact O-N 3.43Å; C92-R94 PolarHBondContact O-N 2.89Å; C92-L95 HydrophobicContact CB-CD1 4.39Å; C92-L95 PolarHBondContact O-N 3.01Å
93	K	55.9	Low	75.5	Confident	126 Å²	126	52.1 Å²	52.1	55%	0.548	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-19.2	-173.7	-65.4	-176.8	175.5	-176.3	0	115.2
94	R	52.7	Low	75.4	Confident	190 Å²	190	51.6 Å²	51.6	72%	0.717	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-6.3	-171.1	-60.6	-171.2	-174.7	-161.1	6.7	115.4	Y7 C92	Y7-R94 WeakPolarHBondContact OH-CD 3.04Å; Y7-R94 PolarHBondContact OH-NE 3.23Å; Y7-R94 PolarHBondContact OH-NH1 2.84Å; C92-R94 PolarHBondContact O-N 2.89Å
95	L	50.6	Low	75.5	Confident	61 Å²	61	51.6 Å²	51.6	32%	0.319	24%	0.239	S	C	.	.	S	Bend	trans	-104.4	15.5	-173.8	-65.9	174.1	0	0	0	113.6	A90 C92 Y99	A90-L95 HydrophobicContact CB-CD1 4.02Å; C92-L95 HydrophobicContact CB-CD1 4.39Å; C92-L95 PolarHBondContact O-N 3.01Å; L95-Y99 VanDerWaalsContact O-CE1 3.26Å; L95-Y99 WeakPolarHBondContact O-CE1 3.3Å; L95-Y99 PolarHBondContact O-OH 3.21Å
96	Q	58.5	Low	75.6	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.019	24%	0.236	C	C	.	.	S	Bend	trans	-88.5	-37	-172.8	-69.9	178.8	6.1	0	0	111.5	E98 L100 E127	Q96-E98 PolarHBondContact O-N 2.85Å; Q96-L100 HydrophobicContact CB-CD1 3.81Å; Q96-L100 WeakPolarHBondContact O-CD1 3.31Å; Q96-L100 WeakPolarHBondContact O-CG 3.37Å; Q96-E127 HydrophobicContact CB-CG 4.14Å
97	G	59.3	Low	75.8	Confident	31 Å²	31	51.1 Å²	51.1	32%	0.32	24%	0.236	S	C	.	.	H	α-helix	trans	-65.3	-35.4	-164.1	0	0	0	0	0	120.1	Y99	G97-Y99 PolarHBondContact O-N 3Å
98	E	63	Low	76	Confident	177 Å²	177	50.3 Å²	50.3	83%	0.827	23%	0.233	S	C	*	.	H	α-helix	trans	-76.9	-20.2	-158.4	-69.5	-174.7	171.9	0	0	116.6	Q96 Y101	Q96-E98 PolarHBondContact O-N 2.85Å; E98-Y101 WeakPolarHBondContact O-CD1 3.24Å; E98-Y101 WeakPolarHBondContact O-CE1 3.38Å
99	Y	71.9	Confident	76.3	Confident	29 Å²	29	50.3 Å²	50.3	11%	0.114	23%	0.233	C	C	.	.	H	α-helix	trans	-119.9	-12.2	-177.5	52.8	-80.3	0	0	0	112.6	V67 Y87 T89 L95 G97 Y101 R102	V67-Y99 HydrophobicContact CB-CD1 4.48Å; V67-Y99 HydrophobicContact CB-CE1 4.09Å; V67-Y99 HydrophobicContact CG1-CD1 4.18Å; V67-Y99 HydrophobicContact CG1-CD2 4.09Å; V67-Y99 HydrophobicContact CG1-CE1 3.91Å; V67-Y99 HydrophobicContact CG1-CE2 3.72Å; V67-Y99 HydrophobicContact CG1-CG 4.3Å; V67-Y99 HydrophobicContact CG2-CD1 3.98Å; V67-Y99 HydrophobicContact CG2-CE1 3.22Å; V67-Y99 HydrophobicContact CG2-CE2 4.36Å; V67-Y99 VanDerWaalsContact CG2-CZ 3.42Å; V67-Y99 WeakPolarHBondContact CG2-OH 3.11Å; Y87-Y99 AromaticContact CD1-CD2 3.43Å; Y87-Y99 HydrophobicContact CD1-CD2 3.43Å; Y87-Y99 VanDerWaalsContact CD1-CD2 3.43Å; Y87-Y99 HydrophobicContact CD1-CE2 4.25Å; Y87-Y99 AromaticContact CD1-CG 3.92Å; Y87-Y99 HydrophobicContact CD1-CG 3.92Å; Y87-Y99 HydrophobicContact CE1-CD2 4.21Å; Y87-Y99 HydrophobicContact CE1-CG 4.38Å; Y87-Y99 AromaticContact CG-CD2 3.65Å; Y87-Y99 HydrophobicContact CG-CD2 3.65Å; Y87-Y99 HydrophobicContact CG-CE2 4.21Å; T89-Y99 WeakPolarHBondContact CB-OH 3.5Å; T89-Y99 HydrophobicContact CG2-CE2 3.76Å; T89-Y99 WeakPolarHBondContact CG2-OH 3.37Å; L95-Y99 VanDerWaalsContact O-CE1 3.26Å; L95-Y99 WeakPolarHBondContact O-CE1 3.3Å; L95-Y99 PolarHBondContact O-OH 3.21Å; G97-Y99 PolarHBondContact O-N 3Å; Y99-Y101 VanDerWaalsContact C-N 3.26Å; Y99-Y101 PolarHBondContact O-N 3.46Å; Y99-R102 PolarHBondContact O-N 3.27Å; Y99-R102 VanDerWaalsContact O-N 3.17Å
100	L	79.5	Confident	77.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-33.5	-177.4	-73.9	-177.9	0	0	0	112.5	A36 I38 Q96 R102 C103 M132	A36-L100 HydrophobicContact CB-CD2 3.12Å; I38-L100 HydrophobicContact CD1-CD1 3.91Å; I38-L100 HydrophobicContact CD1-CD2 3.87Å; I38-L100 HydrophobicContact CG1-CD2 4.38Å; Q96-L100 HydrophobicContact CB-CD1 3.81Å; Q96-L100 WeakPolarHBondContact O-CD1 3.31Å; Q96-L100 WeakPolarHBondContact O-CG 3.37Å; L100-R102 PolarHBondContact O-N 3.25Å; L100-C103 WeakPolarHBondContact O-CB 3.4Å; L100-C103 PolarHBondContact O-N 3.07Å; L100-M132 HydrophobicContact CB-CG 3.76Å; L100-M132 HydrophobicContact CB-SD 4.41Å; L100-M132 HydrophobicContact CD2-SD 4.29Å
101	Y	81.4	Confident	78.1	Confident	126 Å²	126	50.3 Å²	50.3	49%	0.494	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.4	178.1	80.2	-93.3	0	0	0	114.2	E98 Y99 T131	E98-Y101 WeakPolarHBondContact O-CD1 3.24Å; E98-Y101 WeakPolarHBondContact O-CE1 3.38Å; Y99-Y101 VanDerWaalsContact C-N 3.26Å; Y99-Y101 PolarHBondContact O-N 3.46Å; Y101-T131 VanDerWaalsContact CA-O 3.28Å; Y101-T131 WeakPolarHBondContact CA-O 3.43Å; Y101-T131 WeakPolarHBondContact CB-O 3.36Å; Y101-T131 PolarHBondContact N-O 2.81Å
102	R	83.7	Confident	80	Confident	160 Å²	160	49.6 Å²	49.6	60%	0.604	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-11.3	177.9	-60.9	-175.5	174.8	-179.7	-2.2	113.5	Y99 L100	Y99-R102 PolarHBondContact O-N 3.27Å; Y99-R102 VanDerWaalsContact O-N 3.17Å; L100-R102 PolarHBondContact O-N 3.25Å
103	C	92.5	Very high	81.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.21	C	C	.	.			trans	-88.6	140.9	-177.2	-68.6	0	0	0	0	110	G34 A36 Y87 L100 M132	G34-C103 CarbonylContact O-C 3.57Å; G34-C103 VanDerWaalsContact O-CA 3.31Å; G34-C103 WeakPolarHBondContact O-CA 3.49Å; G34-C103 WeakPolarHBondContact O-CB 2.98Å; A36-C103 HydrophobicContact CB-CB 4.37Å; Y87-C103 WeakPolarHBondContact CD2-SG 3.04Å; Y87-C103 WeakPolarHBondContact CE2-SG 3.16Å; L100-C103 WeakPolarHBondContact O-CB 3.4Å; L100-C103 PolarHBondContact O-N 3.07Å; C103-M132 HydrophobicContact CB-CE 3.39Å
104	K	94.5	Very high	83.9	Confident	64 Å²	64	45 Å²	45	28%	0.278	20%	0.2	S	C	.	.	S	Bend	trans	-99	-15.3	174.9	-66.7	-59.3	-160.4	166.6	0	112.5	I33 G34 D135 T136 Q137 I191	I33-K104 HydrophobicContact CG2-CB 4.34Å; G34-K104 PolarHBondContact O-N 2.82Å; K104-D135 IonicContact NZ-OD1 2.81Å; K104-D135 IonicContact NZ-OD2 3.82Å; K104-D135 PolarHBondContact NZ-OD2 3.31Å; K104-T136 WeakPolarHBondContact O-CA 3.3Å; K104-Q137 PolarHBondContact O-N 2.98Å; K104-I191 HydrophobicContact CB-CD1 4.28Å; K104-I191 HydrophobicContact CB-CG1 4.41Å; K104-I191 HydrophobicContact CB-CG2 3.75Å
105	G	96.8	Very high	86	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.8	176.4	0	0	0	0	0	113.2	G34 I35 A36 M132 Q137	G34-G105 PolarHBondContact O-N 2.92Å; I35-G105 WeakPolarHBondContact CA-O 3.42Å; A36-G105 PolarHBondContact N-O 3.44Å; G105-M132 WeakPolarHBondContact O-CE 3.48Å; G105-Q137 CarbonylContact C-O 3.5Å; G105-Q137 VanDerWaalsContact CA-O 3.27Å; G105-Q137 WeakPolarHBondContact CA-O 3.44Å
106	A	96	Very high	88.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.6	169.3	0	0	0	0	0	111.6	A36 V128 M132 T136 Q137 V138 L139	A36-A106 CarbonylContact O-C 3.6Å; A36-A106 WeakPolarHBondContact O-CA 3.26Å; A106-V128 HydrophobicContact CB-CG1 4.23Å; A106-V128 HydrophobicContact CB-CG2 3.95Å; A106-M132 HydrophobicContact CB-CE 3.96Å; A106-M132 HydrophobicContact CB-SD 3.85Å; A106-T136 HydrophobicContact CB-CG2 4.35Å; A106-Q137 PolarHBondContact N-O 3.18Å; A106-V138 HydrophobicContact CB-CG2 4.29Å; A106-V138 WeakPolarHBondContact O-CA 3.44Å; A106-L139 PolarHBondContact O-N 2.9Å
107	L	97.4	Very high	90	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.5	163.1	-63.4	179.1	0	0	0	108	I35 A36 I37 I38 V109 L139 L141 F184 L187	I35-L107 HydrophobicContact CG2-CG 4.31Å; A36-L107 PolarHBondContact O-N 3.11Å; I37-L107 WeakPolarHBondContact CA-O 3.21Å; I37-L107 HydrophobicContact CB-CB 4.42Å; I37-L107 HydrophobicContact CG1-CB 4.12Å; I38-L107 PolarHBondContact N-O 3.07Å; L107-V109 HydrophobicContact CB-CG2 4.34Å; L107-L139 WeakPolarHBondContact CA-O 3.4Å; L107-L139 HydrophobicContact CD2-CB 3.85Å; L107-L139 HydrophobicContact CD2-CD2 3.97Å; L107-L139 HydrophobicContact CD2-CG 4.35Å; L107-L141 HydrophobicContact CB-CD1 4.19Å; L107-L141 HydrophobicContact CD1-CD1 3.96Å; L107-L141 HydrophobicContact CD2-CD1 3.87Å; L107-L141 HydrophobicContact CD2-CG 4.24Å; L107-L141 HydrophobicContact CG-CD1 4.23Å; L107-F184 HydrophobicContact CD1-CD1 3.89Å; L107-F184 HydrophobicContact CD1-CE1 3.44Å; L107-F184 VanDerWaalsContact CD1-CE1 3.44Å; L107-F184 HydrophobicContact CD1-CE2 4.26Å; L107-F184 HydrophobicContact CD1-CG 4.48Å; L107-F184 HydrophobicContact CD1-CZ 3.64Å; L107-L187 HydrophobicContact CD2-CB 4.42Å; L107-L187 HydrophobicContact CD2-CD2 3.6Å; L107-L187 HydrophobicContact CG-CD2 3.82Å
108	I	96.5	Very high	91.8	Very high	0 Å²	0	43 Å²	43	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.8	171.1	-58.3	175.7	0	0	0	107.6	I38 V121 H124 L125 V128 V138 L139 L140 L141	I38-I108 CarbonylContact O-C 3.54Å; I38-I108 WeakPolarHBondContact O-CA 3.14Å; I108-V121 HydrophobicContact CG2-CG1 3.97Å; I108-V121 HydrophobicContact CG2-CG2 4.39Å; I108-H124 HydrophobicContact CG2-CB 3.88Å; I108-L125 HydrophobicContact CD1-CB 3.83Å; I108-L125 HydrophobicContact CD1-CD1 3.78Å; I108-L125 HydrophobicContact CD1-CG 4.42Å; I108-V128 HydrophobicContact CD1-CG2 4.2Å; I108-V128 HydrophobicContact CG1-CG2 4.35Å; I108-V138 HydrophobicContact CD1-CG1 3.65Å; I108-V138 HydrophobicContact CG1-CG1 3.98Å; I108-L139 PolarHBondContact N-O 3.16Å; I108-L140 HydrophobicContact CB-CD1 4.28Å; I108-L140 HydrophobicContact CG2-CD1 4.16Å; I108-L140 CarbonylContact O-C 3.47Å; I108-L140 WeakPolarHBondContact O-CA 3.44Å; I108-L140 WeakPolarHBondContact O-CD1 3.21Å; I108-L141 PolarHBondContact O-N 3.36Å
109	V	97.3	Very high	93.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.2	-166	-172.5	0	0	0	0	110.8	I37 I38 G39 V43 K45 L48 L107 L141 T143	I37-V109 HydrophobicContact CD1-CG2 3.91Å; I37-V109 HydrophobicContact CG1-CG2 3.54Å; I38-V109 PolarHBondContact O-N 3.21Å; G39-V109 WeakPolarHBondContact CA-O 3.4Å; V43-V109 HydrophobicContact CB-CG1 4.37Å; V43-V109 HydrophobicContact CG2-CB 4.12Å; V43-V109 HydrophobicContact CG2-CG1 3.84Å; K45-V109 HydrophobicContact CG-CB 4.33Å; K45-V109 HydrophobicContact CG-CG2 4.47Å; L48-V109 HydrophobicContact CD1-CG1 4.32Å; L107-V109 HydrophobicContact CB-CG2 4.34Å; V109-L141 WeakPolarHBondContact CA-O 3.48Å; V109-L141 HydrophobicContact CG2-CB 4.31Å; V109-L141 HydrophobicContact CG2-CD1 4.47Å; V109-T143 HydrophobicContact CG1-CG2 3.23Å
110	Y	98	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.2	169.8	74.1	-84.2	0	0	0	110.2	I112 F118 V121 L140 L141 G142 T143 V153 A158	Y110-I112 HydrophobicContact CE2-CG2 3.96Å; Y110-F118 AromaticContact CD1-CD2 3.95Å; Y110-F118 HydrophobicContact CD1-CD2 3.95Å; Y110-F118 HydrophobicContact CD2-CB 3.82Å; Y110-F118 AromaticContact CD2-CD2 3.8Å; Y110-F118 HydrophobicContact CD2-CD2 3.8Å; Y110-F118 HydrophobicContact CD2-CG 4.24Å; Y110-F118 HydrophobicContact CE1-CD2 4.01Å; Y110-F118 HydrophobicContact CE1-CE2 4.37Å; Y110-F118 HydrophobicContact CE2-CB 4.44Å; Y110-F118 AromaticContact CE2-CD2 3.87Å; Y110-F118 HydrophobicContact CE2-CD2 3.87Å; Y110-F118 HydrophobicContact CE2-CG 4.47Å; Y110-F118 HydrophobicContact CG-CB 4.17Å; Y110-F118 AromaticContact CG-CD2 3.84Å; Y110-F118 HydrophobicContact CG-CD2 3.84Å; Y110-F118 AromaticContact CZ-CD2 3.98Å; Y110-V121 HydrophobicContact CD1-CG2 4.19Å; Y110-V121 HydrophobicContact CG-CG2 4.3Å; Y110-L140 HydrophobicContact CD1-CD1 3.79Å; Y110-L140 HydrophobicContact CD1-CG 4.32Å; Y110-L140 HydrophobicContact CE1-CD1 4.07Å; Y110-L140 HydrophobicContact CE1-CD2 4.47Å; Y110-L140 HydrophobicContact CE1-CG 4.08Å; Y110-L141 WeakPolarHBondContact CD1-O 3.21Å; Y110-L141 PolarHBondContact N-O 3.33Å; Y110-G142 VanDerWaalsContact CE1-CA 3.41Å; Y110-G142 VanDerWaalsContact CZ-CA 3.41Å; Y110-T143 PolarHBondContact O-N 2.55Å; Y110-T143 PolarHBondContact O-OG1 2.75Å; Y110-V153 HydrophobicContact CE2-CB 4.09Å; Y110-V153 HydrophobicContact CE2-CG1 3.78Å; Y110-V153 HydrophobicContact CE2-CG2 4.46Å; Y110-A158 HydrophobicContact CE1-CB 4.27Å; Y110-A158 WeakPolarHBondContact OH-CB 3.47Å
111	D	97.9	Very high	95.3	Very high	9 Å²	9	40 Å²	40	5%	0.048	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.3	176.9	174	-8.1	0	0	0	110	V43 T113 E114 S117 T143 K144	V43-D111 HydrophobicContact CB-CB 4.25Å; V43-D111 HydrophobicContact CG1-CB 4.26Å; D111-T113 VanDerWaalsContact CG-OG1 3.25Å; D111-T113 PolarHBondContact O-N 2.8Å; D111-T113 WeakPolarHBondContact OD1-CB 3.47Å; D111-T113 PolarHBondContact OD1-N 3.37Å; D111-T113 PolarHBondContact OD1-OG1 2.73Å; D111-T113 PolarHBondContact OD2-OG1 2.73Å; D111-E114 HydrophobicContact CB-CB 4.08Å; D111-E114 PolarHBondContact O-N 3.21Å; D111-S117 PolarHBondContact N-OG 3.36Å; D111-S117 PolarHBondContact O-OG 3.32Å; D111-T143 WeakPolarHBondContact CA-OG1 3.49Å; D111-K144 WeakPolarHBondContact OD2-CD 3.43Å; D111-K144 WeakPolarHBondContact OD2-CE 3.4Å; D111-K144 IonicContact OD2-NZ 3.38Å; D111-K144 PolarHBondContact OD2-NZ 2.93Å
112	I	98.6	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.4	-177.4	68.3	156.7	0	0	0	113.9	Y110 T143 K144 R151 K152 V153	Y110-I112 HydrophobicContact CE2-CG2 3.96Å; I112-T143 WeakPolarHBondContact CG1-O 3.47Å; I112-T143 WeakPolarHBondContact CG2-O 3.46Å; I112-T143 PolarHBondContact N-O 2.99Å; I112-K144 WeakPolarHBondContact CD1-O 3.43Å; I112-R151 HydrophobicContact CD1-CB 4.23Å; I112-R151 HydrophobicContact CD1-CG 4.29Å; I112-K152 PolarHBondContact O-N 2.88Å; I112-V153 PolarHBondContact O-N 2.99Å
113	T	98.2	Very high	96.4	Very high	20 Å²	20	33.7 Å²	33.7	12%	0.123	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-7	179.8	72.2	0	0	0	0	113.1	D111 M147 L150 K152	D111-T113 VanDerWaalsContact CG-OG1 3.25Å; D111-T113 PolarHBondContact O-N 2.8Å; D111-T113 WeakPolarHBondContact OD1-CB 3.47Å; D111-T113 PolarHBondContact OD1-N 3.37Å; D111-T113 PolarHBondContact OD1-OG1 2.73Å; D111-T113 PolarHBondContact OD2-OG1 2.73Å; T113-M147 HydrophobicContact CG2-CB 3.71Å; T113-M147 HydrophobicContact CG2-CG 4.47Å; T113-M147 HydrophobicContact CG2-SD 4.02Å; T113-L150 WeakPolarHBondContact CA-O 3.32Å; T113-L150 WeakPolarHBondContact CB-O 3.4Å; T113-L150 HydrophobicContact CG2-CB 3.76Å; T113-L150 WeakPolarHBondContact CG2-O 3.4Å; T113-K152 VanDerWaalsContact O-CD 3.26Å; T113-K152 WeakPolarHBondContact O-CD 3.44Å; T113-K152 WeakPolarHBondContact O-CE 3.3Å; T113-K152 PolarHBondContact O-NZ 3.43Å
114	E	97.4	Very high	96.4	Very high	73 Å²	73	34 Å²	34	34%	0.341	16%	0.164	S	C	.	.			trans	-127.9	91.5	-174	-174.4	46.2	-100	0	0	111.8	D111 Y116 S117	D111-E114 HydrophobicContact CB-CB 4.08Å; D111-E114 PolarHBondContact O-N 3.21Å; E114-Y116 PolarHBondContact O-N 3.13Å; E114-Y116 VanDerWaalsContact OE1-CD2 3.29Å; E114-Y116 WeakPolarHBondContact OE1-CD2 3.4Å; E114-Y116 PolarHBondContact OE1-N 3.22Å; E114-S117 WeakPolarHBondContact O-CB 3.36Å; E114-S117 PolarHBondContact O-N 3.27Å; E114-S117 PolarHBondContact O-OG 2.97Å
115	P	97.5	Very high	96.4	Very high	42 Å²	42	31 Å²	31	27%	0.273	15%	0.151	S	C	.	.	H	α-helix	trans	-56.8	-32.2	-177.5	-27.6	36.4	0	0	0	114.4	S117 F118 N119 K152 V153	P115-S117 PolarHBondContact O-N 3.22Å; P115-F118 PolarHBondContact O-N 3.15Å; P115-F118 VanDerWaalsContact O-N 3.16Å; P115-N119 PolarHBondContact O-N 3.32Å; P115-K152 HydrophobicContact CG-CB 3.52Å; P115-K152 HydrophobicContact CG-CD 4.1Å; P115-K152 HydrophobicContact CG-CG 4.47Å; P115-V153 HydrophobicContact CB-CG2 4.48Å; P115-V153 HydrophobicContact CG-CG2 4.46Å
116	Y	96.2	Very high	96.2	Very high	176 Å²	176	34.7 Å²	34.7	69%	0.69	17%	0.171	S	C	*	.	H	α-helix	trans	-61.7	-34.9	177.2	-75.1	-74.9	0	0	0	112	E114 F118 N119 N120	E114-Y116 PolarHBondContact O-N 3.13Å; E114-Y116 VanDerWaalsContact OE1-CD2 3.29Å; E114-Y116 WeakPolarHBondContact OE1-CD2 3.4Å; E114-Y116 PolarHBondContact OE1-N 3.22Å; Y116-F118 VanDerWaalsContact C-N 3.33Å; Y116-N119 PolarHBondContact O-N 3.1Å; Y116-N120 PolarHBondContact O-N 2.78Å; Y116-N120 PolarHBondContact O-ND2 2.8Å
117	S	96	Very high	95.8	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-67.2	-35.7	177.3	75.9	0	0	0	0	112.3	D111 E114 P115	D111-S117 PolarHBondContact N-OG 3.36Å; D111-S117 PolarHBondContact O-OG 3.32Å; E114-S117 WeakPolarHBondContact O-CB 3.36Å; E114-S117 PolarHBondContact O-N 3.27Å; E114-S117 PolarHBondContact O-OG 2.97Å; P115-S117 PolarHBondContact O-N 3.22Å
118	F	98.2	Very high	95.5	Very high	24 Å²	24	36.4 Å²	36.4	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-71.1	-42.5	175.1	179.7	-104.5	0	0	0	111.7	Y110 P115 Y116 N120 V121 V153 T157 A158 F161	Y110-F118 AromaticContact CD1-CD2 3.95Å; Y110-F118 HydrophobicContact CD1-CD2 3.95Å; Y110-F118 HydrophobicContact CD2-CB 3.82Å; Y110-F118 AromaticContact CD2-CD2 3.8Å; Y110-F118 HydrophobicContact CD2-CD2 3.8Å; Y110-F118 HydrophobicContact CD2-CG 4.24Å; Y110-F118 HydrophobicContact CE1-CD2 4.01Å; Y110-F118 HydrophobicContact CE1-CE2 4.37Å; Y110-F118 HydrophobicContact CE2-CB 4.44Å; Y110-F118 AromaticContact CE2-CD2 3.87Å; Y110-F118 HydrophobicContact CE2-CD2 3.87Å; Y110-F118 HydrophobicContact CE2-CG 4.47Å; Y110-F118 HydrophobicContact CG-CB 4.17Å; Y110-F118 AromaticContact CG-CD2 3.84Å; Y110-F118 HydrophobicContact CG-CD2 3.84Å; Y110-F118 AromaticContact CZ-CD2 3.98Å; P115-F118 PolarHBondContact O-N 3.15Å; P115-F118 VanDerWaalsContact O-N 3.16Å; Y116-F118 VanDerWaalsContact C-N 3.33Å; F118-N120 PolarHBondContact O-N 2.78Å; F118-N120 VanDerWaalsContact O-N 3.15Å; F118-V121 HydrophobicContact CD2-CG2 4.19Å; F118-V121 WeakPolarHBondContact O-CB 3.26Å; F118-V121 VanDerWaalsContact O-CG2 3.26Å; F118-V121 WeakPolarHBondContact O-CG2 3.47Å; F118-V121 PolarHBondContact O-N 2.95Å; F118-V153 HydrophobicContact CB-CG1 4.23Å; F118-V153 HydrophobicContact CB-CG2 3.9Å; F118-V153 HydrophobicContact CD1-CG1 4.11Å; F118-V153 HydrophobicContact CD2-CG1 4.08Å; F118-V153 HydrophobicContact CG-CG1 3.86Å; F118-V153 HydrophobicContact CG-CG2 4.4Å; F118-T157 HydrophobicContact CE1-CG2 4Å; F118-T157 HydrophobicContact CZ-CG2 4.43Å; F118-A158 HydrophobicContact CD2-CB 4.3Å; F118-A158 HydrophobicContact CE2-CB 3.52Å; F118-A158 HydrophobicContact CZ-CB 3.99Å; F118-F161 HydrophobicContact CZ-CB 3.9Å; F118-F161 HydrophobicContact CZ-CG 4.19Å
119	N	96.6	Very high	95.3	Very high	107 Å²	107	42.4 Å²	42.4	57%	0.572	21%	0.205	S	C	*	.	H	α-helix	trans	-58.9	-29	176.5	-68.5	-17.6	0	0	0	112.7	P115 Y116	P115-N119 PolarHBondContact O-N 3.32Å; Y116-N119 PolarHBondContact O-N 3.1Å
120	N	95	Very high	95	Very high	36 Å²	36	50.4 Å²	50.4	19%	0.193	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-7	176.8	-72.8	-29.5	0	0	0	114.1	D40 Y116 F118 Q122 L123 H124	D40-N120 PolarHBondContact OD2-ND2 2.97Å; Y116-N120 PolarHBondContact O-N 2.78Å; Y116-N120 PolarHBondContact O-ND2 2.8Å; F118-N120 PolarHBondContact O-N 2.78Å; F118-N120 VanDerWaalsContact O-N 3.15Å; N120-Q122 VanDerWaalsContact C-N 3.26Å; N120-Q122 PolarHBondContact O-N 2.96Å; N120-L123 WeakPolarHBondContact O-CB 3.31Å; N120-L123 PolarHBondContact O-N 3.02Å; N120-H124 PolarHBondContact O-CD2 2.82Å; N120-H124 PolarHBondContact O-N 3Å; N120-H124 VanDerWaalsContact O-N 3.13Å
121	V	95.7	Very high	94.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-40.1	179.3	168.7	0	0	0	0	111.8	I108 Y110 F118 L123 H124 L125 L140 F161	I108-V121 HydrophobicContact CG2-CG1 3.97Å; I108-V121 HydrophobicContact CG2-CG2 4.39Å; Y110-V121 HydrophobicContact CD1-CG2 4.19Å; Y110-V121 HydrophobicContact CG-CG2 4.3Å; F118-V121 HydrophobicContact CD2-CG2 4.19Å; F118-V121 WeakPolarHBondContact O-CB 3.26Å; F118-V121 VanDerWaalsContact O-CG2 3.26Å; F118-V121 WeakPolarHBondContact O-CG2 3.47Å; F118-V121 PolarHBondContact O-N 2.95Å; V121-L123 VanDerWaalsContact C-N 3.29Å; V121-L123 PolarHBondContact O-N 2.98Å; V121-H124 PolarHBondContact O-N 3.44Å; V121-L125 WeakPolarHBondContact O-CB 3.31Å; V121-L125 PolarHBondContact O-N 2.9Å; V121-L140 HydrophobicContact CG1-CD1 3.61Å; V121-L140 HydrophobicContact CG1-CD2 4.34Å; V121-L140 HydrophobicContact CG2-CD1 4.03Å; V121-F161 HydrophobicContact CB-CE1 4.43Å; V121-F161 HydrophobicContact CG1-CD1 4.27Å; V121-F161 HydrophobicContact CG1-CE1 3.45Å; V121-F161 VanDerWaalsContact CG1-CE1 3.45Å; V121-F161 HydrophobicContact CG1-CZ 3.85Å
122	Q	95.4	Very high	94.2	Very high	60 Å²	60	51.5 Å²	51.5	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-38.3	176.7	-175.7	64.1	54.7	0	0	112.3	N120 L125 N126 F161	N120-Q122 VanDerWaalsContact C-N 3.26Å; N120-Q122 PolarHBondContact O-N 2.96Å; Q122-L125 PolarHBondContact O-N 2.87Å; Q122-N126 PolarHBondContact NE2-OD1 3.42Å; Q122-N126 WeakPolarHBondContact O-CB 3.47Å; Q122-N126 PolarHBondContact O-N 2.66Å; Q122-N126 PolarHBondContact O-ND2 3.38Å; Q122-N126 PolarHBondContact O-OD1 3.28Å; Q122-F161 HydrophobicContact CB-CE2 4.32Å; Q122-F161 HydrophobicContact CB-CZ 4.34Å
123	L	92.9	Very high	93.8	Very high	93 Å²	93	53 Å²	53	49%	0.487	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-43.5	177.2	-63.1	175.8	0	0	0	110.9	N120 V121 N126 E127	N120-L123 WeakPolarHBondContact O-CB 3.31Å; N120-L123 PolarHBondContact O-N 3.02Å; V121-L123 VanDerWaalsContact C-N 3.29Å; V121-L123 PolarHBondContact O-N 2.98Å; L123-N126 PolarHBondContact O-N 3.27Å; L123-E127 PolarHBondContact O-N 2.98Å
124	H	92.4	Very high	93.5	Very high	7 Å²	7	58.9 Å²	58.9	3%	0.032	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-39.1	176	-64.4	-55.9	0	0	0	112	I38 D40 I108 N120 V121 E127 V128	I38-H124 HydrophobicContact CG2-CB 3.81Å; D40-H124 IonicContact OD1-CD2 2.72Å; D40-H124 IonicContact OD1-CE1 2.63Å; D40-H124 PolarHBondContact OD1-CE1 3.15Å; D40-H124 VanDerWaalsContact OD1-CE1 3.31Å; D40-H124 IonicContact OD1-NE2 3.88Å; D40-H124 PolarHBondContact OD1-NE2 2.98Å; I108-H124 HydrophobicContact CG2-CB 3.88Å; N120-H124 PolarHBondContact O-CD2 2.82Å; N120-H124 PolarHBondContact O-N 3Å; N120-H124 VanDerWaalsContact O-N 3.13Å; V121-H124 PolarHBondContact O-N 3.44Å; H124-E127 WeakPolarHBondContact O-CB 3.24Å; H124-E127 PolarHBondContact O-N 3.4Å; H124-V128 WeakPolarHBondContact O-CG2 3.42Å; H124-V128 PolarHBondContact O-N 2.86Å
125	L	94.2	Very high	93.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-41.4	175.7	-179.5	61.5	0	0	0	112	I108 V121 Q122 E127 V128 K129 V138 Q165 L167	I108-L125 HydrophobicContact CD1-CB 3.83Å; I108-L125 HydrophobicContact CD1-CD1 3.78Å; I108-L125 HydrophobicContact CD1-CG 4.42Å; V121-L125 WeakPolarHBondContact O-CB 3.31Å; V121-L125 PolarHBondContact O-N 2.9Å; Q122-L125 PolarHBondContact O-N 2.87Å; L125-E127 VanDerWaalsContact C-N 3.28Å; L125-E127 PolarHBondContact O-N 2.86Å; L125-V128 PolarHBondContact O-N 2.91Å; L125-K129 HydrophobicContact CG-CD 4.28Å; L125-K129 WeakPolarHBondContact O-CG 3.46Å; L125-K129 PolarHBondContact O-N 3.27Å; L125-V138 HydrophobicContact CD1-CG1 4.27Å; L125-Q165 HydrophobicContact CD2-CB 3.96Å; L125-Q165 HydrophobicContact CD2-CG 3.79Å; L125-L167 HydrophobicContact CD1-CD1 4.07Å; L125-L167 HydrophobicContact CD1-CD2 4.39Å; L125-L167 HydrophobicContact CD2-CD1 3.96Å
126	N	92.6	Very high	93.1	Very high	78 Å²	78	56.1 Å²	56.1	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-38.7	175	-69.2	-11.4	0	0	0	111.1	Q122 L123 K129 R130	Q122-N126 PolarHBondContact NE2-OD1 3.42Å; Q122-N126 WeakPolarHBondContact O-CB 3.47Å; Q122-N126 PolarHBondContact O-N 2.66Å; Q122-N126 PolarHBondContact O-ND2 3.38Å; Q122-N126 PolarHBondContact O-OD1 3.28Å; L123-N126 PolarHBondContact O-N 3.27Å; N126-K129 PolarHBondContact O-N 3.33Å; N126-R130 VanDerWaalsContact O-CB 3.24Å; N126-R130 WeakPolarHBondContact O-CB 3.4Å; N126-R130 PolarHBondContact O-N 3.28Å
127	E	88.3	Confident	93.2	Very high	32 Å²	32	49.9 Å²	49.9	15%	0.15	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-43.5	175.8	-177.5	65.2	179.3	0	0	112.3	Q96 L123 H124 L125 R130 T131	Q96-E127 HydrophobicContact CB-CG 4.14Å; L123-E127 PolarHBondContact O-N 2.98Å; H124-E127 WeakPolarHBondContact O-CB 3.24Å; H124-E127 PolarHBondContact O-N 3.4Å; L125-E127 VanDerWaalsContact C-N 3.28Å; L125-E127 PolarHBondContact O-N 2.86Å; E127-R130 PolarHBondContact O-N 2.98Å; E127-R130 IonicContact OE1-CZ 3.27Å; E127-R130 IonicContact OE1-NH2 3.19Å; E127-R130 PolarHBondContact OE1-NH2 3.2Å; E127-R130 IonicContact OE2-CZ 3.65Å; E127-R130 IonicContact OE2-NE 2.64Å; E127-R130 PolarHBondContact OE2-NE 3.02Å; E127-R130 IonicContact OE2-NH2 3.34Å; E127-R130 PolarHBondContact OE2-NH2 3.04Å; E127-T131 HydrophobicContact CG-CG2 4.46Å; E127-T131 WeakPolarHBondContact O-CB 3.41Å; E127-T131 WeakPolarHBondContact O-CG2 3.32Å; E127-T131 PolarHBondContact O-N 3.06Å; E127-T131 PolarHBondContact O-OG1 2.88Å; E127-T131 WeakPolarHBondContact OE1-CG2 3.22Å
128	V	91.5	Very high	93.2	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.024	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-54.1	172.1	164.9	0	0	0	0	110.5	I38 A106 I108 H124 L125 R130 T131 M132 T136 V138	I38-V128 HydrophobicContact CD1-CG2 3.38Å; A106-V128 HydrophobicContact CB-CG1 4.23Å; A106-V128 HydrophobicContact CB-CG2 3.95Å; I108-V128 HydrophobicContact CD1-CG2 4.2Å; I108-V128 HydrophobicContact CG1-CG2 4.35Å; H124-V128 WeakPolarHBondContact O-CG2 3.42Å; H124-V128 PolarHBondContact O-N 2.86Å; L125-V128 PolarHBondContact O-N 2.91Å; V128-R130 PolarHBondContact O-N 2.82Å; V128-R130 VanDerWaalsContact O-N 3.16Å; V128-T131 PolarHBondContact O-N 3.39Å; V128-M132 HydrophobicContact CB-SD 4.05Å; V128-M132 HydrophobicContact CG1-CB 4.43Å; V128-M132 HydrophobicContact CG1-CG 4.35Å; V128-M132 HydrophobicContact CG1-SD 3.63Å; V128-M132 HydrophobicContact CG2-SD 3.83Å; V128-M132 VanDerWaalsContact O-CB 3.3Å; V128-M132 WeakPolarHBondContact O-CB 3.29Å; V128-M132 PolarHBondContact O-N 3.3Å; V128-T136 HydrophobicContact CG1-CG2 4.31Å; V128-V138 HydrophobicContact CG1-CG2 3.8Å
129	K	92.1	Very high	93.2	Very high	125 Å²	125	49.4 Å²	49.4	54%	0.543	25%	0.252	S	S	.	.	H	α-helix	trans	-59.3	-29.2	179.9	-71.8	175.3	177.4	177	0	112.9	L125 N126	L125-K129 HydrophobicContact CG-CD 4.28Å; L125-K129 WeakPolarHBondContact O-CG 3.46Å; L125-K129 PolarHBondContact O-N 3.27Å; N126-K129 PolarHBondContact O-N 3.33Å
130	R	89.5	Confident	93.3	Very high	168 Å²	168	44.3 Å²	44.3	63%	0.634	23%	0.225	S	C	*	.	H	α-helix	trans	-83.2	-31.8	-178.9	-172.3	-174.5	70.1	76.2	-4.8	113.3	N126 E127 V128	N126-R130 VanDerWaalsContact O-CB 3.24Å; N126-R130 WeakPolarHBondContact O-CB 3.4Å; N126-R130 PolarHBondContact O-N 3.28Å; E127-R130 PolarHBondContact O-N 2.98Å; E127-R130 IonicContact OE1-CZ 3.27Å; E127-R130 IonicContact OE1-NH2 3.19Å; E127-R130 PolarHBondContact OE1-NH2 3.2Å; E127-R130 IonicContact OE2-CZ 3.65Å; E127-R130 IonicContact OE2-NE 2.64Å; E127-R130 PolarHBondContact OE2-NE 3.02Å; E127-R130 IonicContact OE2-NH2 3.34Å; E127-R130 PolarHBondContact OE2-NH2 3.04Å; V128-R130 PolarHBondContact O-N 2.82Å; V128-R130 VanDerWaalsContact O-N 3.16Å
131	T	87.7	Confident	93.5	Very high	21 Å²	21	42.6 Å²	42.6	13%	0.129	22%	0.216	C	C	.	.	H	α-helix	trans	-114.1	-20.2	-167.2	58.9	0	0	0	0	114.5	Y101 E127 V128	Y101-T131 VanDerWaalsContact CA-O 3.28Å; Y101-T131 WeakPolarHBondContact CA-O 3.43Å; Y101-T131 WeakPolarHBondContact CB-O 3.36Å; Y101-T131 PolarHBondContact N-O 2.81Å; E127-T131 HydrophobicContact CG-CG2 4.46Å; E127-T131 WeakPolarHBondContact O-CB 3.41Å; E127-T131 WeakPolarHBondContact O-CG2 3.32Å; E127-T131 PolarHBondContact O-N 3.06Å; E127-T131 PolarHBondContact O-OG1 2.88Å; E127-T131 WeakPolarHBondContact OE1-CG2 3.22Å; V128-T131 PolarHBondContact O-N 3.39Å
132	M	91.2	Very high	93.7	Very high	11 Å²	11	42.6 Å²	42.6	5%	0.054	22%	0.216	C	C	.	.	S	Bend	trans	-104.9	157.8	-177.2	-56.5	-179.2	73.3	0	0	110.7	A36 I38 L100 C103 G105 A106 V128 T136	A36-M132 HydrophobicContact CB-CE 4.27Å; I38-M132 HydrophobicContact CD1-SD 4.48Å; L100-M132 HydrophobicContact CB-CG 3.76Å; L100-M132 HydrophobicContact CB-SD 4.41Å; L100-M132 HydrophobicContact CD2-SD 4.29Å; C103-M132 HydrophobicContact CB-CE 3.39Å; G105-M132 WeakPolarHBondContact O-CE 3.48Å; A106-M132 HydrophobicContact CB-CE 3.96Å; A106-M132 HydrophobicContact CB-SD 3.85Å; V128-M132 HydrophobicContact CB-SD 4.05Å; V128-M132 HydrophobicContact CG1-CB 4.43Å; V128-M132 HydrophobicContact CG1-CG 4.35Å; V128-M132 HydrophobicContact CG1-SD 3.63Å; V128-M132 HydrophobicContact CG2-SD 3.83Å; V128-M132 VanDerWaalsContact O-CB 3.3Å; V128-M132 WeakPolarHBondContact O-CB 3.29Å; V128-M132 PolarHBondContact O-N 3.3Å; M132-T136 HydrophobicContact CB-CG2 4.17Å; M132-T136 WeakPolarHBondContact CB-OG1 3.33Å; M132-T136 HydrophobicContact CE-CG2 3.5Å; M132-T136 VanDerWaalsContact CE-CG2 3.5Å; M132-T136 HydrophobicContact SD-CG2 3.99Å
133	P	91.1	Very high	93.8	Very high	33 Å²	33	40 Å²	40	21%	0.214	20%	0.203	C	C	.	.			trans	-53.8	146.5	175.8	-29.2	38.3	0	0	0	113.3	D135 T136	P133-D135 WeakPolarHBondContact CB-OD1 3.26Å; P133-D135 PolarHBondContact O-N 3.37Å; P133-D135 VanDerWaalsContact O-N 3.15Å; P133-T136 WeakPolarHBondContact O-CB 3.4Å; P133-T136 PolarHBondContact O-N 2.74Å; P133-T136 PolarHBondContact O-OG1 3.41Å
134	P	91.8	Very high	94	Very high	142 Å²	142	38.1 Å²	38.1	92%	0.922	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.2	-179.5	-25.8	35	0	0	0	114.9	T136	P134-T136 PolarHBondContact O-N 3.27Å
135	D	92	Very high	94.3	Very high	41 Å²	41	38.7 Å²	38.7	22%	0.219	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.1	176.8	61.2	-42	0	0	0	113.6	K104 P133 Q137 K194	K104-D135 IonicContact NZ-OD1 2.81Å; K104-D135 IonicContact NZ-OD2 3.82Å; K104-D135 PolarHBondContact NZ-OD2 3.31Å; P133-D135 WeakPolarHBondContact CB-OD1 3.26Å; P133-D135 PolarHBondContact O-N 3.37Å; P133-D135 VanDerWaalsContact O-N 3.15Å; D135-Q137 PolarHBondContact O-N 3.22Å; D135-Q137 PolarHBondContact O-NE2 2.73Å; D135-K194 HydrophobicContact CB-CG 4.49Å
136	T	94.8	Very high	94.5	Very high	17 Å²	17	40.7 Å²	40.7	10%	0.104	21%	0.207	C	C	.	.			trans	-58.1	125.8	-178	-63.6	0	0	0	0	111.5	K104 A106 V128 M132 P133 P134 V138	K104-T136 WeakPolarHBondContact O-CA 3.3Å; A106-T136 HydrophobicContact CB-CG2 4.35Å; V128-T136 HydrophobicContact CG1-CG2 4.31Å; M132-T136 HydrophobicContact CB-CG2 4.17Å; M132-T136 WeakPolarHBondContact CB-OG1 3.33Å; M132-T136 HydrophobicContact CE-CG2 3.5Å; M132-T136 VanDerWaalsContact CE-CG2 3.5Å; M132-T136 HydrophobicContact SD-CG2 3.99Å; P133-T136 WeakPolarHBondContact O-CB 3.4Å; P133-T136 PolarHBondContact O-N 2.74Å; P133-T136 PolarHBondContact O-OG1 3.41Å; P134-T136 PolarHBondContact O-N 3.27Å; T136-V138 HydrophobicContact CG2-CG2 4.11Å
137	Q	97.3	Very high	94.7	Very high	45 Å²	45	40 Å²	40	21%	0.21	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	132.7	173.6	-59.1	-55.5	-59.7	0	0	110.1	K104 G105 A106 D135 L187 R190 I191 K194	K104-Q137 PolarHBondContact O-N 2.98Å; G105-Q137 CarbonylContact C-O 3.5Å; G105-Q137 VanDerWaalsContact CA-O 3.27Å; G105-Q137 WeakPolarHBondContact CA-O 3.44Å; A106-Q137 PolarHBondContact N-O 3.18Å; D135-Q137 PolarHBondContact O-N 3.22Å; D135-Q137 PolarHBondContact O-NE2 2.73Å; Q137-L187 HydrophobicContact CB-CD1 3.71Å; Q137-L187 WeakPolarHBondContact O-CD1 2.88Å; Q137-R190 HydrophobicContact CB-CB 4.21Å; Q137-R190 HydrophobicContact CG-CB 4.01Å; Q137-I191 HydrophobicContact CB-CG1 3.79Å; Q137-I191 HydrophobicContact CG-CB 4.44Å; Q137-I191 HydrophobicContact CG-CG1 3.75Å; Q137-K194 HydrophobicContact CG-CB 4.44Å
138	V	97.3	Very high	95.1	Very high	16 Å²	16	42.7 Å²	42.7	10%	0.097	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.7	-174.7	-175.7	0	0	0	0	110.2	A106 I108 L125 V128 T136 L167	A106-V138 HydrophobicContact CB-CG2 4.29Å; A106-V138 WeakPolarHBondContact O-CA 3.44Å; I108-V138 HydrophobicContact CD1-CG1 3.65Å; I108-V138 HydrophobicContact CG1-CG1 3.98Å; L125-V138 HydrophobicContact CD1-CG1 4.27Å; V128-V138 HydrophobicContact CG1-CG2 3.8Å; T136-V138 HydrophobicContact CG2-CG2 4.11Å; V138-L167 HydrophobicContact CB-CD2 3.69Å; V138-L167 HydrophobicContact CG1-CD1 4.42Å; V138-L167 HydrophobicContact CG1-CD2 3.81Å
139	L	98.3	Very high	95.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.7	174.3	-174.7	70.4	0	0	0	109.6	A106 L107 I108 L141 S168 A183	A106-L139 PolarHBondContact O-N 2.9Å; L107-L139 WeakPolarHBondContact CA-O 3.4Å; L107-L139 HydrophobicContact CD2-CB 3.85Å; L107-L139 HydrophobicContact CD2-CD2 3.97Å; L107-L139 HydrophobicContact CD2-CG 4.35Å; I108-L139 PolarHBondContact N-O 3.16Å; L139-L141 HydrophobicContact CD2-CD2 3.76Å; L139-L141 HydrophobicContact CG-CD2 3.92Å; L139-S168 WeakPolarHBondContact CD1-O 3.29Å; L139-A183 HydrophobicContact CD2-CB 4.13Å
140	L	98.6	Very high	95.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127.4	176	179.9	58.8	0	0	0	110	I108 Y110 V121 F161 A162 S168 I169 M170	I108-L140 HydrophobicContact CB-CD1 4.28Å; I108-L140 HydrophobicContact CG2-CD1 4.16Å; I108-L140 CarbonylContact O-C 3.47Å; I108-L140 WeakPolarHBondContact O-CA 3.44Å; I108-L140 WeakPolarHBondContact O-CD1 3.21Å; Y110-L140 HydrophobicContact CD1-CD1 3.79Å; Y110-L140 HydrophobicContact CD1-CG 4.32Å; Y110-L140 HydrophobicContact CE1-CD1 4.07Å; Y110-L140 HydrophobicContact CE1-CD2 4.47Å; Y110-L140 HydrophobicContact CE1-CG 4.08Å; V121-L140 HydrophobicContact CG1-CD1 3.61Å; V121-L140 HydrophobicContact CG1-CD2 4.34Å; V121-L140 HydrophobicContact CG2-CD1 4.03Å; L140-F161 HydrophobicContact CD2-CD1 3.86Å; L140-F161 HydrophobicContact CD2-CE1 4.26Å; L140-A162 HydrophobicContact CD2-CB 4.23Å; L140-S168 PolarHBondContact N-O 2.57Å; L140-I169 HydrophobicContact CB-CB 4.34Å; L140-I169 HydrophobicContact CB-CG1 4.25Å; L140-I169 HydrophobicContact CD2-CD1 3.91Å; L140-I169 HydrophobicContact CD2-CG1 4.3Å; L140-I169 HydrophobicContact CG-CD1 4.19Å; L140-I169 HydrophobicContact CG-CG1 4.15Å; L140-I169 VanDerWaalsContact O-CA 3.25Å; L140-I169 WeakPolarHBondContact O-CA 3.26Å; L140-M170 PolarHBondContact O-N 3.48Å
141	L	98.8	Very high	96.1	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123	-178.4	-60.9	-174.1	0	0	0	112	L48 L107 I108 V109 Y110 L139 M170 V172 A183	L48-L141 HydrophobicContact CD1-CD1 4.36Å; L107-L141 HydrophobicContact CB-CD1 4.19Å; L107-L141 HydrophobicContact CD1-CD1 3.96Å; L107-L141 HydrophobicContact CD2-CD1 3.87Å; L107-L141 HydrophobicContact CD2-CG 4.24Å; L107-L141 HydrophobicContact CG-CD1 4.23Å; I108-L141 PolarHBondContact O-N 3.36Å; V109-L141 WeakPolarHBondContact CA-O 3.48Å; V109-L141 HydrophobicContact CG2-CB 4.31Å; V109-L141 HydrophobicContact CG2-CD1 4.47Å; Y110-L141 WeakPolarHBondContact CD1-O 3.21Å; Y110-L141 PolarHBondContact N-O 3.33Å; L139-L141 HydrophobicContact CD2-CD2 3.76Å; L139-L141 HydrophobicContact CG-CD2 3.92Å; L141-M170 VanDerWaalsContact CA-O 3.31Å; L141-M170 WeakPolarHBondContact CA-O 2.89Å; L141-M170 HydrophobicContact CD2-CB 3.95Å; L141-V172 HydrophobicContact CB-CG2 4.2Å; L141-V172 HydrophobicContact CD1-CG1 4.45Å; L141-V172 HydrophobicContact CD1-CG2 4.36Å; L141-V172 HydrophobicContact CD2-CG1 4.05Å; L141-A183 HydrophobicContact CD1-CB 4.1Å; L141-A183 HydrophobicContact CD2-CB 3.88Å
142	G	98.8	Very high	96.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	108.1	164.9	0	0	0	0	0	110.4	Y110 M170 E171 V172	Y110-G142 VanDerWaalsContact CE1-CA 3.41Å; Y110-G142 VanDerWaalsContact CZ-CA 3.41Å; G142-M170 PolarHBondContact N-O 2.58Å; G142-E171 CarbonylContact O-C 3.52Å; G142-E171 VanDerWaalsContact O-CA 3.3Å; G142-E171 WeakPolarHBondContact O-CA 3.44Å; G142-V172 PolarHBondContact O-N 2.67Å
143	T	98.6	Very high	96.9	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	165	-179.8	54.5	0	0	0	0	113	V43 L48 V109 Y110 D111 I112 C145 V172	V43-T143 VanDerWaalsContact O-CB 3.31Å; V43-T143 WeakPolarHBondContact O-CB 3.18Å; V43-T143 PolarHBondContact O-OG1 3.33Å; L48-T143 HydrophobicContact CD1-CG2 3.57Å; L48-T143 HydrophobicContact CG-CG2 4.19Å; V109-T143 HydrophobicContact CG1-CG2 3.23Å; Y110-T143 PolarHBondContact O-N 2.55Å; Y110-T143 PolarHBondContact O-OG1 2.75Å; D111-T143 WeakPolarHBondContact CA-OG1 3.49Å; I112-T143 WeakPolarHBondContact CG1-O 3.47Å; I112-T143 WeakPolarHBondContact CG2-O 3.46Å; I112-T143 PolarHBondContact N-O 2.99Å; T143-C145 VanDerWaalsContact C-N 3.27Å; T143-C145 PolarHBondContact O-N 2.68Å; T143-V172 CarbonylContact C-O 3.5Å; T143-V172 VanDerWaalsContact CA-O 3.3Å; T143-V172 WeakPolarHBondContact CA-O 3.44Å; T143-V172 HydrophobicContact CG2-CG2 3.74Å
144	K	97.9	Very high	97.3	Very high	54 Å²	54	52.4 Å²	52.4	24%	0.235	28%	0.275	C	S	.	.			trans	64	34.6	176.5	-46.3	-174.2	-167.1	171.3	0	111.6	G42 D111 I112 D146 M147 V172	G42-K144 PolarHBondContact O-NZ 3.1Å; D111-K144 WeakPolarHBondContact OD2-CD 3.43Å; D111-K144 WeakPolarHBondContact OD2-CE 3.4Å; D111-K144 IonicContact OD2-NZ 3.38Å; D111-K144 PolarHBondContact OD2-NZ 2.93Å; I112-K144 WeakPolarHBondContact CD1-O 3.43Å; K144-D146 PolarHBondContact O-N 3Å; K144-M147 HydrophobicContact CB-CG 4.19Å; K144-M147 HydrophobicContact CB-SD 4.1Å; K144-M147 HydrophobicContact CD-CE 4.28Å; K144-M147 HydrophobicContact CD-SD 4.04Å; K144-M147 WeakPolarHBondContact O-CB 3.28Å; K144-M147 PolarHBondContact O-N 2.78Å; K144-V172 PolarHBondContact N-O 2.95Å
145	C	98.2	Very high	97.6	Very high	20 Å²	20	49 Å²	49	14%	0.135	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.9	177.8	68.9	0	0	0	0	114.1	T143 M147 E171 V172	T143-C145 VanDerWaalsContact C-N 3.27Å; T143-C145 PolarHBondContact O-N 2.68Å; C145-M147 VanDerWaalsContact C-N 3.25Å; C145-M147 PolarHBondContact O-N 3.2Å; C145-E171 HydrophobicContact CB-CB 3.81Å; C145-V172 PolarHBondContact N-O 3.28Å; C145-V172 PolarHBondContact SG-O 2.87Å
146	D	98	Very high	97.9	Very high	42 Å²	42	49.7 Å²	49.7	23%	0.225	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.8	168.7	62.1	-76.2	0	0	0	114.2	K144 T148 S173 R175 T176	K144-D146 PolarHBondContact O-N 3Å; D146-T148 VanDerWaalsContact C-N 3.31Å; D146-T148 PolarHBondContact O-N 3.04Å; D146-S173 VanDerWaalsContact OD1-CB 3.31Å; D146-S173 WeakPolarHBondContact OD1-CB 3.34Å; D146-S173 PolarHBondContact OD1-OG 2.91Å; D146-R175 WeakPolarHBondContact OD2-CD 3.15Å; D146-R175 IonicContact OD2-NH1 2.73Å; D146-R175 PolarHBondContact OD2-NH1 3.21Å; D146-T176 HydrophobicContact CB-CG2 3.77Å
147	M	97.1	Very high	98.1	Very high	63 Å²	63	52.1 Å²	52.1	31%	0.31	27%	0.272	S	S	.	.			trans	-91.7	51.5	-179	-61.2	-171	174.7	0	0	112.2	T113 K144 C145 E149 L150 R151	T113-M147 HydrophobicContact CG2-CB 3.71Å; T113-M147 HydrophobicContact CG2-CG 4.47Å; T113-M147 HydrophobicContact CG2-SD 4.02Å; K144-M147 HydrophobicContact CB-CG 4.19Å; K144-M147 HydrophobicContact CB-SD 4.1Å; K144-M147 HydrophobicContact CD-CE 4.28Å; K144-M147 HydrophobicContact CD-SD 4.04Å; K144-M147 WeakPolarHBondContact O-CB 3.28Å; K144-M147 PolarHBondContact O-N 2.78Å; C145-M147 VanDerWaalsContact C-N 3.25Å; C145-M147 PolarHBondContact O-N 3.2Å; M147-E149 VanDerWaalsContact C-N 3.3Å; M147-E149 PolarHBondContact O-N 3.06Å; M147-L150 HydrophobicContact CB-CB 4.32Å; M147-L150 PolarHBondContact O-N 2.8Å; M147-L150 HydrophobicContact SD-CD1 4.39Å; M147-R151 PolarHBondContact O-N 2.98Å
148	T	96.7	Very high	98.1	Very high	90 Å²	90	50 Å²	50	55%	0.552	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-53	-44	-175.2	-50.8	0	0	0	0	113.2	D146 L150 R151	D146-T148 VanDerWaalsContact C-N 3.31Å; D146-T148 PolarHBondContact O-N 3.04Å; T148-L150 PolarHBondContact O-N 2.89Å; T148-R151 VanDerWaalsContact O-CB 3.28Å; T148-R151 WeakPolarHBondContact O-CB 3.3Å; T148-R151 PolarHBondContact O-N 3.14Å
149	E	97.5	Very high	98.2	Very high	181 Å²	181	54 Å²	54	85%	0.846	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-67.8	-20.4	-179.2	-56.8	-55.4	143	0	0	113.8	M147	M147-E149 VanDerWaalsContact C-N 3.3Å; M147-E149 PolarHBondContact O-N 3.06Å
150	L	97.8	Very high	98.2	Very high	109 Å²	109	60.1 Å²	60.1	57%	0.571	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-104.4	5.1	180	-60	178	0	0	0	112.2	T113 M147 T148 K152	T113-L150 WeakPolarHBondContact CA-O 3.32Å; T113-L150 WeakPolarHBondContact CB-O 3.4Å; T113-L150 HydrophobicContact CG2-CB 3.76Å; T113-L150 WeakPolarHBondContact CG2-O 3.4Å; M147-L150 HydrophobicContact CB-CB 4.32Å; M147-L150 PolarHBondContact O-N 2.8Å; M147-L150 HydrophobicContact SD-CD1 4.39Å; T148-L150 PolarHBondContact O-N 2.89Å; L150-K152 PolarHBondContact O-N 2.81Å
151	R	98.4	Very high	98.2	Very high	72 Å²	72	62.3 Å²	62.3	27%	0.272	32%	0.321	S	S	.	.			trans	-59.9	126.1	-178.9	178.5	180	-70.6	-89.4	7.4	110.2	I112 M147 T148 V153 E171	I112-R151 HydrophobicContact CD1-CB 4.23Å; I112-R151 HydrophobicContact CD1-CG 4.29Å; M147-R151 PolarHBondContact O-N 2.98Å; T148-R151 VanDerWaalsContact O-CB 3.28Å; T148-R151 WeakPolarHBondContact O-CB 3.3Å; T148-R151 PolarHBondContact O-N 3.14Å; R151-V153 WeakPolarHBondContact CG-O 3.46Å; R151-V153 PolarHBondContact NH1-O 2.85Å; R151-E171 IonicContact CZ-OE1 3.43Å; R151-E171 VanDerWaalsContact CZ-OE1 3.28Å; R151-E171 IonicContact CZ-OE2 3.28Å; R151-E171 IonicContact NH1-OE1 3.9Å; R151-E171 PolarHBondContact NH1-OE1 2.79Å; R151-E171 IonicContact NH1-OE2 2.66Å; R151-E171 VanDerWaalsContact NH2-CD 3.25Å; R151-E171 IonicContact NH2-OE1 3.73Å; R151-E171 PolarHBondContact NH2-OE1 3.22Å; R151-E171 IonicContact NH2-OE2 3.02Å; R151-E171 PolarHBondContact NH2-OE2 2.81Å
152	K	98.5	Very high	98.1	Very high	130 Å²	130	62.3 Å²	62.3	57%	0.565	32%	0.322	S	S	*	.			trans	-119.1	-15.1	172.8	-58.2	-173.9	-162.7	149	0	113	I112 T113 P115 L150	I112-K152 PolarHBondContact O-N 2.88Å; T113-K152 VanDerWaalsContact O-CD 3.26Å; T113-K152 WeakPolarHBondContact O-CD 3.44Å; T113-K152 WeakPolarHBondContact O-CE 3.3Å; T113-K152 PolarHBondContact O-NZ 3.43Å; P115-K152 HydrophobicContact CG-CB 3.52Å; P115-K152 HydrophobicContact CG-CD 4.1Å; P115-K152 HydrophobicContact CG-CG 4.47Å; L150-K152 PolarHBondContact O-N 2.81Å
153	V	98.5	Very high	98.1	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.03	35%	0.35	C	S	.	.	S	Bend	trans	-107.9	106.3	172.6	-173.4	0	0	0	0	108.6	Y110 I112 P115 F118 R151	Y110-V153 HydrophobicContact CE2-CB 4.09Å; Y110-V153 HydrophobicContact CE2-CG1 3.78Å; Y110-V153 HydrophobicContact CE2-CG2 4.46Å; I112-V153 PolarHBondContact O-N 2.99Å; P115-V153 HydrophobicContact CB-CG2 4.48Å; P115-V153 HydrophobicContact CG-CG2 4.46Å; F118-V153 HydrophobicContact CB-CG1 4.23Å; F118-V153 HydrophobicContact CB-CG2 3.9Å; F118-V153 HydrophobicContact CD1-CG1 4.11Å; F118-V153 HydrophobicContact CD2-CG1 4.08Å; F118-V153 HydrophobicContact CG-CG1 3.86Å; F118-V153 HydrophobicContact CG-CG2 4.4Å; R151-V153 WeakPolarHBondContact CG-O 3.46Å; R151-V153 PolarHBondContact NH1-O 2.85Å
154	P	98.3	Very high	98.1	Very high	68 Å²	68	69.7 Å²	69.7	44%	0.442	38%	0.378	S	S	.	.			trans	-62.4	138.8	172	-21.4	33.6	0	0	0	110.8	A156 T157 A158	P154-A156 PolarHBondContact O-N 2.95Å; P154-T157 WeakPolarHBondContact O-CB 3.4Å; P154-T157 PolarHBondContact O-N 2.81Å; P154-T157 VanDerWaalsContact O-N 3.07Å; P154-A158 PolarHBondContact O-N 3.43Å
155	F	98.3	Very high	98	Very high	70 Å²	70	69.7 Å²	69.7	31%	0.307	38%	0.378	S	S	.	.	H	α-helix	trans	-56	-41	178	-178	-105.5	0	0	0	112	T157 A158 E159 I169 E171	F155-T157 VanDerWaalsContact C-N 3.27Å; F155-T157 PolarHBondContact O-N 2.72Å; F155-A158 CarbonylContact O-C 3.57Å; F155-A158 PolarHBondContact O-N 2.92Å; F155-E159 HydrophobicContact CE1-CB 4.26Å; F155-E159 HydrophobicContact CE1-CG 4.5Å; F155-E159 WeakPolarHBondContact O-CB 3.35Å; F155-E159 PolarHBondContact O-N 2.81Å; F155-I169 HydrophobicContact CE2-CD1 4.11Å; F155-I169 HydrophobicContact CE2-CG1 4.08Å; F155-I169 HydrophobicContact CE2-CG2 4.23Å; F155-I169 HydrophobicContact CZ-CG2 3.97Å; F155-E171 HydrophobicContact CD2-CG 3.55Å; F155-E171 WeakPolarHBondContact CD2-OE1 3.29Å; F155-E171 HydrophobicContact CE2-CG 3.85Å
156	A	98.3	Very high	97.9	Very high	56 Å²	56	76.2 Å²	76.2	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-56.2	-37.7	177.3	0	0	0	0	0	113.3	P154 E159 L160	P154-A156 PolarHBondContact O-N 2.95Å; A156-E159 PolarHBondContact O-N 2.87Å; A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.24Å; A156-L160 PolarHBondContact O-N 2.98Å
157	T	98.1	Very high	97.9	Very high	68 Å²	68	75.2 Å²	75.2	42%	0.417	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-42.6	176	-56.4	0	0	0	0	111.2	F118 P154 F155 F161	F118-T157 HydrophobicContact CE1-CG2 4Å; F118-T157 HydrophobicContact CZ-CG2 4.43Å; P154-T157 WeakPolarHBondContact O-CB 3.4Å; P154-T157 PolarHBondContact O-N 2.81Å; P154-T157 VanDerWaalsContact O-N 3.07Å; F155-T157 VanDerWaalsContact C-N 3.27Å; F155-T157 PolarHBondContact O-N 2.72Å; T157-F161 PolarHBondContact O-N 2.88Å
158	A	98.3	Very high	97.9	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-72.8	-34.2	179.4	0	0	0	0	0	112.5	Y110 F118 P154 F155 F161 A162 I169	Y110-A158 HydrophobicContact CE1-CB 4.27Å; Y110-A158 WeakPolarHBondContact OH-CB 3.47Å; F118-A158 HydrophobicContact CD2-CB 4.3Å; F118-A158 HydrophobicContact CE2-CB 3.52Å; F118-A158 HydrophobicContact CZ-CB 3.99Å; P154-A158 PolarHBondContact O-N 3.43Å; F155-A158 CarbonylContact O-C 3.57Å; F155-A158 PolarHBondContact O-N 2.92Å; A158-F161 PolarHBondContact O-N 3.4Å; A158-A162 WeakPolarHBondContact O-CB 3.34Å; A158-A162 PolarHBondContact O-N 2.8Å; A158-I169 VanDerWaalsContact C-CD1 3.46Å; A158-I169 HydrophobicContact CB-CD1 3.3Å
159	E	98.4	Very high	98	Very high	100 Å²	100	71.3 Å²	71.3	47%	0.467	39%	0.386	S	S	.	.	H	α-helix	trans	-65.4	-44.4	174.6	-174.4	175.7	-120.8	0	0	112	F155 A156 F161 A162 S163 I169	F155-E159 HydrophobicContact CE1-CB 4.26Å; F155-E159 HydrophobicContact CE1-CG 4.5Å; F155-E159 WeakPolarHBondContact O-CB 3.35Å; F155-E159 PolarHBondContact O-N 2.81Å; A156-E159 PolarHBondContact O-N 2.87Å; E159-F161 VanDerWaalsContact C-N 3.33Å; E159-F161 PolarHBondContact O-N 3.42Å; E159-A162 PolarHBondContact O-N 3.2Å; E159-S163 WeakPolarHBondContact O-CB 3.29Å; E159-S163 PolarHBondContact O-N 2.78Å; E159-I169 HydrophobicContact CB-CG2 4.41Å; E159-I169 HydrophobicContact CG-CG2 4.45Å
160	L	98.4	Very high	98	Very high	130 Å²	130	63.9 Å²	63.9	68%	0.681	35%	0.352	S	S	*	.	H	α-helix	trans	-59.2	-43.6	173.3	-73.3	172.4	0	0	0	111.9	A156 A164	A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.24Å; A156-L160 PolarHBondContact O-N 2.98Å; L160-A164 WeakPolarHBondContact O-CB 3.31Å; L160-A164 PolarHBondContact O-N 2.79Å
161	F	98.4	Very high	98.1	Very high	46 Å²	46	60.3 Å²	60.3	20%	0.202	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-47	174.8	174.6	-88.2	0	0	0	111.8	F118 V121 Q122 L140 T157 A158 E159 S163 A164 Q165	F118-F161 HydrophobicContact CZ-CB 3.9Å; F118-F161 HydrophobicContact CZ-CG 4.19Å; V121-F161 HydrophobicContact CB-CE1 4.43Å; V121-F161 HydrophobicContact CG1-CD1 4.27Å; V121-F161 HydrophobicContact CG1-CE1 3.45Å; V121-F161 VanDerWaalsContact CG1-CE1 3.45Å; V121-F161 HydrophobicContact CG1-CZ 3.85Å; Q122-F161 HydrophobicContact CB-CE2 4.32Å; Q122-F161 HydrophobicContact CB-CZ 4.34Å; L140-F161 HydrophobicContact CD2-CD1 3.86Å; L140-F161 HydrophobicContact CD2-CE1 4.26Å; T157-F161 PolarHBondContact O-N 2.88Å; A158-F161 PolarHBondContact O-N 3.4Å; E159-F161 VanDerWaalsContact C-N 3.33Å; E159-F161 PolarHBondContact O-N 3.42Å; F161-S163 PolarHBondContact O-N 3.48Å; F161-A164 PolarHBondContact O-N 3.34Å; F161-Q165 HydrophobicContact CE1-CG 4Å; F161-Q165 HydrophobicContact CE2-CG 4.15Å; F161-Q165 HydrophobicContact CZ-CG 3.81Å; F161-Q165 PolarHBondContact O-N 2.83Å; F161-Q165 VanDerWaalsContact O-N 3.11Å
162	A	98.4	Very high	98.1	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-46.5	-179.2	0	0	0	0	0	111.3	L140 A158 E159 A164 Q165 N166 L167 I169	L140-A162 HydrophobicContact CD2-CB 4.23Å; A158-A162 WeakPolarHBondContact O-CB 3.34Å; A158-A162 PolarHBondContact O-N 2.8Å; E159-A162 PolarHBondContact O-N 3.2Å; A162-A164 PolarHBondContact O-N 2.94Å; A162-Q165 CarbonylContact O-C 3.53Å; A162-Q165 PolarHBondContact O-N 3.25Å; A162-Q165 VanDerWaalsContact O-N 3.1Å; A162-N166 PolarHBondContact O-N 2.68Å; A162-L167 CarbonylContact C-O 3.57Å; A162-L167 HydrophobicContact CB-CB 4.24Å; A162-L167 PolarHBondContact O-N 2.83Å; A162-I169 HydrophobicContact CB-CB 3.82Å; A162-I169 HydrophobicContact CB-CD1 4.49Å; A162-I169 HydrophobicContact CB-CG2 3.98Å
163	S	97.8	Very high	98.1	Very high	87 Å²	87	50.8 Å²	50.8	61%	0.608	29%	0.293	S	S	*	.	H	α-helix	trans	-58	-46.7	175.6	179.7	0	0	0	0	111.9	E159 F161 Q165 N166	E159-S163 WeakPolarHBondContact O-CB 3.29Å; E159-S163 PolarHBondContact O-N 2.78Å; F161-S163 PolarHBondContact O-N 3.48Å; S163-Q165 PolarHBondContact O-N 3.29Å; S163-N166 PolarHBondContact O-N 3.19Å; S163-N166 VanDerWaalsContact O-N 3.08Å
164	A	98	Very high	98	Very high	72 Å²	72	51 Å²	51	60%	0.595	30%	0.295	S	S	*	.	H	α-helix	trans	-62.7	-25.4	177.8	0	0	0	0	0	113.7	L160 F161 A162	L160-A164 WeakPolarHBondContact O-CB 3.31Å; L160-A164 PolarHBondContact O-N 2.79Å; F161-A164 PolarHBondContact O-N 3.34Å; A162-A164 PolarHBondContact O-N 2.94Å
165	Q	97.3	Very high	97.9	Very high	53 Å²	53	54.8 Å²	54.8	25%	0.248	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	5.3	177.3	-65.2	-60	-51.3	0	0	113.7	L125 F161 A162 S163 L167	L125-Q165 HydrophobicContact CD2-CB 3.96Å; L125-Q165 HydrophobicContact CD2-CG 3.79Å; F161-Q165 HydrophobicContact CE1-CG 4Å; F161-Q165 HydrophobicContact CE2-CG 4.15Å; F161-Q165 HydrophobicContact CZ-CG 3.81Å; F161-Q165 PolarHBondContact O-N 2.83Å; F161-Q165 VanDerWaalsContact O-N 3.11Å; A162-Q165 CarbonylContact O-C 3.53Å; A162-Q165 PolarHBondContact O-N 3.25Å; A162-Q165 VanDerWaalsContact O-N 3.1Å; S163-Q165 PolarHBondContact O-N 3.29Å; Q165-L167 HydrophobicContact CB-CD1 3.94Å; Q165-L167 HydrophobicContact CB-CG 3.83Å; Q165-L167 PolarHBondContact O-N 2.63Å
166	N	96.5	Very high	97.9	Very high	157 Å²	157	55.6 Å²	55.6	84%	0.84	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	38.1	-172.3	-60.3	-53.6	0	0	0	113.3	A162 S163	A162-N166 PolarHBondContact O-N 2.68Å; S163-N166 PolarHBondContact O-N 3.19Å; S163-N166 VanDerWaalsContact O-N 3.08Å
167	L	97.5	Very high	97.9	Very high	22 Å²	22	56.7 Å²	56.7	12%	0.115	31%	0.31	C	S	.	.			trans	-103.9	150.3	176.3	-59.2	-179.3	0	0	0	109.8	L125 V138 A162 Q165	L125-L167 HydrophobicContact CD1-CD1 4.07Å; L125-L167 HydrophobicContact CD1-CD2 4.39Å; L125-L167 HydrophobicContact CD2-CD1 3.96Å; V138-L167 HydrophobicContact CB-CD2 3.69Å; V138-L167 HydrophobicContact CG1-CD1 4.42Å; V138-L167 HydrophobicContact CG1-CD2 3.81Å; A162-L167 CarbonylContact C-O 3.57Å; A162-L167 HydrophobicContact CB-CB 4.24Å; A162-L167 PolarHBondContact O-N 2.83Å; Q165-L167 HydrophobicContact CB-CD1 3.94Å; Q165-L167 HydrophobicContact CB-CG 3.83Å; Q165-L167 PolarHBondContact O-N 2.63Å
168	S	96.4	Very high	97.9	Very high	40 Å²	40	55.7 Å²	55.7	28%	0.28	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	155.7	162.1	-59.6	0	0	0	0	110.5	L139 L140 R190	L139-S168 WeakPolarHBondContact CD1-O 3.29Å; L140-S168 PolarHBondContact N-O 2.57Å; S168-R190 VanDerWaalsContact CB-CZ 3.46Å; S168-R190 PolarHBondContact OG-NH1 3.2Å; S168-R190 PolarHBondContact OG-NH2 2.97Å
169	I	98.5	Very high	97.9	Very high	30 Å²	30	58.6 Å²	58.6	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.5	-175.1	-173.5	172.5	0	0	0	110.7	L140 F155 A158 E159 A162	L140-I169 HydrophobicContact CB-CB 4.34Å; L140-I169 HydrophobicContact CB-CG1 4.25Å; L140-I169 HydrophobicContact CD2-CD1 3.91Å; L140-I169 HydrophobicContact CD2-CG1 4.3Å; L140-I169 HydrophobicContact CG-CD1 4.19Å; L140-I169 HydrophobicContact CG-CG1 4.15Å; L140-I169 VanDerWaalsContact O-CA 3.25Å; L140-I169 WeakPolarHBondContact O-CA 3.26Å; F155-I169 HydrophobicContact CE2-CD1 4.11Å; F155-I169 HydrophobicContact CE2-CG1 4.08Å; F155-I169 HydrophobicContact CE2-CG2 4.23Å; F155-I169 HydrophobicContact CZ-CG2 3.97Å; A158-I169 VanDerWaalsContact C-CD1 3.46Å; A158-I169 HydrophobicContact CB-CD1 3.3Å; E159-I169 HydrophobicContact CB-CG2 4.41Å; E159-I169 HydrophobicContact CG-CG2 4.45Å; A162-I169 HydrophobicContact CB-CB 3.82Å; A162-I169 HydrophobicContact CB-CD1 4.49Å; A162-I169 HydrophobicContact CB-CG2 3.98Å
170	M	98.4	Very high	97.9	Very high	26 Å²	26	53.9 Å²	53.9	13%	0.128	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149	174.2	-176.9	176.8	-71.9	0	0	110.5	L140 L141 G142 V172 N179 T182 A183 E186	L140-M170 PolarHBondContact O-N 3.48Å; L141-M170 VanDerWaalsContact CA-O 3.31Å; L141-M170 WeakPolarHBondContact CA-O 2.89Å; L141-M170 HydrophobicContact CD2-CB 3.95Å; G142-M170 PolarHBondContact N-O 2.58Å; M170-V172 HydrophobicContact CG-CG1 4.28Å; M170-V172 HydrophobicContact SD-CG1 4.44Å; M170-N179 HydrophobicContact CG-CB 4.09Å; M170-N179 HydrophobicContact SD-CB 3.64Å; M170-T182 HydrophobicContact CE-CG2 3.71Å; M170-T182 HydrophobicContact SD-CG2 4.15Å; M170-A183 HydrophobicContact SD-CB 4.07Å; M170-E186 WeakPolarHBondContact CE-OE2 3.48Å
171	E	98.7	Very high	97.8	Very high	33 Å²	33	53 Å²	53	15%	0.154	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.8	169.1	-71.6	-165.8	162.6	0	0	111.5	G142 C145 R151 F155 N179	G142-E171 CarbonylContact O-C 3.52Å; G142-E171 VanDerWaalsContact O-CA 3.3Å; G142-E171 WeakPolarHBondContact O-CA 3.44Å; C145-E171 HydrophobicContact CB-CB 3.81Å; R151-E171 IonicContact CZ-OE1 3.43Å; R151-E171 VanDerWaalsContact CZ-OE1 3.28Å; R151-E171 IonicContact CZ-OE2 3.28Å; R151-E171 IonicContact NH1-OE1 3.9Å; R151-E171 PolarHBondContact NH1-OE1 2.79Å; R151-E171 IonicContact NH1-OE2 2.66Å; R151-E171 VanDerWaalsContact NH2-CD 3.25Å; R151-E171 IonicContact NH2-OE1 3.73Å; R151-E171 PolarHBondContact NH2-OE1 3.22Å; R151-E171 IonicContact NH2-OE2 3.02Å; R151-E171 PolarHBondContact NH2-OE2 2.81Å; F155-E171 HydrophobicContact CD2-CG 3.55Å; F155-E171 WeakPolarHBondContact CD2-OE1 3.29Å; F155-E171 HydrophobicContact CE2-CG 3.85Å; E171-N179 WeakPolarHBondContact O-CB 3.33Å; E171-N179 PolarHBondContact O-ND2 3.38Å
172	V	98.7	Very high	97.8	Very high	1 Å²	1	54 Å²	54	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.9	-173	-61.5	0	0	0	0	111.8	L48 L141 G142 T143 K144 C145 M170 C178 N179 A183	L48-V172 HydrophobicContact CD1-CG2 4.05Å; L48-V172 HydrophobicContact CD2-CB 4.1Å; L48-V172 HydrophobicContact CD2-CG2 3.68Å; L48-V172 HydrophobicContact CG-CG2 4.47Å; L141-V172 HydrophobicContact CB-CG2 4.2Å; L141-V172 HydrophobicContact CD1-CG1 4.45Å; L141-V172 HydrophobicContact CD1-CG2 4.36Å; L141-V172 HydrophobicContact CD2-CG1 4.05Å; G142-V172 PolarHBondContact O-N 2.67Å; T143-V172 CarbonylContact C-O 3.5Å; T143-V172 VanDerWaalsContact CA-O 3.3Å; T143-V172 WeakPolarHBondContact CA-O 3.44Å; T143-V172 HydrophobicContact CG2-CG2 3.74Å; K144-V172 PolarHBondContact N-O 2.95Å; C145-V172 PolarHBondContact N-O 3.28Å; C145-V172 PolarHBondContact SG-O 2.87Å; M170-V172 HydrophobicContact CG-CG1 4.28Å; M170-V172 HydrophobicContact SD-CG1 4.44Å; V172-C178 WeakPolarHBondContact CA-O 3.31Å; V172-N179 HydrophobicContact CG1-CB 3.9Å; V172-A183 HydrophobicContact CG1-CB 4.07Å
173	S	98.4	Very high	97.8	Very high	1 Å²	1	54 Å²	54	1%	0.007	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-134.8	114.3	169.5	176	0	0	0	0	111.1	D146 R175 T176 D177 C178 V180	D146-S173 VanDerWaalsContact OD1-CB 3.31Å; D146-S173 WeakPolarHBondContact OD1-CB 3.34Å; D146-S173 PolarHBondContact OD1-OG 2.91Å; S173-R175 PolarHBondContact O-N 3.23Å; S173-R175 WeakPolarHBondContact OG-CB 3.39Å; S173-R175 PolarHBondContact OG-N 3.25Å; S173-R175 VanDerWaalsContact OG-N 3.1Å; S173-T176 VanDerWaalsContact CB-OG1 3.23Å; S173-T176 WeakPolarHBondContact CB-OG1 3.43Å; S173-T176 PolarHBondContact OG-N 3.46Å; S173-T176 VanDerWaalsContact OG-N 3.13Å; S173-T176 PolarHBondContact OG-OG1 3.33Å; S173-D177 CarbonylContact O-C 3.55Å; S173-D177 WeakPolarHBondContact O-CA 3.26Å; S173-D177 PolarHBondContact O-N 3.27Å; S173-C178 PolarHBondContact N-O 3.45Å; S173-C178 PolarHBondContact O-N 3.01Å; S173-V180 WeakPolarHBondContact O-CG2 3.47Å
174	A	97.4	Very high	97.8	Very high	10 Å²	10	50 Å²	50	8%	0.083	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.6	168.3	0	0	0	0	0	112.3	A47 L48 R51 F57	A47-A174 HydrophobicContact CB-CB 3.84Å; A47-A174 WeakPolarHBondContact O-CB 3.45Å; L48-A174 HydrophobicContact CD2-CB 4.11Å; L48-A174 HydrophobicContact CG-CB 4.47Å; R51-A174 HydrophobicContact CB-CB 4.3Å; R51-A174 VanDerWaalsContact CZ-O 3.3Å; R51-A174 PolarHBondContact NE-O 3.02Å; R51-A174 PolarHBondContact NH2-O 2.87Å; F57-A174 HydrophobicContact CD2-CB 4.13Å; F57-A174 VanDerWaalsContact CD2-O 3.32Å; F57-A174 WeakPolarHBondContact CD2-O 3.39Å; F57-A174 HydrophobicContact CE2-CB 4.09Å
175	R	96.8	Very high	97.8	Very high	148 Å²	148	47.3 Å²	47.3	56%	0.558	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-49.8	-177.3	-172	-169	-178.5	178.7	-2.2	111.5	R51 F57 D146 S173	R51-R175 PolarHBondContact NH2-O 3Å; F57-R175 HydrophobicContact CD1-CG 4.29Å; F57-R175 VanDerWaalsContact CD2-CA 3.47Å; F57-R175 HydrophobicContact CD2-CB 4.09Å; F57-R175 HydrophobicContact CE1-CB 4.49Å; F57-R175 HydrophobicContact CE1-CG 4.24Å; F57-R175 HydrophobicContact CE2-CB 3.92Å; F57-R175 HydrophobicContact CG-CB 4.44Å; F57-R175 HydrophobicContact CG-CG 4.45Å; F57-R175 HydrophobicContact CZ-CB 4.14Å; F57-R175 HydrophobicContact CZ-CG 4.36Å; D146-R175 WeakPolarHBondContact OD2-CD 3.15Å; D146-R175 IonicContact OD2-NH1 2.73Å; D146-R175 PolarHBondContact OD2-NH1 3.21Å; S173-R175 PolarHBondContact O-N 3.23Å; S173-R175 WeakPolarHBondContact OG-CB 3.39Å; S173-R175 PolarHBondContact OG-N 3.25Å; S173-R175 VanDerWaalsContact OG-N 3.1Å
176	T	97.1	Very high	97.8	Very high	86 Å²	86	46.9 Å²	46.9	53%	0.528	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.3	-178.7	60.3	0	0	0	0	113.4	D146 S173 C178	D146-T176 HydrophobicContact CB-CG2 3.77Å; S173-T176 VanDerWaalsContact CB-OG1 3.23Å; S173-T176 WeakPolarHBondContact CB-OG1 3.43Å; S173-T176 PolarHBondContact OG-N 3.46Å; S173-T176 VanDerWaalsContact OG-N 3.13Å; S173-T176 PolarHBondContact OG-OG1 3.33Å; T176-C178 PolarHBondContact O-N 2.94Å; T176-C178 WeakPolarHBondContact OG1-CB 3.39Å
177	D	97.7	Very high	97.9	Very high	79 Å²	79	39.4 Å²	39.4	42%	0.422	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	17.2	-172.6	-156.6	32.2	0	0	0	113.7	R51 S173 N179	R51-D177 VanDerWaalsContact CD-OD1 3.23Å; R51-D177 WeakPolarHBondContact CD-OD1 3.24Å; R51-D177 HydrophobicContact CG-CB 4.5Å; R51-D177 WeakPolarHBondContact CG-OD1 3.47Å; S173-D177 CarbonylContact O-C 3.55Å; S173-D177 WeakPolarHBondContact O-CA 3.26Å; S173-D177 PolarHBondContact O-N 3.27Å; D177-N179 PolarHBondContact O-N 2.95Å
178	C	98.4	Very high	97.9	Very high	48 Å²	48	38.3 Å²	38.3	32%	0.324	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-63.7	120.8	177	-177.6	0	0	0	0	110	V172 S173 T176 V180	V172-C178 WeakPolarHBondContact CA-O 3.31Å; S173-C178 PolarHBondContact N-O 3.45Å; S173-C178 PolarHBondContact O-N 3.01Å; T176-C178 PolarHBondContact O-N 2.94Å; T176-C178 WeakPolarHBondContact OG1-CB 3.39Å; C178-V180 PolarHBondContact O-N 3.1Å
179	N	98.3	Very high	98	Very high	61 Å²	61	39.1 Å²	39.1	33%	0.326	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	11.4	173.1	-68	-23.9	0	0	0	116.3	M170 E171 V172 D177 T182 A183	M170-N179 HydrophobicContact CG-CB 4.09Å; M170-N179 HydrophobicContact SD-CB 3.64Å; E171-N179 WeakPolarHBondContact O-CB 3.33Å; E171-N179 PolarHBondContact O-ND2 3.38Å; V172-N179 HydrophobicContact CG1-CB 3.9Å; D177-N179 PolarHBondContact O-N 2.95Å; N179-T182 PolarHBondContact O-N 3.26Å; N179-A183 WeakPolarHBondContact O-CB 3.22Å; N179-A183 PolarHBondContact O-N 3.46Å
180	V	98.2	Very high	97.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-56.4	-177.6	179.1	0	0	0	0	109.9	L48 R51 L52 S173 C178 T182 A183 F184	L48-V180 HydrophobicContact CD2-CG2 3.98Å; R51-V180 HydrophobicContact CB-CG1 4.25Å; R51-V180 HydrophobicContact CG-CB 4.2Å; R51-V180 HydrophobicContact CG-CG1 3.94Å; R51-V180 HydrophobicContact CG-CG2 3.97Å; L52-V180 HydrophobicContact CB-CG1 4.13Å; S173-V180 WeakPolarHBondContact O-CG2 3.47Å; C178-V180 PolarHBondContact O-N 3.1Å; V180-T182 VanDerWaalsContact C-N 3.31Å; V180-T182 PolarHBondContact O-N 3.03Å; V180-A183 PolarHBondContact O-N 2.94Å; V180-F184 HydrophobicContact CG1-CD2 4.49Å; V180-F184 HydrophobicContact CG1-CE2 4.26Å; V180-F184 VanDerWaalsContact O-CD2 3.24Å; V180-F184 WeakPolarHBondContact O-CD2 3.37Å
181	Q	96.9	Very high	97.8	Very high	110 Å²	110	40.1 Å²	40.1	51%	0.514	20%	0.201	S	C	.	.	H	α-helix	trans	-61.4	-41.4	177.9	-173.5	177.5	-10.3	0	0	111.8	A183 F184 V185	Q181-A183 PolarHBondContact O-N 3.35Å; Q181-F184 PolarHBondContact O-N 3.32Å; Q181-V185 HydrophobicContact CG-CG2 4.07Å; Q181-V185 WeakPolarHBondContact O-CG2 3.49Å; Q181-V185 PolarHBondContact O-N 3.45Å
182	T	98.1	Very high	97.7	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.423	21%	0.207	S	C	.	.	H	α-helix	trans	-55.5	-48	-180	-44.7	0	0	0	0	111.7	M170 N179 V180 F184 V185 E186	M170-T182 HydrophobicContact CE-CG2 3.71Å; M170-T182 HydrophobicContact SD-CG2 4.15Å; N179-T182 PolarHBondContact O-N 3.26Å; V180-T182 VanDerWaalsContact C-N 3.31Å; V180-T182 PolarHBondContact O-N 3.03Å; T182-F184 PolarHBondContact O-N 3.24Å; T182-V185 PolarHBondContact O-N 3.13Å; T182-E186 VanDerWaalsContact O-CB 3.3Å; T182-E186 WeakPolarHBondContact O-CB 3.39Å; T182-E186 PolarHBondContact O-N 2.85Å
183	A	98.4	Very high	97.5	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-41.7	-179	0	0	0	0	0	113.1	L139 L141 M170 V172 N179 V180 Q181 L187	L139-A183 HydrophobicContact CD2-CB 4.13Å; L141-A183 HydrophobicContact CD1-CB 4.1Å; L141-A183 HydrophobicContact CD2-CB 3.88Å; M170-A183 HydrophobicContact SD-CB 4.07Å; V172-A183 HydrophobicContact CG1-CB 4.07Å; N179-A183 WeakPolarHBondContact O-CB 3.22Å; N179-A183 PolarHBondContact O-N 3.46Å; V180-A183 PolarHBondContact O-N 2.94Å; Q181-A183 PolarHBondContact O-N 3.35Å; A183-L187 WeakPolarHBondContact O-CB 3.48Å; A183-L187 PolarHBondContact O-N 2.55Å
184	F	97.9	Very high	97.3	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-74	-36.9	178.7	-73.1	-85.4	0	0	0	112.6	L52 M84 I86 L107 V180 Q181 T182 A188	L52-F184 HydrophobicContact CB-CD2 4.3Å; L52-F184 HydrophobicContact CB-CE2 4.09Å; L52-F184 HydrophobicContact CD1-CB 4.31Å; L52-F184 HydrophobicContact CD1-CD2 3.81Å; L52-F184 HydrophobicContact CD1-CE2 4.45Å; L52-F184 HydrophobicContact CD1-CG 4.21Å; L52-F184 HydrophobicContact CD2-CB 4.22Å; L52-F184 HydrophobicContact CD2-CD1 3.77Å; L52-F184 HydrophobicContact CD2-CD2 3.58Å; L52-F184 HydrophobicContact CD2-CE1 3.95Å; L52-F184 HydrophobicContact CD2-CE2 3.79Å; L52-F184 HydrophobicContact CD2-CG 3.59Å; L52-F184 HydrophobicContact CD2-CZ 3.97Å; L52-F184 HydrophobicContact CG-CD2 4.09Å; L52-F184 HydrophobicContact CG-CE2 4.33Å; L52-F184 HydrophobicContact CG-CG 4.46Å; M84-F184 HydrophobicContact CE-CB 4.04Å; M84-F184 HydrophobicContact CE-CD1 4.41Å; I86-F184 HydrophobicContact CD1-CD1 3.89Å; I86-F184 HydrophobicContact CD1-CE1 3.52Å; I86-F184 HydrophobicContact CD1-CZ 4.22Å; I86-F184 HydrophobicContact CG1-CD1 4.45Å; I86-F184 HydrophobicContact CG1-CE1 4.08Å; I86-F184 HydrophobicContact CG2-CE1 4.34Å; L107-F184 HydrophobicContact CD1-CD1 3.89Å; L107-F184 HydrophobicContact CD1-CE1 3.44Å; L107-F184 VanDerWaalsContact CD1-CE1 3.44Å; L107-F184 HydrophobicContact CD1-CE2 4.26Å; L107-F184 HydrophobicContact CD1-CG 4.48Å; L107-F184 HydrophobicContact CD1-CZ 3.64Å; V180-F184 HydrophobicContact CG1-CD2 4.49Å; V180-F184 HydrophobicContact CG1-CE2 4.26Å; V180-F184 VanDerWaalsContact O-CD2 3.24Å; V180-F184 WeakPolarHBondContact O-CD2 3.37Å; Q181-F184 PolarHBondContact O-N 3.32Å; T182-F184 PolarHBondContact O-N 3.24Å; F184-A188 WeakPolarHBondContact O-CB 3.49Å; F184-A188 PolarHBondContact O-N 3.1Å; F184-A188 VanDerWaalsContact O-N 3.07Å
185	V	98	Very high	97	Very high	16 Å²	16	50.4 Å²	50.4	10%	0.097	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-48.4	175.9	170	0	0	0	0	110.6	V74 L76 Q181 T182 L187 A188 E189	V74-V185 HydrophobicContact CB-CG2 4.24Å; V74-V185 HydrophobicContact CG2-CG2 4.33Å; L76-V185 HydrophobicContact CD2-CG1 4.4Å; Q181-V185 HydrophobicContact CG-CG2 4.07Å; Q181-V185 WeakPolarHBondContact O-CG2 3.49Å; Q181-V185 PolarHBondContact O-N 3.45Å; T182-V185 PolarHBondContact O-N 3.13Å; V185-L187 VanDerWaalsContact C-N 3.32Å; V185-L187 PolarHBondContact O-N 3.13Å; V185-A188 PolarHBondContact O-N 3.28Å; V185-A188 VanDerWaalsContact O-N 3.11Å; V185-E189 HydrophobicContact CG1-CG 4.27Å; V185-E189 WeakPolarHBondContact O-CG 3.39Å; V185-E189 PolarHBondContact O-N 3.26Å
186	E	98.1	Very high	96.7	Very high	43 Å²	43	49 Å²	49	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-44.6	179.1	179.7	179.1	165.5	0	0	111.7	M170 T182 E189 R190	M170-E186 WeakPolarHBondContact CE-OE2 3.48Å; T182-E186 VanDerWaalsContact O-CB 3.3Å; T182-E186 WeakPolarHBondContact O-CB 3.39Å; T182-E186 PolarHBondContact O-N 2.85Å; E186-E189 PolarHBondContact O-N 3.18Å; E186-R190 VanDerWaalsContact O-CG 3.28Å; E186-R190 WeakPolarHBondContact O-CG 3.49Å; E186-R190 PolarHBondContact O-N 2.78Å; E186-R190 IonicContact OE1-CZ 2.99Å; E186-R190 VanDerWaalsContact OE1-CZ 3.27Å; E186-R190 IonicContact OE1-NE 2.77Å; E186-R190 PolarHBondContact OE1-NE 3.29Å; E186-R190 IonicContact OE1-NH2 3.42Å; E186-R190 PolarHBondContact OE1-NH2 2.98Å
187	L	98.1	Very high	96.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-42.9	176.4	180	59.3	0	0	0	111.7	I35 L107 Q137 A183 V185 R190 I191	I35-L187 HydrophobicContact CD1-CD2 4.04Å; I35-L187 HydrophobicContact CD1-CG 4.37Å; I35-L187 HydrophobicContact CG1-CD2 4.21Å; I35-L187 HydrophobicContact CG2-CD2 3.68Å; L107-L187 HydrophobicContact CD2-CB 4.42Å; L107-L187 HydrophobicContact CD2-CD2 3.6Å; L107-L187 HydrophobicContact CG-CD2 3.82Å; Q137-L187 HydrophobicContact CB-CD1 3.71Å; Q137-L187 WeakPolarHBondContact O-CD1 2.88Å; A183-L187 WeakPolarHBondContact O-CB 3.48Å; A183-L187 PolarHBondContact O-N 2.55Å; V185-L187 VanDerWaalsContact C-N 3.32Å; V185-L187 PolarHBondContact O-N 3.13Å; L187-R190 PolarHBondContact O-N 2.73Å; L187-I191 HydrophobicContact CD1-CD1 4.27Å; L187-I191 HydrophobicContact CD1-CG1 4.48Å; L187-I191 HydrophobicContact CG-CD1 4.08Å; L187-I191 WeakPolarHBondContact O-CD1 3.23Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.44Å; L187-I191 PolarHBondContact O-N 2.9Å; L187-I191 VanDerWaalsContact O-N 3.12Å
188	A	97.5	Very high	95.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-42.5	178.2	0	0	0	0	0	112.2	L76 V82 M84 F184 V185 I191 I192	L76-A188 HydrophobicContact CD2-CB 4.06Å; V82-A188 HydrophobicContact CG1-CB 4.17Å; M84-A188 HydrophobicContact SD-CB 3.93Å; F184-A188 WeakPolarHBondContact O-CB 3.49Å; F184-A188 PolarHBondContact O-N 3.1Å; F184-A188 VanDerWaalsContact O-N 3.07Å; V185-A188 PolarHBondContact O-N 3.28Å; V185-A188 VanDerWaalsContact O-N 3.11Å; A188-I191 PolarHBondContact O-N 3.32Å; A188-I192 VanDerWaalsContact O-CG1 3.31Å; A188-I192 WeakPolarHBondContact O-CG1 3.06Å; A188-I192 PolarHBondContact O-N 3.31Å
189	E	97.6	Very high	95.1	Very high	56 Å²	56	54.3 Å²	54.3	26%	0.262	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-41.2	178.1	-70.6	177.7	160	0	0	112.1	L76 S77 V185 E186 I191 I192 E193	L76-E189 HydrophobicContact CB-CG 4.43Å; L76-E189 HydrophobicContact CD2-CG 3.97Å; S77-E189 WeakPolarHBondContact CA-OE1 3.42Å; S77-E189 WeakPolarHBondContact CB-OE1 3.31Å; S77-E189 PolarHBondContact N-OE1 3.37Å; S77-E189 PolarHBondContact OG-OE1 3.5Å; V185-E189 HydrophobicContact CG1-CG 4.27Å; V185-E189 WeakPolarHBondContact O-CG 3.39Å; V185-E189 PolarHBondContact O-N 3.26Å; E186-E189 PolarHBondContact O-N 3.18Å; E189-I191 VanDerWaalsContact C-N 3.31Å; E189-I191 PolarHBondContact O-N 3.33Å; E189-I192 PolarHBondContact O-N 2.89Å; E189-E193 WeakPolarHBondContact O-CB 3.24Å; E189-E193 PolarHBondContact O-N 3.44Å
190	R	97.1	Very high	93.9	Very high	73 Å²	73	60.2 Å²	60.2	28%	0.275	27%	0.27	S	S	.	.	H	α-helix	trans	-60.6	-40.9	174.1	-71.5	168.5	-177.4	-123	-6.6	112.4	Q137 S168 E186 L187 K194	Q137-R190 HydrophobicContact CB-CB 4.21Å; Q137-R190 HydrophobicContact CG-CB 4.01Å; S168-R190 VanDerWaalsContact CB-CZ 3.46Å; S168-R190 PolarHBondContact OG-NH1 3.2Å; S168-R190 PolarHBondContact OG-NH2 2.97Å; E186-R190 VanDerWaalsContact O-CG 3.28Å; E186-R190 WeakPolarHBondContact O-CG 3.49Å; E186-R190 PolarHBondContact O-N 2.78Å; E186-R190 IonicContact OE1-CZ 2.99Å; E186-R190 VanDerWaalsContact OE1-CZ 3.27Å; E186-R190 IonicContact OE1-NE 2.77Å; E186-R190 PolarHBondContact OE1-NE 3.29Å; E186-R190 IonicContact OE1-NH2 3.42Å; E186-R190 PolarHBondContact OE1-NH2 2.98Å; L187-R190 PolarHBondContact O-N 2.73Å; R190-K194 VanDerWaalsContact O-CB 3.31Å; R190-K194 WeakPolarHBondContact O-CB 3.44Å; R190-K194 PolarHBondContact O-N 3.49Å
191	I	96.6	Very high	91.9	Very high	4 Å²	4	67.4 Å²	67.4	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-48.7	177.8	-66.6	163	0	0	0	109.8	I33 I35 K104 Q137 L187 A188 E189 E193 K194 E195	I33-I191 HydrophobicContact CD1-CG2 4.22Å; I33-I191 HydrophobicContact CG2-CB 4.5Å; I33-I191 HydrophobicContact CG2-CD1 3.56Å; I33-I191 HydrophobicContact CG2-CG2 3.96Å; I35-I191 HydrophobicContact CG1-CD1 4.39Å; K104-I191 HydrophobicContact CB-CD1 4.28Å; K104-I191 HydrophobicContact CB-CG1 4.41Å; K104-I191 HydrophobicContact CB-CG2 3.75Å; Q137-I191 HydrophobicContact CB-CG1 3.79Å; Q137-I191 HydrophobicContact CG-CB 4.44Å; Q137-I191 HydrophobicContact CG-CG1 3.75Å; L187-I191 HydrophobicContact CD1-CD1 4.27Å; L187-I191 HydrophobicContact CD1-CG1 4.48Å; L187-I191 HydrophobicContact CG-CD1 4.08Å; L187-I191 WeakPolarHBondContact O-CD1 3.23Å; L187-I191 VanDerWaalsContact O-CG1 3.26Å; L187-I191 WeakPolarHBondContact O-CG1 3.44Å; L187-I191 PolarHBondContact O-N 2.9Å; L187-I191 VanDerWaalsContact O-N 3.12Å; A188-I191 PolarHBondContact O-N 3.32Å; E189-I191 VanDerWaalsContact C-N 3.31Å; E189-I191 PolarHBondContact O-N 3.33Å; I191-E193 VanDerWaalsContact C-N 3.34Å; I191-E193 PolarHBondContact O-N 3.19Å; I191-K194 PolarHBondContact O-N 2.74Å; I191-E195 HydrophobicContact CG2-CG 4.47Å; I191-E195 WeakPolarHBondContact O-CG 3.21Å; I191-E195 PolarHBondContact O-N 3.07Å
192	I	95.3	Very high	89.6	Confident	55 Å²	55	67.3 Å²	67.3	28%	0.282	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-42.4	-180	-67.6	164.8	0	0	0	111.1	I33 L76 V82 A188 E189 E195 R196	I33-I192 HydrophobicContact CD1-CD1 4.21Å; I33-I192 HydrophobicContact CD1-CG1 3.9Å; L76-I192 HydrophobicContact CD1-CD1 3.47Å; L76-I192 VanDerWaalsContact CD1-CD1 3.47Å; V82-I192 HydrophobicContact CG2-CD1 4.41Å; A188-I192 VanDerWaalsContact O-CG1 3.31Å; A188-I192 WeakPolarHBondContact O-CG1 3.06Å; A188-I192 PolarHBondContact O-N 3.31Å; E189-I192 PolarHBondContact O-N 2.89Å; I192-E195 PolarHBondContact O-N 3.38Å; I192-R196 WeakPolarHBondContact O-CB 3.31Å; I192-R196 PolarHBondContact O-N 2.87Å
193	E	95	Very high	87.3	Confident	71 Å²	71	72.2 Å²	72.2	33%	0.332	34%	0.335	S	S	.	.	H	α-helix	trans	-65.1	-44.1	177.3	-177.6	56.9	-153	0	0	111.4	E189 I191 R196 L197	E189-E193 WeakPolarHBondContact O-CB 3.24Å; E189-E193 PolarHBondContact O-N 3.44Å; I191-E193 VanDerWaalsContact C-N 3.34Å; I191-E193 PolarHBondContact O-N 3.19Å; E193-R196 WeakPolarHBondContact O-CB 3.33Å; E193-R196 PolarHBondContact O-N 2.91Å; E193-R196 VanDerWaalsContact O-N 3.15Å; E193-R196 IonicContact OE1-CZ 2.68Å; E193-R196 IonicContact OE1-NE 2.68Å; E193-R196 PolarHBondContact OE1-NE 2.88Å; E193-R196 IonicContact OE1-NH2 3.46Å; E193-R196 PolarHBondContact OE1-NH2 3.49Å; E193-R196 IonicContact OE2-CZ 3.66Å; E193-R196 IonicContact OE2-NE 2.75Å; E193-R196 PolarHBondContact OE2-NE 2.84Å; E193-R196 IonicContact OE2-NH2 3.16Å; E193-R196 PolarHBondContact OE2-NH2 2.86Å; E193-L197 HydrophobicContact CG-CD1 4.26Å; E193-L197 WeakPolarHBondContact O-CG 3.16Å; E193-L197 PolarHBondContact O-N 3.19Å
194	K	93.8	Very high	84.7	Confident	68 Å²	68	76.5 Å²	76.5	30%	0.296	37%	0.365	S	S	.	.	H	α-helix	trans	-60.1	-47.9	176.1	-179.4	56.7	177	154.7	0	111.5	D135 Q137 R190 I191 R196 L197 D198	D135-K194 HydrophobicContact CB-CG 4.49Å; Q137-K194 HydrophobicContact CG-CB 4.44Å; R190-K194 VanDerWaalsContact O-CB 3.31Å; R190-K194 WeakPolarHBondContact O-CB 3.44Å; R190-K194 PolarHBondContact O-N 3.49Å; I191-K194 PolarHBondContact O-N 2.74Å; K194-R196 PolarHBondContact O-N 2.81Å; K194-L197 PolarHBondContact O-N 3.09Å; K194-D198 VanDerWaalsContact CE-OD1 3.27Å; K194-D198 WeakPolarHBondContact CE-OD1 3.38Å; K194-D198 WeakPolarHBondContact CE-OD2 3.08Å; K194-D198 IonicContact NZ-OD1 3.31Å; K194-D198 PolarHBondContact NZ-OD1 2.97Å; K194-D198 IonicContact NZ-OD2 3.96Å; K194-D198 VanDerWaalsContact O-CG 3.25Å; K194-D198 PolarHBondContact O-N 2.68Å
195	E	91.2	Very high	82.2	Confident	67 Å²	67	83.5 Å²	83.5	31%	0.313	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-31	176.3	-73.1	-177.4	168	0	0	112.7	I191 I192 R199	I191-E195 HydrophobicContact CG2-CG 4.47Å; I191-E195 WeakPolarHBondContact O-CG 3.21Å; I191-E195 PolarHBondContact O-N 3.07Å; I192-E195 PolarHBondContact O-N 3.38Å; E195-R199 WeakPolarHBondContact O-CG 3.32Å; E195-R199 PolarHBondContact O-N 2.75Å; E195-R199 PolarHBondContact O-NH1 3.37Å
196	R	91.4	Very high	79.9	Confident	119 Å²	119	91 Å²	91	45%	0.449	44%	0.436	S	S	.	.	H	α-helix	trans	-67.6	-49.9	173.3	-174.1	179.6	71	143.5	-1.6	110.6	I192 E193 K194 D198 R199 Y200	I192-R196 WeakPolarHBondContact O-CB 3.31Å; I192-R196 PolarHBondContact O-N 2.87Å; E193-R196 WeakPolarHBondContact O-CB 3.33Å; E193-R196 PolarHBondContact O-N 2.91Å; E193-R196 VanDerWaalsContact O-N 3.15Å; E193-R196 IonicContact OE1-CZ 2.68Å; E193-R196 IonicContact OE1-NE 2.68Å; E193-R196 PolarHBondContact OE1-NE 2.88Å; E193-R196 IonicContact OE1-NH2 3.46Å; E193-R196 PolarHBondContact OE1-NH2 3.49Å; E193-R196 IonicContact OE2-CZ 3.66Å; E193-R196 IonicContact OE2-NE 2.75Å; E193-R196 PolarHBondContact OE2-NE 2.84Å; E193-R196 IonicContact OE2-NH2 3.16Å; E193-R196 PolarHBondContact OE2-NH2 2.86Å; K194-R196 PolarHBondContact O-N 2.81Å; R196-D198 VanDerWaalsContact C-N 3.34Å; R196-D198 PolarHBondContact O-N 2.84Å; R196-R199 PolarHBondContact O-N 3.44Å; R196-Y200 HydrophobicContact CG-CD2 4.23Å; R196-Y200 HydrophobicContact CG-CE2 4.13Å; R196-Y200 VanDerWaalsContact O-CD2 3.26Å; R196-Y200 WeakPolarHBondContact O-CD2 3.23Å
197	L	90.5	Very high	77.3	Confident	95 Å²	95	95.4 Å²	95.4	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-60.5	-43.1	-179.6	-68.1	170.9	0	0	0	111.8	E193 K194 R199 Y200 E201	E193-L197 HydrophobicContact CG-CD1 4.26Å; E193-L197 WeakPolarHBondContact O-CG 3.16Å; E193-L197 PolarHBondContact O-N 3.19Å; K194-L197 PolarHBondContact O-N 3.09Å; L197-R199 PolarHBondContact O-N 3.48Å; L197-Y200 PolarHBondContact O-N 2.86Å; L197-E201 PolarHBondContact O-N 3.45Å
198	D	86.8	Confident	74.7	Confident	62 Å²	62	102.9 Å²	102.9	33%	0.332	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-21.1	-179.9	-65.7	-10.2	0	0	0	112.9	K194 R196	K194-D198 VanDerWaalsContact CE-OD1 3.27Å; K194-D198 WeakPolarHBondContact CE-OD1 3.38Å; K194-D198 WeakPolarHBondContact CE-OD2 3.08Å; K194-D198 IonicContact NZ-OD1 3.31Å; K194-D198 PolarHBondContact NZ-OD1 2.97Å; K194-D198 IonicContact NZ-OD2 3.96Å; K194-D198 VanDerWaalsContact O-CG 3.25Å; K194-D198 PolarHBondContact O-N 2.68Å; R196-D198 VanDerWaalsContact C-N 3.34Å; R196-D198 PolarHBondContact O-N 2.84Å
199	R	82.6	Confident	72.1	Confident	167 Å²	167	110.6 Å²	110.6	63%	0.63	54%	0.544	S	S	*	.	H	α-helix	trans	-79.9	-21.5	172.7	-73.6	-171.2	-59.5	-91.6	6.8	113.8	E195 R196 L197	E195-R199 WeakPolarHBondContact O-CG 3.32Å; E195-R199 PolarHBondContact O-N 2.75Å; E195-R199 PolarHBondContact O-NH1 3.37Å; R196-R199 PolarHBondContact O-N 3.44Å; L197-R199 PolarHBondContact O-N 3.48Å
200	Y	72.1	Confident	69.4	Low	186 Å²	186	116.8 Å²	116.8	73%	0.729	57%	0.573	S	S	*	*	H	α-helix	trans	-104.2	-5.7	-175.5	-77.4	-76.3	0	0	0	113.5	R196 L197 P202	R196-Y200 HydrophobicContact CG-CD2 4.23Å; R196-Y200 HydrophobicContact CG-CE2 4.13Å; R196-Y200 VanDerWaalsContact O-CD2 3.26Å; R196-Y200 WeakPolarHBondContact O-CD2 3.23Å; L197-Y200 PolarHBondContact O-N 2.86Å; Y200-P202 WeakPolarHBondContact O-CD 3.26Å
201	E	57.1	Low	66.7	Low	151 Å²	151	122.5 Å²	122.5	71%	0.706	60%	0.603	S	S	*	*			trans	-70	109.1	175.7	-150.2	163.7	-145.7	0	0	109.3	L197 L203	L197-E201 PolarHBondContact O-N 3.45Å; E201-L203 PolarHBondContact O-N 3.22Å
202	P	48.5	Very low	64.1	Low	108 Å²	108	131 Å²	131	70%	0.701	65%	0.647	S	S	*	*			trans	-67.9	135.4	172.2	5.6	9.4	0	0	0	107	Y200 S204	Y200-P202 WeakPolarHBondContact O-CD 3.26Å; P202-S204 PolarHBondContact O-N 3.41Å
203	L	49.2	Very low	61.4	Low	172 Å²	172	131.2 Å²	131.2	90%	0.901	66%	0.662	S	S	*	*			trans	-39.1	107.8	165.3	-78.7	149.9	0	0	0	108.4	E201 L205	E201-L203 PolarHBondContact O-N 3.22Å; L203-L205 PolarHBondContact O-N 3.2Å
204	S	45.2	Very low	58.7	Low	91 Å²	91	134.1 Å²	134.1	64%	0.636	69%	0.687	S	S	*	*			trans	-56.9	128.9	176.3	44.2	0	0	0	0	107.6	P202 E206	P202-S204 PolarHBondContact O-N 3.41Å; S204-E206 PolarHBondContact O-N 3.2Å
205	L	45.1	Very low	56	Low	150 Å²	150	139.3 Å²	139.3	79%	0.785	71%	0.714	S	S	*	*	S	Bend	trans	-61.9	85.2	173.6	-80.9	94.4	0	0	0	109.1	L203	L203-L205 PolarHBondContact O-N 3.2Å
206	E	48.9	Very low	53.6	Low	173 Å²	173	140.7 Å²	140.7	81%	0.808	73%	0.731	S	S	*	*			trans	-126.7	14.7	169.4	-71.5	-169.1	161.6	0	0	112.6	S204	S204-E206 PolarHBondContact O-N 3.2Å
207	T	44.7	Very low	51.1	Low	136 Å²	136	144.3 Å²	144.3	83%	0.834	75%	0.75	S	S	*	*	S	Bend	trans	-120.6	17.1	177.1	37.9	0	0	0	0	115.5
208	M	42.7	Very low	48.6	Very low	157 Å²	157	147.7 Å²	147.7	77%	0.773	77%	0.768	S	S	*	*	S	Bend	trans	-108.5	4.1	-179.7	-72.8	-164.7	72.7	0	0	117
209	D	43	Very low	46.3	Very low	161 Å²	161	149 Å²	149	86%	0.861	78%	0.782	S	S	*	*	S	Bend	trans	-116.4	27.7	-176.1	-75.5	-22.7	0	0	0	115.4
210	Q	40.1	Very low	44.5	Very low	187 Å²	187	151.5 Å²	151.5	87%	0.874	80%	0.798	S	S	*	*	S	Bend	trans	-134	94.6	170.4	-73.6	-173.4	-17.2	0	0	111.1
211	E	40.1	Very low	43.2	Very low	193 Å²	193	152.3 Å²	152.3	90%	0.902	81%	0.806	S	S	*	*			trans	146	61.9	149.7	-78.9	-172.1	-175.5	0	0	111.5	G213	E211-G213 VanDerWaalsContact C-N 3.26Å; E211-G213 PolarHBondContact O-N 3.14Å
212	I	42.5	Very low	42.5	Very low	183 Å²	183	150.5 Å²	150.5	94%	0.938	81%	0.809	S	S	*	*			trans	-86.2	79.9	153.7	-58.4	177.9	0	0	0	106.7
213	G	39.9	Very low	42.3	Very low	58 Å²	58	150.4 Å²	150.4	60%	0.598	81%	0.809	S	S	*	*			trans	-97.7	137.5	165.3	0	0	0	0	0	110	E211 M215	E211-G213 VanDerWaalsContact C-N 3.26Å; E211-G213 PolarHBondContact O-N 3.14Å; G213-M215 PolarHBondContact O-N 3.49Å
214	P	37.1	Very low	42.3	Very low	132 Å²	132	151.1 Å²	151.1	86%	0.857	81%	0.805	S	S	*	*			trans	-83.3	109.7	-173.8	32.4	-30.3	0	0	0	110.1
215	M	37.9	Very low	42.4	Very low	177 Å²	177	160 Å²	160	87%	0.872	83%	0.833	S	S	*	*			trans	-140.9	103	161.1	-97.5	-154.8	-67.9	0	0	113.2	G213	G213-M215 PolarHBondContact O-N 3.49Å
216	S	40.9	Very low	42.3	Very low	96 Å²	96	160.5 Å²	160.5	67%	0.671	84%	0.835	S	S	*	*			trans	20	122.3	134.5	55.6	0	0	0	0	120
217	K	37.5	Very low	41.9	Very low	196 Å²	196	159.8 Å²	159.8	85%	0.852	84%	0.837	S	S	*	*			trans	30.8	106.8	135.6	-65.5	-179.3	178.8	177.6	0	116.2
218	L	38.8	Very low	41.8	Very low	166 Å²	166	161.1 Å²	161.1	87%	0.869	84%	0.837	S	S	*	*				-164.4	134.4	114.6	-122.8	83.8	0	0	0	110.7
219	S	39.2	Very low	41.7	Very low	90 Å²	90	161.4 Å²	161.4	63%	0.629	84%	0.84	S	S	*	*			trans	-27.9	130.6	168.3	53.1	0	0	0	0	117.2
220	F	43.8	Very low	41.6	Very low	219 Å²	219	161.4 Å²	161.4	96%	0.961	84%	0.839	S	S	*	*			trans	-147.9	92.3	134.7	-104.4	-81.4	0	0	0	108.5
221	F	44.5	Very low	41.7	Very low	202 Å²	202	159.7 Å²	159.7	89%	0.886	84%	0.837	S	S	*	*			trans	-93.2	120.7	163.5	-131.8	-89	0	0	0	106.3
222	C	43.1	Very low	41.9	Very low	114 Å²	114	157.3 Å²	157.3	77%	0.77	83%	0.832	S	S	*	*			trans	-161.3	140.5	147	-157.7	0	0	0	0	110.7
223	C	44.4	Very low	41.8	Very low	106 Å²	106	155.3 Å²	155.3	72%	0.716	82%	0.824	S	S	*	*	S	Bend	trans	87.2	74.2	170.7	-55.6	0	0	0	0	117.2
224	F	49.8	Very low	42	Very low	187 Å²	187	163.4 Å²	163.4	82%	0.82	84%	0.843	S	S	*	*				-164.9	119.5	126.7	-101.7	-76.2	0	0	0	108.9
225	F	46.6	Very low	42.4	Very low	276 Å²	276	166.3 Å²	166.3	100%	1.211	84%	0.842	S	S	*	*			trans	72	0	-179.8	-67.4	-83.7	0	0	0	118.7

Retrieved 225 of 225 residues in 69.4 ms (Link to these results)

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