A0A077ZCP9_TRITR Loading...

Pkinase domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZCP9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 295 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	29.7	Very low	27.3	Very low	236 Å²	236	166.5 Å²	166.5	100%	1.163	86%	0.86	S	S	*	*				0	44.3	0	-162.6	-177.9	-81.3	0	0	110.8
2	F	24.8	Very low	27.3	Very low	213 Å²	213	161.2 Å²	161.2	93%	0.934	85%	0.846	S	S	*	*			trans	-143.7	73.4	-178.6	-85.1	-81.4	0	0	0	109.8
3	K	23	Very low	27.3	Very low	198 Å²	198	163.4 Å²	163.4	86%	0.861	84%	0.844	S	S	*	*			trans	-137.5	-3.8	170.8	-98.2	-166.8	176.8	-176.5	0	116.9
4	D	26.9	Very low	27.4	Very low	150 Å²	150	160.6 Å²	160.6	80%	0.802	84%	0.839	S	S	*	*			trans	-132.5	67.5	-172.9	-64.9	-47	0	0	0	113.9
5	F	28.6	Very low	27.5	Very low	222 Å²	222	158.3 Å²	158.3	97%	0.974	83%	0.834	S	S	*	*			trans	-117.5	68.2	157.1	-106.3	-91.1	0	0	0	109.8
6	A	27.8	Very low	27.8	Very low	82 Å²	82	152.3 Å²	152.3	68%	0.678	81%	0.805	S	S	*	*			trans	-75.2	118.1	165.1	0	0	0	0	0	109.8	S8	A6-S8 PolarHBondContact O-N 3.49Å
7	L	27.4	Very low	28	Very low	148 Å²	148	149.1 Å²	149.1	78%	0.775	79%	0.794	S	S	*	*			trans	39.5	79.7	131.3	-67.7	160.6	0	0	0	116.9	L24	L7-L24 HydrophobicContact CD2-CD2 4.14Å
8	S	26.6	Very low	28.1	Very low	124 Å²	124	152 Å²	152	87%	0.867	80%	0.798	S	S	*	*			trans	-154.1	109.5	151.1	94.2	0	0	0	0	106.7	A6	A6-S8 PolarHBondContact O-N 3.49Å
9	G	27.5	Very low	28.6	Very low	62 Å²	62	148.6 Å²	148.6	64%	0.639	78%	0.784	S	S	*	*				159.3	159.2	66.1	0	0	0	0	0	108.1
10	Y	27.7	Very low	29	Very low	235 Å²	235	144.5 Å²	144.5	92%	0.922	76%	0.762	S	S	*	*			trans	73.1	81.2	178	-61	-86.8	0	0	0	117.3
11	L	30.2	Very low	29.2	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	75%	0.747	S	S	*	*	S	Bend	trans	-158	139.6	140.4	-101	158.1	0	0	0	109.9	K13	L11-K13 PolarHBondContact O-N 3.4Å
12	C	27.6	Very low	29.6	Very low	102 Å²	102	132 Å²	132	69%	0.689	72%	0.715	S	S	*	*			trans	-54.7	120.3	-165.5	-170.5	0	0	0	0	114.1	T14	C12-T14 PolarHBondContact O-N 3.03Å
13	K	27	Very low	30.2	Very low	190 Å²	190	123.1 Å²	123.1	83%	0.826	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	94.1	-177.1	-67.6	176.4	177.1	177.8	0	111.5	L11	L11-K13 PolarHBondContact O-N 3.4Å
14	T	28.4	Very low	30.8	Very low	125 Å²	125	117.7 Å²	117.7	77%	0.767	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172.1	-29.3	143.5	8.2	0	0	0	0	115.5	C12	C12-T14 PolarHBondContact O-N 3.03Å
15	T	29.7	Very low	31.4	Very low	125 Å²	125	118.4 Å²	118.4	77%	0.767	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-20.3	179.2	-47	0	0	0	0	112.8	T17	T15-T17 PolarHBondContact O-N 2.97Å
16	V	32.6	Very low	31.8	Very low	62 Å²	62	112.9 Å²	112.9	38%	0.376	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-26.7	-174.3	177.6	0	0	0	0	112.6	K18 V19 I20	V16-K18 PolarHBondContact O-N 3.48Å; V16-V19 PolarHBondContact O-N 3.45Å; V16-I20 HydrophobicContact CG1-CB 4.38Å; V16-I20 HydrophobicContact CG1-CD1 3.09Å; V16-I20 HydrophobicContact CG1-CG1 3.6Å; V16-I20 WeakPolarHBondContact O-CB 3.4Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.41Å; V16-I20 PolarHBondContact O-N 3.18Å; V16-I20 VanDerWaalsContact O-N 3.12Å
17	T	29.7	Very low	32.8	Very low	99 Å²	99	112.4 Å²	112.4	61%	0.607	62%	0.615	S	S	*	*	H	α-helix	trans	-71.9	-25.1	-169.7	-20.4	0	0	0	0	114.5	T15 G21	T15-T17 PolarHBondContact O-N 2.97Å; T17-G21 PolarHBondContact O-N 3.02Å
18	K	30.9	Very low	33.8	Very low	201 Å²	201	109.6 Å²	109.6	87%	0.874	61%	0.607	S	S	*	*	H	α-helix	trans	-80.1	-20.7	179.1	-78.8	-171.7	176	-179.5	0	113.9	V16	V16-K18 PolarHBondContact O-N 3.48Å
19	V	38.2	Very low	35.3	Very low	87 Å²	87	105.3 Å²	105.3	53%	0.527	58%	0.583	S	S	.	*	H	α-helix	trans	-98.5	-29.3	178.3	-175.3	0	0	0	0	111.2	V16 V23	V16-V19 PolarHBondContact O-N 3.45Å; V19-V23 WeakPolarHBondContact O-CG2 3.39Å
20	I	35.6	Very low	36.8	Very low	66 Å²	66	106.3 Å²	106.3	34%	0.338	57%	0.568	S	S	.	*	H	α-helix	trans	-87.2	-20.8	-175	-64.5	-158.6	0	0	0	114.3	V16 V23 L24	V16-I20 HydrophobicContact CG1-CB 4.38Å; V16-I20 HydrophobicContact CG1-CD1 3.09Å; V16-I20 HydrophobicContact CG1-CG1 3.6Å; V16-I20 WeakPolarHBondContact O-CB 3.4Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.41Å; V16-I20 PolarHBondContact O-N 3.18Å; V16-I20 VanDerWaalsContact O-N 3.12Å; I20-V23 WeakPolarHBondContact O-CA 3.43Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 PolarHBondContact O-N 3.47Å; I20-L24 HydrophobicContact CG2-CD1 3.82Å; I20-L24 HydrophobicContact CG2-CG 3.93Å; I20-L24 PolarHBondContact O-N 3.39Å
21	G	34	Very low	39.4	Very low	44 Å²	44	95.8 Å²	95.8	45%	0.454	53%	0.532	S	S	.	.	H	α-helix	trans	-50	-45.3	-179.8	0	0	0	0	0	115	T17	T17-G21 PolarHBondContact O-N 3.02Å
22	P	36.8	Very low	42	Very low	75 Å²	75	90 Å²	90	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-81.7	-16.2	175.6	-5.8	23	0	0	0	113.9	Y78	P22-Y78 WeakPolarHBondContact CB-OH 3.48Å
23	V	38.7	Very low	44.9	Very low	26 Å²	26	85.1 Å²	85.1	16%	0.158	47%	0.468	C	S	.	.	H	α-helix	trans	-74.1	-42.4	177.2	-175.9	0	0	0	0	110.2	V19 I20 H25 Y26 I27 Y78	V19-V23 WeakPolarHBondContact O-CG2 3.39Å; I20-V23 WeakPolarHBondContact O-CA 3.43Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 PolarHBondContact O-N 3.47Å; V23-H25 PolarHBondContact O-N 2.76Å; V23-Y26 PolarHBondContact O-N 3.09Å; V23-I27 HydrophobicContact CG1-CD1 3.7Å; V23-I27 HydrophobicContact CG1-CG1 4.13Å; V23-I27 WeakPolarHBondContact O-CG1 3.46Å; V23-I27 PolarHBondContact O-N 3.15Å; V23-Y78 HydrophobicContact CG2-CE1 3.67Å
24	L	35.4	Very low	47.9	Very low	85 Å²	85	79.1 Å²	79.1	45%	0.445	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-26.9	177.5	-83.9	163	0	0	0	113.7	L7 I20 Y26 I27	L7-L24 HydrophobicContact CD2-CD2 4.14Å; I20-L24 HydrophobicContact CG2-CD1 3.82Å; I20-L24 HydrophobicContact CG2-CG 3.93Å; I20-L24 PolarHBondContact O-N 3.39Å; L24-Y26 PolarHBondContact O-N 3.46Å; L24-I27 HydrophobicContact CD2-CD1 4.26Å
25	H	38.1	Very low	50.7	Low	164 Å²	164	76.7 Å²	76.7	76%	0.759	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.5	176.9	-129.6	-70.1	0	0	0	113.3	V23	V23-H25 PolarHBondContact O-N 2.76Å
26	Y	38.7	Very low	53.4	Low	106 Å²	106	71.5 Å²	71.5	42%	0.416	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-13.8	176.1	-104.2	-75.7	0	0	0	113.8	V23 L24 S28 D110 E111	V23-Y26 PolarHBondContact O-N 3.09Å; L24-Y26 PolarHBondContact O-N 3.46Å; Y26-S28 PolarHBondContact O-N 3.4Å; Y26-D110 HydrophobicContact CD1-CB 4.3Å; Y26-D110 HydrophobicContact CE1-CB 4.47Å; Y26-E111 WeakPolarHBondContact CE1-OE2 3.48Å
27	I	47.5	Very low	56.1	Low	73 Å²	73	70.3 Å²	70.3	37%	0.374	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	19.4	165.9	-59.1	161.7	0	0	0	110.9	V23 L24 G29	V23-I27 HydrophobicContact CG1-CD1 3.7Å; V23-I27 HydrophobicContact CG1-CG1 4.13Å; V23-I27 WeakPolarHBondContact O-CG1 3.46Å; V23-I27 PolarHBondContact O-N 3.15Å; L24-I27 HydrophobicContact CD2-CD1 4.26Å; I27-G29 PolarHBondContact O-N 2.9Å
28	S	48.4	Very low	58.7	Low	88 Å²	88	73.4 Å²	73.4	62%	0.615	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-0.9	176.1	62.3	0	0	0	0	114	Y26	Y26-S28 PolarHBondContact O-N 3.4Å
29	G	57.9	Low	61.1	Low	35 Å²	35	71.7 Å²	71.7	36%	0.361	37%	0.372	S	S	.	.	S	Bend	trans	-100.3	-104.2	178.8	0	0	0	0	0	112.5	I27	I27-G29 PolarHBondContact O-N 2.9Å
30	Y	59.7	Low	63	Low	82 Å²	82	70.5 Å²	70.5	32%	0.322	36%	0.361	S	S	.	.	S	Bend	trans	-110.7	-2	-167.5	-67.1	-92.4	0	0	0	114.7	Y36 L109 A113 I246	Y30-Y36 AromaticContact CD1-CD2 3.72Å; Y30-Y36 HydrophobicContact CD1-CD2 3.72Å; Y30-Y36 AromaticContact CD1-CE2 3.56Å; Y30-Y36 HydrophobicContact CD1-CE2 3.56Å; Y30-Y36 AromaticContact CE1-CE2 3.93Å; Y30-Y36 HydrophobicContact CE1-CE2 3.93Å; Y30-Y36 HydrophobicContact CG-CD2 4.43Å; Y30-L109 HydrophobicContact CG-CD1 4.43Å; Y30-A113 HydrophobicContact CD2-CB 3.82Å; Y30-A113 HydrophobicContact CE2-CB 3.66Å; Y30-I246 HydrophobicContact CE1-CD1 4.32Å
31	G	81.3	Confident	64.9	Low	15 Å²	15	71.4 Å²	71.4	16%	0.155	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.4	-150	-172.2	0	0	0	0	0	112.4	L109	G31-L109 PolarHBondContact O-N 2.95Å
32	D	86.2	Confident	67.3	Low	39 Å²	39	72.9 Å²	72.9	21%	0.209	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	162.7	168.7	68.8	48.6	0	0	0	111.9	Y34 D35 Y36 V108	D32-Y34 PolarHBondContact O-N 3.48Å; D32-Y34 WeakPolarHBondContact OD1-CA 3.31Å; D32-Y34 VanDerWaalsContact OD1-CB 3.26Å; D32-Y34 WeakPolarHBondContact OD1-CB 3.41Å; D32-Y34 PolarHBondContact OD1-N 3.32Å; D32-D35 PolarHBondContact O-N 3.41Å; D32-D35 PolarHBondContact OD1-N 3.21Å; D32-Y36 PolarHBondContact O-N 3.01Å; D32-V108 HydrophobicContact CB-CG1 4.2Å
33	L	88.8	Confident	69.8	Low	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-68	-22	-177.1	-173.6	60.7	0	0	0	111.9	W37 W51 M104 V107 L109 L164 L168	L33-W37 WeakPolarHBondContact O-CB 3.39Å; L33-W37 PolarHBondContact O-N 2.97Å; L33-W51 HydrophobicContact CD1-CD2 4.18Å; L33-W51 HydrophobicContact CD1-CE3 3.77Å; L33-W51 HydrophobicContact CD1-CH2 3.79Å; L33-W51 HydrophobicContact CD1-CZ2 4.17Å; L33-W51 HydrophobicContact CD1-CZ3 3.58Å; L33-M104 HydrophobicContact CB-CB 4.45Å; L33-V107 HydrophobicContact CB-CB 4Å; L33-V107 HydrophobicContact CB-CG1 4.08Å; L33-V107 WeakPolarHBondContact CB-O 3.44Å; L33-V107 HydrophobicContact CD2-CB 4.14Å; L33-V107 HydrophobicContact CD2-CG1 3.85Å; L33-V107 PolarHBondContact N-O 2.84Å; L33-L109 HydrophobicContact CD1-CD1 4.08Å; L33-L109 HydrophobicContact CD1-CD2 4.39Å; L33-L164 HydrophobicContact CD2-CD2 4.41Å; L33-L168 HydrophobicContact CD1-CD2 4.3Å; L33-L168 HydrophobicContact CD2-CD1 4.08Å; L33-L168 HydrophobicContact CD2-CD2 4.06Å; L33-L168 HydrophobicContact CG-CD2 4.02Å
34	Y	89.7	Confident	72.3	Confident	65 Å²	65	68.7 Å²	68.7	26%	0.255	35%	0.347	S	S	.	.	H	α-helix	trans	-71	-48.3	177.6	177.4	-93.4	0	0	0	110.8	D32 Y36 W37 R38 M104 E105	D32-Y34 PolarHBondContact O-N 3.48Å; D32-Y34 WeakPolarHBondContact OD1-CA 3.31Å; D32-Y34 VanDerWaalsContact OD1-CB 3.26Å; D32-Y34 WeakPolarHBondContact OD1-CB 3.41Å; D32-Y34 PolarHBondContact OD1-N 3.32Å; Y34-Y36 VanDerWaalsContact C-N 3.34Å; Y34-Y36 PolarHBondContact O-N 3.04Å; Y34-W37 HydrophobicContact CD2-CE3 4.24Å; Y34-W37 HydrophobicContact CD2-CZ3 4.41Å; Y34-W37 HydrophobicContact CE2-CE3 4.21Å; Y34-W37 AromaticContact CE2-CZ3 3.95Å; Y34-W37 HydrophobicContact CE2-CZ3 3.95Å; Y34-W37 PolarHBondContact O-N 3Å; Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 3.33Å; Y34-M104 HydrophobicContact CD2-CB 4.38Å; Y34-M104 HydrophobicContact CD2-CE 3.9Å; Y34-M104 HydrophobicContact CE2-CE 4.43Å; Y34-E105 HydrophobicContact CG-CG 4.19Å
35	D	86.1	Confident	75.1	Confident	73 Å²	73	68.6 Å²	68.6	39%	0.39	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-47.5	175.3	-79.2	-18.2	0	0	0	110.2	D32 W37 R38 F39	D32-D35 PolarHBondContact O-N 3.41Å; D32-D35 PolarHBondContact OD1-N 3.21Å; D35-W37 PolarHBondContact O-N 3.47Å; D35-R38 PolarHBondContact O-N 3.12Å; D35-F39 WeakPolarHBondContact O-CD2 3.31Å; D35-F39 PolarHBondContact O-N 3.03Å; D35-F39 VanDerWaalsContact O-N 3.13Å
36	Y	86.9	Confident	77.8	Confident	16 Å²	16	64 Å²	64	6%	0.063	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-49.3	177.2	-170.3	-98.4	0	0	0	112.4	Y30 D32 Y34 R38 F39 E40 L43 W51 L109 I246	Y30-Y36 AromaticContact CD1-CD2 3.72Å; Y30-Y36 HydrophobicContact CD1-CD2 3.72Å; Y30-Y36 AromaticContact CD1-CE2 3.56Å; Y30-Y36 HydrophobicContact CD1-CE2 3.56Å; Y30-Y36 AromaticContact CE1-CE2 3.93Å; Y30-Y36 HydrophobicContact CE1-CE2 3.93Å; Y30-Y36 HydrophobicContact CG-CD2 4.43Å; D32-Y36 PolarHBondContact O-N 3.01Å; Y34-Y36 VanDerWaalsContact C-N 3.34Å; Y34-Y36 PolarHBondContact O-N 3.04Å; Y36-R38 VanDerWaalsContact C-N 3.25Å; Y36-R38 PolarHBondContact O-N 3.39Å; Y36-F39 PolarHBondContact O-N 3.01Å; Y36-E40 HydrophobicContact CD1-CB 4.49Å; Y36-E40 HydrophobicContact CD2-CG 4.49Å; Y36-E40 HydrophobicContact CE1-CB 4.07Å; Y36-E40 HydrophobicContact CE1-CG 4.44Å; Y36-E40 HydrophobicContact CE2-CB 4.42Å; Y36-E40 HydrophobicContact CE2-CG 3.93Å; Y36-E40 WeakPolarHBondContact O-CB 3.41Å; Y36-E40 PolarHBondContact O-N 3.37Å; Y36-L43 HydrophobicContact CD1-CD2 3.48Å; Y36-L43 VanDerWaalsContact CD1-CD2 3.48Å; Y36-L43 HydrophobicContact CE1-CD2 3.31Å; Y36-W51 AromaticContact CD1-CH2 3.69Å; Y36-W51 HydrophobicContact CD1-CH2 3.69Å; Y36-W51 HydrophobicContact CD1-CZ2 4.47Å; Y36-W51 HydrophobicContact CD1-CZ3 4.5Å; Y36-W51 AromaticContact CE1-CH2 3.61Å; Y36-W51 HydrophobicContact CE1-CH2 3.61Å; Y36-W51 HydrophobicContact CE1-CZ2 4.38Å; Y36-L109 HydrophobicContact CG-CD1 4.29Å; Y36-I246 HydrophobicContact CE1-CD1 4.46Å; Y36-I246 VanDerWaalsContact OH-CG2 3.24Å; Y36-I246 WeakPolarHBondContact OH-CG2 3.35Å
37	W	88.9	Confident	80.4	Confident	37 Å²	37	58.9 Å²	58.9	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-34.6	177.2	170.7	80.5	0	0	0	113.3	L33 Y34 D35 L43 M104 T167 L168 G171	L33-W37 WeakPolarHBondContact O-CB 3.39Å; L33-W37 PolarHBondContact O-N 2.97Å; Y34-W37 HydrophobicContact CD2-CE3 4.24Å; Y34-W37 HydrophobicContact CD2-CZ3 4.41Å; Y34-W37 HydrophobicContact CE2-CE3 4.21Å; Y34-W37 AromaticContact CE2-CZ3 3.95Å; Y34-W37 HydrophobicContact CE2-CZ3 3.95Å; Y34-W37 PolarHBondContact O-N 3Å; D35-W37 PolarHBondContact O-N 3.47Å; W37-L43 HydrophobicContact CB-CD1 4.33Å; W37-L43 HydrophobicContact CG-CD1 4.42Å; W37-M104 HydrophobicContact CB-SD 4.14Å; W37-M104 HydrophobicContact CD2-CE 4.09Å; W37-M104 HydrophobicContact CD2-SD 3.99Å; W37-M104 HydrophobicContact CE3-CE 3.95Å; W37-M104 HydrophobicContact CE3-SD 4.28Å; W37-M104 HydrophobicContact CG-SD 3.94Å; W37-M104 HydrophobicContact CH2-CE 4.5Å; W37-M104 HydrophobicContact CZ3-CE 4.18Å; W37-T167 HydrophobicContact CH2-CG2 4.43Å; W37-T167 HydrophobicContact CZ2-CG2 3.8Å; W37-T167 PolarHBondContact NE1-O 3.17Å; W37-L168 HydrophobicContact CB-CD2 4.26Å; W37-L168 HydrophobicContact CG-CD2 4.29Å; W37-G171 WeakPolarHBondContact CZ2-O 3.3Å
38	R	84.5	Confident	82.7	Confident	165 Å²	165	55.6 Å²	55.6	62%	0.623	30%	0.296	S	S	*	.	H	α-helix	trans	-71.7	-36.1	179.7	-174.8	176.2	179.5	161.1	0	112.7	Y34 D35 Y36	Y34-R38 WeakPolarHBondContact O-CB 3.34Å; Y34-R38 PolarHBondContact O-N 3.33Å; D35-R38 PolarHBondContact O-N 3.12Å; Y36-R38 VanDerWaalsContact C-N 3.25Å; Y36-R38 PolarHBondContact O-N 3.39Å
39	F	81.9	Confident	85.1	Confident	165 Å²	165	52.7 Å²	52.7	72%	0.724	27%	0.272	S	S	*	.	H	α-helix	trans	-88.2	-33.3	-178.9	-72.2	-68.4	0	0	0	113.2	D35 Y36	D35-F39 WeakPolarHBondContact O-CD2 3.31Å; D35-F39 PolarHBondContact O-N 3.03Å; D35-F39 VanDerWaalsContact O-N 3.13Å; Y36-F39 PolarHBondContact O-N 3.01Å
40	E	77	Confident	86.9	Confident	62 Å²	62	51.8 Å²	51.8	29%	0.29	26%	0.258	S	S	.	.	S	Bend	trans	-111.1	96.2	-177.1	-71.9	-74.8	-174.5	0	0	110.2	Y36 L43	Y36-E40 HydrophobicContact CD1-CB 4.49Å; Y36-E40 HydrophobicContact CD2-CG 4.49Å; Y36-E40 HydrophobicContact CE1-CB 4.07Å; Y36-E40 HydrophobicContact CE1-CG 4.44Å; Y36-E40 HydrophobicContact CE2-CB 4.42Å; Y36-E40 HydrophobicContact CE2-CG 3.93Å; Y36-E40 WeakPolarHBondContact O-CB 3.41Å; Y36-E40 PolarHBondContact O-N 3.37Å; E40-L43 HydrophobicContact CB-CD2 4.04Å; E40-L43 WeakPolarHBondContact O-CD2 3.44Å; E40-L43 WeakPolarHBondContact O-CG 3.37Å
41	S	76.5	Confident	88.6	Confident	84 Å²	84	47.9 Å²	47.9	59%	0.587	24%	0.243	S	C	*	.	S	Bend	trans	-137.5	126.3	175.6	-171.9	0	0	0	0	111.1
42	P	84.4	Confident	89.4	Confident	76 Å²	76	47.2 Å²	47.2	49%	0.494	24%	0.235	S	C	.	.	S	Bend	cis	-74	148.3	-0.4	30.6	-34.8	0	0	0	112.8
43	L	90.3	Very high	89.8	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-71.2	152.7	176.3	-71	173.3	0	0	0	112.3	Y36 W37 E40 P45 V48 W51 L168	Y36-L43 HydrophobicContact CD1-CD2 3.48Å; Y36-L43 VanDerWaalsContact CD1-CD2 3.48Å; Y36-L43 HydrophobicContact CE1-CD2 3.31Å; W37-L43 HydrophobicContact CB-CD1 4.33Å; W37-L43 HydrophobicContact CG-CD1 4.42Å; E40-L43 HydrophobicContact CB-CD2 4.04Å; E40-L43 WeakPolarHBondContact O-CD2 3.44Å; E40-L43 WeakPolarHBondContact O-CG 3.37Å; L43-P45 WeakPolarHBondContact O-CD 3.4Å; L43-V48 HydrophobicContact CB-CG2 3.71Å; L43-V48 HydrophobicContact CD1-CG2 4.04Å; L43-W51 HydrophobicContact CD1-CZ3 4.16Å; L43-W51 HydrophobicContact CD2-CZ3 4.47Å; L43-L168 HydrophobicContact CD1-CB 4.01Å; L43-L168 HydrophobicContact CD1-CD2 3.71Å; L43-L168 HydrophobicContact CD1-CG 4.41Å
44	P	91.1	Very high	90	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.019	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-60.3	120.6	173.8	-17.9	28.3	0	0	0	111.4	N46 A47 V48 I246 Y249	P44-N46 VanDerWaalsContact C-N 3.29Å; P44-N46 PolarHBondContact O-N 2.99Å; P44-A47 HydrophobicContact CB-CB 3.85Å; P44-A47 HydrophobicContact CG-CB 4.25Å; P44-A47 PolarHBondContact O-N 2.86Å; P44-A47 VanDerWaalsContact O-N 3.14Å; P44-V48 PolarHBondContact O-N 3.09Å; P44-I246 HydrophobicContact CG-CB 4.44Å; P44-I246 HydrophobicContact CG-CG1 4.03Å; P44-Y249 HydrophobicContact CB-CD1 3.84Å; P44-Y249 HydrophobicContact CB-CD2 4.26Å; P44-Y249 HydrophobicContact CB-CE1 4.49Å; P44-Y249 HydrophobicContact CB-CG 3.68Å; P44-Y249 HydrophobicContact CG-CD1 3.56Å; P44-Y249 HydrophobicContact CG-CE1 4.22Å; P44-Y249 HydrophobicContact CG-CG 3.9Å
45	P	93.1	Very high	90.3	Very high	82 Å²	82	42.5 Å²	42.5	53%	0.532	21%	0.214	S	C	.	.	H	α-helix	trans	-59.5	-36.1	-174.8	-27.5	35	0	0	0	114.3	L43 K49	L43-P45 WeakPolarHBondContact O-CD 3.4Å; P45-K49 PolarHBondContact O-N 3.07Å
46	N	94.8	Very high	90.6	Very high	67 Å²	67	39 Å²	39	36%	0.358	20%	0.196	S	C	.	.	H	α-helix	trans	-73.5	-36.5	178.4	-71.3	-17.3	0	0	0	112.4	P44 V48 K49 Y50 E245	P44-N46 VanDerWaalsContact C-N 3.29Å; P44-N46 PolarHBondContact O-N 2.99Å; N46-V48 VanDerWaalsContact C-N 3.35Å; N46-K49 WeakPolarHBondContact O-CB 3.41Å; N46-K49 PolarHBondContact O-N 3.48Å; N46-Y50 WeakPolarHBondContact O-CD1 3.39Å; N46-Y50 PolarHBondContact O-N 3.35Å; N46-E245 HydrophobicContact CB-CB 4.02Å; N46-E245 HydrophobicContact CB-CG 3.79Å; N46-E245 WeakPolarHBondContact CB-OE2 3.48Å; N46-E245 PolarHBondContact ND2-OE2 3.05Å
47	A	94.4	Very high	90.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-44.5	173.9	0	0	0	0	0	110.6	P44 K49 Y50 W51 E245 I246	P44-A47 HydrophobicContact CB-CB 3.85Å; P44-A47 HydrophobicContact CG-CB 4.25Å; P44-A47 PolarHBondContact O-N 2.86Å; P44-A47 VanDerWaalsContact O-N 3.14Å; A47-K49 VanDerWaalsContact C-N 3.29Å; A47-K49 PolarHBondContact O-N 2.99Å; A47-Y50 PolarHBondContact O-N 3.38Å; A47-Y50 VanDerWaalsContact O-N 3.07Å; A47-W51 HydrophobicContact CB-CH2 4.34Å; A47-W51 HydrophobicContact CB-CZ2 4.29Å; A47-W51 PolarHBondContact O-N 3.13Å; A47-E245 HydrophobicContact CB-CB 4.25Å; A47-I246 HydrophobicContact CB-CG1 3.9Å
48	V	95.8	Very high	90.8	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-39.8	174.6	179.8	0	0	0	0	111.6	L43 P44 N46 Y50 W51 A52 L168 V169	L43-V48 HydrophobicContact CB-CG2 3.71Å; L43-V48 HydrophobicContact CD1-CG2 4.04Å; P44-V48 PolarHBondContact O-N 3.09Å; N46-V48 VanDerWaalsContact C-N 3.35Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.2Å; V48-W51 HydrophobicContact CB-CE3 4.46Å; V48-W51 HydrophobicContact CG2-CE3 4.13Å; V48-W51 HydrophobicContact CG2-CZ3 4.03Å; V48-W51 PolarHBondContact O-N 3.19Å; V48-A52 WeakPolarHBondContact O-CB 3.32Å; V48-A52 PolarHBondContact O-N 3.48Å; V48-L168 HydrophobicContact CG1-CB 4Å; V48-L168 HydrophobicContact CG1-CD1 4.07Å; V48-L168 HydrophobicContact CG2-CB 4.36Å; V48-V169 HydrophobicContact CB-CG1 4.43Å; V48-V169 HydrophobicContact CG1-CG1 3.63Å
49	K	96.8	Very high	91.1	Very high	27 Å²	27	28.7 Å²	28.7	12%	0.117	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-40.9	173.8	-174.3	-178.8	-69	-175.2	0	111.8	P45 N46 A47 A52 V53 Y226 F227 N229 V230	P45-K49 PolarHBondContact O-N 3.07Å; N46-K49 WeakPolarHBondContact O-CB 3.41Å; N46-K49 PolarHBondContact O-N 3.48Å; A47-K49 VanDerWaalsContact C-N 3.29Å; A47-K49 PolarHBondContact O-N 2.99Å; K49-A52 WeakPolarHBondContact O-CB 3.48Å; K49-A52 PolarHBondContact O-N 3.35Å; K49-V53 WeakPolarHBondContact O-CG2 3.38Å; K49-V53 PolarHBondContact O-N 2.96Å; K49-V53 VanDerWaalsContact O-N 3.09Å; K49-Y226 HydrophobicContact CB-CE1 4.08Å; K49-Y226 HydrophobicContact CD-CE1 4.49Å; K49-Y226 WeakPolarHBondContact CD-O 3.43Å; K49-Y226 WeakPolarHBondContact CE-O 3.35Å; K49-Y226 HydrophobicContact CG-CD1 4.31Å; K49-Y226 HydrophobicContact CG-CE1 3.73Å; K49-Y226 PolarHBondContact NZ-O 3.48Å; K49-Y226 VanDerWaalsContact NZ-O 3.17Å; K49-F227 HydrophobicContact CG-CD1 4.15Å; K49-F227 HydrophobicContact CG-CE1 4.47Å; K49-N229 PolarHBondContact NZ-OD1 3.18Å; K49-V230 HydrophobicContact CD-CG2 3.46Å; K49-V230 VanDerWaalsContact CD-CG2 3.46Å; K49-V230 HydrophobicContact CG-CG2 4.07Å
50	Y	96.6	Very high	91.4	Very high	17 Å²	17	21 Å²	21	7%	0.067	12%	0.124	C	C	.	.	H	α-helix	trans	-67.3	-43.6	178.1	-70.5	3.7	0	0	0	111.5	N46 A47 V48 A52 V53 E54 V230 L235 L240 P242 E245	N46-Y50 WeakPolarHBondContact O-CD1 3.39Å; N46-Y50 PolarHBondContact O-N 3.35Å; A47-Y50 PolarHBondContact O-N 3.38Å; A47-Y50 VanDerWaalsContact O-N 3.07Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.2Å; Y50-A52 VanDerWaalsContact C-N 3.29Å; Y50-A52 PolarHBondContact O-N 3.37Å; Y50-V53 WeakPolarHBondContact O-CB 3.48Å; Y50-V53 PolarHBondContact O-N 3.12Å; Y50-V53 VanDerWaalsContact O-N 3.13Å; Y50-E54 WeakPolarHBondContact O-CG 3.49Å; Y50-E54 PolarHBondContact O-N 3.48Å; Y50-V230 HydrophobicContact CD1-CG1 3.86Å; Y50-V230 HydrophobicContact CD1-CG2 4.19Å; Y50-V230 HydrophobicContact CE1-CB 4.43Å; Y50-V230 HydrophobicContact CE1-CG1 3.76Å; Y50-V230 HydrophobicContact CE1-CG2 3.78Å; Y50-L235 HydrophobicContact CD1-CD1 3.78Å; Y50-L235 HydrophobicContact CD1-CD2 4.26Å; Y50-L235 HydrophobicContact CD2-CD1 4.49Å; Y50-L235 HydrophobicContact CD2-CD2 3.49Å; Y50-L235 VanDerWaalsContact CD2-CD2 3.49Å; Y50-L235 HydrophobicContact CE1-CD1 4.44Å; Y50-L235 HydrophobicContact CE2-CD2 4.07Å; Y50-L235 HydrophobicContact CG-CD1 3.81Å; Y50-L235 HydrophobicContact CG-CD2 3.6Å; Y50-L235 HydrophobicContact CG-CG 4.3Å; Y50-L240 HydrophobicContact CE2-CB 4.34Å; Y50-P242 HydrophobicContact CD2-CB 4.44Å; Y50-P242 HydrophobicContact CD2-CG 4.22Å; Y50-E245 HydrophobicContact CD2-CG 3.81Å; Y50-E245 HydrophobicContact CE2-CG 3.26Å; Y50-E245 PolarHBondContact OH-OE1 3Å
51	W	95.8	Very high	91.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.8	-37.3	173.7	-60.4	-29.5	0	0	0	112.4	L33 Y36 L43 A47 V48 V53 E54 L55 L109 A113 V115 L168 I246	L33-W51 HydrophobicContact CD1-CD2 4.18Å; L33-W51 HydrophobicContact CD1-CE3 3.77Å; L33-W51 HydrophobicContact CD1-CH2 3.79Å; L33-W51 HydrophobicContact CD1-CZ2 4.17Å; L33-W51 HydrophobicContact CD1-CZ3 3.58Å; Y36-W51 AromaticContact CD1-CH2 3.69Å; Y36-W51 HydrophobicContact CD1-CH2 3.69Å; Y36-W51 HydrophobicContact CD1-CZ2 4.47Å; Y36-W51 HydrophobicContact CD1-CZ3 4.5Å; Y36-W51 AromaticContact CE1-CH2 3.61Å; Y36-W51 HydrophobicContact CE1-CH2 3.61Å; Y36-W51 HydrophobicContact CE1-CZ2 4.38Å; L43-W51 HydrophobicContact CD1-CZ3 4.16Å; L43-W51 HydrophobicContact CD2-CZ3 4.47Å; A47-W51 HydrophobicContact CB-CH2 4.34Å; A47-W51 HydrophobicContact CB-CZ2 4.29Å; A47-W51 PolarHBondContact O-N 3.13Å; V48-W51 HydrophobicContact CB-CE3 4.46Å; V48-W51 HydrophobicContact CG2-CE3 4.13Å; V48-W51 HydrophobicContact CG2-CZ3 4.03Å; V48-W51 PolarHBondContact O-N 3.19Å; W51-V53 VanDerWaalsContact C-N 3.33Å; W51-V53 PolarHBondContact O-N 3.36Å; W51-E54 PolarHBondContact O-N 2.79Å; W51-L55 VanDerWaalsContact O-CB 3.31Å; W51-L55 WeakPolarHBondContact O-CB 3.24Å; W51-L55 VanDerWaalsContact O-CG 3.22Å; W51-L55 WeakPolarHBondContact O-CG 3.45Å; W51-L55 PolarHBondContact O-N 3.37Å; W51-L109 HydrophobicContact CZ2-CD1 4Å; W51-L109 HydrophobicContact CZ2-CD2 4.37Å; W51-A113 PolarHBondContact NE1-O 3.44Å; W51-V115 HydrophobicContact CB-CG1 3.87Å; W51-V115 VanDerWaalsContact CD1-CG1 3.4Å; W51-V115 HydrophobicContact CG-CG1 3.74Å; W51-L168 HydrophobicContact CE3-CD1 4.25Å; W51-I246 HydrophobicContact CZ2-CD1 4.15Å
52	A	97.1	Very high	92	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.7	-45.1	173.1	0	0	0	0	0	111.8	V48 K49 Y50 G56 L165 Y221 F227	V48-A52 WeakPolarHBondContact O-CB 3.32Å; V48-A52 PolarHBondContact O-N 3.48Å; K49-A52 WeakPolarHBondContact O-CB 3.48Å; K49-A52 PolarHBondContact O-N 3.35Å; Y50-A52 VanDerWaalsContact C-N 3.29Å; Y50-A52 PolarHBondContact O-N 3.37Å; A52-G56 PolarHBondContact O-N 3.12Å; A52-L165 HydrophobicContact CB-CD1 3.82Å; A52-L165 HydrophobicContact CB-CD2 3.5Å; A52-L165 HydrophobicContact CB-CG 4.32Å; A52-Y221 PolarHBondContact O-OH 3.36Å; A52-F227 HydrophobicContact CB-CE1 3.9Å; A52-F227 HydrophobicContact CB-CZ 4.24Å
53	V	95.6	Very high	91.8	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-58.7	-49.3	175.7	166.3	0	0	0	0	111.3	K49 Y50 W51 S57 F227 V230 F232 L235	K49-V53 WeakPolarHBondContact O-CG2 3.38Å; K49-V53 PolarHBondContact O-N 2.96Å; K49-V53 VanDerWaalsContact O-N 3.09Å; Y50-V53 WeakPolarHBondContact O-CB 3.48Å; Y50-V53 PolarHBondContact O-N 3.12Å; Y50-V53 VanDerWaalsContact O-N 3.13Å; W51-V53 VanDerWaalsContact C-N 3.33Å; W51-V53 PolarHBondContact O-N 3.36Å; V53-S57 VanDerWaalsContact O-CB 3.27Å; V53-S57 WeakPolarHBondContact O-CB 3.12Å; V53-S57 PolarHBondContact O-N 2.92Å; V53-S57 PolarHBondContact O-OG 3.43Å; V53-F227 HydrophobicContact CG2-CD1 3.51Å; V53-F227 HydrophobicContact CG2-CE1 3.81Å; V53-F227 HydrophobicContact CG2-CG 4.22Å; V53-V230 HydrophobicContact CG2-CG1 4.12Å; V53-F232 HydrophobicContact CB-CE1 4.3Å; V53-F232 HydrophobicContact CB-CE2 4.38Å; V53-F232 HydrophobicContact CB-CZ 4.19Å; V53-F232 HydrophobicContact CG1-CB 4.21Å; V53-F232 HydrophobicContact CG1-CD1 3.54Å; V53-F232 HydrophobicContact CG1-CD2 3.83Å; V53-F232 HydrophobicContact CG1-CE1 3.72Å; V53-F232 HydrophobicContact CG1-CE2 4.02Å; V53-F232 HydrophobicContact CG1-CG 3.58Å; V53-F232 HydrophobicContact CG1-CZ 3.95Å; V53-F232 HydrophobicContact CG2-CD2 4.13Å; V53-F232 HydrophobicContact CG2-CE1 4.36Å; V53-F232 HydrophobicContact CG2-CE2 3.65Å; V53-F232 HydrophobicContact CG2-CZ 3.76Å; V53-L235 HydrophobicContact CB-CD1 3.74Å; V53-L235 HydrophobicContact CG1-CB 4.36Å; V53-L235 HydrophobicContact CG1-CD1 3.59Å; V53-L235 HydrophobicContact CG2-CD1 4.16Å
54	E	93.9	Very high	91	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.019	7%	0.073	C	C	.	.	H	α-helix	trans	-67.6	-44.7	-177.3	-64	-175.5	131.7	0	0	112.5	Y50 W51 S57 A58 I76 H114 V115	Y50-E54 WeakPolarHBondContact O-CG 3.49Å; Y50-E54 PolarHBondContact O-N 3.48Å; W51-E54 PolarHBondContact O-N 2.79Å; E54-S57 WeakPolarHBondContact O-CB 3.48Å; E54-S57 PolarHBondContact O-N 3.16Å; E54-A58 PolarHBondContact O-N 3.27Å; E54-I76 HydrophobicContact CB-CD1 4.39Å; E54-H114 IonicContact OE1-CE1 3.99Å; E54-H114 IonicContact OE1-CG 3.74Å; E54-H114 IonicContact OE1-ND1 2.68Å; E54-H114 PolarHBondContact OE1-ND1 2.74Å; E54-V115 HydrophobicContact CB-CG2 3.33Å; E54-V115 HydrophobicContact CG-CG2 4.3Å; E54-V115 WeakPolarHBondContact OE2-CG2 3.35Å; E54-V115 PolarHBondContact OE2-N 3.47Å
55	L	93.9	Very high	89.4	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-43.7	178.3	-68.2	173.7	0	0	0	111.7	W51 S57 A58 L59 L102 V107 V115 L117 L161 L164	W51-L55 VanDerWaalsContact O-CB 3.31Å; W51-L55 WeakPolarHBondContact O-CB 3.24Å; W51-L55 VanDerWaalsContact O-CG 3.22Å; W51-L55 WeakPolarHBondContact O-CG 3.45Å; W51-L55 PolarHBondContact O-N 3.37Å; L55-S57 VanDerWaalsContact C-N 3.28Å; L55-S57 PolarHBondContact O-N 2.89Å; L55-A58 WeakPolarHBondContact O-CB 3.47Å; L55-A58 PolarHBondContact O-N 2.6Å; L55-L59 WeakPolarHBondContact O-CG 3.23Å; L55-L59 PolarHBondContact O-N 3.38Å; L55-L102 HydrophobicContact CD2-CD1 4.28Å; L55-V107 HydrophobicContact CD2-CG1 4.23Å; L55-V107 HydrophobicContact CD2-CG2 3.94Å; L55-V115 HydrophobicContact CD2-CB 4.27Å; L55-V115 HydrophobicContact CD2-CG2 3.93Å; L55-V115 HydrophobicContact CG-CG1 4.43Å; L55-V115 HydrophobicContact CG-CG2 4.14Å; L55-L117 HydrophobicContact CD2-CD2 3.74Å; L55-L161 HydrophobicContact CB-CD1 3.7Å; L55-L161 HydrophobicContact CD1-CD1 4.11Å; L55-L164 HydrophobicContact CD1-CD1 4.48Å; L55-L164 HydrophobicContact CD1-CD2 3.76Å
56	G	94	Very high	87.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-38	174.5	0	0	0	0	0	112.1	A52 L59 G60 F218	A52-G56 PolarHBondContact O-N 3.12Å; G56-L59 PolarHBondContact O-N 3.25Å; G56-G60 PolarHBondContact O-N 2.93Å; G56-F218 WeakPolarHBondContact O-CD2 3.38Å
57	S	91.3	Very high	85.4	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-44.4	173.5	-58.2	0	0	0	0	111.7	V53 E54 L55 L59 G60 M61 F232	V53-S57 VanDerWaalsContact O-CB 3.27Å; V53-S57 WeakPolarHBondContact O-CB 3.12Å; V53-S57 PolarHBondContact O-N 2.92Å; V53-S57 PolarHBondContact O-OG 3.43Å; E54-S57 WeakPolarHBondContact O-CB 3.48Å; E54-S57 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact C-N 3.28Å; L55-S57 PolarHBondContact O-N 2.89Å; S57-L59 PolarHBondContact O-N 2.9Å; S57-G60 PolarHBondContact O-N 3.04Å; S57-M61 WeakPolarHBondContact O-CG 3.32Å; S57-M61 PolarHBondContact O-N 3.09Å; S57-F232 WeakPolarHBondContact OG-CD1 3.38Å
58	A	88.9	Confident	83.5	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-49.3	175	0	0	0	0	0	111.6	E54 L55 G60 M61 L62 I76 L117	E54-A58 PolarHBondContact O-N 3.27Å; L55-A58 WeakPolarHBondContact O-CB 3.47Å; L55-A58 PolarHBondContact O-N 2.6Å; A58-G60 VanDerWaalsContact C-N 3.32Å; A58-G60 PolarHBondContact O-N 3.16Å; A58-M61 PolarHBondContact O-N 3.38Å; A58-M61 VanDerWaalsContact O-N 3.16Å; A58-L62 VanDerWaalsContact O-CG 3.26Å; A58-L62 WeakPolarHBondContact O-CG 3.1Å; A58-L62 PolarHBondContact O-N 3.37Å; A58-I76 HydrophobicContact CB-CB 4.48Å; A58-I76 HydrophobicContact CB-CG2 3.63Å; A58-L117 HydrophobicContact CB-CD1 3.86Å
59	L	90	Very high	81.5	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-39.9	177.5	-68.1	-168.3	0	0	0	112.7	L55 G56 S57 L62 S63 L102 D157 W158 L161	L55-L59 WeakPolarHBondContact O-CG 3.23Å; L55-L59 PolarHBondContact O-N 3.38Å; G56-L59 PolarHBondContact O-N 3.25Å; S57-L59 PolarHBondContact O-N 2.9Å; L59-L62 HydrophobicContact CD2-CD1 4.11Å; L59-L62 PolarHBondContact O-N 3.31Å; L59-S63 VanDerWaalsContact O-CB 3.3Å; L59-S63 WeakPolarHBondContact O-CB 3.45Å; L59-S63 PolarHBondContact O-N 2.97Å; L59-S63 PolarHBondContact O-OG 2.97Å; L59-L102 HydrophobicContact CD1-CD2 4.07Å; L59-L102 HydrophobicContact CD2-CD2 4.35Å; L59-L102 HydrophobicContact CG-CD2 4.47Å; L59-D157 HydrophobicContact CD1-CB 4.05Å; L59-D157 WeakPolarHBondContact CD1-O 3.46Å; L59-D157 HydrophobicContact CD2-CB 3.79Å; L59-W158 HydrophobicContact CB-CH2 4.43Å; L59-W158 HydrophobicContact CB-CZ2 4.14Å; L59-W158 HydrophobicContact CD1-CD2 4.27Å; L59-W158 HydrophobicContact CD1-CE3 4.41Å; L59-W158 HydrophobicContact CD1-CG 4.49Å; L59-L161 HydrophobicContact CD1-CB 3.89Å; L59-L161 HydrophobicContact CD1-CD2 4.04Å
60	G	87.9	Confident	79.6	Confident	4 Å²	4	31 Å²	31	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-47.3	173.1	0	0	0	0	0	112	G56 S57 A58 S63 F64	G56-G60 PolarHBondContact O-N 2.93Å; S57-G60 PolarHBondContact O-N 3.04Å; A58-G60 VanDerWaalsContact C-N 3.32Å; A58-G60 PolarHBondContact O-N 3.16Å; G60-S63 PolarHBondContact O-N 3.5Å; G60-F64 PolarHBondContact O-N 2.92Å
61	M	83.1	Confident	77.6	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-36.2	178.5	-64.1	174.9	-148.3	0	0	113.1	S57 A58 F64 Y69 P72 M73 I76 L236	S57-M61 WeakPolarHBondContact O-CG 3.32Å; S57-M61 PolarHBondContact O-N 3.09Å; A58-M61 PolarHBondContact O-N 3.38Å; A58-M61 VanDerWaalsContact O-N 3.16Å; M61-F64 VanDerWaalsContact O-O 3.08Å; M61-Y69 HydrophobicContact CE-CD1 4.14Å; M61-Y69 HydrophobicContact CE-CG 4.06Å; M61-Y69 HydrophobicContact CG-CG 4.28Å; M61-P72 HydrophobicContact CE-CB 3.88Å; M61-P72 HydrophobicContact SD-CB 4.49Å; M61-M73 HydrophobicContact CB-CE 3.6Å; M61-M73 HydrophobicContact CB-CG 4.36Å; M61-M73 HydrophobicContact CB-SD 4.28Å; M61-M73 WeakPolarHBondContact O-CE 3.47Å; M61-M73 HydrophobicContact SD-CB 3.86Å; M61-M73 HydrophobicContact SD-CG 4Å; M61-I76 HydrophobicContact CE-CD1 4.37Å; M61-L236 HydrophobicContact CE-CD1 4.15Å; M61-L236 HydrophobicContact CE-CD2 4.12Å
62	L	83.4	Confident	75.8	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-42.8	174.8	-70.1	176.5	0	0	0	110.9	A58 L59 M73 M77 W87 V97 Y99 L117 F120	A58-L62 VanDerWaalsContact O-CG 3.26Å; A58-L62 WeakPolarHBondContact O-CG 3.1Å; A58-L62 PolarHBondContact O-N 3.37Å; L59-L62 HydrophobicContact CD2-CD1 4.11Å; L59-L62 PolarHBondContact O-N 3.31Å; L62-M73 HydrophobicContact CD2-CE 4.35Å; L62-M77 HydrophobicContact CD2-CE 3.38Å; L62-M77 HydrophobicContact CD2-SD 3.45Å; L62-M77 WeakPolarHBondContact CD2-SD 3.48Å; L62-M77 HydrophobicContact CG-SD 4.15Å; L62-W87 HydrophobicContact CD2-CH2 3.18Å; L62-W87 HydrophobicContact CD2-CZ2 3.56Å; L62-W87 HydrophobicContact CD2-CZ3 4.2Å; L62-W87 HydrophobicContact CG-CH2 4.44Å; L62-V97 HydrophobicContact CD2-CB 4.39Å; L62-V97 PolarHBondContact O-N 3.1Å; L62-Y99 HydrophobicContact CD1-CD2 4.46Å; L62-Y99 HydrophobicContact CD1-CG 4.45Å; L62-L117 HydrophobicContact CD1-CD1 4.47Å; L62-F120 HydrophobicContact CD2-CE1 4.25Å
63	S	81.1	Confident	74.2	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-78.3	-32.1	-176.3	-58.6	0	0	0	0	112.9	L59 G60	L59-S63 VanDerWaalsContact O-CB 3.3Å; L59-S63 WeakPolarHBondContact O-CB 3.45Å; L59-S63 PolarHBondContact O-N 2.97Å; L59-S63 PolarHBondContact O-OG 2.97Å; G60-S63 PolarHBondContact O-N 3.5Å
64	F	71.4	Confident	72.7	Confident	59 Å²	59	43.2 Å²	43.2	26%	0.259	22%	0.224	S	C	.	.	S	Bend	trans	-135	140.9	-171.2	-80.2	-87.4	0	0	0	114.4	G60 M61 H66 R128	G60-F64 PolarHBondContact O-N 2.92Å; M61-F64 VanDerWaalsContact O-O 3.08Å; F64-H66 PolarHBondContact O-N 2.91Å; F64-R128 VanDerWaalsContact CZ-NE 3.3Å
65	K	58.1	Low	71.5	Confident	104 Å²	104	47.8 Å²	47.8	45%	0.452	24%	0.241	S	C	.	.			trans	-75.3	89.9	168.5	-159.5	-180	-173.9	-178	0	109.4	Y91 I92	K65-Y91 WeakPolarHBondContact CE-O 3.16Å; K65-Y91 HydrophobicContact CG-CD1 4.48Å; K65-Y91 HydrophobicContact CG-CE1 4.09Å; K65-I92 PolarHBondContact NZ-O 2.73Å
66	H	54.9	Low	70.2	Confident	101 Å²	101	48 Å²	48	47%	0.468	24%	0.242	S	C	.	.			trans	-106.8	106	160.3	-93.9	-89.2	0	0	0	108.3	F64 V68 Y69	F64-H66 PolarHBondContact O-N 2.91Å; H66-V68 PolarHBondContact O-N 3.24Å; H66-Y69 HydrophobicContact CB-CD2 3.51Å; H66-Y69 HydrophobicContact CB-CE2 3.89Å; H66-Y69 PolarHBondContact O-N 3.38Å
67	S	49	Very low	69	Low	108 Å²	108	48.6 Å²	48.6	76%	0.755	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-53.3	-21.8	179.2	33.8	0	0	0	0	113.9	Y69	S67-Y69 PolarHBondContact O-N 3.3Å
68	V	54.4	Low	67.6	Low	109 Å²	109	51.5 Å²	51.5	66%	0.661	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-70.2	-18.7	-179.8	-164.9	0	0	0	0	112.8	H66	H66-V68 PolarHBondContact O-N 3.24Å
69	Y	54	Low	65.9	Low	44 Å²	44	53 Å²	53	17%	0.173	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-111.1	7.6	-170.3	-60.8	-63.8	0	0	0	115.7	M61 H66 S67 L71 P72 M73 F218 L236	M61-Y69 HydrophobicContact CE-CD1 4.14Å; M61-Y69 HydrophobicContact CE-CG 4.06Å; M61-Y69 HydrophobicContact CG-CG 4.28Å; H66-Y69 HydrophobicContact CB-CD2 3.51Å; H66-Y69 HydrophobicContact CB-CE2 3.89Å; H66-Y69 PolarHBondContact O-N 3.38Å; S67-Y69 PolarHBondContact O-N 3.3Å; Y69-L71 PolarHBondContact O-N 3.44Å; Y69-P72 HydrophobicContact CD1-CG 4.46Å; Y69-P72 VanDerWaalsContact O-CD 3.26Å; Y69-P72 WeakPolarHBondContact O-CD 3.47Å; Y69-M73 WeakPolarHBondContact O-CB 3.4Å; Y69-M73 PolarHBondContact O-N 3.3Å; Y69-F218 AromaticContact CE2-CE1 3.95Å; Y69-F218 HydrophobicContact CE2-CE1 3.95Å; Y69-F218 AromaticContact CZ-CE1 3.98Å; Y69-L236 HydrophobicContact CD1-CD1 4.06Å; Y69-L236 HydrophobicContact CE1-CD1 4.07Å
70	F	56.7	Low	63.8	Low	84 Å²	84	56 Å²	56	37%	0.368	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-41.9	-176.3	-172.2	-98.7	0	0	0	113.5	M73 Y91	F70-M73 WeakPolarHBondContact O-CB 3.48Å; F70-M73 PolarHBondContact O-N 3.48Å; F70-Y91 HydrophobicContact CD2-CD1 4.39Å; F70-Y91 HydrophobicContact CD2-CE1 4.2Å
71	L	55.2	Low	61.6	Low	134 Å²	134	63.8 Å²	63.8	70%	0.702	32%	0.322	S	S	*	.	H	α-helix	trans	-69	-45.8	177.5	-80.2	160.9	0	0	0	113	Y69 M73 Q74	Y69-L71 PolarHBondContact O-N 3.44Å; L71-M73 PolarHBondContact O-N 3.19Å; L71-Q74 PolarHBondContact O-N 2.96Å
72	P	58.7	Low	59.8	Low	23 Å²	23	68.8 Å²	68.8	15%	0.149	35%	0.353	C	S	.	.	H	α-helix	trans	-54	-32.3	168.3	-31.2	34.8	0	0	0	114.7	M61 Y69 Q74 R75 I76 L236	M61-P72 HydrophobicContact CE-CB 3.88Å; M61-P72 HydrophobicContact SD-CB 4.49Å; Y69-P72 HydrophobicContact CD1-CG 4.46Å; Y69-P72 VanDerWaalsContact O-CD 3.26Å; Y69-P72 WeakPolarHBondContact O-CD 3.47Å; P72-Q74 VanDerWaalsContact C-N 3.32Å; P72-Q74 PolarHBondContact O-N 3.41Å; P72-R75 WeakPolarHBondContact O-CB 3.19Å; P72-R75 PolarHBondContact O-N 3.26Å; P72-R75 VanDerWaalsContact O-N 3.1Å; P72-I76 PolarHBondContact O-N 2.7Å; P72-L236 HydrophobicContact CB-CB 4.12Å; P72-L236 HydrophobicContact CB-CD1 4.42Å; P72-L236 HydrophobicContact CB-CD2 4.34Å; P72-L236 HydrophobicContact CG-CB 4.31Å
73	M	62	Low	58.2	Low	11 Å²	11	71 Å²	71	5%	0.054	36%	0.363	C	S	.	.	H	α-helix	trans	-61.1	-39.7	-178.4	-155.1	172.8	-156.6	0	0	112.2	M61 L62 Y69 F70 L71 R75 I76 M77 W87 Y91	M61-M73 HydrophobicContact CB-CE 3.6Å; M61-M73 HydrophobicContact CB-CG 4.36Å; M61-M73 HydrophobicContact CB-SD 4.28Å; M61-M73 WeakPolarHBondContact O-CE 3.47Å; M61-M73 HydrophobicContact SD-CB 3.86Å; M61-M73 HydrophobicContact SD-CG 4Å; L62-M73 HydrophobicContact CD2-CE 4.35Å; Y69-M73 WeakPolarHBondContact O-CB 3.4Å; Y69-M73 PolarHBondContact O-N 3.3Å; F70-M73 WeakPolarHBondContact O-CB 3.48Å; F70-M73 PolarHBondContact O-N 3.48Å; L71-M73 PolarHBondContact O-N 3.19Å; M73-R75 PolarHBondContact O-N 3.48Å; M73-I76 PolarHBondContact O-N 3.3Å; M73-M77 HydrophobicContact CE-CE 4.19Å; M73-M77 HydrophobicContact CE-SD 3.39Å; M73-M77 WeakPolarHBondContact CE-SD 3.34Å; M73-M77 HydrophobicContact CG-CG 4.34Å; M73-M77 HydrophobicContact CG-SD 3.5Å; M73-M77 VanDerWaalsContact CG-SD 3.5Å; M73-M77 WeakPolarHBondContact O-CB 3.38Å; M73-M77 PolarHBondContact O-N 3.25Å; M73-M77 HydrophobicContact SD-SD 4.19Å; M73-W87 HydrophobicContact CE-CE3 3.99Å; M73-W87 HydrophobicContact CE-CH2 3.9Å; M73-W87 HydrophobicContact CE-CZ3 3.26Å; M73-W87 HydrophobicContact SD-CE3 4.41Å; M73-W87 HydrophobicContact SD-CZ3 4.22Å; M73-Y91 HydrophobicContact CE-CE2 3.86Å; M73-Y91 HydrophobicContact SD-CE2 3.89Å
74	Q	64.7	Low	56.9	Low	104 Å²	104	74.8 Å²	74.8	49%	0.486	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-27.4	177.2	-74	-176.5	-47.1	0	0	112.9	L71 P72 E84	L71-Q74 PolarHBondContact O-N 2.96Å; P72-Q74 VanDerWaalsContact C-N 3.32Å; P72-Q74 PolarHBondContact O-N 3.41Å; Q74-E84 PolarHBondContact NE2-OE1 3.17Å
75	R	69.3	Low	55.9	Low	101 Å²	101	79.5 Å²	79.5	38%	0.381	40%	0.402	S	S	.	.	H	α-helix	trans	-70.6	-46.1	176	-95.9	-179.4	159.4	-117.2	-3.7	111.7	P72 M73 K116 G238	P72-R75 WeakPolarHBondContact O-CB 3.19Å; P72-R75 PolarHBondContact O-N 3.26Å; P72-R75 VanDerWaalsContact O-N 3.1Å; M73-R75 PolarHBondContact O-N 3.48Å; R75-K116 WeakPolarHBondContact O-CE 3.3Å; R75-K116 WeakPolarHBondContact O-CG 3.42Å; R75-G238 VanDerWaalsContact NH1-CA 3.3Å
76	I	67	Low	55.9	Low	4 Å²	4	81.1 Å²	81.1	2%	0.021	41%	0.409	C	S	.	.	H	α-helix	trans	-88.6	-30	-171.5	-56.7	164.4	0	0	0	112.2	E54 A58 M61 P72 M73 V115 K116 L117 L236	E54-I76 HydrophobicContact CB-CD1 4.39Å; A58-I76 HydrophobicContact CB-CB 4.48Å; A58-I76 HydrophobicContact CB-CG2 3.63Å; M61-I76 HydrophobicContact CE-CD1 4.37Å; P72-I76 PolarHBondContact O-N 2.7Å; M73-I76 PolarHBondContact O-N 3.3Å; I76-V115 HydrophobicContact CG2-CG2 4.04Å; I76-K116 CarbonylContact O-C 3.53Å; I76-K116 WeakPolarHBondContact O-CA 3.47Å; I76-L117 PolarHBondContact O-N 3.3Å; I76-L236 HydrophobicContact CD1-CD2 3.4Å
77	M	67.8	Low	56	Low	14 Å²	14	77.3 Å²	77.3	7%	0.069	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-99.2	100.3	-178.3	-66.8	177.6	50	0	0	110.1	L62 M73 S79 F83 W87 F120	L62-M77 HydrophobicContact CD2-CE 3.38Å; L62-M77 HydrophobicContact CD2-SD 3.45Å; L62-M77 WeakPolarHBondContact CD2-SD 3.48Å; L62-M77 HydrophobicContact CG-SD 4.15Å; M73-M77 HydrophobicContact CE-CE 4.19Å; M73-M77 HydrophobicContact CE-SD 3.39Å; M73-M77 WeakPolarHBondContact CE-SD 3.34Å; M73-M77 HydrophobicContact CG-CG 4.34Å; M73-M77 HydrophobicContact CG-SD 3.5Å; M73-M77 VanDerWaalsContact CG-SD 3.5Å; M73-M77 WeakPolarHBondContact O-CB 3.38Å; M73-M77 PolarHBondContact O-N 3.25Å; M73-M77 HydrophobicContact SD-SD 4.19Å; M77-S79 PolarHBondContact O-N 2.95Å; M77-F83 HydrophobicContact CE-CE1 4.4Å; M77-W87 HydrophobicContact CE-CD2 4.26Å; M77-W87 HydrophobicContact CE-CE3 4.32Å; M77-W87 HydrophobicContact CE-CH2 3.69Å; M77-W87 HydrophobicContact CE-CZ2 3.49Å; M77-W87 VanDerWaalsContact CE-CZ2 3.49Å; M77-W87 HydrophobicContact CE-CZ3 4.1Å; M77-F120 HydrophobicContact CB-CZ 4.13Å; M77-F120 HydrophobicContact CE-CE1 3.69Å; M77-F120 HydrophobicContact CE-CZ 3.76Å; M77-F120 HydrophobicContact CG-CZ 4.09Å
78	Y	62.5	Low	56.1	Low	61 Å²	61	75.2 Å²	75.2	24%	0.239	37%	0.373	C	S	.	.			trans	-81	113.2	171.4	-173.1	-92.5	0	0	0	108.9	P22 V23 L117 I118 F120	P22-Y78 WeakPolarHBondContact CB-OH 3.48Å; V23-Y78 HydrophobicContact CG2-CE1 3.67Å; Y78-L117 PolarHBondContact N-O 3Å; Y78-I118 HydrophobicContact CD1-CG2 4.22Å; Y78-I118 HydrophobicContact CG-CG2 4.5Å; Y78-F120 WeakPolarHBondContact O-CE2 3.28Å
79	S	53.1	Low	55.9	Low	31 Å²	31	78.3 Å²	78.3	22%	0.217	37%	0.373	C	S	.	.			trans	-141.6	133.7	175.8	62.7	0	0	0	0	109.9	M77 Q81 F83	M77-S79 PolarHBondContact O-N 2.95Å; S79-Q81 PolarHBondContact O-N 3.08Å; S79-F83 VanDerWaalsContact OG-CB 3.32Å; S79-F83 WeakPolarHBondContact OG-CB 3.26Å; S79-F83 WeakPolarHBondContact OG-CD1 3.13Å
80	C	45.4	Very low	55.9	Low	64 Å²	64	78.9 Å²	78.9	43%	0.432	38%	0.378	S	S	.	.			trans	-45.6	139.1	177.5	-157.3	0	0	0	0	109.2	T82 F83	C80-T82 PolarHBondContact O-N 3.26Å; C80-F83 VanDerWaalsContact O-CB 3.23Å; C80-F83 WeakPolarHBondContact O-CB 3.41Å; C80-F83 PolarHBondContact O-N 3.49Å
81	Q	42.8	Very low	55.7	Low	169 Å²	169	76 Å²	76	79%	0.79	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.8	-31.1	-175.5	-88.3	171.6	-32.7	0	0	115.8	S79 F83 E84	S79-Q81 PolarHBondContact O-N 3.08Å; Q81-F83 PolarHBondContact O-N 3.25Å; Q81-E84 PolarHBondContact O-N 3.13Å
82	T	44.4	Very low	55.1	Low	108 Å²	108	74.8 Å²	74.8	66%	0.663	36%	0.357	S	S	*	.	H	α-helix	trans	-64.2	-19.8	174.7	35.2	0	0	0	0	115.3	C80	C80-T82 PolarHBondContact O-N 3.26Å
83	F	50.2	Low	54.8	Low	50 Å²	50	79 Å²	79	22%	0.219	38%	0.375	C	S	.	.	H	α-helix	trans	-82.4	-32.3	-179.8	-149.5	-107.1	0	0	0	111.2	M77 S79 C80 Q81 E85 K86 W87 F120	M77-F83 HydrophobicContact CE-CE1 4.4Å; S79-F83 VanDerWaalsContact OG-CB 3.32Å; S79-F83 WeakPolarHBondContact OG-CB 3.26Å; S79-F83 WeakPolarHBondContact OG-CD1 3.13Å; C80-F83 VanDerWaalsContact O-CB 3.23Å; C80-F83 WeakPolarHBondContact O-CB 3.41Å; C80-F83 PolarHBondContact O-N 3.49Å; Q81-F83 PolarHBondContact O-N 3.25Å; F83-E85 PolarHBondContact O-N 3.44Å; F83-K86 PolarHBondContact O-N 3.49Å; F83-W87 AromaticContact CD1-CD1 3.13Å; F83-W87 HydrophobicContact CD1-CG 4.04Å; F83-W87 AromaticContact CD1-NE1 3.24Å; F83-W87 AromaticContact CE1-CD1 3.27Å; F83-W87 HydrophobicContact CE1-CD2 4.43Å; F83-W87 AromaticContact CE1-CE2 3.59Å; F83-W87 HydrophobicContact CE1-CG 4.25Å; F83-W87 HydrophobicContact CE1-CZ2 4.23Å; F83-W87 AromaticContact CE1-NE1 2.77Å; F83-W87 AromaticContact CG-CD1 3.75Å; F83-W87 AromaticContact CZ-CD1 3.84Å; F83-W87 AromaticContact CZ-NE1 3.17Å; F83-W87 WeakPolarHBondContact O-CB 3.17Å; F83-W87 PolarHBondContact O-N 3.3Å; F83-F120 HydrophobicContact CE1-CB 4.13Å; F83-F120 AromaticContact CE1-CD1 3.75Å; F83-F120 HydrophobicContact CE1-CD1 3.75Å; F83-F120 HydrophobicContact CE1-CD2 4.07Å; F83-F120 HydrophobicContact CE1-CE1 4.18Å; F83-F120 HydrophobicContact CE1-CE2 4.47Å; F83-F120 AromaticContact CE1-CG 3.7Å; F83-F120 HydrophobicContact CE1-CG 3.7Å; F83-F120 HydrophobicContact CE2-CB 3.65Å; F83-F120 HydrophobicContact CE2-CG 4.16Å; F83-F120 HydrophobicContact CZ-CB 3.28Å; F83-F120 AromaticContact CZ-CD1 3.53Å; F83-F120 HydrophobicContact CZ-CD1 3.53Å; F83-F120 HydrophobicContact CZ-CD2 4.09Å; F83-F120 HydrophobicContact CZ-CE1 4.39Å; F83-F120 AromaticContact CZ-CG 3.35Å; F83-F120 HydrophobicContact CZ-CG 3.35Å
84	E	53.3	Low	54.6	Low	87 Å²	87	84.1 Å²	84.1	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-44.9	179.2	-70.2	-163.3	135.5	0	0	112.7	Q74 Q81 T88	Q74-E84 PolarHBondContact NE2-OE1 3.17Å; Q81-E84 PolarHBondContact O-N 3.13Å; E84-T88 WeakPolarHBondContact O-CB 3.1Å; E84-T88 PolarHBondContact O-N 3.4Å; E84-T88 PolarHBondContact O-OG1 2.89Å
85	E	51.2	Low	54.6	Low	158 Å²	158	80.6 Å²	80.6	74%	0.738	39%	0.387	S	S	*	.	H	α-helix	trans	-66	-45.5	179.5	-71.6	-172.5	155	0	0	112.1	F83 T88 R89	F83-E85 PolarHBondContact O-N 3.44Å; E85-T88 PolarHBondContact O-N 2.89Å; E85-R89 PolarHBondContact O-N 3.32Å; E85-R89 VanDerWaalsContact O-N 3.11Å
86	K	56.3	Low	55.1	Low	138 Å²	138	76.2 Å²	76.2	60%	0.6	37%	0.373	S	S	*	.	H	α-helix	trans	-70.3	-37.2	-177.4	-150.4	177.6	-171.6	178.7	0	111.1	F83 H90	F83-K86 PolarHBondContact O-N 3.49Å; K86-H90 PolarHBondContact O-N 2.89Å; K86-H90 VanDerWaalsContact O-N 3.11Å
87	W	58.5	Low	56	Low	21 Å²	21	76.1 Å²	76.1	8%	0.08	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-56.4	171.5	-96.3	70.1	0	0	0	111	L62 M73 M77 F83 R89 H90 Y91 V97 W125	L62-W87 HydrophobicContact CD2-CH2 3.18Å; L62-W87 HydrophobicContact CD2-CZ2 3.56Å; L62-W87 HydrophobicContact CD2-CZ3 4.2Å; L62-W87 HydrophobicContact CG-CH2 4.44Å; M73-W87 HydrophobicContact CE-CE3 3.99Å; M73-W87 HydrophobicContact CE-CH2 3.9Å; M73-W87 HydrophobicContact CE-CZ3 3.26Å; M73-W87 HydrophobicContact SD-CE3 4.41Å; M73-W87 HydrophobicContact SD-CZ3 4.22Å; M77-W87 HydrophobicContact CE-CD2 4.26Å; M77-W87 HydrophobicContact CE-CE3 4.32Å; M77-W87 HydrophobicContact CE-CH2 3.69Å; M77-W87 HydrophobicContact CE-CZ2 3.49Å; M77-W87 VanDerWaalsContact CE-CZ2 3.49Å; M77-W87 HydrophobicContact CE-CZ3 4.1Å; F83-W87 AromaticContact CD1-CD1 3.13Å; F83-W87 HydrophobicContact CD1-CG 4.04Å; F83-W87 AromaticContact CD1-NE1 3.24Å; F83-W87 AromaticContact CE1-CD1 3.27Å; F83-W87 HydrophobicContact CE1-CD2 4.43Å; F83-W87 AromaticContact CE1-CE2 3.59Å; F83-W87 HydrophobicContact CE1-CG 4.25Å; F83-W87 HydrophobicContact CE1-CZ2 4.23Å; F83-W87 AromaticContact CE1-NE1 2.77Å; F83-W87 AromaticContact CG-CD1 3.75Å; F83-W87 AromaticContact CZ-CD1 3.84Å; F83-W87 AromaticContact CZ-NE1 3.17Å; F83-W87 WeakPolarHBondContact O-CB 3.17Å; F83-W87 PolarHBondContact O-N 3.3Å; W87-R89 PolarHBondContact O-N 3.23Å; W87-R89 VanDerWaalsContact O-N 3.13Å; W87-H90 PolarHBondContact O-N 3.22Å; W87-Y91 AromaticContact CE3-CD2 3.79Å; W87-Y91 HydrophobicContact CE3-CD2 3.79Å; W87-Y91 HydrophobicContact CE3-CE2 4.35Å; W87-Y91 AromaticContact CZ3-CD2 3.77Å; W87-Y91 HydrophobicContact CZ3-CD2 3.77Å; W87-Y91 HydrophobicContact CZ3-CE2 4.01Å; W87-Y91 WeakPolarHBondContact O-CA 3.37Å; W87-Y91 WeakPolarHBondContact O-CB 3.35Å; W87-Y91 PolarHBondContact O-N 2.74Å; W87-V97 HydrophobicContact CH2-CB 3.62Å; W87-V97 HydrophobicContact CH2-CG1 4.26Å; W87-V97 HydrophobicContact CH2-CG2 3.41Å; W87-V97 VanDerWaalsContact CH2-CG2 3.41Å; W87-V97 HydrophobicContact CZ2-CB 3.66Å; W87-V97 HydrophobicContact CZ2-CG1 3.82Å; W87-V97 HydrophobicContact CZ2-CG2 3.36Å; W87-V97 HydrophobicContact CZ3-CG2 4.25Å; W87-W125 AromaticContact CD2-CH2 3.95Å; W87-W125 HydrophobicContact CD2-CH2 3.95Å; W87-W125 HydrophobicContact CD2-CZ2 4.35Å; W87-W125 HydrophobicContact CE3-CH2 4.23Å; W87-W125 HydrophobicContact CG-CH2 4.17Å; W87-W125 HydrophobicContact CG-CZ2 4.26Å
88	T	51.3	Low	57	Low	64 Å²	64	75.5 Å²	75.5	39%	0.393	37%	0.369	S	S	.	.	H	α-helix	trans	-52.9	-44.2	-177.6	-56.1	0	0	0	0	111	E84 E85 I92	E84-T88 WeakPolarHBondContact O-CB 3.1Å; E84-T88 PolarHBondContact O-N 3.4Å; E84-T88 PolarHBondContact O-OG1 2.89Å; E85-T88 PolarHBondContact O-N 2.89Å; T88-I92 VanDerWaalsContact O-CD1 3.32Å; T88-I92 WeakPolarHBondContact O-CD1 3.19Å; T88-I92 WeakPolarHBondContact O-CG1 3.35Å; T88-I92 PolarHBondContact O-N 3.19Å
89	R	50.2	Low	58.4	Low	174 Å²	174	72.6 Å²	72.6	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-66.1	-42.6	178.8	-171.8	176.6	162.2	178	-4.4	113.9	E85 W87 H93	E85-R89 PolarHBondContact O-N 3.32Å; E85-R89 VanDerWaalsContact O-N 3.11Å; W87-R89 PolarHBondContact O-N 3.23Å; W87-R89 VanDerWaalsContact O-N 3.13Å; R89-H93 PolarHBondContact O-CD2 2.76Å
90	H	52.2	Low	60.3	Low	57 Å²	57	72.7 Å²	72.7	26%	0.264	35%	0.354	S	S	.	.	H	α-helix	trans	-84.6	-25.8	-179.7	-84.7	21.1	0	0	0	113.8	K86 W87 I92 H93 W125	K86-H90 PolarHBondContact O-N 2.89Å; K86-H90 VanDerWaalsContact O-N 3.11Å; W87-H90 PolarHBondContact O-N 3.22Å; H90-I92 PolarHBondContact O-N 3.08Å; H90-H93 PolarHBondContact O-N 2.76Å; H90-W125 HydrophobicContact CB-CD2 3.9Å; H90-W125 HydrophobicContact CB-CE3 3.79Å; H90-W125 HydrophobicContact CB-CH2 3.3Å; H90-W125 HydrophobicContact CB-CZ2 3.4Å; H90-W125 VanDerWaalsContact CB-CZ2 3.4Å; H90-W125 HydrophobicContact CB-CZ3 3.49Å; H90-W125 VanDerWaalsContact CB-CZ3 3.49Å; H90-W125 AromaticContact CD2-CD1 3.85Å; H90-W125 AromaticContact CD2-CD2 3.72Å; H90-W125 AromaticContact CD2-CE2 3.63Å; H90-W125 AromaticContact CD2-CG 3.89Å; H90-W125 AromaticContact CD2-NE1 3.68Å
91	Y	52.5	Low	62.7	Low	24 Å²	24	70.1 Å²	70.1	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-32.4	170.1	-156.9	-99	0	0	0	110.8	K65 F70 M73 W87 H93	K65-Y91 WeakPolarHBondContact CE-O 3.16Å; K65-Y91 HydrophobicContact CG-CD1 4.48Å; K65-Y91 HydrophobicContact CG-CE1 4.09Å; F70-Y91 HydrophobicContact CD2-CD1 4.39Å; F70-Y91 HydrophobicContact CD2-CE1 4.2Å; M73-Y91 HydrophobicContact CE-CE2 3.86Å; M73-Y91 HydrophobicContact SD-CE2 3.89Å; W87-Y91 AromaticContact CE3-CD2 3.79Å; W87-Y91 HydrophobicContact CE3-CD2 3.79Å; W87-Y91 HydrophobicContact CE3-CE2 4.35Å; W87-Y91 AromaticContact CZ3-CD2 3.77Å; W87-Y91 HydrophobicContact CZ3-CD2 3.77Å; W87-Y91 HydrophobicContact CZ3-CE2 4.01Å; W87-Y91 WeakPolarHBondContact O-CA 3.37Å; W87-Y91 WeakPolarHBondContact O-CB 3.35Å; W87-Y91 PolarHBondContact O-N 2.74Å; Y91-H93 VanDerWaalsContact C-N 3.32Å; Y91-H93 PolarHBondContact O-N 3.33Å
92	I	44.3	Very low	65.2	Low	107 Å²	107	62.1 Å²	62.1	55%	0.549	30%	0.298	S	S	.	.	H	α-helix	trans	-63.7	-36.6	172	-67.1	161.5	0	0	0	111.6	K65 T88 H90 N94	K65-I92 PolarHBondContact NZ-O 2.73Å; T88-I92 VanDerWaalsContact O-CD1 3.32Å; T88-I92 WeakPolarHBondContact O-CD1 3.19Å; T88-I92 WeakPolarHBondContact O-CG1 3.35Å; T88-I92 PolarHBondContact O-N 3.19Å; H90-I92 PolarHBondContact O-N 3.08Å; I92-N94 VanDerWaalsContact C-N 3.3Å; I92-N94 PolarHBondContact O-N 3.34Å
93	H	52	Low	67.5	Low	113 Å²	113	58.6 Å²	58.6	52%	0.523	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	10.9	-171	-72.5	-132.7	0	0	0	115.2	R89 H90 Y91 N95	R89-H93 PolarHBondContact O-CD2 2.76Å; H90-H93 PolarHBondContact O-N 2.76Å; Y91-H93 VanDerWaalsContact C-N 3.32Å; Y91-H93 PolarHBondContact O-N 3.33Å; H93-N95 PolarHBondContact O-N 3.33Å
94	N	57	Low	69.6	Low	118 Å²	118	56.2 Å²	56.2	63%	0.631	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	23.2	178	-145.2	33.8	0	0	0	114.2	I92	I92-N94 VanDerWaalsContact C-N 3.3Å; I92-N94 PolarHBondContact O-N 3.34Å
95	N	64.4	Low	71.4	Confident	30 Å²	30	55.1 Å²	55.1	16%	0.16	26%	0.258	C	S	.	.			trans	-88.3	122.6	173.3	-63.1	-27.1	0	0	0	108.2	H93 W125 K127	H93-N95 PolarHBondContact O-N 3.33Å; N95-W125 HydrophobicContact CB-CE3 3.7Å; N95-W125 HydrophobicContact CB-CZ3 4.34Å; N95-W125 WeakPolarHBondContact O-CZ3 3.13Å; N95-K127 WeakPolarHBondContact OD1-CE 3.35Å; N95-K127 WeakPolarHBondContact OD1-CG 3.19Å
96	G	80.8	Confident	73.3	Confident	8 Å²	8	48 Å²	48	8%	0.082	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	166.6	168.3	0	0	0	0	0	110.7	W125 L126	G96-W125 WeakPolarHBondContact O-CA 3.33Å; G96-L126 CarbonylContact C-O 3.52Å; G96-L126 WeakPolarHBondContact CA-O 3.49Å; G96-L126 PolarHBondContact N-O 3.33Å; G96-L126 PolarHBondContact O-N 2.94Å
97	V	85.2	Confident	75	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.8	170.6	178.5	0	0	0	0	108.9	L62 W87 A123 K124 W125 H154	L62-V97 HydrophobicContact CD2-CB 4.39Å; L62-V97 PolarHBondContact O-N 3.1Å; W87-V97 HydrophobicContact CH2-CB 3.62Å; W87-V97 HydrophobicContact CH2-CG1 4.26Å; W87-V97 HydrophobicContact CH2-CG2 3.41Å; W87-V97 VanDerWaalsContact CH2-CG2 3.41Å; W87-V97 HydrophobicContact CZ2-CB 3.66Å; W87-V97 HydrophobicContact CZ2-CG1 3.82Å; W87-V97 HydrophobicContact CZ2-CG2 3.36Å; W87-V97 HydrophobicContact CZ3-CG2 4.25Å; V97-A123 HydrophobicContact CG1-CB 4Å; V97-K124 WeakPolarHBondContact CA-O 3.26Å; V97-W125 HydrophobicContact CG2-CD2 3.74Å; V97-W125 HydrophobicContact CG2-CE3 3.31Å; V97-W125 HydrophobicContact CG2-CH2 3.74Å; V97-W125 HydrophobicContact CG2-CZ2 4.13Å; V97-W125 HydrophobicContact CG2-CZ3 3.33Å; V97-H154 PolarHBondContact O-ND1 3.14Å
98	I	90.1	Very high	76.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.8	166.4	-165.3	178.5	0	0	0	108.1	R100 A123 K124 L126 Y152 S153 D157	I98-R100 HydrophobicContact CB-CG 4.13Å; I98-R100 HydrophobicContact CD1-CG 3.77Å; I98-R100 HydrophobicContact CG1-CG 3.56Å; I98-R100 HydrophobicContact CG2-CG 3.79Å; I98-A123 CarbonylContact O-C 3.46Å; I98-A123 VanDerWaalsContact O-CA 3.25Å; I98-A123 WeakPolarHBondContact O-CA 3.33Å; I98-K124 HydrophobicContact CG2-CB 4.03Å; I98-K124 WeakPolarHBondContact CG2-O 3.37Å; I98-K124 PolarHBondContact N-O 3.08Å; I98-K124 PolarHBondContact O-N 3.31Å; I98-L126 HydrophobicContact CB-CB 4.45Å; I98-L126 HydrophobicContact CB-CD2 4.31Å; I98-L126 HydrophobicContact CD1-CD2 4.23Å; I98-L126 HydrophobicContact CG2-CB 4.07Å; I98-L126 HydrophobicContact CG2-CD2 4.18Å; I98-Y152 HydrophobicContact CD1-CD2 3.71Å; I98-Y152 HydrophobicContact CD1-CE2 3.58Å; I98-S153 VanDerWaalsContact CD1-O 3.26Å; I98-S153 WeakPolarHBondContact CD1-O 3.43Å; I98-D157 WeakPolarHBondContact CA-OD2 3.35Å; I98-D157 VanDerWaalsContact CG1-OD2 3.25Å; I98-D157 WeakPolarHBondContact CG1-OD2 3.29Å
99	Y	91.3	Very high	78.3	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	18%	0.181	C	C	.	.			trans	-82.5	-47.6	-174.1	-172.5	-116.7	0	0	0	112.6	L62 D101 L102 I118 F120 L122 A123 D157	L62-Y99 HydrophobicContact CD1-CD2 4.46Å; L62-Y99 HydrophobicContact CD1-CG 4.45Å; Y99-D101 VanDerWaalsContact CE1-C 3.44Å; Y99-D101 VanDerWaalsContact CE1-O 3.29Å; Y99-D101 WeakPolarHBondContact CE1-O 3.39Å; Y99-D101 PolarHBondContact O-N 2.66Å; Y99-D101 VanDerWaalsContact O-N 3.17Å; Y99-L102 HydrophobicContact CD1-CB 3.87Å; Y99-L102 HydrophobicContact CE1-CB 4.14Å; Y99-L102 HydrophobicContact CE1-CD1 4.33Å; Y99-I118 PolarHBondContact OH-O 3.24Å; Y99-F120 AromaticContact CD2-CD1 3.61Å; Y99-F120 HydrophobicContact CD2-CD1 3.61Å; Y99-F120 AromaticContact CD2-CE1 3.57Å; Y99-F120 HydrophobicContact CD2-CE1 3.57Å; Y99-F120 HydrophobicContact CD2-CG 4.4Å; Y99-F120 HydrophobicContact CD2-CZ 4.34Å; Y99-F120 AromaticContact CE2-CD1 3.5Å; Y99-F120 HydrophobicContact CE2-CD1 3.5Å; Y99-F120 HydrophobicContact CE2-CD2 4.26Å; Y99-F120 AromaticContact CE2-CE1 3.45Å; Y99-F120 HydrophobicContact CE2-CE1 3.45Å; Y99-F120 VanDerWaalsContact CE2-CE1 3.45Å; Y99-F120 HydrophobicContact CE2-CE2 4.22Å; Y99-F120 AromaticContact CE2-CG 3.91Å; Y99-F120 HydrophobicContact CE2-CG 3.91Å; Y99-F120 AromaticContact CE2-CZ 3.83Å; Y99-F120 HydrophobicContact CE2-CZ 3.83Å; Y99-L122 CarbonylContact O-C 3.38Å; Y99-A123 HydrophobicContact CD2-CB 4.46Å; Y99-A123 PolarHBondContact O-N 2.9Å; Y99-D157 PolarHBondContact N-OD2 3.07Å
100	R	93.6	Very high	80	Confident	32 Å²	32	30.7 Å²	30.7	12%	0.121	15%	0.152	C	C	.	.			trans	68	-1.5	171.5	-51.5	-171.4	-71.7	160	4.6	117.5	I98 L122 C136 G137 Y152 D157	I98-R100 HydrophobicContact CB-CG 4.13Å; I98-R100 HydrophobicContact CD1-CG 3.77Å; I98-R100 HydrophobicContact CG1-CG 3.56Å; I98-R100 HydrophobicContact CG2-CG 3.79Å; R100-L122 PolarHBondContact NE-O 3.49Å; R100-L122 PolarHBondContact NH2-O 2.87Å; R100-C136 VanDerWaalsContact CZ-SG 3.57Å; R100-C136 PolarHBondContact NH1-SG 2.75Å; R100-G137 WeakPolarHBondContact O-CA 3.26Å; R100-Y152 VanDerWaalsContact CD-OH 3.22Å; R100-Y152 WeakPolarHBondContact CD-OH 3.29Å; R100-Y152 HydrophobicContact CG-CE2 4.21Å; R100-Y152 PolarHBondContact NH1-OH 2.97Å; R100-D157 WeakPolarHBondContact CA-OD1 3.45Å; R100-D157 PolarHBondContact N-OD1 3.02Å
101	D	94.1	Very high	81.6	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.053	16%	0.161	C	C	.	.			trans	-141.5	47.3	174.8	-155.9	35.4	0	0	0	112.3	Y99 K103 N106 L122 G137 T138	Y99-D101 VanDerWaalsContact CE1-C 3.44Å; Y99-D101 VanDerWaalsContact CE1-O 3.29Å; Y99-D101 WeakPolarHBondContact CE1-O 3.39Å; Y99-D101 PolarHBondContact O-N 2.66Å; Y99-D101 VanDerWaalsContact O-N 3.17Å; D101-K103 PolarHBondContact O-N 2.8Å; D101-K103 IonicContact OD1-NZ 2.66Å; D101-K103 WeakPolarHBondContact OD2-CE 3.38Å; D101-K103 IonicContact OD2-NZ 3.48Å; D101-K103 PolarHBondContact OD2-NZ 3.49Å; D101-N106 PolarHBondContact O-ND2 2.88Å; D101-N106 PolarHBondContact OD2-ND2 2.84Å; D101-L122 HydrophobicContact CB-CB 4.26Å; D101-L122 HydrophobicContact CB-CD1 3.81Å; D101-L122 HydrophobicContact CB-CG 4.5Å; D101-G137 WeakPolarHBondContact OD1-CA 3.22Å; D101-T138 PolarHBondContact OD1-N 2.75Å; D101-T138 PolarHBondContact OD1-OG1 2.98Å
102	L	95.7	Very high	83.3	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.172	C	C	.	.			trans	-74.3	106.8	173.3	-175.7	63.5	0	0	0	109.7	L55 L59 Y99 V107 L117 Y141 L161 L164	L55-L102 HydrophobicContact CD2-CD1 4.28Å; L59-L102 HydrophobicContact CD1-CD2 4.07Å; L59-L102 HydrophobicContact CD2-CD2 4.35Å; L59-L102 HydrophobicContact CG-CD2 4.47Å; Y99-L102 HydrophobicContact CD1-CB 3.87Å; Y99-L102 HydrophobicContact CE1-CB 4.14Å; Y99-L102 HydrophobicContact CE1-CD1 4.33Å; L102-V107 HydrophobicContact CD1-CG2 4.11Å; L102-L117 HydrophobicContact CD1-CD2 3.7Å; L102-Y141 WeakPolarHBondContact O-CD1 3.18Å; L102-L161 HydrophobicContact CD2-CB 3.92Å; L102-L161 HydrophobicContact CD2-CD1 4.42Å; L102-L164 HydrophobicContact CD1-CD1 4.4Å; L102-L164 HydrophobicContact CG-CD1 4.23Å
103	K	93.9	Very high	85.6	Confident	34 Å²	34	30.4 Å²	30.4	15%	0.148	15%	0.146	C	C	.	.			trans	-147.8	164.3	179.3	66.7	-172.2	-176.7	-151.9	0	109.9	D101 E105 N106 V107 T138 Y141	D101-K103 PolarHBondContact O-N 2.8Å; D101-K103 IonicContact OD1-NZ 2.66Å; D101-K103 WeakPolarHBondContact OD2-CE 3.38Å; D101-K103 IonicContact OD2-NZ 3.48Å; D101-K103 PolarHBondContact OD2-NZ 3.49Å; K103-E105 VanDerWaalsContact C-N 3.25Å; K103-E105 WeakPolarHBondContact CB-OE2 3.33Å; K103-E105 HydrophobicContact CD-CB 4.4Å; K103-E105 WeakPolarHBondContact CD-OE2 3.46Å; K103-E105 HydrophobicContact CG-CB 4.25Å; K103-E105 WeakPolarHBondContact CG-OE2 3.46Å; K103-E105 PolarHBondContact O-N 2.98Å; K103-N106 WeakPolarHBondContact CE-ND2 3.36Å; K103-N106 WeakPolarHBondContact CE-OD1 3.32Å; K103-N106 HydrophobicContact CG-CB 3.98Å; K103-N106 PolarHBondContact O-N 3.17Å; K103-V107 WeakPolarHBondContact O-CG2 3.22Å; K103-V107 PolarHBondContact O-N 3.3Å; K103-T138 HydrophobicContact CD-CG2 4.31Å; K103-T138 WeakPolarHBondContact CD-OG1 3.46Å; K103-T138 PolarHBondContact NZ-OG1 3.08Å; K103-Y141 HydrophobicContact CB-CD1 4.46Å; K103-Y141 HydrophobicContact CB-CD2 3.72Å; K103-Y141 HydrophobicContact CB-CE1 4.32Å; K103-Y141 HydrophobicContact CB-CE2 3.55Å; K103-Y141 HydrophobicContact CB-CG 4.17Å
104	M	92.9	Very high	87.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-61.5	-36	-174.1	-67.3	-175.6	-79	0	0	112.2	L33 Y34 W37 N106 V107 Y141 L164 T167 L168	L33-M104 HydrophobicContact CB-CB 4.45Å; Y34-M104 HydrophobicContact CD2-CB 4.38Å; Y34-M104 HydrophobicContact CD2-CE 3.9Å; Y34-M104 HydrophobicContact CE2-CE 4.43Å; W37-M104 HydrophobicContact CB-SD 4.14Å; W37-M104 HydrophobicContact CD2-CE 4.09Å; W37-M104 HydrophobicContact CD2-SD 3.99Å; W37-M104 HydrophobicContact CE3-CE 3.95Å; W37-M104 HydrophobicContact CE3-SD 4.28Å; W37-M104 HydrophobicContact CG-SD 3.94Å; W37-M104 HydrophobicContact CH2-CE 4.5Å; W37-M104 HydrophobicContact CZ3-CE 4.18Å; M104-N106 PolarHBondContact O-N 2.84Å; M104-V107 PolarHBondContact O-N 2.97Å; M104-V107 VanDerWaalsContact O-N 3.08Å; M104-Y141 WeakPolarHBondContact CE-OH 3.25Å; M104-L164 HydrophobicContact CG-CD1 4.31Å; M104-L164 HydrophobicContact CG-CG 4.21Å; M104-T167 HydrophobicContact CE-CG2 3.77Å; M104-L168 HydrophobicContact CG-CD2 4.46Å; M104-L168 HydrophobicContact SD-CD2 3.83Å
105	E	91.4	Very high	89.1	Confident	64 Å²	64	19.7 Å²	19.7	30%	0.299	9%	0.092	S	C	.	.	G	3₁₀ helix	trans	-66.7	-23.9	178.5	-53.9	92.2	143.4	0	0	112.8	Y34 K103	Y34-E105 HydrophobicContact CG-CG 4.19Å; K103-E105 VanDerWaalsContact C-N 3.25Å; K103-E105 WeakPolarHBondContact CB-OE2 3.33Å; K103-E105 HydrophobicContact CD-CB 4.4Å; K103-E105 WeakPolarHBondContact CD-OE2 3.46Å; K103-E105 HydrophobicContact CG-CB 4.25Å; K103-E105 WeakPolarHBondContact CG-OE2 3.46Å; K103-E105 PolarHBondContact O-N 2.98Å
106	N	91.5	Very high	90.1	Very high	9 Å²	9	19.3 Å²	19.3	5%	0.048	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-95.7	8.7	176.7	-72.8	-3.5	0	0	0	112.6	D101 K103 M104 L117 I118	D101-N106 PolarHBondContact O-ND2 2.88Å; D101-N106 PolarHBondContact OD2-ND2 2.84Å; K103-N106 WeakPolarHBondContact CE-ND2 3.36Å; K103-N106 WeakPolarHBondContact CE-OD1 3.32Å; K103-N106 HydrophobicContact CG-CB 3.98Å; K103-N106 PolarHBondContact O-N 3.17Å; M104-N106 PolarHBondContact O-N 2.84Å; N106-L117 WeakPolarHBondContact O-CA 3.45Å; N106-I118 HydrophobicContact CB-CG1 4.41Å; N106-I118 WeakPolarHBondContact O-CG1 3.19Å; N106-I118 PolarHBondContact O-N 2.94Å
107	V	92	Very high	90.5	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	102.7	175.8	-179	0	0	0	0	107.6	L33 L55 L102 K103 M104 V115 L117 L164	L33-V107 HydrophobicContact CB-CB 4Å; L33-V107 HydrophobicContact CB-CG1 4.08Å; L33-V107 WeakPolarHBondContact CB-O 3.44Å; L33-V107 HydrophobicContact CD2-CB 4.14Å; L33-V107 HydrophobicContact CD2-CG1 3.85Å; L33-V107 PolarHBondContact N-O 2.84Å; L55-V107 HydrophobicContact CD2-CG1 4.23Å; L55-V107 HydrophobicContact CD2-CG2 3.94Å; L102-V107 HydrophobicContact CD1-CG2 4.11Å; K103-V107 WeakPolarHBondContact O-CG2 3.22Å; K103-V107 PolarHBondContact O-N 3.3Å; M104-V107 PolarHBondContact O-N 2.97Å; M104-V107 VanDerWaalsContact O-N 3.08Å; V107-V115 HydrophobicContact CG1-CB 3.74Å; V107-V115 HydrophobicContact CG1-CG1 3.78Å; V107-L117 HydrophobicContact CG2-CD2 3.89Å; V107-L164 HydrophobicContact CG2-CD1 4.29Å
108	V	90.3	Very high	90.6	Very high	21 Å²	21	20.5 Å²	20.5	13%	0.127	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	152.4	174.5	-55.9	0	0	0	0	111.1	D32 V115 K116 I118	D32-V108 HydrophobicContact CB-CG1 4.2Å; V108-V115 CarbonylContact O-C 3.54Å; V108-K116 HydrophobicContact CG2-CB 3.72Å; V108-K116 PolarHBondContact N-O 3.39Å; V108-K116 PolarHBondContact O-N 2.91Å; V108-I118 HydrophobicContact CB-CG2 4.46Å; V108-I118 HydrophobicContact CG1-CD1 3.58Å; V108-I118 HydrophobicContact CG1-CG1 4Å; V108-I118 HydrophobicContact CG1-CG2 3.99Å; V108-I118 HydrophobicContact CG2-CG2 3.66Å
109	L	89	Confident	90.4	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.7	-179.2	-63.6	-178	0	0	0	109.7	Y30 G31 L33 Y36 W51 H114 V115	Y30-L109 HydrophobicContact CG-CD1 4.43Å; G31-L109 PolarHBondContact O-N 2.95Å; L33-L109 HydrophobicContact CD1-CD1 4.08Å; L33-L109 HydrophobicContact CD1-CD2 4.39Å; Y36-L109 HydrophobicContact CG-CD1 4.29Å; W51-L109 HydrophobicContact CZ2-CD1 4Å; W51-L109 HydrophobicContact CZ2-CD2 4.37Å; L109-H114 WeakPolarHBondContact CA-O 3.45Å; L109-V115 HydrophobicContact CD2-CG1 4.03Å
110	D	86.6	Confident	90.1	Very high	11 Å²	11	25.7 Å²	25.7	6%	0.059	12%	0.12	C	C	.	.			trans	-77.6	-177.6	172.9	77.6	9.3	0	0	0	112.4	Y26 R112 A113 H114 K116	Y26-D110 HydrophobicContact CD1-CB 4.3Å; Y26-D110 HydrophobicContact CE1-CB 4.47Å; D110-R112 PolarHBondContact O-N 2.73Å; D110-R112 VanDerWaalsContact O-N 3.12Å; D110-R112 WeakPolarHBondContact OD1-CA 3.45Å; D110-R112 PolarHBondContact OD1-N 3.33Å; D110-A113 WeakPolarHBondContact O-CA 3.31Å; D110-A113 PolarHBondContact O-N 2.94Å; D110-A113 PolarHBondContact OD1-N 3.35Å; D110-A113 VanDerWaalsContact OD1-N 3.16Å; D110-H114 PolarHBondContact N-O 3.3Å; D110-H114 IonicContact OD1-CD2 3.9Å; D110-H114 IonicContact OD1-CG 2.64Å; D110-H114 PolarHBondContact OD1-N 3.28Å; D110-H114 IonicContact OD2-CD2 3.69Å; D110-K116 HydrophobicContact CB-CD 4.48Å; D110-K116 IonicContact OD2-NZ 3.94Å
111	E	85.1	Confident	89.8	Confident	95 Å²	95	27.2 Å²	27.2	44%	0.444	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.1	-179	65.5	-77.8	-179.9	0	0	114.4	Y26	Y26-E111 WeakPolarHBondContact CE1-OE2 3.48Å
112	R	89	Confident	89.5	Confident	86 Å²	86	29.4 Å²	29.4	33%	0.325	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	14.9	174.6	-64.8	-178.7	70.7	-159.3	-3.4	111.9	D110 H114 G238 P242 A243	D110-R112 PolarHBondContact O-N 2.73Å; D110-R112 VanDerWaalsContact O-N 3.12Å; D110-R112 WeakPolarHBondContact OD1-CA 3.45Å; D110-R112 PolarHBondContact OD1-N 3.33Å; R112-H114 PolarHBondContact O-N 2.86Å; R112-G238 PolarHBondContact NH1-O 2.94Å; R112-G238 PolarHBondContact NH2-O 3.11Å; R112-P242 WeakPolarHBondContact O-CD 3.41Å; R112-A243 WeakPolarHBondContact O-CB 3.46Å; R112-A243 PolarHBondContact O-N 2.93Å; R112-A243 VanDerWaalsContact O-N 3.09Å
113	A	90.9	Very high	89.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.			trans	57.5	24.4	-177.2	0	0	0	0	0	114.4	Y30 W51 D110 P242 A243 I246	Y30-A113 HydrophobicContact CD2-CB 3.82Å; Y30-A113 HydrophobicContact CE2-CB 3.66Å; W51-A113 PolarHBondContact NE1-O 3.44Å; D110-A113 WeakPolarHBondContact O-CA 3.31Å; D110-A113 PolarHBondContact O-N 2.94Å; D110-A113 PolarHBondContact OD1-N 3.35Å; D110-A113 VanDerWaalsContact OD1-N 3.16Å; A113-P242 HydrophobicContact CB-CB 3.97Å; A113-P242 WeakPolarHBondContact O-CB 3.17Å; A113-P242 VanDerWaalsContact O-CG 3.3Å; A113-P242 WeakPolarHBondContact O-CG 3.48Å; A113-A243 HydrophobicContact CB-CB 4.17Å; A113-I246 HydrophobicContact CB-CD1 3.76Å
114	H	91.2	Very high	88.9	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.023	18%	0.178	C	C	.	.			trans	-72.9	144.6	168.6	-67.1	-78.6	0	0	0	110.2	E54 L109 D110 R112 L240	E54-H114 IonicContact OE1-CE1 3.99Å; E54-H114 IonicContact OE1-CG 3.74Å; E54-H114 IonicContact OE1-ND1 2.68Å; E54-H114 PolarHBondContact OE1-ND1 2.74Å; L109-H114 WeakPolarHBondContact CA-O 3.45Å; D110-H114 PolarHBondContact N-O 3.3Å; D110-H114 IonicContact OD1-CD2 3.9Å; D110-H114 IonicContact OD1-CG 2.64Å; D110-H114 PolarHBondContact OD1-N 3.28Å; D110-H114 IonicContact OD2-CD2 3.69Å; R112-H114 PolarHBondContact O-N 2.86Å; H114-L240 PolarHBondContact CE1-O 3.46Å
115	V	91.3	Very high	88.6	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	141.8	179.6	-55.3	0	0	0	0	111.9	W51 E54 L55 I76 V107 V108 L109	W51-V115 HydrophobicContact CB-CG1 3.87Å; W51-V115 VanDerWaalsContact CD1-CG1 3.4Å; W51-V115 HydrophobicContact CG-CG1 3.74Å; E54-V115 HydrophobicContact CB-CG2 3.33Å; E54-V115 HydrophobicContact CG-CG2 4.3Å; E54-V115 WeakPolarHBondContact OE2-CG2 3.35Å; E54-V115 PolarHBondContact OE2-N 3.47Å; L55-V115 HydrophobicContact CD2-CB 4.27Å; L55-V115 HydrophobicContact CD2-CG2 3.93Å; L55-V115 HydrophobicContact CG-CG1 4.43Å; L55-V115 HydrophobicContact CG-CG2 4.14Å; I76-V115 HydrophobicContact CG2-CG2 4.04Å; V107-V115 HydrophobicContact CG1-CB 3.74Å; V107-V115 HydrophobicContact CG1-CG1 3.78Å; V108-V115 CarbonylContact O-C 3.54Å; L109-V115 HydrophobicContact CD2-CG1 4.03Å
116	K	87.3	Confident	88.4	Confident	23 Å²	23	33.3 Å²	33.3	10%	0.1	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.8	167	-57.2	-173.4	175.9	174.1	0	110	R75 I76 V108 D110	R75-K116 WeakPolarHBondContact O-CE 3.3Å; R75-K116 WeakPolarHBondContact O-CG 3.42Å; I76-K116 CarbonylContact O-C 3.53Å; I76-K116 WeakPolarHBondContact O-CA 3.47Å; V108-K116 HydrophobicContact CG2-CB 3.72Å; V108-K116 PolarHBondContact N-O 3.39Å; V108-K116 PolarHBondContact O-N 2.91Å; D110-K116 HydrophobicContact CB-CD 4.48Å; D110-K116 IonicContact OD2-NZ 3.94Å
117	L	89	Confident	88	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.6	172.5	-64	-177.2	0	0	0	109.8	L55 A58 L62 I76 Y78 L102 N106 V107 F120	L55-L117 HydrophobicContact CD2-CD2 3.74Å; A58-L117 HydrophobicContact CB-CD1 3.86Å; L62-L117 HydrophobicContact CD1-CD1 4.47Å; I76-L117 PolarHBondContact O-N 3.3Å; Y78-L117 PolarHBondContact N-O 3Å; L102-L117 HydrophobicContact CD1-CD2 3.7Å; N106-L117 WeakPolarHBondContact O-CA 3.45Å; V107-L117 HydrophobicContact CG2-CD2 3.89Å; L117-F120 HydrophobicContact CB-CE2 4.3Å; L117-F120 HydrophobicContact CB-CZ 3.98Å
118	I	87	Confident	87.3	Confident	35 Å²	35	46.7 Å²	46.7	18%	0.179	23%	0.229	C	C	.	.			trans	-125.6	163.5	176.6	63.3	158.8	0	0	0	110.6	Y78 Y99 N106 V108	Y78-I118 HydrophobicContact CD1-CG2 4.22Å; Y78-I118 HydrophobicContact CG-CG2 4.5Å; Y99-I118 PolarHBondContact OH-O 3.24Å; N106-I118 HydrophobicContact CB-CG1 4.41Å; N106-I118 WeakPolarHBondContact O-CG1 3.19Å; N106-I118 PolarHBondContact O-N 2.94Å; V108-I118 HydrophobicContact CB-CG2 4.46Å; V108-I118 HydrophobicContact CG1-CD1 3.58Å; V108-I118 HydrophobicContact CG1-CG1 4Å; V108-I118 HydrophobicContact CG1-CG2 3.99Å; V108-I118 HydrophobicContact CG2-CG2 3.66Å
119	D	85.1	Confident	86.9	Confident	89 Å²	89	49.4 Å²	49.4	48%	0.476	26%	0.26	S	S	.	.			trans	61.6	74.9	178.3	-166.3	5.6	0	0	0	114.4	G121	D119-G121 PolarHBondContact O-N 3.1Å; D119-G121 PolarHBondContact OD1-N 3.41Å
120	F	86.1	Confident	86.9	Confident	21 Å²	21	53.5 Å²	53.5	9%	0.092	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-83	19.4	170.3	-68.1	-98.5	0	0	0	112.8	L62 M77 Y78 F83 Y99 L117 L122 A123	L62-F120 HydrophobicContact CD2-CE1 4.25Å; M77-F120 HydrophobicContact CB-CZ 4.13Å; M77-F120 HydrophobicContact CE-CE1 3.69Å; M77-F120 HydrophobicContact CE-CZ 3.76Å; M77-F120 HydrophobicContact CG-CZ 4.09Å; Y78-F120 WeakPolarHBondContact O-CE2 3.28Å; F83-F120 HydrophobicContact CE1-CB 4.13Å; F83-F120 AromaticContact CE1-CD1 3.75Å; F83-F120 HydrophobicContact CE1-CD1 3.75Å; F83-F120 HydrophobicContact CE1-CD2 4.07Å; F83-F120 HydrophobicContact CE1-CE1 4.18Å; F83-F120 HydrophobicContact CE1-CE2 4.47Å; F83-F120 AromaticContact CE1-CG 3.7Å; F83-F120 HydrophobicContact CE1-CG 3.7Å; F83-F120 HydrophobicContact CE2-CB 3.65Å; F83-F120 HydrophobicContact CE2-CG 4.16Å; F83-F120 HydrophobicContact CZ-CB 3.28Å; F83-F120 AromaticContact CZ-CD1 3.53Å; F83-F120 HydrophobicContact CZ-CD1 3.53Å; F83-F120 HydrophobicContact CZ-CD2 4.09Å; F83-F120 HydrophobicContact CZ-CE1 4.39Å; F83-F120 AromaticContact CZ-CG 3.35Å; F83-F120 HydrophobicContact CZ-CG 3.35Å; Y99-F120 AromaticContact CD2-CD1 3.61Å; Y99-F120 HydrophobicContact CD2-CD1 3.61Å; Y99-F120 AromaticContact CD2-CE1 3.57Å; Y99-F120 HydrophobicContact CD2-CE1 3.57Å; Y99-F120 HydrophobicContact CD2-CG 4.4Å; Y99-F120 HydrophobicContact CD2-CZ 4.34Å; Y99-F120 AromaticContact CE2-CD1 3.5Å; Y99-F120 HydrophobicContact CE2-CD1 3.5Å; Y99-F120 HydrophobicContact CE2-CD2 4.26Å; Y99-F120 AromaticContact CE2-CE1 3.45Å; Y99-F120 HydrophobicContact CE2-CE1 3.45Å; Y99-F120 VanDerWaalsContact CE2-CE1 3.45Å; Y99-F120 HydrophobicContact CE2-CE2 4.22Å; Y99-F120 AromaticContact CE2-CG 3.91Å; Y99-F120 HydrophobicContact CE2-CG 3.91Å; Y99-F120 AromaticContact CE2-CZ 3.83Å; Y99-F120 HydrophobicContact CE2-CZ 3.83Å; L117-F120 HydrophobicContact CB-CE2 4.3Å; L117-F120 HydrophobicContact CB-CZ 3.98Å; F120-L122 PolarHBondContact O-N 3.41Å; F120-A123 HydrophobicContact CB-CB 3.88Å; F120-A123 HydrophobicContact CD1-CB 3.86Å; F120-A123 HydrophobicContact CG-CB 4.37Å; F120-A123 WeakPolarHBondContact O-CB 3.21Å; F120-A123 PolarHBondContact O-N 3.2Å
121	G	86.3	Confident	87.2	Confident	64 Å²	64	60 Å²	60	66%	0.66	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-60.2	-28.4	-177.8	0	0	0	0	0	113.4	D119	D119-G121 PolarHBondContact O-N 3.1Å; D119-G121 PolarHBondContact OD1-N 3.41Å
122	L	88.5	Confident	87.6	Confident	56 Å²	56	55.7 Å²	55.7	29%	0.293	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-97.9	-1.2	173.7	-63.3	-178	0	0	0	113.4	Y99 R100 D101 F120 C136	Y99-L122 CarbonylContact O-C 3.38Å; R100-L122 PolarHBondContact NE-O 3.49Å; R100-L122 PolarHBondContact NH2-O 2.87Å; D101-L122 HydrophobicContact CB-CB 4.26Å; D101-L122 HydrophobicContact CB-CD1 3.81Å; D101-L122 HydrophobicContact CB-CG 4.5Å; F120-L122 PolarHBondContact O-N 3.41Å; L122-C136 HydrophobicContact CD1-CB 4.36Å; L122-C136 HydrophobicContact CD2-CB 4.19Å
123	A	89.1	Confident	87.8	Confident	24 Å²	24	58.8 Å²	58.8	20%	0.198	30%	0.299	C	S	.	.			trans	-69	150.6	178.7	0	0	0	0	0	111.5	V97 I98 Y99 F120	V97-A123 HydrophobicContact CG1-CB 4Å; I98-A123 CarbonylContact O-C 3.46Å; I98-A123 VanDerWaalsContact O-CA 3.25Å; I98-A123 WeakPolarHBondContact O-CA 3.33Å; Y99-A123 HydrophobicContact CD2-CB 4.46Å; Y99-A123 PolarHBondContact O-N 2.9Å; F120-A123 HydrophobicContact CB-CB 3.88Å; F120-A123 HydrophobicContact CD1-CB 3.86Å; F120-A123 HydrophobicContact CG-CB 4.37Å; F120-A123 WeakPolarHBondContact O-CB 3.21Å; F120-A123 PolarHBondContact O-N 3.2Å
124	K	87.2	Confident	87.9	Confident	88 Å²	88	62.7 Å²	62.7	38%	0.383	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	141	179.8	-177.3	176.1	175.9	178.4	0	111.4	V97 I98 L126 T132	V97-K124 WeakPolarHBondContact CA-O 3.26Å; I98-K124 HydrophobicContact CG2-CB 4.03Å; I98-K124 WeakPolarHBondContact CG2-O 3.37Å; I98-K124 PolarHBondContact N-O 3.08Å; I98-K124 PolarHBondContact O-N 3.31Å; K124-L126 PolarHBondContact O-N 2.77Å; K124-T132 PolarHBondContact NZ-OG1 3.2Å
125	W	86.3	Confident	87.8	Confident	63 Å²	63	66 Å²	66	24%	0.239	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	123.4	167.2	-61.8	97.4	0	0	0	109.8	W87 H90 N95 G96 V97	W87-W125 AromaticContact CD2-CH2 3.95Å; W87-W125 HydrophobicContact CD2-CH2 3.95Å; W87-W125 HydrophobicContact CD2-CZ2 4.35Å; W87-W125 HydrophobicContact CE3-CH2 4.23Å; W87-W125 HydrophobicContact CG-CH2 4.17Å; W87-W125 HydrophobicContact CG-CZ2 4.26Å; H90-W125 HydrophobicContact CB-CD2 3.9Å; H90-W125 HydrophobicContact CB-CE3 3.79Å; H90-W125 HydrophobicContact CB-CH2 3.3Å; H90-W125 HydrophobicContact CB-CZ2 3.4Å; H90-W125 VanDerWaalsContact CB-CZ2 3.4Å; H90-W125 HydrophobicContact CB-CZ3 3.49Å; H90-W125 VanDerWaalsContact CB-CZ3 3.49Å; H90-W125 AromaticContact CD2-CD1 3.85Å; H90-W125 AromaticContact CD2-CD2 3.72Å; H90-W125 AromaticContact CD2-CE2 3.63Å; H90-W125 AromaticContact CD2-CG 3.89Å; H90-W125 AromaticContact CD2-NE1 3.68Å; N95-W125 HydrophobicContact CB-CE3 3.7Å; N95-W125 HydrophobicContact CB-CZ3 4.34Å; N95-W125 WeakPolarHBondContact O-CZ3 3.13Å; G96-W125 WeakPolarHBondContact O-CA 3.33Å; V97-W125 HydrophobicContact CG2-CD2 3.74Å; V97-W125 HydrophobicContact CG2-CE3 3.31Å; V97-W125 HydrophobicContact CG2-CH2 3.74Å; V97-W125 HydrophobicContact CG2-CZ2 4.13Å; V97-W125 HydrophobicContact CG2-CZ3 3.33Å
126	L	87.3	Confident	87.9	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	120.2	179.5	-171.7	70.1	0	0	0	107.2	G96 I98 K124 E130 H154	G96-L126 CarbonylContact C-O 3.52Å; G96-L126 WeakPolarHBondContact CA-O 3.49Å; G96-L126 PolarHBondContact N-O 3.33Å; G96-L126 PolarHBondContact O-N 2.94Å; I98-L126 HydrophobicContact CB-CB 4.45Å; I98-L126 HydrophobicContact CB-CD2 4.31Å; I98-L126 HydrophobicContact CD1-CD2 4.23Å; I98-L126 HydrophobicContact CG2-CB 4.07Å; I98-L126 HydrophobicContact CG2-CD2 4.18Å; K124-L126 PolarHBondContact O-N 2.77Å; L126-E130 HydrophobicContact CD1-CB 3.56Å; L126-E130 HydrophobicContact CG-CB 4.04Å; L126-H154 PolarHBondContact O-CE1 3.31Å; L126-H154 PolarHBondContact O-NE2 2.97Å
127	K	84.2	Confident	88	Confident	104 Å²	104	67.2 Å²	67.2	45%	0.452	36%	0.355	S	S	.	.			trans	-71.4	156.7	177.7	-63	178.5	-175.4	167.2	0	110.1	N95 G129 E130	N95-K127 WeakPolarHBondContact OD1-CE 3.35Å; N95-K127 WeakPolarHBondContact OD1-CG 3.19Å; K127-G129 PolarHBondContact O-N 3.01Å; K127-E130 HydrophobicContact CB-CB 4.49Å; K127-E130 HydrophobicContact CB-CG 3.9Å; K127-E130 WeakPolarHBondContact CB-OE2 3.32Å; K127-E130 PolarHBondContact N-OE2 3.38Å; K127-E130 WeakPolarHBondContact O-CB 3.34Å; K127-E130 PolarHBondContact O-N 3.13Å
128	R	77.3	Confident	88.1	Confident	187 Å²	187	69 Å²	69	71%	0.706	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	127	173.8	-161.9	178.9	-179.8	-169.1	6.1	110	F64 E130	F64-R128 VanDerWaalsContact CZ-NE 3.3Å; R128-E130 VanDerWaalsContact C-N 3.3Å
129	G	81.2	Confident	88.3	Confident	77 Å²	77	69.7 Å²	69.7	79%	0.794	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-12.1	-176.5	0	0	0	0	0	114.8	K127	K127-G129 PolarHBondContact O-N 3.01Å
130	E	89.5	Confident	88.6	Confident	88 Å²	88	68.7 Å²	68.7	41%	0.411	36%	0.362	S	S	.	.			trans	-76.2	157	171	-70.8	-179.3	167.9	0	0	111.4	L126 K127 R128	L126-E130 HydrophobicContact CD1-CB 3.56Å; L126-E130 HydrophobicContact CG-CB 4.04Å; K127-E130 HydrophobicContact CB-CB 4.49Å; K127-E130 HydrophobicContact CB-CG 3.9Å; K127-E130 WeakPolarHBondContact CB-OE2 3.32Å; K127-E130 PolarHBondContact N-OE2 3.38Å; K127-E130 WeakPolarHBondContact O-CB 3.34Å; K127-E130 PolarHBondContact O-N 3.13Å; R128-E130 VanDerWaalsContact C-N 3.3Å
131	R	92.5	Very high	89	Confident	148 Å²	148	67.9 Å²	67.9	56%	0.558	36%	0.359	S	S	*	.			trans	-126.3	141.1	175.6	-57.3	-177.5	109.9	-162	4.2	109.8	G151 Y152	R131-G151 PolarHBondContact NE-O 3.11Å; R131-G151 PolarHBondContact NH1-O 3.13Å; R131-G151 PolarHBondContact NH2-O 3.29Å; R131-Y152 CarbonylContact C-O 3.57Å; R131-Y152 VanDerWaalsContact CA-O 3.22Å; R131-Y152 WeakPolarHBondContact CA-O 3.21Å
132	T	93.2	Very high	89.3	Confident	4 Å²	4	65.6 Å²	65.6	3%	0.025	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-107.1	145.6	170.5	-172.2	0	0	0	0	109.8	K124 G151 Y152	K124-T132 PolarHBondContact NZ-OG1 3.2Å; T132-G151 CarbonylContact O-C 3.45Å; T132-G151 WeakPolarHBondContact O-CA 3.43Å; T132-Y152 HydrophobicContact CG2-CD1 4.4Å; T132-Y152 HydrophobicContact CG2-CD2 4.02Å; T132-Y152 HydrophobicContact CG2-CE1 3.96Å; T132-Y152 HydrophobicContact CG2-CE2 3.52Å; T132-Y152 HydrophobicContact CG2-CG 4.43Å; T132-Y152 VanDerWaalsContact CG2-CZ 3.48Å; T132-Y152 PolarHBondContact N-O 3.01Å; T132-Y152 VanDerWaalsContact O-CD1 3.3Å; T132-Y152 WeakPolarHBondContact O-CD1 3.05Å; T132-Y152 PolarHBondContact O-N 3.27Å
133	K	93.6	Very high	89.5	Confident	152 Å²	152	63 Å²	63	66%	0.661	32%	0.317	S	S	*	.			trans	-106.9	-13.5	-175.1	-62.7	-177.2	-179.2	-179.6	0	114.2	I135	K133-I135 PolarHBondContact O-N 2.61Å
134	T	92.5	Very high	89.5	Confident	82 Å²	82	62.7 Å²	62.7	50%	0.503	31%	0.313	S	S	.	.			trans	-65.9	118.1	-178.8	-49.1	0	0	0	0	110	C136 Y152	T134-C136 PolarHBondContact O-N 3.42Å; T134-Y152 VanDerWaalsContact O-CE1 3.31Å; T134-Y152 WeakPolarHBondContact O-CE1 3.48Å; T134-Y152 PolarHBondContact O-OH 3.32Å
135	I	90.5	Very high	89.7	Confident	74 Å²	74	59.2 Å²	59.2	38%	0.379	30%	0.298	S	S	.	.			trans	-76.4	119.1	173.2	-50.5	-176	0	0	0	107.4	K133 M142 T146 L147	K133-I135 PolarHBondContact O-N 2.61Å; I135-M142 HydrophobicContact CG2-SD 4.44Å; I135-T146 WeakPolarHBondContact CG1-O 3.45Å; I135-L147 HydrophobicContact CG2-CD2 4.24Å
136	C	92.4	Very high	89.9	Confident	25 Å²	25	56.5 Å²	56.5	17%	0.169	29%	0.289	C	S	.	.			trans	-163.5	161.1	-180	62.2	0	0	0	0	110.5	R100 L122 T134 M142	R100-C136 VanDerWaalsContact CZ-SG 3.57Å; R100-C136 PolarHBondContact NH1-SG 2.75Å; L122-C136 HydrophobicContact CD1-CB 4.36Å; L122-C136 HydrophobicContact CD2-CB 4.19Å; T134-C136 PolarHBondContact O-N 3.42Å; C136-M142 VanDerWaalsContact O-CE 3.31Å; C136-M142 WeakPolarHBondContact O-CE 3.43Å
137	G	89.9	Confident	90	Very high	24 Å²	24	57.7 Å²	57.7	25%	0.247	30%	0.295	C	S	.	.	S	Bend	trans	116.1	-172.2	-176.8	0	0	0	0	0	111.7	R100 D101 M142	R100-G137 WeakPolarHBondContact O-CA 3.26Å; D101-G137 WeakPolarHBondContact OD1-CA 3.22Å; G137-M142 WeakPolarHBondContact O-CE 3.42Å
138	T	91	Very high	90.1	Very high	39 Å²	39	56.4 Å²	56.4	24%	0.239	30%	0.296	C	S	.	.			trans	-95.3	121.6	179.8	-58.6	0	0	0	0	111.1	D101 K103 H140 Y141 M142	D101-T138 PolarHBondContact OD1-N 2.75Å; D101-T138 PolarHBondContact OD1-OG1 2.98Å; K103-T138 HydrophobicContact CD-CG2 4.31Å; K103-T138 WeakPolarHBondContact CD-OG1 3.46Å; K103-T138 PolarHBondContact NZ-OG1 3.08Å; T138-H140 VanDerWaalsContact C-N 3.3Å; T138-H140 PolarHBondContact O-N 3.07Å; T138-H140 VanDerWaalsContact O-N 3.09Å; T138-Y141 HydrophobicContact CG2-CD2 3.82Å; T138-Y141 HydrophobicContact CG2-CE2 4.19Å; T138-Y141 PolarHBondContact O-N 2.92Å; T138-M142 PolarHBondContact O-N 3.48Å
139	L	90.6	Very high	90.4	Very high	49 Å²	49	49 Å²	49	26%	0.257	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-50.7	-41.1	-165.4	-176.2	60.8	0	0	0	114.8	Y141 M142 L147 V177 E180	L139-Y141 VanDerWaalsContact C-N 3.26Å; L139-Y141 PolarHBondContact O-N 2.9Å; L139-M142 HydrophobicContact CD1-SD 4.49Å; L139-M142 PolarHBondContact O-N 3.37Å; L139-L147 HydrophobicContact CD1-CD1 4.28Å; L139-L147 HydrophobicContact CD1-CD2 3.96Å; L139-V177 HydrophobicContact CD1-CG1 3.93Å; L139-V177 HydrophobicContact CD2-CG1 3.73Å; L139-V177 HydrophobicContact CG-CB 4.37Å; L139-V177 HydrophobicContact CG-CG1 3.55Å; L139-E180 HydrophobicContact CD1-CG 4.1Å
140	H	91.5	Very high	90.6	Very high	68 Å²	68	51.5 Å²	51.5	32%	0.315	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-64.6	-28.3	179.4	-74	86.7	0	0	0	113.6	T138 V163 Y173	T138-H140 VanDerWaalsContact C-N 3.3Å; T138-H140 PolarHBondContact O-N 3.07Å; T138-H140 VanDerWaalsContact O-N 3.09Å; H140-V163 WeakPolarHBondContact O-CG1 3.33Å; H140-Y173 HydrophobicContact CB-CD1 3.88Å; H140-Y173 HydrophobicContact CB-CE1 3.68Å; H140-Y173 HydrophobicContact CB-CG 4.42Å; H140-Y173 AromaticContact CD2-CD2 3.77Å; H140-Y173 AromaticContact CD2-CG 3.84Å
141	Y	94.5	Very high	90.6	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.016	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-97.5	-7.7	-178.1	-60.1	-88.9	0	0	0	113	L102 K103 M104 T138 L139 S160 V163 L164 Y173	L102-Y141 WeakPolarHBondContact O-CD1 3.18Å; K103-Y141 HydrophobicContact CB-CD1 4.46Å; K103-Y141 HydrophobicContact CB-CD2 3.72Å; K103-Y141 HydrophobicContact CB-CE1 4.32Å; K103-Y141 HydrophobicContact CB-CE2 3.55Å; K103-Y141 HydrophobicContact CB-CG 4.17Å; M104-Y141 WeakPolarHBondContact CE-OH 3.25Å; T138-Y141 HydrophobicContact CG2-CD2 3.82Å; T138-Y141 HydrophobicContact CG2-CE2 4.19Å; T138-Y141 PolarHBondContact O-N 2.92Å; L139-Y141 VanDerWaalsContact C-N 3.26Å; L139-Y141 PolarHBondContact O-N 2.9Å; Y141-S160 WeakPolarHBondContact O-CA 3.46Å; Y141-S160 WeakPolarHBondContact O-CB 3.27Å; Y141-S160 PolarHBondContact O-OG 3.43Å; Y141-V163 HydrophobicContact CD1-CB 4.19Å; Y141-V163 HydrophobicContact CD1-CG1 3.75Å; Y141-V163 HydrophobicContact CE1-CG1 4.16Å; Y141-V163 HydrophobicContact CG-CG1 4.39Å; Y141-L164 HydrophobicContact CD1-CB 4.45Å; Y141-L164 HydrophobicContact CE1-CB 4.16Å; Y141-Y173 HydrophobicContact CE1-CE1 4.23Å; Y141-Y173 AromaticContact CE2-CE1 3.97Å; Y141-Y173 HydrophobicContact CE2-CE1 3.97Å; Y141-Y173 AromaticContact CZ-CE1 3.72Å; Y141-Y173 PolarHBondContact OH-OH 3.1Å
142	M	92.7	Very high	90.7	Very high	17 Å²	17	40.4 Å²	40.4	8%	0.084	23%	0.227	C	C	.	.			trans	-68.3	135	-177.3	-76.6	-164	-170.4	0	0	112	I135 C136 G137 T138 L139 L147 W159	I135-M142 HydrophobicContact CG2-SD 4.44Å; C136-M142 VanDerWaalsContact O-CE 3.31Å; C136-M142 WeakPolarHBondContact O-CE 3.43Å; G137-M142 WeakPolarHBondContact O-CE 3.42Å; T138-M142 PolarHBondContact O-N 3.48Å; L139-M142 HydrophobicContact CD1-SD 4.49Å; L139-M142 PolarHBondContact O-N 3.37Å; M142-L147 HydrophobicContact CB-CD1 4.44Å; M142-L147 HydrophobicContact CB-CG 4.46Å; M142-L147 HydrophobicContact SD-CD2 3.58Å; M142-L147 VanDerWaalsContact SD-CD2 3.58Å; M142-L147 HydrophobicContact SD-CG 4.18Å; M142-W159 PolarHBondContact O-NE1 3.22Å; M142-W159 VanDerWaalsContact O-NE1 3.11Å
143	A	92	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.			trans	-69.7	145.7	171.8	0	0	0	0	0	110.8	E145 T146 A156 W159	A143-E145 HydrophobicContact CB-CG 4.45Å; A143-E145 WeakPolarHBondContact CB-OE2 3.47Å; A143-E145 PolarHBondContact O-N 3.02Å; A143-E145 VanDerWaalsContact O-N 3.12Å; A143-T146 HydrophobicContact CB-CG2 4.03Å; A143-T146 WeakPolarHBondContact O-CB 3.46Å; A143-T146 PolarHBondContact O-N 3.24Å; A143-T146 PolarHBondContact O-OG1 3.06Å; A143-A156 HydrophobicContact CB-CB 4.08Å; A143-W159 HydrophobicContact CB-CB 3.64Å; A143-W159 HydrophobicContact CB-CD2 4.1Å; A143-W159 HydrophobicContact CB-CG 3.55Å
144	P	90.3	Very high	90.7	Very high	18 Å²	18	35.8 Å²	35.8	12%	0.117	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-35	-176.6	22.6	-34.2	0	0	0	112.3	T146 L147 W159 F186 F209	P144-T146 VanDerWaalsContact C-N 3.29Å; P144-T146 PolarHBondContact O-N 3.01Å; P144-L147 PolarHBondContact O-N 3.29Å; P144-W159 HydrophobicContact CG-CE3 4.48Å; P144-W159 HydrophobicContact CG-CH2 4.02Å; P144-W159 HydrophobicContact CG-CZ2 4.35Å; P144-W159 HydrophobicContact CG-CZ3 4.08Å; P144-F186 HydrophobicContact CB-CD2 4.19Å; P144-F186 HydrophobicContact CB-CE2 4.03Å; P144-F209 HydrophobicContact CB-CD1 4.17Å; P144-F209 HydrophobicContact CB-CE1 4.12Å; P144-F209 HydrophobicContact CG-CD1 3.77Å; P144-F209 HydrophobicContact CG-CE1 3.91Å
145	E	90.8	Very high	90.8	Very high	15 Å²	15	32.2 Å²	32.2	7%	0.07	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.1	178.1	69.4	-91.4	-154	0	0	113.9	A143 L147 T148 S155 P211 R214	A143-E145 HydrophobicContact CB-CG 4.45Å; A143-E145 WeakPolarHBondContact CB-OE2 3.47Å; A143-E145 PolarHBondContact O-N 3.02Å; A143-E145 VanDerWaalsContact O-N 3.12Å; E145-L147 PolarHBondContact O-N 2.92Å; E145-T148 PolarHBondContact O-N 3.07Å; E145-T148 PolarHBondContact O-OG1 3.34Å; E145-S155 PolarHBondContact OE1-OG 2.71Å; E145-P211 HydrophobicContact CG-CG 4.47Å; E145-R214 IonicContact OE1-CZ 3.67Å; E145-R214 IonicContact OE1-NH1 3.52Å; E145-R214 PolarHBondContact OE1-NH1 3.14Å; E145-R214 IonicContact OE1-NH2 2.67Å; E145-R214 PolarHBondContact OE1-NH2 3.22Å; E145-R214 IonicContact OE2-CZ 2.78Å; E145-R214 IonicContact OE2-NH1 3.68Å; E145-R214 IonicContact OE2-NH2 2.88Å; E145-R214 PolarHBondContact OE2-NH2 2.78Å
146	T	91.4	Very high	91	Very high	6 Å²	6	28.9 Å²	28.9	4%	0.037	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-66	-33.5	179.6	64.9	0	0	0	0	111.2	I135 A143 P144 T148 Y152 A156	I135-T146 WeakPolarHBondContact CG1-O 3.45Å; A143-T146 HydrophobicContact CB-CG2 4.03Å; A143-T146 WeakPolarHBondContact O-CB 3.46Å; A143-T146 PolarHBondContact O-N 3.24Å; A143-T146 PolarHBondContact O-OG1 3.06Å; P144-T146 VanDerWaalsContact C-N 3.29Å; P144-T146 PolarHBondContact O-N 3.01Å; T146-T148 VanDerWaalsContact C-N 3.31Å; T146-T148 PolarHBondContact O-N 2.86Å; T146-Y152 HydrophobicContact CG2-CD1 3.9Å; T146-Y152 HydrophobicContact CG2-CD2 3.79Å; T146-Y152 HydrophobicContact CG2-CE1 4.16Å; T146-Y152 HydrophobicContact CG2-CE2 4.04Å; T146-Y152 HydrophobicContact CG2-CG 3.71Å; T146-A156 HydrophobicContact CG2-CB 3.69Å
147	L	88.2	Confident	91.2	Very high	30 Å²	30	27.8 Å²	27.8	16%	0.157	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-81.2	-10.8	-177.9	-64.6	166.9	0	0	0	113.1	I135 L139 M142 P144 E145 G149 E180 V183	I135-L147 HydrophobicContact CG2-CD2 4.24Å; L139-L147 HydrophobicContact CD1-CD1 4.28Å; L139-L147 HydrophobicContact CD1-CD2 3.96Å; M142-L147 HydrophobicContact CB-CD1 4.44Å; M142-L147 HydrophobicContact CB-CG 4.46Å; M142-L147 HydrophobicContact SD-CD2 3.58Å; M142-L147 VanDerWaalsContact SD-CD2 3.58Å; M142-L147 HydrophobicContact SD-CG 4.18Å; P144-L147 PolarHBondContact O-N 3.29Å; E145-L147 PolarHBondContact O-N 2.92Å; L147-G149 VanDerWaalsContact C-N 3.33Å; L147-E180 HydrophobicContact CD2-CG 4.47Å; L147-V183 HydrophobicContact CB-CG1 4.43Å; L147-V183 HydrophobicContact CD1-CB 3.91Å; L147-V183 HydrophobicContact CD1-CG1 3.62Å; L147-V183 HydrophobicContact CD1-CG2 3.4Å; L147-V183 VanDerWaalsContact CD1-CG2 3.4Å
148	T	85.9	Confident	91.5	Very high	78 Å²	78	26.7 Å²	26.7	48%	0.479	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-76.6	-19.8	178.7	68	0	0	0	0	113.4	E145 T146 L150	E145-T148 PolarHBondContact O-N 3.07Å; E145-T148 PolarHBondContact O-OG1 3.34Å; T146-T148 VanDerWaalsContact C-N 3.31Å; T146-T148 PolarHBondContact O-N 2.86Å; T148-L150 PolarHBondContact O-N 3Å; T148-L150 VanDerWaalsContact O-N 3.09Å; T148-L150 WeakPolarHBondContact OG1-CB 3.39Å; T148-L150 PolarHBondContact OG1-N 2.93Å
149	G	83.2	Confident	91.8	Very high	31 Å²	31	24.9 Å²	24.9	32%	0.32	14%	0.143	S	C	.	.	S	Bend	trans	67.7	-2.8	-170.6	0	0	0	0	0	115.1	L147 G151	L147-G149 VanDerWaalsContact C-N 3.33Å; G149-G151 PolarHBondContact O-N 3.1Å
150	L	85.5	Confident	92.1	Very high	130 Å²	130	22.9 Å²	22.9	68%	0.681	13%	0.134	S	C	*	.	S	Bend	trans	-75.8	-8.5	-179.7	-61.1	177.9	0	0	0	113.3	T148	T148-L150 PolarHBondContact O-N 3Å; T148-L150 VanDerWaalsContact O-N 3.09Å; T148-L150 WeakPolarHBondContact OG1-CB 3.39Å; T148-L150 PolarHBondContact OG1-N 2.93Å
151	G	90.5	Very high	92.5	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.01	12%	0.119	C	C	.	.			trans	98.1	146.4	179	0	0	0	0	0	113.4	R131 T132 G149	R131-G151 PolarHBondContact NE-O 3.11Å; R131-G151 PolarHBondContact NH1-O 3.13Å; R131-G151 PolarHBondContact NH2-O 3.29Å; T132-G151 CarbonylContact O-C 3.45Å; T132-G151 WeakPolarHBondContact O-CA 3.43Å; G149-G151 PolarHBondContact O-N 3.1Å
152	Y	93.8	Very high	92.6	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.008	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-138.9	168.8	-174.5	59.9	-87	0	0	0	111	I98 R100 R131 T132 T134 T146 A156	I98-Y152 HydrophobicContact CD1-CD2 3.71Å; I98-Y152 HydrophobicContact CD1-CE2 3.58Å; R100-Y152 VanDerWaalsContact CD-OH 3.22Å; R100-Y152 WeakPolarHBondContact CD-OH 3.29Å; R100-Y152 HydrophobicContact CG-CE2 4.21Å; R100-Y152 PolarHBondContact NH1-OH 2.97Å; R131-Y152 CarbonylContact C-O 3.57Å; R131-Y152 VanDerWaalsContact CA-O 3.22Å; R131-Y152 WeakPolarHBondContact CA-O 3.21Å; T132-Y152 HydrophobicContact CG2-CD1 4.4Å; T132-Y152 HydrophobicContact CG2-CD2 4.02Å; T132-Y152 HydrophobicContact CG2-CE1 3.96Å; T132-Y152 HydrophobicContact CG2-CE2 3.52Å; T132-Y152 HydrophobicContact CG2-CG 4.43Å; T132-Y152 VanDerWaalsContact CG2-CZ 3.48Å; T132-Y152 PolarHBondContact N-O 3.01Å; T132-Y152 VanDerWaalsContact O-CD1 3.3Å; T132-Y152 WeakPolarHBondContact O-CD1 3.05Å; T132-Y152 PolarHBondContact O-N 3.27Å; T134-Y152 VanDerWaalsContact O-CE1 3.31Å; T134-Y152 WeakPolarHBondContact O-CE1 3.48Å; T134-Y152 PolarHBondContact O-OH 3.32Å; T146-Y152 HydrophobicContact CG2-CD1 3.9Å; T146-Y152 HydrophobicContact CG2-CD2 3.79Å; T146-Y152 HydrophobicContact CG2-CE1 4.16Å; T146-Y152 HydrophobicContact CG2-CE2 4.04Å; T146-Y152 HydrophobicContact CG2-CG 3.71Å; Y152-A156 HydrophobicContact CD2-CB 3.75Å; Y152-A156 HydrophobicContact CE2-CB 4.34Å
153	S	93.5	Very high	92.8	Very high	39 Å²	39	18.7 Å²	18.7	27%	0.273	11%	0.114	S	C	.	.			trans	-126.1	-171.2	-175.7	75.5	0	0	0	0	110.9	I98 S155 A156	I98-S153 VanDerWaalsContact CD1-O 3.26Å; I98-S153 WeakPolarHBondContact CD1-O 3.43Å; S153-S155 PolarHBondContact O-N 3.11Å; S153-S155 PolarHBondContact OG-N 3.35Å; S153-S155 PolarHBondContact OG-OG 3.05Å; S153-S155 VanDerWaalsContact OG-OG 3.13Å; S153-A156 WeakPolarHBondContact O-CB 3.11Å; S153-A156 PolarHBondContact O-N 3.39Å
154	H	93.4	Very high	93.1	Very high	19 Å²	19	18.7 Å²	18.7	9%	0.088	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-20.3	174.1	-55.7	-56.6	0	0	0	114	V97 L126 A156 D157	V97-H154 PolarHBondContact O-ND1 3.14Å; L126-H154 PolarHBondContact O-CE1 3.31Å; L126-H154 PolarHBondContact O-NE2 2.97Å; H154-A156 PolarHBondContact O-N 3.41Å; H154-D157 PolarHBondContact O-N 2.86Å; H154-D157 VanDerWaalsContact O-N 3.08Å
155	S	94.6	Very high	93.4	Very high	8 Å²	8	18 Å²	18	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-51.4	-28.5	171.8	62.7	0	0	0	0	114.1	E145 S153 W158 W159 R214	E145-S155 PolarHBondContact OE1-OG 2.71Å; S153-S155 PolarHBondContact O-N 3.11Å; S153-S155 PolarHBondContact OG-N 3.35Å; S153-S155 PolarHBondContact OG-OG 3.05Å; S153-S155 VanDerWaalsContact OG-OG 3.13Å; S155-W158 PolarHBondContact O-N 3.49Å; S155-W159 PolarHBondContact O-N 3.46Å; S155-R214 PolarHBondContact O-NH1 3.06Å
156	A	95.5	Very high	93.6	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-65.5	-38.9	179.3	0	0	0	0	0	112.3	A143 T146 Y152 S153 H154 W158 W159 S160	A143-A156 HydrophobicContact CB-CB 4.08Å; T146-A156 HydrophobicContact CG2-CB 3.69Å; Y152-A156 HydrophobicContact CD2-CB 3.75Å; Y152-A156 HydrophobicContact CE2-CB 4.34Å; S153-A156 WeakPolarHBondContact O-CB 3.11Å; S153-A156 PolarHBondContact O-N 3.39Å; H154-A156 PolarHBondContact O-N 3.41Å; A156-W158 VanDerWaalsContact C-N 3.33Å; A156-W158 PolarHBondContact O-N 2.85Å; A156-W159 WeakPolarHBondContact O-CB 3.42Å; A156-W159 PolarHBondContact O-N 3.16Å; A156-S160 PolarHBondContact O-N 3.39Å; A156-S160 VanDerWaalsContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.23Å
157	D	95.9	Very high	93.8	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-67.8	-35.6	-179.3	-65.4	-28.4	0	0	0	111.5	L59 I98 Y99 R100 H154 W159 S160 L161	L59-D157 HydrophobicContact CD1-CB 4.05Å; L59-D157 WeakPolarHBondContact CD1-O 3.46Å; L59-D157 HydrophobicContact CD2-CB 3.79Å; I98-D157 WeakPolarHBondContact CA-OD2 3.35Å; I98-D157 VanDerWaalsContact CG1-OD2 3.25Å; I98-D157 WeakPolarHBondContact CG1-OD2 3.29Å; Y99-D157 PolarHBondContact N-OD2 3.07Å; R100-D157 WeakPolarHBondContact CA-OD1 3.45Å; R100-D157 PolarHBondContact N-OD1 3.02Å; H154-D157 PolarHBondContact O-N 2.86Å; H154-D157 VanDerWaalsContact O-N 3.08Å; D157-W159 VanDerWaalsContact C-N 3.32Å; D157-W159 PolarHBondContact O-N 2.92Å; D157-S160 WeakPolarHBondContact O-CB 3.36Å; D157-S160 PolarHBondContact O-N 3.27Å; D157-L161 PolarHBondContact O-N 3.28Å
158	W	97.5	Very high	94.1	Very high	1 Å²	1	16.1 Å²	16.1	0%	0.004	10%	0.1	C	C	.	.	H	α-helix	trans	-66.5	-32.7	175	-70.1	96.2	0	0	0	113.1	L59 S155 A156 L161 G162 L206 L215 T216 F218 Y221	L59-W158 HydrophobicContact CB-CH2 4.43Å; L59-W158 HydrophobicContact CB-CZ2 4.14Å; L59-W158 HydrophobicContact CD1-CD2 4.27Å; L59-W158 HydrophobicContact CD1-CE3 4.41Å; L59-W158 HydrophobicContact CD1-CG 4.49Å; S155-W158 PolarHBondContact O-N 3.49Å; A156-W158 VanDerWaalsContact C-N 3.33Å; A156-W158 PolarHBondContact O-N 2.85Å; W158-L161 HydrophobicContact CE3-CD2 4.08Å; W158-L161 HydrophobicContact CZ3-CD2 4.13Å; W158-G162 PolarHBondContact O-N 2.67Å; W158-G162 VanDerWaalsContact O-N 3.12Å; W158-L206 HydrophobicContact CE3-CD2 3.89Å; W158-L215 WeakPolarHBondContact CB-O 3.48Å; W158-T216 HydrophobicContact CB-CG2 4.15Å; W158-T216 VanDerWaalsContact CE2-O 3.24Å; W158-T216 HydrophobicContact CG-CG2 4.05Å; W158-T216 WeakPolarHBondContact CZ2-O 3.33Å; W158-T216 PolarHBondContact NE1-O 2.93Å; W158-T216 VanDerWaalsContact NE1-O 3.08Å; W158-F218 HydrophobicContact CH2-CB 4.31Å; W158-F218 HydrophobicContact CH2-CD2 4.2Å; W158-F218 HydrophobicContact CZ2-CB 4.35Å; W158-Y221 HydrophobicContact CE3-CD2 4.17Å; W158-Y221 HydrophobicContact CH2-CD1 4.43Å; W158-Y221 HydrophobicContact CH2-CD2 4.38Å; W158-Y221 HydrophobicContact CH2-CG 4.03Å; W158-Y221 HydrophobicContact CZ3-CD1 4.14Å; W158-Y221 AromaticContact CZ3-CD2 3.46Å; W158-Y221 HydrophobicContact CZ3-CD2 3.46Å; W158-Y221 VanDerWaalsContact CZ3-CD2 3.46Å; W158-Y221 AromaticContact CZ3-CE2 3.94Å; W158-Y221 HydrophobicContact CZ3-CE2 3.94Å; W158-Y221 AromaticContact CZ3-CG 3.56Å; W158-Y221 HydrophobicContact CZ3-CG 3.56Å
159	W	97	Very high	94.6	Very high	1 Å²	1	14.4 Å²	14.4	0%	0.004	9%	0.089	C	C	.	.	H	α-helix	trans	-65	-47.3	170	172.3	-78.5	0	0	0	110.8	M142 A143 P144 S155 A156 D157 L161 G162 V163 F175 L207 F209	M142-W159 PolarHBondContact O-NE1 3.22Å; M142-W159 VanDerWaalsContact O-NE1 3.11Å; A143-W159 HydrophobicContact CB-CB 3.64Å; A143-W159 HydrophobicContact CB-CD2 4.1Å; A143-W159 HydrophobicContact CB-CG 3.55Å; P144-W159 HydrophobicContact CG-CE3 4.48Å; P144-W159 HydrophobicContact CG-CH2 4.02Å; P144-W159 HydrophobicContact CG-CZ2 4.35Å; P144-W159 HydrophobicContact CG-CZ3 4.08Å; S155-W159 PolarHBondContact O-N 3.46Å; A156-W159 WeakPolarHBondContact O-CB 3.42Å; A156-W159 PolarHBondContact O-N 3.16Å; D157-W159 VanDerWaalsContact C-N 3.32Å; D157-W159 PolarHBondContact O-N 2.92Å; W159-L161 PolarHBondContact O-N 2.94Å; W159-G162 WeakPolarHBondContact O-CA 3.32Å; W159-G162 PolarHBondContact O-N 2.95Å; W159-V163 PolarHBondContact O-N 2.89Å; W159-F175 AromaticContact CH2-CE2 3.78Å; W159-F175 HydrophobicContact CH2-CE2 3.78Å; W159-F175 AromaticContact CH2-CZ 3.72Å; W159-F175 HydrophobicContact CH2-CZ 3.72Å; W159-F175 HydrophobicContact CZ2-CD2 4.07Å; W159-F175 AromaticContact CZ2-CE2 3.32Å; W159-F175 HydrophobicContact CZ2-CE2 3.32Å; W159-F175 AromaticContact CZ2-CZ 3.78Å; W159-F175 HydrophobicContact CZ2-CZ 3.78Å; W159-L207 HydrophobicContact CD2-CD2 4.06Å; W159-L207 HydrophobicContact CE3-CD2 4.23Å; W159-L207 HydrophobicContact CZ2-CD2 4.46Å; W159-F209 HydrophobicContact CH2-CD1 4.35Å; W159-F209 HydrophobicContact CH2-CD2 4.49Å; W159-F209 AromaticContact CH2-CE1 3.77Å; W159-F209 HydrophobicContact CH2-CE1 3.77Å; W159-F209 AromaticContact CH2-CE2 3.98Å; W159-F209 HydrophobicContact CH2-CE2 3.98Å; W159-F209 AromaticContact CH2-CZ 3.52Å; W159-F209 HydrophobicContact CH2-CZ 3.52Å; W159-F209 HydrophobicContact CZ2-CZ 4.42Å; W159-F209 HydrophobicContact CZ3-CE1 4.46Å; W159-F209 HydrophobicContact CZ3-CE2 4.47Å; W159-F209 HydrophobicContact CZ3-CZ 4.34Å
160	S	97.5	Very high	95	Very high	8 Å²	8	14.6 Å²	14.6	6%	0.056	9%	0.085	C	C	.	.	H	α-helix	trans	-58.5	-37.9	178.1	-55.4	0	0	0	0	111.6	Y141 A156 D157 V163 L164	Y141-S160 WeakPolarHBondContact O-CA 3.46Å; Y141-S160 WeakPolarHBondContact O-CB 3.27Å; Y141-S160 PolarHBondContact O-OG 3.43Å; A156-S160 PolarHBondContact O-N 3.39Å; A156-S160 VanDerWaalsContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.23Å; D157-S160 WeakPolarHBondContact O-CB 3.36Å; D157-S160 PolarHBondContact O-N 3.27Å; S160-V163 PolarHBondContact O-N 2.95Å; S160-L164 WeakPolarHBondContact O-CB 2.96Å; S160-L164 PolarHBondContact O-N 3.46Å
161	L	98.1	Very high	95.4	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60.3	-45.5	171.1	178.9	60.9	0	0	0	111.9	L55 L59 L102 D157 W158 W159 V163 L164 L165 Y221	L55-L161 HydrophobicContact CB-CD1 3.7Å; L55-L161 HydrophobicContact CD1-CD1 4.11Å; L59-L161 HydrophobicContact CD1-CB 3.89Å; L59-L161 HydrophobicContact CD1-CD2 4.04Å; L102-L161 HydrophobicContact CD2-CB 3.92Å; L102-L161 HydrophobicContact CD2-CD1 4.42Å; D157-L161 PolarHBondContact O-N 3.28Å; W158-L161 HydrophobicContact CE3-CD2 4.08Å; W158-L161 HydrophobicContact CZ3-CD2 4.13Å; W159-L161 PolarHBondContact O-N 2.94Å; L161-V163 VanDerWaalsContact C-N 3.33Å; L161-V163 PolarHBondContact O-N 2.9Å; L161-L164 PolarHBondContact O-N 2.87Å; L161-L165 HydrophobicContact CD1-CD1 4.16Å; L161-L165 HydrophobicContact CD1-CD2 4.39Å; L161-L165 HydrophobicContact CD1-CG 3.99Å; L161-L165 HydrophobicContact CG-CD1 4.15Å; L161-L165 HydrophobicContact CG-CG 4.36Å; L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.41Å; L161-L165 PolarHBondContact O-N 3.46Å; L161-Y221 HydrophobicContact CD2-CE2 3.97Å
162	G	97.9	Very high	95.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.2	-42.2	175.9	0	0	0	0	0	113.1	W158 W159 H166	W158-G162 PolarHBondContact O-N 2.67Å; W158-G162 VanDerWaalsContact O-N 3.12Å; W159-G162 WeakPolarHBondContact O-CA 3.32Å; W159-G162 PolarHBondContact O-N 2.95Å; G162-H166 WeakPolarHBondContact O-CB 3.5Å; G162-H166 PolarHBondContact O-N 2.67Å
163	V	96.6	Very high	95.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.5	-45.4	176.2	173.4	0	0	0	0	110.7	H140 Y141 W159 S160 L161 H166 T167 Y173 P174 F175 L207	H140-V163 WeakPolarHBondContact O-CG1 3.33Å; Y141-V163 HydrophobicContact CD1-CB 4.19Å; Y141-V163 HydrophobicContact CD1-CG1 3.75Å; Y141-V163 HydrophobicContact CE1-CG1 4.16Å; Y141-V163 HydrophobicContact CG-CG1 4.39Å; W159-V163 PolarHBondContact O-N 2.89Å; S160-V163 PolarHBondContact O-N 2.95Å; L161-V163 VanDerWaalsContact C-N 3.33Å; L161-V163 PolarHBondContact O-N 2.9Å; V163-H166 PolarHBondContact O-N 2.74Å; V163-T167 WeakPolarHBondContact O-CB 3.21Å; V163-T167 PolarHBondContact O-N 2.78Å; V163-T167 PolarHBondContact O-OG1 3.03Å; V163-Y173 HydrophobicContact CG1-CD1 4.15Å; V163-P174 HydrophobicContact CB-CG 4.35Å; V163-P174 HydrophobicContact CG1-CG 4.09Å; V163-P174 HydrophobicContact CG2-CG 4.13Å; V163-F175 HydrophobicContact CG2-CE2 4.37Å; V163-L207 HydrophobicContact CG2-CD2 3.83Å
164	L	97.2	Very high	95.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.5	-50.4	179.3	-172.1	150.8	0	0	0	110.6	L33 L55 L102 M104 V107 Y141 S160 L161 H166 T167 L168	L33-L164 HydrophobicContact CD2-CD2 4.41Å; L55-L164 HydrophobicContact CD1-CD1 4.48Å; L55-L164 HydrophobicContact CD1-CD2 3.76Å; L102-L164 HydrophobicContact CD1-CD1 4.4Å; L102-L164 HydrophobicContact CG-CD1 4.23Å; M104-L164 HydrophobicContact CG-CD1 4.31Å; M104-L164 HydrophobicContact CG-CG 4.21Å; V107-L164 HydrophobicContact CG2-CD1 4.29Å; Y141-L164 HydrophobicContact CD1-CB 4.45Å; Y141-L164 HydrophobicContact CE1-CB 4.16Å; S160-L164 WeakPolarHBondContact O-CB 2.96Å; S160-L164 PolarHBondContact O-N 3.46Å; L161-L164 PolarHBondContact O-N 2.87Å; L164-H166 PolarHBondContact O-N 3.47Å; L164-T167 PolarHBondContact O-N 2.95Å; L164-T167 VanDerWaalsContact O-N 3.1Å; L164-L168 HydrophobicContact CD2-CD1 3.51Å; L164-L168 HydrophobicContact CD2-CG 4.03Å; L164-L168 WeakPolarHBondContact O-CG 3.41Å; L164-L168 PolarHBondContact O-N 3.09Å
165	L	97.1	Very high	95	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-61.1	-44.4	179.2	-68.1	-177.9	0	0	0	112.6	A52 L161 T167 L168 V169 L202 L203 L206	A52-L165 HydrophobicContact CB-CD1 3.82Å; A52-L165 HydrophobicContact CB-CD2 3.5Å; A52-L165 HydrophobicContact CB-CG 4.32Å; L161-L165 HydrophobicContact CD1-CD1 4.16Å; L161-L165 HydrophobicContact CD1-CD2 4.39Å; L161-L165 HydrophobicContact CD1-CG 3.99Å; L161-L165 HydrophobicContact CG-CD1 4.15Å; L161-L165 HydrophobicContact CG-CG 4.36Å; L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 VanDerWaalsContact O-CG 3.32Å; L161-L165 WeakPolarHBondContact O-CG 3.41Å; L161-L165 PolarHBondContact O-N 3.46Å; L165-T167 VanDerWaalsContact C-N 3.29Å; L165-T167 PolarHBondContact O-N 3.35Å; L165-L168 HydrophobicContact CD2-CD1 4.47Å; L165-L168 PolarHBondContact O-N 2.97Å; L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 2.88Å; L165-V169 VanDerWaalsContact O-N 3.14Å; L165-L202 HydrophobicContact CD1-CD2 4.43Å; L165-L203 HydrophobicContact CB-CD2 3.93Å; L165-L206 HydrophobicContact CD1-CD1 4.11Å
166	H	96.1	Very high	94.2	Very high	9 Å²	9	25 Å²	25	4%	0.042	14%	0.137	C	C	.	.	H	α-helix	trans	-56.5	-46.9	173.1	173.9	-79.6	0	0	0	111.1	G162 V163 L164 L168 V169 C170 T172 P174 Y189 L203	G162-H166 WeakPolarHBondContact O-CB 3.5Å; G162-H166 PolarHBondContact O-N 2.67Å; V163-H166 PolarHBondContact O-N 2.74Å; L164-H166 PolarHBondContact O-N 3.47Å; H166-L168 VanDerWaalsContact C-N 3.34Å; H166-L168 PolarHBondContact O-N 3.21Å; H166-V169 WeakPolarHBondContact O-CG2 3.43Å; H166-V169 PolarHBondContact O-N 3.32Å; H166-C170 VanDerWaalsContact CD2-SG 3.57Å; H166-C170 PolarHBondContact NE2-SG 3.04Å; H166-C170 VanDerWaalsContact NE2-SG 3.37Å; H166-C170 WeakPolarHBondContact O-CB 3.41Å; H166-C170 PolarHBondContact O-N 2.9Å; H166-C170 PolarHBondContact O-SG 3.44Å; H166-T172 PolarHBondContact CE1-O 2.87Å; H166-T172 PolarHBondContact ND1-O 3.17Å; H166-P174 HydrophobicContact CB-CB 4.28Å; H166-P174 HydrophobicContact CB-CG 4.2Å; H166-P174 VanDerWaalsContact CE1-CA 3.43Å; H166-P174 WeakPolarHBondContact CE1-CA 3.47Å; H166-P174 WeakPolarHBondContact ND1-CD 3.36Å; H166-Y189 AromaticContact CD2-CE2 3.7Å; H166-Y189 AromaticContact CD2-CZ 3.92Å; H166-Y189 PolarHBondContact CD2-OH 2.84Å; H166-Y189 VanDerWaalsContact CD2-OH 3.24Å; H166-L203 HydrophobicContact CB-CD2 4.3Å
167	T	95.2	Very high	93.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.4	-39.3	-175.4	-52.2	0	0	0	0	111.6	W37 M104 V163 L164 L165 G171 T172 Y173	W37-T167 HydrophobicContact CH2-CG2 4.43Å; W37-T167 HydrophobicContact CZ2-CG2 3.8Å; W37-T167 PolarHBondContact NE1-O 3.17Å; M104-T167 HydrophobicContact CE-CG2 3.77Å; V163-T167 WeakPolarHBondContact O-CB 3.21Å; V163-T167 PolarHBondContact O-N 2.78Å; V163-T167 PolarHBondContact O-OG1 3.03Å; L164-T167 PolarHBondContact O-N 2.95Å; L164-T167 VanDerWaalsContact O-N 3.1Å; L165-T167 VanDerWaalsContact C-N 3.29Å; L165-T167 PolarHBondContact O-N 3.35Å; T167-G171 WeakPolarHBondContact O-CA 3.42Å; T167-G171 PolarHBondContact O-N 2.85Å; T167-T172 WeakPolarHBondContact CA-O 3.2Å; T167-Y173 HydrophobicContact CG2-CD1 4.17Å; T167-Y173 HydrophobicContact CG2-CE1 4.14Å; T167-Y173 WeakPolarHBondContact OG1-CD1 3.34Å
168	L	95.3	Very high	91.7	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-45.1	174.9	-68	178.1	0	0	0	112.3	L33 W37 L43 V48 W51 M104 L164 L165 H166	L33-L168 HydrophobicContact CD1-CD2 4.3Å; L33-L168 HydrophobicContact CD2-CD1 4.08Å; L33-L168 HydrophobicContact CD2-CD2 4.06Å; L33-L168 HydrophobicContact CG-CD2 4.02Å; W37-L168 HydrophobicContact CB-CD2 4.26Å; W37-L168 HydrophobicContact CG-CD2 4.29Å; L43-L168 HydrophobicContact CD1-CB 4.01Å; L43-L168 HydrophobicContact CD1-CD2 3.71Å; L43-L168 HydrophobicContact CD1-CG 4.41Å; V48-L168 HydrophobicContact CG1-CB 4Å; V48-L168 HydrophobicContact CG1-CD1 4.07Å; V48-L168 HydrophobicContact CG2-CB 4.36Å; W51-L168 HydrophobicContact CE3-CD1 4.25Å; M104-L168 HydrophobicContact CG-CD2 4.46Å; M104-L168 HydrophobicContact SD-CD2 3.83Å; L164-L168 HydrophobicContact CD2-CD1 3.51Å; L164-L168 HydrophobicContact CD2-CG 4.03Å; L164-L168 WeakPolarHBondContact O-CG 3.41Å; L164-L168 PolarHBondContact O-N 3.09Å; L165-L168 HydrophobicContact CD2-CD1 4.47Å; L165-L168 PolarHBondContact O-N 2.97Å; H166-L168 VanDerWaalsContact C-N 3.34Å; H166-L168 PolarHBondContact O-N 3.21Å
169	V	94.5	Very high	90.1	Very high	42 Å²	42	33.7 Å²	33.7	26%	0.255	19%	0.187	S	C	.	.	H	α-helix	trans	-83.2	-29	-175.2	-58.4	0	0	0	0	113.8	V48 L165 H166 L195 L199	V48-V169 HydrophobicContact CB-CG1 4.43Å; V48-V169 HydrophobicContact CG1-CG1 3.63Å; L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 2.88Å; L165-V169 VanDerWaalsContact O-N 3.14Å; H166-V169 WeakPolarHBondContact O-CG2 3.43Å; H166-V169 PolarHBondContact O-N 3.32Å; V169-L195 HydrophobicContact CB-CD2 4.17Å; V169-L195 HydrophobicContact CG2-CD1 4.08Å; V169-L195 HydrophobicContact CG2-CD2 3.82Å; V169-L199 HydrophobicContact CB-CD2 4.33Å; V169-L199 HydrophobicContact CG1-CD2 4Å; V169-L199 HydrophobicContact CG2-CD2 4.15Å
170	C	93.3	Very high	88.4	Confident	35 Å²	35	39.3 Å²	39.3	24%	0.236	21%	0.214	C	C	.	.	H	α-helix	trans	-100.7	-11.8	-176.2	-62.5	0	0	0	0	113.6	H166 T172	H166-C170 VanDerWaalsContact CD2-SG 3.57Å; H166-C170 PolarHBondContact NE2-SG 3.04Å; H166-C170 VanDerWaalsContact NE2-SG 3.37Å; H166-C170 WeakPolarHBondContact O-CB 3.41Å; H166-C170 PolarHBondContact O-N 2.9Å; H166-C170 PolarHBondContact O-SG 3.44Å; C170-T172 PolarHBondContact O-N 3.46Å; C170-T172 VanDerWaalsContact O-N 3.13Å; C170-T172 PolarHBondContact O-OG1 2.93Å
171	G	92.1	Very high	86.5	Confident	26 Å²	26	48.7 Å²	48.7	27%	0.268	25%	0.248	S	C	.	.	S	Bend	trans	66.9	8.1	-173.9	0	0	0	0	0	114.4	W37 T167	W37-G171 WeakPolarHBondContact CZ2-O 3.3Å; T167-G171 WeakPolarHBondContact O-CA 3.42Å; T167-G171 PolarHBondContact O-N 2.85Å
172	T	91.6	Very high	84.3	Confident	85 Å²	85	55 Å²	55	52%	0.521	28%	0.275	S	S	.	.	S	Bend	trans	-146.2	152.6	-177.4	52.6	0	0	0	0	110.8	H166 T167 C170	H166-T172 PolarHBondContact CE1-O 2.87Å; H166-T172 PolarHBondContact ND1-O 3.17Å; T167-T172 WeakPolarHBondContact CA-O 3.2Å; C170-T172 PolarHBondContact O-N 3.46Å; C170-T172 VanDerWaalsContact O-N 3.13Å; C170-T172 PolarHBondContact O-OG1 2.93Å
173	Y	91.9	Very high	82.2	Confident	70 Å²	70	55.9 Å²	55.9	28%	0.275	28%	0.281	S	S	.	.			trans	-68	142.9	174.9	-69.8	-75.2	0	0	0	111.2	H140 Y141 V163 T167 F175	H140-Y173 HydrophobicContact CB-CD1 3.88Å; H140-Y173 HydrophobicContact CB-CE1 3.68Å; H140-Y173 HydrophobicContact CB-CG 4.42Å; H140-Y173 AromaticContact CD2-CD2 3.77Å; H140-Y173 AromaticContact CD2-CG 3.84Å; Y141-Y173 HydrophobicContact CE1-CE1 4.23Å; Y141-Y173 AromaticContact CE2-CE1 3.97Å; Y141-Y173 HydrophobicContact CE2-CE1 3.97Å; Y141-Y173 AromaticContact CZ-CE1 3.72Å; Y141-Y173 PolarHBondContact OH-OH 3.1Å; V163-Y173 HydrophobicContact CG1-CD1 4.15Å; T167-Y173 HydrophobicContact CG2-CD1 4.17Å; T167-Y173 HydrophobicContact CG2-CE1 4.14Å; T167-Y173 WeakPolarHBondContact OG1-CD1 3.34Å; Y173-F175 PolarHBondContact O-N 3.27Å
174	P	91.5	Very high	79.9	Confident	26 Å²	26	65.1 Å²	65.1	17%	0.169	32%	0.321	C	S	.	.	S	Bend	trans	-67.4	-18.6	-179.5	24.3	-30.4	0	0	0	113.4	V163 H166 Y189 L207	V163-P174 HydrophobicContact CB-CG 4.35Å; V163-P174 HydrophobicContact CG1-CG 4.09Å; V163-P174 HydrophobicContact CG2-CG 4.13Å; H166-P174 HydrophobicContact CB-CB 4.28Å; H166-P174 HydrophobicContact CB-CG 4.2Å; H166-P174 VanDerWaalsContact CE1-CA 3.43Å; H166-P174 WeakPolarHBondContact CE1-CA 3.47Å; H166-P174 WeakPolarHBondContact ND1-CD 3.36Å; P174-Y189 HydrophobicContact CB-CD2 3.95Å; P174-Y189 HydrophobicContact CB-CE2 3.75Å; P174-L207 HydrophobicContact CB-CD1 4.35Å; P174-L207 HydrophobicContact CG-CD1 4.41Å
175	F	88	Confident	77.7	Confident	22 Å²	22	72.6 Å²	72.6	10%	0.096	36%	0.356	C	S	.	.	S	Bend	trans	-141	141.5	-176.4	-44.6	-75.1	0	0	0	111	W159 V163 Y173 F186 Y189 L207 F209	W159-F175 AromaticContact CH2-CE2 3.78Å; W159-F175 HydrophobicContact CH2-CE2 3.78Å; W159-F175 AromaticContact CH2-CZ 3.72Å; W159-F175 HydrophobicContact CH2-CZ 3.72Å; W159-F175 HydrophobicContact CZ2-CD2 4.07Å; W159-F175 AromaticContact CZ2-CE2 3.32Å; W159-F175 HydrophobicContact CZ2-CE2 3.32Å; W159-F175 AromaticContact CZ2-CZ 3.78Å; W159-F175 HydrophobicContact CZ2-CZ 3.78Å; V163-F175 HydrophobicContact CG2-CE2 4.37Å; Y173-F175 PolarHBondContact O-N 3.27Å; F175-F186 HydrophobicContact CB-CD1 3.82Å; F175-F186 HydrophobicContact CB-CE1 3.33Å; F175-F186 HydrophobicContact CB-CZ 4.46Å; F175-F186 AromaticContact CD1-CD1 3.45Å; F175-F186 HydrophobicContact CD1-CD1 3.45Å; F175-F186 VanDerWaalsContact CD1-CD1 3.45Å; F175-F186 AromaticContact CD1-CE1 3.7Å; F175-F186 HydrophobicContact CD1-CE1 3.7Å; F175-F186 HydrophobicContact CD2-CD1 4.18Å; F175-F186 AromaticContact CD2-CE1 3.59Å; F175-F186 HydrophobicContact CD2-CE1 3.59Å; F175-F186 HydrophobicContact CD2-CZ 4.47Å; F175-F186 AromaticContact CE1-CD1 3.97Å; F175-F186 HydrophobicContact CE1-CD1 3.97Å; F175-F186 HydrophobicContact CE1-CE1 4.34Å; F175-F186 HydrophobicContact CE2-CE1 4.28Å; F175-F186 AromaticContact CG-CD1 3.57Å; F175-F186 HydrophobicContact CG-CD1 3.57Å; F175-F186 AromaticContact CG-CE1 3.26Å; F175-F186 HydrophobicContact CG-CE1 3.26Å; F175-F186 HydrophobicContact CG-CZ 4.45Å; F175-Y189 HydrophobicContact CE1-CD2 4.15Å; F175-Y189 HydrophobicContact CZ-CD2 4.06Å; F175-Y189 HydrophobicContact CZ-CG 4.33Å; F175-L207 HydrophobicContact CE2-CD2 4.21Å; F175-L207 HydrophobicContact CZ-CD1 4.49Å; F175-F209 HydrophobicContact CE1-CE2 4.31Å; F175-F209 HydrophobicContact CE1-CZ 4.1Å; F175-F209 HydrophobicContact CZ-CE2 4.42Å; F175-F209 HydrophobicContact CZ-CZ 4.23Å
176	Q	77.9	Confident	76	Confident	188 Å²	188	74.3 Å²	74.3	88%	0.879	36%	0.363	S	S	*	.			trans	-85.4	114.5	173	-65.2	-161.1	-7.3	0	0	110.1
177	V	72.7	Confident	74.5	Confident	18 Å²	18	79.2 Å²	79.2	11%	0.109	39%	0.393	C	S	.	.			trans	-113.6	102.3	177.9	-164.9	0	0	0	0	108.8	L139 V183 F186	L139-V177 HydrophobicContact CD1-CG1 3.93Å; L139-V177 HydrophobicContact CD2-CG1 3.73Å; L139-V177 HydrophobicContact CG-CB 4.37Å; L139-V177 HydrophobicContact CG-CG1 3.55Å; V177-V183 HydrophobicContact CG1-CG2 3.84Å; V177-F186 HydrophobicContact CG2-CZ 4.46Å
178	T	66.3	Low	73.7	Confident	101 Å²	101	81.4 Å²	81.4	62%	0.62	42%	0.416	S	S	*	.	S	Bend	trans	-98.2	-21.3	-178.9	46.6	0	0	0	0	113.5	K182	T178-K182 WeakPolarHBondContact OG1-CD 3.41Å
179	D	64.6	Low	73.4	Confident	69 Å²	69	82.1 Å²	82.1	37%	0.369	42%	0.418	S	S	.	.			trans	-162.3	146.2	177.6	-173.4	-19.3	0	0	0	108.2	R181 K182	D179-R181 PolarHBondContact O-N 3.42Å; D179-R181 PolarHBondContact OD1-N 3.14Å; D179-K182 PolarHBondContact O-N 3.09Å
180	E	61.2	Low	73.3	Confident	119 Å²	119	90.1 Å²	90.1	56%	0.556	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-46.9	-34.1	171.9	-64.1	-177	174.5	0	0	111.9	L139 L147 K182	L139-E180 HydrophobicContact CD1-CG 4.1Å; L147-E180 HydrophobicContact CD2-CG 4.47Å; E180-K182 PolarHBondContact O-N 3.41Å
181	R	58.1	Low	73.3	Confident	205 Å²	205	89.4 Å²	89.4	77%	0.774	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-73.6	-23.4	-178.3	-56.7	-177.6	-160.2	-170.9	5.7	114.3	D179	D179-R181 PolarHBondContact O-N 3.42Å; D179-R181 PolarHBondContact OD1-N 3.14Å
182	K	52.1	Low	73.3	Confident	132 Å²	132	90.2 Å²	90.2	57%	0.574	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-92.1	-6.7	-172.7	-74.2	-177.2	178.5	179	0	114.4	T178 D179 E180 K184 H185	T178-K182 WeakPolarHBondContact OG1-CD 3.41Å; D179-K182 PolarHBondContact O-N 3.09Å; E180-K182 PolarHBondContact O-N 3.41Å; K182-K184 PolarHBondContact O-N 2.7Å; K182-H185 PolarHBondContact O-N 3.23Å; K182-H185 VanDerWaalsContact O-N 3.14Å
183	V	52.8	Low	73.5	Confident	20 Å²	20	93.7 Å²	93.7	12%	0.121	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-54.6	-22.9	172.4	154.8	0	0	0	0	112.9	L147 V177 H185 F186	L147-V183 HydrophobicContact CB-CG1 4.43Å; L147-V183 HydrophobicContact CD1-CB 3.91Å; L147-V183 HydrophobicContact CD1-CG1 3.62Å; L147-V183 HydrophobicContact CD1-CG2 3.4Å; L147-V183 VanDerWaalsContact CD1-CG2 3.4Å; V177-V183 HydrophobicContact CG1-CG2 3.84Å; V183-H185 PolarHBondContact O-N 2.89Å; V183-F186 HydrophobicContact CB-CD2 4.31Å; V183-F186 HydrophobicContact CB-CE2 3.86Å; V183-F186 HydrophobicContact CG1-CD2 3.69Å; V183-F186 HydrophobicContact CG1-CE2 3.25Å; V183-F186 HydrophobicContact CG1-CZ 4.29Å; V183-F186 HydrophobicContact CG2-CE2 3.94Å; V183-F186 HydrophobicContact CG2-CZ 4.2Å; V183-F186 WeakPolarHBondContact O-CD2 3.25Å; V183-F186 PolarHBondContact O-N 3.44Å
184	K	48	Very low	73.5	Confident	193 Å²	193	98 Å²	98	84%	0.839	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-59.7	-15.7	175.8	-70	-173.1	177.8	-178.2	0	115	K182	K182-K184 PolarHBondContact O-N 2.7Å
185	H	51.3	Low	73.7	Confident	158 Å²	158	97.7 Å²	97.7	73%	0.731	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-105.5	32	177.9	-59.8	105.4	0	0	0	113.7	K182 V183 V187	K182-H185 PolarHBondContact O-N 3.23Å; K182-H185 VanDerWaalsContact O-N 3.14Å; V183-H185 PolarHBondContact O-N 2.89Å; H185-V187 VanDerWaalsContact C-N 3.31Å; H185-V187 PolarHBondContact O-N 3.46Å
186	F	60.6	Low	74.1	Confident	39 Å²	39	100.6 Å²	100.6	17%	0.171	50%	0.497	C	S	.	.			trans	-63	99.7	167.8	-79.3	-69.4	0	0	0	110.2	P144 F175 V177 V183 G188 F209	P144-F186 HydrophobicContact CB-CD2 4.19Å; P144-F186 HydrophobicContact CB-CE2 4.03Å; F175-F186 HydrophobicContact CB-CD1 3.82Å; F175-F186 HydrophobicContact CB-CE1 3.33Å; F175-F186 HydrophobicContact CB-CZ 4.46Å; F175-F186 AromaticContact CD1-CD1 3.45Å; F175-F186 HydrophobicContact CD1-CD1 3.45Å; F175-F186 VanDerWaalsContact CD1-CD1 3.45Å; F175-F186 AromaticContact CD1-CE1 3.7Å; F175-F186 HydrophobicContact CD1-CE1 3.7Å; F175-F186 HydrophobicContact CD2-CD1 4.18Å; F175-F186 AromaticContact CD2-CE1 3.59Å; F175-F186 HydrophobicContact CD2-CE1 3.59Å; F175-F186 HydrophobicContact CD2-CZ 4.47Å; F175-F186 AromaticContact CE1-CD1 3.97Å; F175-F186 HydrophobicContact CE1-CD1 3.97Å; F175-F186 HydrophobicContact CE1-CE1 4.34Å; F175-F186 HydrophobicContact CE2-CE1 4.28Å; F175-F186 AromaticContact CG-CD1 3.57Å; F175-F186 HydrophobicContact CG-CD1 3.57Å; F175-F186 AromaticContact CG-CE1 3.26Å; F175-F186 HydrophobicContact CG-CE1 3.26Å; F175-F186 HydrophobicContact CG-CZ 4.45Å; V177-F186 HydrophobicContact CG2-CZ 4.46Å; V183-F186 HydrophobicContact CB-CD2 4.31Å; V183-F186 HydrophobicContact CB-CE2 3.86Å; V183-F186 HydrophobicContact CG1-CD2 3.69Å; V183-F186 HydrophobicContact CG1-CE2 3.25Å; V183-F186 HydrophobicContact CG1-CZ 4.29Å; V183-F186 HydrophobicContact CG2-CE2 3.94Å; V183-F186 HydrophobicContact CG2-CZ 4.2Å; V183-F186 WeakPolarHBondContact O-CD2 3.25Å; V183-F186 PolarHBondContact O-N 3.44Å; F186-G188 PolarHBondContact O-N 2.96Å; F186-F209 HydrophobicContact CB-CD1 4.2Å; F186-F209 HydrophobicContact CB-CE1 3.11Å; F186-F209 HydrophobicContact CB-CE2 4.16Å; F186-F209 HydrophobicContact CB-CZ 3.11Å; F186-F209 HydrophobicContact CD1-CE1 4.1Å; F186-F209 AromaticContact CD1-CZ 3.77Å; F186-F209 HydrophobicContact CD1-CZ 3.77Å; F186-F209 AromaticContact CD2-CE1 3.46Å; F186-F209 HydrophobicContact CD2-CE1 3.46Å; F186-F209 VanDerWaalsContact CD2-CE1 3.46Å; F186-F209 HydrophobicContact CD2-CZ 4.01Å; F186-F209 HydrophobicContact CE2-CE1 4.29Å; F186-F209 AromaticContact CG-CE1 3.34Å; F186-F209 HydrophobicContact CG-CE1 3.34Å; F186-F209 AromaticContact CG-CZ 3.42Å; F186-F209 HydrophobicContact CG-CZ 3.42Å; F186-F209 VanDerWaalsContact CG-CZ 3.42Å
187	V	65.9	Low	75	Confident	111 Å²	111	98.1 Å²	98.1	67%	0.673	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-61.4	134	163.1	-168.6	0	0	0	0	106.2	H185 Y189	H185-V187 VanDerWaalsContact C-N 3.31Å; H185-V187 PolarHBondContact O-N 3.46Å; V187-Y189 PolarHBondContact O-N 3.37Å
188	G	77.5	Confident	76.2	Confident	46 Å²	46	100.3 Å²	100.3	47%	0.474	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-47.7	137.4	-176.2	0	0	0	0	0	111.7	F186 R190	F186-G188 PolarHBondContact O-N 2.96Å; G188-R190 PolarHBondContact O-N 3.29Å
189	Y	90.6	Very high	77.7	Confident	20 Å²	20	96 Å²	96	8%	0.078	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-56.9	132.2	-177.2	173.5	-108.1	0	0	0	111.2	H166 P174 F175 V187 P191 L203 L204 L207	H166-Y189 AromaticContact CD2-CE2 3.7Å; H166-Y189 AromaticContact CD2-CZ 3.92Å; H166-Y189 PolarHBondContact CD2-OH 2.84Å; H166-Y189 VanDerWaalsContact CD2-OH 3.24Å; P174-Y189 HydrophobicContact CB-CD2 3.95Å; P174-Y189 HydrophobicContact CB-CE2 3.75Å; F175-Y189 HydrophobicContact CE1-CD2 4.15Å; F175-Y189 HydrophobicContact CZ-CD2 4.06Å; F175-Y189 HydrophobicContact CZ-CG 4.33Å; V187-Y189 PolarHBondContact O-N 3.37Å; Y189-P191 HydrophobicContact CE1-CB 3.83Å; Y189-P191 HydrophobicContact CE1-CG 4.26Å; Y189-P191 WeakPolarHBondContact OH-CA 3.47Å; Y189-P191 WeakPolarHBondContact OH-CB 3.43Å; Y189-L203 HydrophobicContact CE1-CB 3.68Å; Y189-L203 WeakPolarHBondContact OH-CD1 3.37Å; Y189-L204 HydrophobicContact CD1-CD2 4.1Å; Y189-L207 HydrophobicContact CD1-CB 3.86Å; Y189-L207 HydrophobicContact CD1-CD1 3.87Å; Y189-L207 HydrophobicContact CD1-CG 4.47Å; Y189-L207 HydrophobicContact CD2-CD1 3.61Å; Y189-L207 HydrophobicContact CE1-CB 4.46Å; Y189-L207 HydrophobicContact CE1-CD1 3.8Å; Y189-L207 HydrophobicContact CE2-CD1 3.54Å; Y189-L207 HydrophobicContact CG-CB 3.9Å; Y189-L207 HydrophobicContact CG-CD1 3.78Å
190	R	90.9	Very high	79.3	Confident	210 Å²	210	94.1 Å²	94.1	79%	0.792	46%	0.457	S	S	*	.			trans	-124.9	108.3	175.7	-66.3	-173.8	-175	-172.3	0.8	108.7	G188	G188-R190 PolarHBondContact O-N 3.29Å
191	P	93.1	Very high	81	Confident	19 Å²	19	92 Å²	92	12%	0.123	45%	0.447	C	S	.	.			trans	-66.3	144.2	179.3	28.9	-35.1	0	0	0	110.6	Y189 Q200 L204	Y189-P191 HydrophobicContact CE1-CB 3.83Å; Y189-P191 HydrophobicContact CE1-CG 4.26Å; Y189-P191 WeakPolarHBondContact OH-CA 3.47Å; Y189-P191 WeakPolarHBondContact OH-CB 3.43Å; P191-Q200 HydrophobicContact CB-CB 3.97Å; P191-Q200 HydrophobicContact CB-CG 3.92Å; P191-Q200 HydrophobicContact CG-CB 3.78Å; P191-Q200 HydrophobicContact CG-CG 4.06Å; P191-L204 HydrophobicContact CG-CD1 4.01Å; P191-L204 HydrophobicContact CG-CD2 4.35Å; P191-L204 HydrophobicContact CG-CG 3.94Å
192	P	93.9	Very high	82.9	Confident	44 Å²	44	82.3 Å²	82.3	29%	0.286	41%	0.41	S	S	.	.			trans	-61.1	138.4	174.2	-26.7	36.7	0	0	0	112.6	I194 L195	P192-I194 HydrophobicContact CB-CG2 3.99Å; P192-I194 PolarHBondContact O-N 3.09Å; P192-L195 HydrophobicContact CB-CG 4.34Å; P192-L195 WeakPolarHBondContact O-CB 3.35Å; P192-L195 PolarHBondContact O-N 3.13Å; P192-L195 VanDerWaalsContact O-N 3.14Å
193	L	94	Very high	85.1	Confident	158 Å²	158	76 Å²	76	83%	0.827	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.2	-178.1	-61.7	-179.8	0	0	0	113.8	L195	L193-L195 PolarHBondContact O-N 3.48Å
194	I	93.6	Very high	87.2	Confident	159 Å²	159	77.3 Å²	77.3	82%	0.815	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.8	176	-165.3	165.8	0	0	0	112.7	P192	P192-I194 HydrophobicContact CB-CG2 3.99Å; P192-I194 PolarHBondContact O-N 3.09Å
195	L	95	Very high	89.6	Confident	20 Å²	20	71.7 Å²	71.7	11%	0.105	36%	0.364	C	S	.	.	S	Bend	trans	-74.9	152.4	178.1	-57.7	-177.4	0	0	0	110.8	V169 P192 L193 L199 Q200 L203	V169-L195 HydrophobicContact CB-CD2 4.17Å; V169-L195 HydrophobicContact CG2-CD1 4.08Å; V169-L195 HydrophobicContact CG2-CD2 3.82Å; P192-L195 HydrophobicContact CB-CG 4.34Å; P192-L195 WeakPolarHBondContact O-CB 3.35Å; P192-L195 PolarHBondContact O-N 3.13Å; P192-L195 VanDerWaalsContact O-N 3.14Å; L193-L195 PolarHBondContact O-N 3.48Å; L195-L199 HydrophobicContact CB-CD2 4.35Å; L195-L199 HydrophobicContact CD1-CD2 4.3Å; L195-L199 HydrophobicContact CD1-CG 4.43Å; L195-L199 HydrophobicContact CD2-CD2 4.18Å; L195-Q200 HydrophobicContact CB-CG 3.82Å; L195-Q200 PolarHBondContact O-NE2 3.25Å; L195-L203 HydrophobicContact CD1-CD1 3.77Å
196	T	96.1	Very high	91.8	Very high	84 Å²	84	64.2 Å²	64.2	52%	0.515	33%	0.329	S	S	.	.			trans	-60.1	146.7	172.8	61.3	0	0	0	0	111.1	D198 L199 Q200	T196-D198 VanDerWaalsContact C-N 3.27Å; T196-D198 PolarHBondContact O-N 3.46Å; T196-L199 PolarHBondContact O-N 2.97Å; T196-L199 VanDerWaalsContact O-N 3.09Å; T196-L199 VanDerWaalsContact OG1-CB 3.31Å; T196-L199 WeakPolarHBondContact OG1-CB 3.31Å; T196-L199 PolarHBondContact OG1-N 3.06Å; T196-Q200 WeakPolarHBondContact O-CG 3.31Å; T196-Q200 PolarHBondContact O-N 3.26Å
197	F	97.3	Very high	93.5	Very high	136 Å²	136	62.5 Å²	62.5	60%	0.596	32%	0.322	S	S	*	.	H	α-helix	trans	-52.8	-45.6	-179.4	179.9	-101.4	0	0	0	112.1	L199 Q200 Q201	F197-L199 VanDerWaalsContact C-N 3.32Å; F197-L199 PolarHBondContact O-N 3.34Å; F197-Q200 WeakPolarHBondContact O-CB 3.37Å; F197-Q200 PolarHBondContact O-N 2.89Å; F197-Q201 HydrophobicContact CD1-CG 4.12Å; F197-Q201 HydrophobicContact CD2-CG 4.49Å; F197-Q201 HydrophobicContact CE1-CG 3.76Å; F197-Q201 HydrophobicContact CE2-CG 4.16Å; F197-Q201 HydrophobicContact CG-CG 4.49Å; F197-Q201 HydrophobicContact CZ-CG 3.78Å; F197-Q201 VanDerWaalsContact O-CG 3.27Å; F197-Q201 WeakPolarHBondContact O-CG 3.22Å; F197-Q201 PolarHBondContact O-N 3.4Å
198	D	97.8	Very high	94.8	Very high	63 Å²	63	63.5 Å²	63.5	34%	0.337	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-39.1	-179.5	-61.3	-30.2	0	0	0	112.8	T196 Q201 L202 P225 Y226	T196-D198 VanDerWaalsContact C-N 3.27Å; T196-D198 PolarHBondContact O-N 3.46Å; D198-Q201 PolarHBondContact O-N 2.94Å; D198-L202 PolarHBondContact O-N 2.94Å; D198-P225 HydrophobicContact CB-CB 4.33Å; D198-Y226 HydrophobicContact CB-CD2 4.32Å
199	L	97.7	Very high	95.4	Very high	10 Å²	10	64.4 Å²	64.4	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-40.7	176.1	-179.4	54.9	0	0	0	111.8	V169 L195 T196 F197 Q201 L202 L203 Y226	V169-L199 HydrophobicContact CB-CD2 4.33Å; V169-L199 HydrophobicContact CG1-CD2 4Å; V169-L199 HydrophobicContact CG2-CD2 4.15Å; L195-L199 HydrophobicContact CB-CD2 4.35Å; L195-L199 HydrophobicContact CD1-CD2 4.3Å; L195-L199 HydrophobicContact CD1-CG 4.43Å; L195-L199 HydrophobicContact CD2-CD2 4.18Å; T196-L199 PolarHBondContact O-N 2.97Å; T196-L199 VanDerWaalsContact O-N 3.09Å; T196-L199 VanDerWaalsContact OG1-CB 3.31Å; T196-L199 WeakPolarHBondContact OG1-CB 3.31Å; T196-L199 PolarHBondContact OG1-N 3.06Å; F197-L199 VanDerWaalsContact C-N 3.32Å; F197-L199 PolarHBondContact O-N 3.34Å; L199-Q201 VanDerWaalsContact C-N 3.26Å; L199-Q201 PolarHBondContact O-N 2.87Å; L199-L202 HydrophobicContact CD1-CD2 4.46Å; L199-L202 PolarHBondContact O-N 2.92Å; L199-L203 HydrophobicContact CD1-CD1 4.04Å; L199-L203 HydrophobicContact CD1-CG 4.02Å; L199-L203 HydrophobicContact CG-CD1 4.01Å; L199-L203 HydrophobicContact CG-CG 4.42Å; L199-L203 WeakPolarHBondContact O-CB 3.43Å; L199-L203 WeakPolarHBondContact O-CG 3.26Å; L199-L203 PolarHBondContact O-N 2.82Å; L199-Y226 HydrophobicContact CB-CD2 3.71Å; L199-Y226 HydrophobicContact CB-CE2 3.65Å; L199-Y226 HydrophobicContact CD1-CD1 4.45Å; L199-Y226 HydrophobicContact CD1-CD2 4.28Å; L199-Y226 HydrophobicContact CD1-CE1 4.08Å; L199-Y226 HydrophobicContact CD1-CE2 3.91Å; L199-Y226 HydrophobicContact CD2-CE2 4.18Å; L199-Y226 HydrophobicContact CG-CE2 4.12Å
200	Q	97.9	Very high	95.4	Very high	31 Å²	31	67.1 Å²	67.1	15%	0.145	32%	0.321	C	S	.	.	H	α-helix	trans	-57.2	-44.7	174.6	-65.2	-174.9	44.4	0	0	110.6	P191 L195 T196 F197 L203 L204	P191-Q200 HydrophobicContact CB-CB 3.97Å; P191-Q200 HydrophobicContact CB-CG 3.92Å; P191-Q200 HydrophobicContact CG-CB 3.78Å; P191-Q200 HydrophobicContact CG-CG 4.06Å; L195-Q200 HydrophobicContact CB-CG 3.82Å; L195-Q200 PolarHBondContact O-NE2 3.25Å; T196-Q200 WeakPolarHBondContact O-CG 3.31Å; T196-Q200 PolarHBondContact O-N 3.26Å; F197-Q200 WeakPolarHBondContact O-CB 3.37Å; F197-Q200 PolarHBondContact O-N 2.89Å; Q200-L203 PolarHBondContact O-N 2.85Å; Q200-L204 WeakPolarHBondContact O-CB 3.38Å; Q200-L204 VanDerWaalsContact O-CG 3.3Å; Q200-L204 WeakPolarHBondContact O-CG 3.2Å; Q200-L204 PolarHBondContact O-N 3.48Å
201	Q	97.8	Very high	95.5	Very high	75 Å²	75	58.4 Å²	58.4	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-43	179.3	-65.6	-67.9	80.9	0	0	112.3	F197 D198 L199 L204 K205	F197-Q201 HydrophobicContact CD1-CG 4.12Å; F197-Q201 HydrophobicContact CD2-CG 4.49Å; F197-Q201 HydrophobicContact CE1-CG 3.76Å; F197-Q201 HydrophobicContact CE2-CG 4.16Å; F197-Q201 HydrophobicContact CG-CG 4.49Å; F197-Q201 HydrophobicContact CZ-CG 3.78Å; F197-Q201 VanDerWaalsContact O-CG 3.27Å; F197-Q201 WeakPolarHBondContact O-CG 3.22Å; F197-Q201 PolarHBondContact O-N 3.4Å; D198-Q201 PolarHBondContact O-N 2.94Å; L199-Q201 VanDerWaalsContact C-N 3.26Å; L199-Q201 PolarHBondContact O-N 2.87Å; Q201-L204 PolarHBondContact O-N 3.46Å; Q201-K205 WeakPolarHBondContact O-CG 3.45Å; Q201-K205 PolarHBondContact O-N 2.9Å; Q201-K205 VanDerWaalsContact O-N 3.14Å
202	L	98.2	Very high	95.5	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.8	-50.2	174.2	175.4	63.9	0	0	0	111.3	L165 D198 L199 L204 K205 L206 L215 Y221 E224 Y226 F227	L165-L202 HydrophobicContact CD1-CD2 4.43Å; D198-L202 PolarHBondContact O-N 2.94Å; L199-L202 HydrophobicContact CD1-CD2 4.46Å; L199-L202 PolarHBondContact O-N 2.92Å; L202-L204 VanDerWaalsContact C-N 3.34Å; L202-L204 PolarHBondContact O-N 2.87Å; L202-K205 WeakPolarHBondContact O-CB 3.42Å; L202-K205 PolarHBondContact O-N 3.24Å; L202-K205 VanDerWaalsContact O-N 3.11Å; L202-L206 HydrophobicContact CD1-CD1 4.02Å; L202-L206 HydrophobicContact CD1-CG 4.26Å; L202-L206 HydrophobicContact CG-CD1 3.99Å; L202-L206 PolarHBondContact O-N 3.42Å; L202-L215 HydrophobicContact CD1-CD2 4.01Å; L202-Y221 HydrophobicContact CD1-CD2 4.09Å; L202-Y221 HydrophobicContact CD1-CE2 3.86Å; L202-E224 HydrophobicContact CD1-CB 4.17Å; L202-E224 HydrophobicContact CD1-CG 3.81Å; L202-Y226 HydrophobicContact CD2-CD1 3.51Å; L202-Y226 HydrophobicContact CD2-CE1 4.17Å; L202-Y226 HydrophobicContact CD2-CG 4.11Å; L202-F227 HydrophobicContact CD1-CE2 4.37Å; L202-F227 HydrophobicContact CD2-CE1 4.43Å; L202-F227 HydrophobicContact CD2-CE2 4.12Å; L202-F227 HydrophobicContact CD2-CZ 3.66Å
203	L	97.9	Very high	95.5	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.3	-39.5	-179.7	-68.4	171.8	0	0	0	111.7	L165 H166 Y189 L195 L199 Q200 K205 L206 L207	L165-L203 HydrophobicContact CB-CD2 3.93Å; H166-L203 HydrophobicContact CB-CD2 4.3Å; Y189-L203 HydrophobicContact CE1-CB 3.68Å; Y189-L203 WeakPolarHBondContact OH-CD1 3.37Å; L195-L203 HydrophobicContact CD1-CD1 3.77Å; L199-L203 HydrophobicContact CD1-CD1 4.04Å; L199-L203 HydrophobicContact CD1-CG 4.02Å; L199-L203 HydrophobicContact CG-CD1 4.01Å; L199-L203 HydrophobicContact CG-CG 4.42Å; L199-L203 WeakPolarHBondContact O-CB 3.43Å; L199-L203 WeakPolarHBondContact O-CG 3.26Å; L199-L203 PolarHBondContact O-N 2.82Å; Q200-L203 PolarHBondContact O-N 2.85Å; L203-K205 PolarHBondContact O-N 3.45Å; L203-L206 PolarHBondContact O-N 3.15Å; L203-L207 VanDerWaalsContact O-CB 3.29Å; L203-L207 WeakPolarHBondContact O-CB 3.31Å; L203-L207 PolarHBondContact O-N 2.95Å
204	L	96.7	Very high	95.5	Very high	48 Å²	48	59.7 Å²	59.7	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-31.1	174.6	-80.7	166.3	0	0	0	113.1	Y189 P191 Q200 Q201 L202 R208	Y189-L204 HydrophobicContact CD1-CD2 4.1Å; P191-L204 HydrophobicContact CG-CD1 4.01Å; P191-L204 HydrophobicContact CG-CD2 4.35Å; P191-L204 HydrophobicContact CG-CG 3.94Å; Q200-L204 WeakPolarHBondContact O-CB 3.38Å; Q200-L204 VanDerWaalsContact O-CG 3.3Å; Q200-L204 WeakPolarHBondContact O-CG 3.2Å; Q200-L204 PolarHBondContact O-N 3.48Å; Q201-L204 PolarHBondContact O-N 3.46Å; L202-L204 VanDerWaalsContact C-N 3.34Å; L202-L204 PolarHBondContact O-N 2.87Å; L204-R208 WeakPolarHBondContact O-CD 3.47Å; L204-R208 VanDerWaalsContact O-CG 3.31Å; L204-R208 WeakPolarHBondContact O-CG 3.31Å; L204-R208 PolarHBondContact O-NE 3.1Å
205	K	97.5	Very high	95.7	Very high	75 Å²	75	52.5 Å²	52.5	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-79.8	-39.1	177.1	-71.4	172.5	179.9	176.3	0	112.6	Q201 L202 L203 L215 E224	Q201-K205 WeakPolarHBondContact O-CG 3.45Å; Q201-K205 PolarHBondContact O-N 2.9Å; Q201-K205 VanDerWaalsContact O-N 3.14Å; L202-K205 WeakPolarHBondContact O-CB 3.42Å; L202-K205 PolarHBondContact O-N 3.24Å; L202-K205 VanDerWaalsContact O-N 3.11Å; L203-K205 PolarHBondContact O-N 3.45Å; K205-L215 HydrophobicContact CB-CB 3.9Å; K205-L215 HydrophobicContact CB-CD2 4.16Å; K205-L215 PolarHBondContact O-N 2.78Å; K205-E224 WeakPolarHBondContact CD-OE1 3.03Å; K205-E224 WeakPolarHBondContact CD-OE2 3.36Å; K205-E224 WeakPolarHBondContact CE-OE1 3.17Å; K205-E224 IonicContact NZ-OE1 3.46Å; K205-E224 PolarHBondContact NZ-OE1 3.11Å; K205-E224 IonicContact NZ-OE2 3.51Å; K205-E224 PolarHBondContact NZ-OE2 3.34Å
206	L	97.7	Very high	95.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-72.4	-38.9	176.8	-68.4	170.8	0	0	0	112.4	W158 L165 L202 L203 R208 R214 L215 Y221	W158-L206 HydrophobicContact CE3-CD2 3.89Å; L165-L206 HydrophobicContact CD1-CD1 4.11Å; L202-L206 HydrophobicContact CD1-CD1 4.02Å; L202-L206 HydrophobicContact CD1-CG 4.26Å; L202-L206 HydrophobicContact CG-CD1 3.99Å; L202-L206 PolarHBondContact O-N 3.42Å; L203-L206 PolarHBondContact O-N 3.15Å; L206-R208 VanDerWaalsContact C-N 3.28Å; L206-R208 PolarHBondContact O-N 2.99Å; L206-R214 WeakPolarHBondContact O-CD 3.33Å; L206-R214 WeakPolarHBondContact O-CG 3.32Å; L206-L215 HydrophobicContact CD2-CB 4.35Å; L206-L215 HydrophobicContact CD2-CD2 4.24Å; L206-L215 HydrophobicContact CD2-CG 4.41Å; L206-Y221 HydrophobicContact CD1-CE2 4.18Å; L206-Y221 HydrophobicContact CD2-CD2 4.2Å; L206-Y221 HydrophobicContact CD2-CE2 4.13Å
207	L	96	Very high	95.4	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	31.9	-176.8	-62.2	176.5	0	0	0	112.9	W159 V163 P174 F175 Y189 L203	W159-L207 HydrophobicContact CD2-CD2 4.06Å; W159-L207 HydrophobicContact CE3-CD2 4.23Å; W159-L207 HydrophobicContact CZ2-CD2 4.46Å; V163-L207 HydrophobicContact CG2-CD2 3.83Å; P174-L207 HydrophobicContact CB-CD1 4.35Å; P174-L207 HydrophobicContact CG-CD1 4.41Å; F175-L207 HydrophobicContact CE2-CD2 4.21Å; F175-L207 HydrophobicContact CZ-CD1 4.49Å; Y189-L207 HydrophobicContact CD1-CB 3.86Å; Y189-L207 HydrophobicContact CD1-CD1 3.87Å; Y189-L207 HydrophobicContact CD1-CG 4.47Å; Y189-L207 HydrophobicContact CD2-CD1 3.61Å; Y189-L207 HydrophobicContact CE1-CB 4.46Å; Y189-L207 HydrophobicContact CE1-CD1 3.8Å; Y189-L207 HydrophobicContact CE2-CD1 3.54Å; Y189-L207 HydrophobicContact CG-CB 3.9Å; Y189-L207 HydrophobicContact CG-CD1 3.78Å; L203-L207 VanDerWaalsContact O-CB 3.29Å; L203-L207 WeakPolarHBondContact O-CB 3.31Å; L203-L207 PolarHBondContact O-N 2.95Å
208	R	93.5	Very high	95.1	Very high	132 Å²	132	46.6 Å²	46.6	50%	0.498	24%	0.235	S	C	.	.			trans	-71.4	128.1	169.2	-72	-63.7	-171	166.4	0.1	110.5	L204 L206 R214	L204-R208 WeakPolarHBondContact O-CD 3.47Å; L204-R208 VanDerWaalsContact O-CG 3.31Å; L204-R208 WeakPolarHBondContact O-CG 3.31Å; L204-R208 PolarHBondContact O-NE 3.1Å; L206-R208 VanDerWaalsContact C-N 3.28Å; L206-R208 PolarHBondContact O-N 2.99Å; R208-R214 HydrophobicContact CB-CB 4.11Å; R208-R214 HydrophobicContact CB-CG 4.41Å; R208-R214 PolarHBondContact O-NE 3.22Å; R208-R214 PolarHBondContact O-NH2 3.21Å
209	F	90.8	Very high	94.8	Very high	64 Å²	64	50.2 Å²	50.2	28%	0.281	25%	0.248	S	C	.	.	S	Bend	trans	-61.8	-47.6	177.3	-87	-84.2	0	0	0	113.1	P144 W159 F175 F186 P211 R214	P144-F209 HydrophobicContact CB-CD1 4.17Å; P144-F209 HydrophobicContact CB-CE1 4.12Å; P144-F209 HydrophobicContact CG-CD1 3.77Å; P144-F209 HydrophobicContact CG-CE1 3.91Å; W159-F209 HydrophobicContact CH2-CD1 4.35Å; W159-F209 HydrophobicContact CH2-CD2 4.49Å; W159-F209 AromaticContact CH2-CE1 3.77Å; W159-F209 HydrophobicContact CH2-CE1 3.77Å; W159-F209 AromaticContact CH2-CE2 3.98Å; W159-F209 HydrophobicContact CH2-CE2 3.98Å; W159-F209 AromaticContact CH2-CZ 3.52Å; W159-F209 HydrophobicContact CH2-CZ 3.52Å; W159-F209 HydrophobicContact CZ2-CZ 4.42Å; W159-F209 HydrophobicContact CZ3-CE1 4.46Å; W159-F209 HydrophobicContact CZ3-CE2 4.47Å; W159-F209 HydrophobicContact CZ3-CZ 4.34Å; F175-F209 HydrophobicContact CE1-CE2 4.31Å; F175-F209 HydrophobicContact CE1-CZ 4.1Å; F175-F209 HydrophobicContact CZ-CE2 4.42Å; F175-F209 HydrophobicContact CZ-CZ 4.23Å; F186-F209 HydrophobicContact CB-CD1 4.2Å; F186-F209 HydrophobicContact CB-CE1 3.11Å; F186-F209 HydrophobicContact CB-CE2 4.16Å; F186-F209 HydrophobicContact CB-CZ 3.11Å; F186-F209 HydrophobicContact CD1-CE1 4.1Å; F186-F209 AromaticContact CD1-CZ 3.77Å; F186-F209 HydrophobicContact CD1-CZ 3.77Å; F186-F209 AromaticContact CD2-CE1 3.46Å; F186-F209 HydrophobicContact CD2-CE1 3.46Å; F186-F209 VanDerWaalsContact CD2-CE1 3.46Å; F186-F209 HydrophobicContact CD2-CZ 4.01Å; F186-F209 HydrophobicContact CE2-CE1 4.29Å; F186-F209 AromaticContact CG-CE1 3.34Å; F186-F209 HydrophobicContact CG-CE1 3.34Å; F186-F209 AromaticContact CG-CZ 3.42Å; F186-F209 HydrophobicContact CG-CZ 3.42Å; F186-F209 VanDerWaalsContact CG-CZ 3.42Å; F209-P211 VanDerWaalsContact O-CD 3.22Å; F209-P211 WeakPolarHBondContact O-CD 3.49Å; F209-R214 PolarHBondContact O-NH2 3.1Å
210	N	90.6	Very high	94.7	Very high	78 Å²	78	55.2 Å²	55.2	42%	0.417	27%	0.271	S	S	.	.	S	Bend	trans	-72.9	114.2	174	-177.3	-3.3	0	0	0	108.9	L212 C213 R214	N210-L212 PolarHBondContact O-N 3.02Å; N210-L212 VanDerWaalsContact O-N 3.14Å; N210-L212 WeakPolarHBondContact OD1-CB 3.42Å; N210-L212 PolarHBondContact OD1-N 2.79Å; N210-C213 HydrophobicContact CB-CB 4.32Å; N210-C213 PolarHBondContact ND2-SG 3.44Å; N210-C213 PolarHBondContact O-N 3.24Å; N210-R214 PolarHBondContact O-N 2.64Å
211	P	92.8	Very high	94.6	Very high	26 Å²	26	53.7 Å²	53.7	17%	0.169	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-61.2	-23.4	180	24.8	-34.3	0	0	0	113.1	E145 F209 C213 R214	E145-P211 HydrophobicContact CG-CG 4.47Å; F209-P211 VanDerWaalsContact O-CD 3.22Å; F209-P211 WeakPolarHBondContact O-CD 3.49Å; P211-C213 VanDerWaalsContact C-N 3.3Å; P211-R214 WeakPolarHBondContact O-CB 3.49Å; P211-R214 PolarHBondContact O-N 3.08Å
212	L	91.9	Very high	94.4	Very high	159 Å²	159	52.8 Å²	52.8	83%	0.832	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-73.5	-22.1	176.8	-59.1	177.4	0	0	0	113.3	N210	N210-L212 PolarHBondContact O-N 3.02Å; N210-L212 VanDerWaalsContact O-N 3.14Å; N210-L212 WeakPolarHBondContact OD1-CB 3.42Å; N210-L212 PolarHBondContact OD1-N 2.79Å
213	C	94.1	Very high	94.3	Very high	80 Å²	80	57.6 Å²	57.6	54%	0.541	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-99.6	0.6	176.7	-57.5	0	0	0	0	112.1	N210 P211	N210-C213 HydrophobicContact CB-CB 4.32Å; N210-C213 PolarHBondContact ND2-SG 3.44Å; N210-C213 PolarHBondContact O-N 3.24Å; P211-C213 VanDerWaalsContact C-N 3.3Å
214	R	95.6	Very high	94.3	Very high	9 Å²	9	58.3 Å²	58.3	3%	0.034	29%	0.289	C	S	.	.	S	Bend	trans	-82	140.5	-176.2	-167.3	179.1	-59.6	144.3	4.3	110.4	E145 S155 L206 R208 F209 N210 P211 T216	E145-R214 IonicContact OE1-CZ 3.67Å; E145-R214 IonicContact OE1-NH1 3.52Å; E145-R214 PolarHBondContact OE1-NH1 3.14Å; E145-R214 IonicContact OE1-NH2 2.67Å; E145-R214 PolarHBondContact OE1-NH2 3.22Å; E145-R214 IonicContact OE2-CZ 2.78Å; E145-R214 IonicContact OE2-NH1 3.68Å; E145-R214 IonicContact OE2-NH2 2.88Å; E145-R214 PolarHBondContact OE2-NH2 2.78Å; S155-R214 PolarHBondContact O-NH1 3.06Å; L206-R214 WeakPolarHBondContact O-CD 3.33Å; L206-R214 WeakPolarHBondContact O-CG 3.32Å; R208-R214 HydrophobicContact CB-CB 4.11Å; R208-R214 HydrophobicContact CB-CG 4.41Å; R208-R214 PolarHBondContact O-NE 3.22Å; R208-R214 PolarHBondContact O-NH2 3.21Å; F209-R214 PolarHBondContact O-NH2 3.1Å; N210-R214 PolarHBondContact O-N 2.64Å; P211-R214 WeakPolarHBondContact O-CB 3.49Å; P211-R214 PolarHBondContact O-N 3.08Å; R214-T216 HydrophobicContact CB-CG2 4.2Å; R214-T216 HydrophobicContact CG-CG2 4.32Å; R214-T216 PolarHBondContact O-N 3.43Å; R214-T216 VanDerWaalsContact O-N 3.11Å; R214-T216 PolarHBondContact O-OG1 3.31Å
215	L	96.3	Very high	94.4	Very high	8 Å²	8	59.1 Å²	59.1	4%	0.042	30%	0.297	C	S	.	.			trans	-63.4	112.9	169.1	178.2	62.1	0	0	0	109.3	W158 L202 K205 L206 Q220 Y221 E224	W158-L215 WeakPolarHBondContact CB-O 3.48Å; L202-L215 HydrophobicContact CD1-CD2 4.01Å; K205-L215 HydrophobicContact CB-CB 3.9Å; K205-L215 HydrophobicContact CB-CD2 4.16Å; K205-L215 PolarHBondContact O-N 2.78Å; L206-L215 HydrophobicContact CD2-CB 4.35Å; L206-L215 HydrophobicContact CD2-CD2 4.24Å; L206-L215 HydrophobicContact CD2-CG 4.41Å; L215-Q220 HydrophobicContact CD1-CB 3.54Å; L215-Y221 HydrophobicContact CD2-CD2 3.79Å; L215-Y221 HydrophobicContact CG-CD2 4.38Å; L215-E224 HydrophobicContact CD2-CG 3.97Å
216	T	93.7	Very high	94.4	Very high	48 Å²	48	56.1 Å²	56.1	29%	0.294	28%	0.284	S	S	.	.			trans	-137.4	-10.6	-177.3	54.2	0	0	0	0	112.8	W158 R214	W158-T216 HydrophobicContact CB-CG2 4.15Å; W158-T216 VanDerWaalsContact CE2-O 3.24Å; W158-T216 HydrophobicContact CG-CG2 4.05Å; W158-T216 WeakPolarHBondContact CZ2-O 3.33Å; W158-T216 PolarHBondContact NE1-O 2.93Å; W158-T216 VanDerWaalsContact NE1-O 3.08Å; R214-T216 HydrophobicContact CB-CG2 4.2Å; R214-T216 HydrophobicContact CG-CG2 4.32Å; R214-T216 PolarHBondContact O-N 3.43Å; R214-T216 VanDerWaalsContact O-N 3.11Å; R214-T216 PolarHBondContact O-OG1 3.31Å
217	D	91.3	Very high	94.4	Very high	52 Å²	52	56.4 Å²	56.4	28%	0.278	29%	0.285	S	S	.	.			trans	-86.9	123.1	176.1	-178.1	-93.2	0	0	0	109.4	F219 Q220 Y221	D217-F219 VanDerWaalsContact C-N 3.31Å; D217-F219 PolarHBondContact O-N 3.47Å; D217-F219 WeakPolarHBondContact OD1-CA 3.48Å; D217-F219 WeakPolarHBondContact OD1-CB 3.35Å; D217-F219 PolarHBondContact OD1-N 2.72Å; D217-F219 VanDerWaalsContact OD1-N 3.07Å; D217-Q220 HydrophobicContact CB-CB 4.14Å; D217-Q220 HydrophobicContact CB-CG 4.06Å; D217-Q220 PolarHBondContact O-N 2.97Å; D217-Q220 PolarHBondContact OD1-N 3.5Å; D217-Y221 PolarHBondContact O-N 3.12Å
218	F	91.2	Very high	94.4	Very high	16 Å²	16	61.1 Å²	61.1	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-34.9	-176.4	175.7	-114.4	0	0	0	112.5	G56 Y69 W158 Y221 Q222 F232	G56-F218 WeakPolarHBondContact O-CD2 3.38Å; Y69-F218 AromaticContact CE2-CE1 3.95Å; Y69-F218 HydrophobicContact CE2-CE1 3.95Å; Y69-F218 AromaticContact CZ-CE1 3.98Å; W158-F218 HydrophobicContact CH2-CB 4.31Å; W158-F218 HydrophobicContact CH2-CD2 4.2Å; W158-F218 HydrophobicContact CZ2-CB 4.35Å; F218-Y221 HydrophobicContact CD2-CD1 4.38Å; F218-Y221 HydrophobicContact CE2-CD1 4.44Å; F218-Y221 WeakPolarHBondContact O-CB 3.49Å; F218-Y221 PolarHBondContact O-N 3.47Å; F218-Q222 WeakPolarHBondContact O-CB 3.31Å; F218-Q222 PolarHBondContact O-N 3.2Å; F218-F232 HydrophobicContact CE2-CD1 4.29Å; F218-F232 AromaticContact CE2-CE1 3.89Å; F218-F232 HydrophobicContact CE2-CE1 3.89Å; F218-F232 AromaticContact CZ-CD1 3.97Å; F218-F232 HydrophobicContact CZ-CD1 3.97Å; F218-F232 HydrophobicContact CZ-CE1 4.03Å
219	F	91.7	Very high	94.4	Very high	139 Å²	139	59.8 Å²	59.8	61%	0.61	32%	0.321	S	S	*	.	H	α-helix	trans	-66.8	-42.5	177.8	-177.5	-95.5	0	0	0	110.7	D217 Y221 Q222 N223	D217-F219 VanDerWaalsContact C-N 3.31Å; D217-F219 PolarHBondContact O-N 3.47Å; D217-F219 WeakPolarHBondContact OD1-CA 3.48Å; D217-F219 WeakPolarHBondContact OD1-CB 3.35Å; D217-F219 PolarHBondContact OD1-N 2.72Å; D217-F219 VanDerWaalsContact OD1-N 3.07Å; F219-Y221 VanDerWaalsContact C-N 3.33Å; F219-Y221 PolarHBondContact O-N 2.94Å; F219-Q222 PolarHBondContact O-N 3.19Å; F219-N223 WeakPolarHBondContact CD1-ND2 3.5Å; F219-N223 WeakPolarHBondContact CE1-ND2 3.49Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.47Å; F219-N223 PolarHBondContact O-N 2.94Å; F219-N223 PolarHBondContact O-ND2 3.49Å
220	Q	94.9	Very high	94.6	Very high	115 Å²	115	57.5 Å²	57.5	54%	0.537	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-43.1	171.6	-68.5	-178.3	-1.3	0	0	111.6	L215 D217 Q222 N223 E224	L215-Q220 HydrophobicContact CD1-CB 3.54Å; D217-Q220 HydrophobicContact CB-CB 4.14Å; D217-Q220 HydrophobicContact CB-CG 4.06Å; D217-Q220 PolarHBondContact O-N 2.97Å; D217-Q220 PolarHBondContact OD1-N 3.5Å; Q220-Q222 PolarHBondContact O-N 3.39Å; Q220-N223 PolarHBondContact O-N 3.09Å; Q220-E224 PolarHBondContact O-N 3.43Å
221	Y	95.9	Very high	94.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-45.5	178.6	-179.8	-92.5	0	0	0	112.4	A52 W158 L161 L202 L206 L215 D217 F218 F219 N223 E224 F227 F232	A52-Y221 PolarHBondContact O-OH 3.36Å; W158-Y221 HydrophobicContact CE3-CD2 4.17Å; W158-Y221 HydrophobicContact CH2-CD1 4.43Å; W158-Y221 HydrophobicContact CH2-CD2 4.38Å; W158-Y221 HydrophobicContact CH2-CG 4.03Å; W158-Y221 HydrophobicContact CZ3-CD1 4.14Å; W158-Y221 AromaticContact CZ3-CD2 3.46Å; W158-Y221 HydrophobicContact CZ3-CD2 3.46Å; W158-Y221 VanDerWaalsContact CZ3-CD2 3.46Å; W158-Y221 AromaticContact CZ3-CE2 3.94Å; W158-Y221 HydrophobicContact CZ3-CE2 3.94Å; W158-Y221 AromaticContact CZ3-CG 3.56Å; W158-Y221 HydrophobicContact CZ3-CG 3.56Å; L161-Y221 HydrophobicContact CD2-CE2 3.97Å; L202-Y221 HydrophobicContact CD1-CD2 4.09Å; L202-Y221 HydrophobicContact CD1-CE2 3.86Å; L206-Y221 HydrophobicContact CD1-CE2 4.18Å; L206-Y221 HydrophobicContact CD2-CD2 4.2Å; L206-Y221 HydrophobicContact CD2-CE2 4.13Å; L215-Y221 HydrophobicContact CD2-CD2 3.79Å; L215-Y221 HydrophobicContact CG-CD2 4.38Å; D217-Y221 PolarHBondContact O-N 3.12Å; F218-Y221 HydrophobicContact CD2-CD1 4.38Å; F218-Y221 HydrophobicContact CE2-CD1 4.44Å; F218-Y221 WeakPolarHBondContact O-CB 3.49Å; F218-Y221 PolarHBondContact O-N 3.47Å; F219-Y221 VanDerWaalsContact C-N 3.33Å; F219-Y221 PolarHBondContact O-N 2.94Å; Y221-N223 PolarHBondContact O-N 3.35Å; Y221-E224 WeakPolarHBondContact O-CB 3.43Å; Y221-E224 WeakPolarHBondContact O-CG 3.32Å; Y221-E224 PolarHBondContact O-N 2.96Å; Y221-E224 VanDerWaalsContact O-N 3.15Å; Y221-F227 AromaticContact CD1-CE2 3.99Å; Y221-F227 HydrophobicContact CD1-CE2 3.99Å; Y221-F227 HydrophobicContact CD1-CZ 4.5Å; Y221-F227 HydrophobicContact CD2-CE2 4.46Å; Y221-F227 AromaticContact CE1-CE2 3.59Å; Y221-F227 HydrophobicContact CE1-CE2 3.59Å; Y221-F227 AromaticContact CE1-CZ 3.65Å; Y221-F227 HydrophobicContact CE1-CZ 3.65Å; Y221-F227 HydrophobicContact CE2-CE2 4.13Å; Y221-F227 HydrophobicContact CE2-CZ 4.15Å; Y221-F227 HydrophobicContact CG-CE2 4.41Å; Y221-F227 AromaticContact CZ-CE2 3.68Å; Y221-F227 AromaticContact CZ-CZ 3.46Å; Y221-F227 VanDerWaalsContact CZ-CZ 3.46Å; Y221-F227 VanDerWaalsContact O-CD2 3.31Å; Y221-F227 WeakPolarHBondContact O-CD2 3.23Å; Y221-F227 VanDerWaalsContact O-CE2 3.31Å; Y221-F227 WeakPolarHBondContact O-CE2 3.47Å; Y221-F227 WeakPolarHBondContact OH-CZ 3.5Å; Y221-F232 HydrophobicContact CD1-CZ 4.44Å; Y221-F232 HydrophobicContact CE1-CZ 4.39Å
222	Q	94.3	Very high	94.7	Very high	56 Å²	56	55.8 Å²	55.8	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-27.6	179	-175.5	174.6	6.8	0	0	112.7	F218 F219 Q220 F232	F218-Q222 WeakPolarHBondContact O-CB 3.31Å; F218-Q222 PolarHBondContact O-N 3.2Å; F219-Q222 PolarHBondContact O-N 3.19Å; Q220-Q222 PolarHBondContact O-N 3.39Å; Q222-F232 HydrophobicContact CB-CD1 4.48Å; Q222-F232 HydrophobicContact CB-CE1 4.06Å; Q222-F232 HydrophobicContact CB-CE2 4.49Å; Q222-F232 HydrophobicContact CB-CZ 4.08Å; Q222-F232 HydrophobicContact CG-CD1 3.85Å; Q222-F232 HydrophobicContact CG-CD2 3.9Å; Q222-F232 HydrophobicContact CG-CE1 3.85Å; Q222-F232 HydrophobicContact CG-CE2 3.86Å; Q222-F232 HydrophobicContact CG-CG 3.9Å; Q222-F232 HydrophobicContact CG-CZ 3.87Å
223	N	96.1	Very high	94.7	Very high	100 Å²	100	55.4 Å²	55.4	54%	0.535	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.9	179.3	-72.2	-61.7	0	0	0	113.8	F219 Q220 Y221	F219-N223 WeakPolarHBondContact CD1-ND2 3.5Å; F219-N223 WeakPolarHBondContact CE1-ND2 3.49Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.47Å; F219-N223 PolarHBondContact O-N 2.94Å; F219-N223 PolarHBondContact O-ND2 3.49Å; Q220-N223 PolarHBondContact O-N 3.09Å; Y221-N223 PolarHBondContact O-N 3.35Å
224	E	98.2	Very high	94.6	Very high	15 Å²	15	52.4 Å²	52.4	7%	0.07	28%	0.281	C	S	.	.			trans	-66.8	136.4	176.7	-72	-68.4	144.8	0	0	111.4	L202 K205 L215 Q220 Y221 Y226 F227	L202-E224 HydrophobicContact CD1-CB 4.17Å; L202-E224 HydrophobicContact CD1-CG 3.81Å; K205-E224 WeakPolarHBondContact CD-OE1 3.03Å; K205-E224 WeakPolarHBondContact CD-OE2 3.36Å; K205-E224 WeakPolarHBondContact CE-OE1 3.17Å; K205-E224 IonicContact NZ-OE1 3.46Å; K205-E224 PolarHBondContact NZ-OE1 3.11Å; K205-E224 IonicContact NZ-OE2 3.51Å; K205-E224 PolarHBondContact NZ-OE2 3.34Å; L215-E224 HydrophobicContact CD2-CG 3.97Å; Q220-E224 PolarHBondContact O-N 3.43Å; Y221-E224 WeakPolarHBondContact O-CB 3.43Å; Y221-E224 WeakPolarHBondContact O-CG 3.32Å; Y221-E224 PolarHBondContact O-N 2.96Å; Y221-E224 VanDerWaalsContact O-N 3.15Å; E224-Y226 PolarHBondContact O-N 3.25Å; E224-F227 HydrophobicContact CB-CD2 3.92Å; E224-F227 HydrophobicContact CB-CE2 4.05Å; E224-F227 PolarHBondContact O-N 3.33Å
225	P	97.9	Very high	94.4	Very high	65 Å²	65	52 Å²	52	42%	0.422	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-55	-28.5	-177	-28.8	35.7	0	0	0	114.6	D198 F227 S228	D198-P225 HydrophobicContact CB-CB 4.33Å; P225-F227 PolarHBondContact O-N 2.88Å; P225-F227 VanDerWaalsContact O-N 3.1Å; P225-S228 WeakPolarHBondContact O-CB 3.33Å; P225-S228 PolarHBondContact O-N 3.14Å; P225-S228 PolarHBondContact O-OG 3.45Å
226	Y	98	Very high	93.9	Very high	12 Å²	12	52 Å²	52	5%	0.047	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-56	-27.9	177	-178.1	-113.6	0	0	0	112.9	K49 D198 L199 L202 E224	K49-Y226 HydrophobicContact CB-CE1 4.08Å; K49-Y226 HydrophobicContact CD-CE1 4.49Å; K49-Y226 WeakPolarHBondContact CD-O 3.43Å; K49-Y226 WeakPolarHBondContact CE-O 3.35Å; K49-Y226 HydrophobicContact CG-CD1 4.31Å; K49-Y226 HydrophobicContact CG-CE1 3.73Å; K49-Y226 PolarHBondContact NZ-O 3.48Å; K49-Y226 VanDerWaalsContact NZ-O 3.17Å; D198-Y226 HydrophobicContact CB-CD2 4.32Å; L199-Y226 HydrophobicContact CB-CD2 3.71Å; L199-Y226 HydrophobicContact CB-CE2 3.65Å; L199-Y226 HydrophobicContact CD1-CD1 4.45Å; L199-Y226 HydrophobicContact CD1-CD2 4.28Å; L199-Y226 HydrophobicContact CD1-CE1 4.08Å; L199-Y226 HydrophobicContact CD1-CE2 3.91Å; L199-Y226 HydrophobicContact CD2-CE2 4.18Å; L199-Y226 HydrophobicContact CG-CE2 4.12Å; L202-Y226 HydrophobicContact CD2-CD1 3.51Å; L202-Y226 HydrophobicContact CD2-CE1 4.17Å; L202-Y226 HydrophobicContact CD2-CG 4.11Å; E224-Y226 PolarHBondContact O-N 3.25Å
227	F	97.7	Very high	93.5	Very high	6 Å²	6	53.2 Å²	53.2	3%	0.026	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-99.2	5.5	179.3	-51	-58.8	0	0	0	114.6	K49 A52 V53 L202 Y221 E224 P225 N229 V230 F232	K49-F227 HydrophobicContact CG-CD1 4.15Å; K49-F227 HydrophobicContact CG-CE1 4.47Å; A52-F227 HydrophobicContact CB-CE1 3.9Å; A52-F227 HydrophobicContact CB-CZ 4.24Å; V53-F227 HydrophobicContact CG2-CD1 3.51Å; V53-F227 HydrophobicContact CG2-CE1 3.81Å; V53-F227 HydrophobicContact CG2-CG 4.22Å; L202-F227 HydrophobicContact CD1-CE2 4.37Å; L202-F227 HydrophobicContact CD2-CE1 4.43Å; L202-F227 HydrophobicContact CD2-CE2 4.12Å; L202-F227 HydrophobicContact CD2-CZ 3.66Å; Y221-F227 AromaticContact CD1-CE2 3.99Å; Y221-F227 HydrophobicContact CD1-CE2 3.99Å; Y221-F227 HydrophobicContact CD1-CZ 4.5Å; Y221-F227 HydrophobicContact CD2-CE2 4.46Å; Y221-F227 AromaticContact CE1-CE2 3.59Å; Y221-F227 HydrophobicContact CE1-CE2 3.59Å; Y221-F227 AromaticContact CE1-CZ 3.65Å; Y221-F227 HydrophobicContact CE1-CZ 3.65Å; Y221-F227 HydrophobicContact CE2-CE2 4.13Å; Y221-F227 HydrophobicContact CE2-CZ 4.15Å; Y221-F227 HydrophobicContact CG-CE2 4.41Å; Y221-F227 AromaticContact CZ-CE2 3.68Å; Y221-F227 AromaticContact CZ-CZ 3.46Å; Y221-F227 VanDerWaalsContact CZ-CZ 3.46Å; Y221-F227 VanDerWaalsContact O-CD2 3.31Å; Y221-F227 WeakPolarHBondContact O-CD2 3.23Å; Y221-F227 VanDerWaalsContact O-CE2 3.31Å; Y221-F227 WeakPolarHBondContact O-CE2 3.47Å; Y221-F227 WeakPolarHBondContact OH-CZ 3.5Å; E224-F227 HydrophobicContact CB-CD2 3.92Å; E224-F227 HydrophobicContact CB-CE2 4.05Å; E224-F227 PolarHBondContact O-N 3.33Å; P225-F227 PolarHBondContact O-N 2.88Å; P225-F227 VanDerWaalsContact O-N 3.1Å; F227-N229 PolarHBondContact O-N 3.24Å; F227-V230 PolarHBondContact O-N 2.79Å; F227-F232 HydrophobicContact CB-CE2 3.75Å; F227-F232 HydrophobicContact CB-CZ 4.42Å; F227-F232 HydrophobicContact CD1-CE2 4.43Å; F227-F232 HydrophobicContact CD2-CE2 4.14Å; F227-F232 AromaticContact CD2-CZ 3.96Å; F227-F232 HydrophobicContact CD2-CZ 3.96Å; F227-F232 HydrophobicContact CE2-CZ 4.37Å; F227-F232 AromaticContact CG-CE2 3.87Å; F227-F232 HydrophobicContact CG-CE2 3.87Å; F227-F232 HydrophobicContact CG-CZ 4.06Å
228	S	95.6	Very high	93.3	Very high	103 Å²	103	51 Å²	51	72%	0.72	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-26.5	-173.5	54.2	0	0	0	0	114.9	P225	P225-S228 WeakPolarHBondContact O-CB 3.33Å; P225-S228 PolarHBondContact O-N 3.14Å; P225-S228 PolarHBondContact O-OG 3.45Å
229	N	94.2	Very high	93.3	Very high	105 Å²	105	55.2 Å²	55.2	56%	0.561	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	14.4	-179.1	73.5	-43.6	0	0	0	114.3	K49 F227	K49-N229 PolarHBondContact NZ-OD1 3.18Å; F227-N229 PolarHBondContact O-N 3.24Å
230	V	94.8	Very high	93.4	Very high	16 Å²	16	51.2 Å²	51.2	10%	0.097	29%	0.288	C	S	.	.			trans	-127.5	130.2	-175.6	-176	0	0	0	0	111.3	K49 Y50 V53 F227 F232 L235	K49-V230 HydrophobicContact CD-CG2 3.46Å; K49-V230 VanDerWaalsContact CD-CG2 3.46Å; K49-V230 HydrophobicContact CG-CG2 4.07Å; Y50-V230 HydrophobicContact CD1-CG1 3.86Å; Y50-V230 HydrophobicContact CD1-CG2 4.19Å; Y50-V230 HydrophobicContact CE1-CB 4.43Å; Y50-V230 HydrophobicContact CE1-CG1 3.76Å; Y50-V230 HydrophobicContact CE1-CG2 3.78Å; V53-V230 HydrophobicContact CG2-CG1 4.12Å; F227-V230 PolarHBondContact O-N 2.79Å; V230-F232 PolarHBondContact O-N 3.2Å; V230-L235 HydrophobicContact CG1-CD1 3.4Å; V230-L235 HydrophobicContact CG1-CG 4.3Å
231	S	94.1	Very high	93.2	Very high	58 Å²	58	45.9 Å²	45.9	41%	0.406	26%	0.264	S	S	.	.			trans	-85.8	110.1	172.6	174.6	0	0	0	0	110.8	Q233 A234 L235	S231-Q233 VanDerWaalsContact C-N 3.27Å; S231-Q233 PolarHBondContact O-N 3.21Å; S231-A234 PolarHBondContact O-N 3.18Å; S231-A234 WeakPolarHBondContact OG-CB 3.32Å; S231-A234 PolarHBondContact OG-N 2.93Å; S231-A234 VanDerWaalsContact OG-N 3.1Å; S231-L235 PolarHBondContact O-N 3.07Å; S231-L235 VanDerWaalsContact O-N 3.08Å
232	F	92.3	Very high	93.1	Very high	10 Å²	10	45.9 Å²	45.9	4%	0.044	26%	0.264	C	S	.	.	H	α-helix	trans	-54.8	-45.6	172.2	-84.3	-120	0	0	0	110.9	V53 S57 F218 Y221 Q222 F227 V230 A234 L235 L236	V53-F232 HydrophobicContact CB-CE1 4.3Å; V53-F232 HydrophobicContact CB-CE2 4.38Å; V53-F232 HydrophobicContact CB-CZ 4.19Å; V53-F232 HydrophobicContact CG1-CB 4.21Å; V53-F232 HydrophobicContact CG1-CD1 3.54Å; V53-F232 HydrophobicContact CG1-CD2 3.83Å; V53-F232 HydrophobicContact CG1-CE1 3.72Å; V53-F232 HydrophobicContact CG1-CE2 4.02Å; V53-F232 HydrophobicContact CG1-CG 3.58Å; V53-F232 HydrophobicContact CG1-CZ 3.95Å; V53-F232 HydrophobicContact CG2-CD2 4.13Å; V53-F232 HydrophobicContact CG2-CE1 4.36Å; V53-F232 HydrophobicContact CG2-CE2 3.65Å; V53-F232 HydrophobicContact CG2-CZ 3.76Å; S57-F232 WeakPolarHBondContact OG-CD1 3.38Å; F218-F232 HydrophobicContact CE2-CD1 4.29Å; F218-F232 AromaticContact CE2-CE1 3.89Å; F218-F232 HydrophobicContact CE2-CE1 3.89Å; F218-F232 AromaticContact CZ-CD1 3.97Å; F218-F232 HydrophobicContact CZ-CD1 3.97Å; F218-F232 HydrophobicContact CZ-CE1 4.03Å; Y221-F232 HydrophobicContact CD1-CZ 4.44Å; Y221-F232 HydrophobicContact CE1-CZ 4.39Å; Q222-F232 HydrophobicContact CB-CD1 4.48Å; Q222-F232 HydrophobicContact CB-CE1 4.06Å; Q222-F232 HydrophobicContact CB-CE2 4.49Å; Q222-F232 HydrophobicContact CB-CZ 4.08Å; Q222-F232 HydrophobicContact CG-CD1 3.85Å; Q222-F232 HydrophobicContact CG-CD2 3.9Å; Q222-F232 HydrophobicContact CG-CE1 3.85Å; Q222-F232 HydrophobicContact CG-CE2 3.86Å; Q222-F232 HydrophobicContact CG-CG 3.9Å; Q222-F232 HydrophobicContact CG-CZ 3.87Å; F227-F232 HydrophobicContact CB-CE2 3.75Å; F227-F232 HydrophobicContact CB-CZ 4.42Å; F227-F232 HydrophobicContact CD1-CE2 4.43Å; F227-F232 HydrophobicContact CD2-CE2 4.14Å; F227-F232 AromaticContact CD2-CZ 3.96Å; F227-F232 HydrophobicContact CD2-CZ 3.96Å; F227-F232 HydrophobicContact CE2-CZ 4.37Å; F227-F232 AromaticContact CG-CE2 3.87Å; F227-F232 HydrophobicContact CG-CE2 3.87Å; F227-F232 HydrophobicContact CG-CZ 4.06Å; V230-F232 PolarHBondContact O-N 3.2Å; F232-A234 VanDerWaalsContact C-N 3.34Å; F232-A234 PolarHBondContact O-N 3.23Å; F232-L235 PolarHBondContact O-N 3.41Å; F232-L236 WeakPolarHBondContact O-CB 3.47Å; F232-L236 WeakPolarHBondContact O-CG 3.49Å; F232-L236 PolarHBondContact O-N 2.87Å
233	Q	90	Very high	92.9	Very high	150 Å²	150	44 Å²	44	70%	0.701	26%	0.258	S	S	*	.	H	α-helix	trans	-62	-41.9	179.5	-175.6	-178.7	-5.4	0	0	111.9	S231 L235 L236 T237	S231-Q233 VanDerWaalsContact C-N 3.27Å; S231-Q233 PolarHBondContact O-N 3.21Å; Q233-L235 VanDerWaalsContact C-N 3.34Å; Q233-L235 PolarHBondContact O-N 3.27Å; Q233-L236 PolarHBondContact O-N 2.97Å; Q233-T237 HydrophobicContact CG-CG2 4.32Å; Q233-T237 WeakPolarHBondContact O-CB 3.22Å; Q233-T237 VanDerWaalsContact O-CG2 3.29Å; Q233-T237 WeakPolarHBondContact O-CG2 3.11Å; Q233-T237 PolarHBondContact O-N 2.76Å; Q233-T237 PolarHBondContact O-OG1 3.2Å
234	A	92.5	Very high	92.7	Very high	18 Å²	18	43.1 Å²	43.1	15%	0.149	25%	0.253	C	S	.	.	H	α-helix	trans	-66.7	-36.9	-179.7	0	0	0	0	0	111.8	S231 F232 T237 G238 T239 L240	S231-A234 PolarHBondContact O-N 3.18Å; S231-A234 WeakPolarHBondContact OG-CB 3.32Å; S231-A234 PolarHBondContact OG-N 2.93Å; S231-A234 VanDerWaalsContact OG-N 3.1Å; F232-A234 VanDerWaalsContact C-N 3.34Å; F232-A234 PolarHBondContact O-N 3.23Å; A234-T237 PolarHBondContact O-OG1 3.26Å; A234-G238 PolarHBondContact O-N 3.49Å; A234-T239 WeakPolarHBondContact O-CA 3.5Å; A234-T239 PolarHBondContact O-N 2.64Å; A234-L240 HydrophobicContact CB-CB 4.4Å; A234-L240 HydrophobicContact CB-CD1 3.79Å; A234-L240 HydrophobicContact CB-CG 3.73Å; A234-L240 PolarHBondContact O-N 3.42Å; A234-L240 VanDerWaalsContact O-N 3.07Å
235	L	91.4	Very high	92.4	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67	-49.2	172.4	-80	170.2	0	0	0	112.1	Y50 V53 V230 S231 F232 Q233 T237 G238 L240	Y50-L235 HydrophobicContact CD1-CD1 3.78Å; Y50-L235 HydrophobicContact CD1-CD2 4.26Å; Y50-L235 HydrophobicContact CD2-CD1 4.49Å; Y50-L235 HydrophobicContact CD2-CD2 3.49Å; Y50-L235 VanDerWaalsContact CD2-CD2 3.49Å; Y50-L235 HydrophobicContact CE1-CD1 4.44Å; Y50-L235 HydrophobicContact CE2-CD2 4.07Å; Y50-L235 HydrophobicContact CG-CD1 3.81Å; Y50-L235 HydrophobicContact CG-CD2 3.6Å; Y50-L235 HydrophobicContact CG-CG 4.3Å; V53-L235 HydrophobicContact CB-CD1 3.74Å; V53-L235 HydrophobicContact CG1-CB 4.36Å; V53-L235 HydrophobicContact CG1-CD1 3.59Å; V53-L235 HydrophobicContact CG2-CD1 4.16Å; V230-L235 HydrophobicContact CG1-CD1 3.4Å; V230-L235 HydrophobicContact CG1-CG 4.3Å; S231-L235 PolarHBondContact O-N 3.07Å; S231-L235 VanDerWaalsContact O-N 3.08Å; F232-L235 PolarHBondContact O-N 3.41Å; Q233-L235 VanDerWaalsContact C-N 3.34Å; Q233-L235 PolarHBondContact O-N 3.27Å; L235-T237 PolarHBondContact O-N 3.26Å; L235-G238 WeakPolarHBondContact O-CA 3.3Å; L235-G238 PolarHBondContact O-N 3.08Å; L235-L240 HydrophobicContact CD2-CB 3.69Å; L235-L240 HydrophobicContact CG-CB 4Å; L235-L240 HydrophobicContact CG-CD1 4.28Å
236	L	86.9	Confident	92	Very high	9 Å²	9	41 Å²	41	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-29	-178.1	-69.4	179.1	0	0	0	113.4	M61 Y69 P72 I76 F232 Q233	M61-L236 HydrophobicContact CE-CD1 4.15Å; M61-L236 HydrophobicContact CE-CD2 4.12Å; Y69-L236 HydrophobicContact CD1-CD1 4.06Å; Y69-L236 HydrophobicContact CE1-CD1 4.07Å; P72-L236 HydrophobicContact CB-CB 4.12Å; P72-L236 HydrophobicContact CB-CD1 4.42Å; P72-L236 HydrophobicContact CB-CD2 4.34Å; P72-L236 HydrophobicContact CG-CB 4.31Å; I76-L236 HydrophobicContact CD1-CD2 3.4Å; F232-L236 WeakPolarHBondContact O-CB 3.47Å; F232-L236 WeakPolarHBondContact O-CG 3.49Å; F232-L236 PolarHBondContact O-N 2.87Å; Q233-L236 PolarHBondContact O-N 2.97Å
237	T	85.7	Confident	91.6	Very high	72 Å²	72	44.4 Å²	44.4	44%	0.442	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-9.4	173.5	55	0	0	0	0	113.1	Q233 A234 L235 T239	Q233-T237 HydrophobicContact CG-CG2 4.32Å; Q233-T237 WeakPolarHBondContact O-CB 3.22Å; Q233-T237 VanDerWaalsContact O-CG2 3.29Å; Q233-T237 WeakPolarHBondContact O-CG2 3.11Å; Q233-T237 PolarHBondContact O-N 2.76Å; Q233-T237 PolarHBondContact O-OG1 3.2Å; A234-T237 PolarHBondContact O-OG1 3.26Å; L235-T237 PolarHBondContact O-N 3.26Å; T237-T239 VanDerWaalsContact C-N 3.32Å; T237-T239 PolarHBondContact OG1-OG1 3.31Å; T237-T239 VanDerWaalsContact OG1-OG1 3.08Å
238	G	86.2	Confident	91.1	Very high	5 Å²	5	48.1 Å²	48.1	5%	0.052	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	20.5	-174.9	0	0	0	0	0	114.1	R75 R112 A234 L235	R75-G238 VanDerWaalsContact NH1-CA 3.3Å; R112-G238 PolarHBondContact NH1-O 2.94Å; R112-G238 PolarHBondContact NH2-O 3.11Å; A234-G238 PolarHBondContact O-N 3.49Å; L235-G238 WeakPolarHBondContact O-CA 3.3Å; L235-G238 PolarHBondContact O-N 3.08Å
239	T	90.9	Very high	90.7	Very high	106 Å²	106	45.7 Å²	45.7	65%	0.65	25%	0.251	S	S	*	.	S	Bend	trans	-73	-41.6	171.8	-51.3	0	0	0	0	110.5	A234 T237	A234-T239 WeakPolarHBondContact O-CA 3.5Å; A234-T239 PolarHBondContact O-N 2.64Å; T237-T239 VanDerWaalsContact C-N 3.32Å; T237-T239 PolarHBondContact OG1-OG1 3.31Å; T237-T239 VanDerWaalsContact OG1-OG1 3.08Å
240	L	93.1	Very high	90.2	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.288	24%	0.243	S	C	.	.	S	Bend	trans	-91.2	143.4	165.5	-68.5	175.6	0	0	0	108.9	Y50 H114 A234 L235	Y50-L240 HydrophobicContact CE2-CB 4.34Å; H114-L240 PolarHBondContact CE1-O 3.46Å; A234-L240 HydrophobicContact CB-CB 4.4Å; A234-L240 HydrophobicContact CB-CD1 3.79Å; A234-L240 HydrophobicContact CB-CG 3.73Å; A234-L240 PolarHBondContact O-N 3.42Å; A234-L240 VanDerWaalsContact O-N 3.07Å; L235-L240 HydrophobicContact CD2-CB 3.69Å; L235-L240 HydrophobicContact CG-CB 4Å; L235-L240 HydrophobicContact CG-CD1 4.28Å
241	S	91.6	Very high	89.7	Confident	3 Å²	3	49 Å²	49	2%	0.021	26%	0.262	C	S	.	.			trans	-126.9	140.6	174.2	87.9	0	0	0	0	112.8	A243 D244	S241-A243 PolarHBondContact O-N 2.95Å; S241-D244 WeakPolarHBondContact CB-OD2 3.15Å; S241-D244 PolarHBondContact O-N 3.03Å; S241-D244 PolarHBondContact OG-N 3.17Å; S241-D244 VanDerWaalsContact OG-N 3.16Å; S241-D244 PolarHBondContact OG-OD2 3.3Å
242	P	93	Very high	89.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-30	170.5	-23.5	34.4	0	0	0	113.2	Y50 R112 A113 D244 E245 I246	Y50-P242 HydrophobicContact CD2-CB 4.44Å; Y50-P242 HydrophobicContact CD2-CG 4.22Å; R112-P242 WeakPolarHBondContact O-CD 3.41Å; A113-P242 HydrophobicContact CB-CB 3.97Å; A113-P242 WeakPolarHBondContact O-CB 3.17Å; A113-P242 VanDerWaalsContact O-CG 3.3Å; A113-P242 WeakPolarHBondContact O-CG 3.48Å; P242-D244 VanDerWaalsContact C-N 3.29Å; P242-D244 PolarHBondContact O-N 2.96Å; P242-E245 PolarHBondContact O-N 2.79Å; P242-I246 WeakPolarHBondContact O-CG1 3.4Å; P242-I246 PolarHBondContact O-N 2.68Å
243	A	90.7	Very high	88.7	Confident	16 Å²	16	55.2 Å²	55.2	13%	0.132	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-37	176.8	0	0	0	0	0	112.8	R112 A113 S241 E245 I246 L247	R112-A243 WeakPolarHBondContact O-CB 3.46Å; R112-A243 PolarHBondContact O-N 2.93Å; R112-A243 VanDerWaalsContact O-N 3.09Å; A113-A243 HydrophobicContact CB-CB 4.17Å; S241-A243 PolarHBondContact O-N 2.95Å; A243-E245 VanDerWaalsContact C-N 3.35Å; A243-E245 PolarHBondContact O-N 3.06Å; A243-I246 PolarHBondContact O-N 3.11Å; A243-L247 WeakPolarHBondContact O-CB 3.33Å; A243-L247 PolarHBondContact O-N 3Å
244	D	92	Very high	87.7	Confident	81 Å²	81	53.7 Å²	53.7	43%	0.433	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-40.9	176	-61.1	-43	0	0	0	111.2	S241 P242 L247 N248	S241-D244 WeakPolarHBondContact CB-OD2 3.15Å; S241-D244 PolarHBondContact O-N 3.03Å; S241-D244 PolarHBondContact OG-N 3.17Å; S241-D244 VanDerWaalsContact OG-N 3.16Å; S241-D244 PolarHBondContact OG-OD2 3.3Å; P242-D244 VanDerWaalsContact C-N 3.29Å; P242-D244 PolarHBondContact O-N 2.96Å; D244-L247 PolarHBondContact O-N 3.42Å; D244-N248 WeakPolarHBondContact O-CB 3.29Å; D244-N248 PolarHBondContact O-N 3.37Å; D244-N248 PolarHBondContact O-ND2 3.46Å
245	E	92.9	Very high	86	Confident	33 Å²	33	58.5 Å²	58.5	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-67.9	-37.2	176.2	-62.8	-61.9	155.2	0	0	112.3	N46 A47 Y50 P242 A243 Y249	N46-E245 HydrophobicContact CB-CB 4.02Å; N46-E245 HydrophobicContact CB-CG 3.79Å; N46-E245 WeakPolarHBondContact CB-OE2 3.48Å; N46-E245 PolarHBondContact ND2-OE2 3.05Å; A47-E245 HydrophobicContact CB-CB 4.25Å; Y50-E245 HydrophobicContact CD2-CG 3.81Å; Y50-E245 HydrophobicContact CE2-CG 3.26Å; Y50-E245 PolarHBondContact OH-OE1 3Å; P242-E245 PolarHBondContact O-N 2.79Å; A243-E245 VanDerWaalsContact C-N 3.35Å; A243-E245 PolarHBondContact O-N 3.06Å; E245-Y249 VanDerWaalsContact O-CB 3.28Å; E245-Y249 WeakPolarHBondContact O-CB 3.49Å; E245-Y249 PolarHBondContact O-N 3.34Å
246	I	89.5	Confident	84.4	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-60.9	-48.6	173.4	-68.3	164.1	0	0	0	109.8	Y30 Y36 P44 A47 W51 A113 P242 A243 Y249 Q250	Y30-I246 HydrophobicContact CE1-CD1 4.32Å; Y36-I246 HydrophobicContact CE1-CD1 4.46Å; Y36-I246 VanDerWaalsContact OH-CG2 3.24Å; Y36-I246 WeakPolarHBondContact OH-CG2 3.35Å; P44-I246 HydrophobicContact CG-CB 4.44Å; P44-I246 HydrophobicContact CG-CG1 4.03Å; A47-I246 HydrophobicContact CB-CG1 3.9Å; W51-I246 HydrophobicContact CZ2-CD1 4.15Å; A113-I246 HydrophobicContact CB-CD1 3.76Å; P242-I246 WeakPolarHBondContact O-CG1 3.4Å; P242-I246 PolarHBondContact O-N 2.68Å; A243-I246 PolarHBondContact O-N 3.11Å; I246-Y249 PolarHBondContact O-N 3.43Å; I246-Q250 WeakPolarHBondContact O-CG 3.39Å; I246-Q250 PolarHBondContact O-N 3.32Å
247	L	87.8	Confident	82.5	Confident	84 Å²	84	75.5 Å²	75.5	44%	0.44	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-46.5	-179.6	-178.3	63.4	0	0	0	111.6	A243 D244 Y249 Q250 Q251	A243-L247 WeakPolarHBondContact O-CB 3.33Å; A243-L247 PolarHBondContact O-N 3Å; D244-L247 PolarHBondContact O-N 3.42Å; L247-Y249 VanDerWaalsContact C-N 3.28Å; L247-Y249 PolarHBondContact O-N 3.23Å; L247-Q250 PolarHBondContact O-N 2.61Å; L247-Q251 WeakPolarHBondContact O-CG 3.44Å; L247-Q251 PolarHBondContact O-N 3.47Å
248	N	88.7	Confident	80.6	Confident	84 Å²	84	81 Å²	81	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-59.1	-41.6	177	-72	-21.6	0	0	0	111.4	D244 Q251 S252	D244-N248 WeakPolarHBondContact O-CB 3.29Å; D244-N248 PolarHBondContact O-N 3.37Å; D244-N248 PolarHBondContact O-ND2 3.46Å; N248-Q251 PolarHBondContact O-N 3.32Å; N248-S252 WeakPolarHBondContact O-CB 3.3Å; N248-S252 PolarHBondContact O-N 2.92Å
249	Y	86.5	Confident	78.2	Confident	52 Å²	52	89.7 Å²	89.7	20%	0.204	45%	0.454	C	S	.	.	H	α-helix	trans	-65.1	-44	177.1	-176.9	-106.7	0	0	0	112.2	P44 E245 I246 L247 Q251 S252 K253	P44-Y249 HydrophobicContact CB-CD1 3.84Å; P44-Y249 HydrophobicContact CB-CD2 4.26Å; P44-Y249 HydrophobicContact CB-CE1 4.49Å; P44-Y249 HydrophobicContact CB-CG 3.68Å; P44-Y249 HydrophobicContact CG-CD1 3.56Å; P44-Y249 HydrophobicContact CG-CE1 4.22Å; P44-Y249 HydrophobicContact CG-CG 3.9Å; E245-Y249 VanDerWaalsContact O-CB 3.28Å; E245-Y249 WeakPolarHBondContact O-CB 3.49Å; E245-Y249 PolarHBondContact O-N 3.34Å; I246-Y249 PolarHBondContact O-N 3.43Å; L247-Y249 VanDerWaalsContact C-N 3.28Å; L247-Y249 PolarHBondContact O-N 3.23Å; Y249-Q251 VanDerWaalsContact C-N 3.35Å; Y249-Q251 PolarHBondContact O-N 3.14Å; Y249-S252 PolarHBondContact O-N 2.67Å; Y249-S252 PolarHBondContact O-OG 3.12Å; Y249-K253 HydrophobicContact CE1-CD 4.24Å; Y249-K253 VanDerWaalsContact CE1-NZ 3.32Å; Y249-K253 PolarHBondContact O-N 2.92Å; Y249-K253 WeakPolarHBondContact OH-CE 2.94Å; Y249-K253 PolarHBondContact OH-NZ 3.41Å
250	Q	83	Confident	75.5	Confident	83 Å²	83	93.5 Å²	93.5	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-61.8	-42.1	175.6	-72.8	177	-23.1	0	0	111.9	I246 L247 S252 K253	I246-Q250 WeakPolarHBondContact O-CG 3.39Å; I246-Q250 PolarHBondContact O-N 3.32Å; L247-Q250 PolarHBondContact O-N 2.61Å; Q250-S252 VanDerWaalsContact C-N 3.34Å; Q250-S252 PolarHBondContact O-N 2.84Å; Q250-K253 PolarHBondContact O-N 3.31Å
251	Q	85.6	Confident	72.9	Confident	107 Å²	107	100.5 Å²	100.5	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.6	-72	176.8	-0.7	0	0	112.3	L247 N248 Y249 K253 L254	L247-Q251 WeakPolarHBondContact O-CG 3.44Å; L247-Q251 PolarHBondContact O-N 3.47Å; N248-Q251 PolarHBondContact O-N 3.32Å; Y249-Q251 VanDerWaalsContact C-N 3.35Å; Y249-Q251 PolarHBondContact O-N 3.14Å; Q251-K253 PolarHBondContact O-N 3.41Å; Q251-L254 WeakPolarHBondContact O-CB 3.27Å; Q251-L254 PolarHBondContact O-N 2.91Å; Q251-L254 VanDerWaalsContact O-N 3.08Å
252	S	86	Confident	70.1	Confident	87 Å²	87	107.7 Å²	107.7	61%	0.608	53%	0.532	S	S	*	.	H	α-helix	trans	-65.4	-21.7	178.1	77	0	0	0	0	113.9	N248 Y249 Q250	N248-S252 WeakPolarHBondContact O-CB 3.3Å; N248-S252 PolarHBondContact O-N 2.92Å; Y249-S252 PolarHBondContact O-N 2.67Å; Y249-S252 PolarHBondContact O-OG 3.12Å; Q250-S252 VanDerWaalsContact C-N 3.34Å; Q250-S252 PolarHBondContact O-N 2.84Å
253	K	78.4	Confident	67.4	Low	113 Å²	113	116.5 Å²	116.5	49%	0.491	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	-15.6	174.7	-73.4	-172.5	175.7	175.5	0	113.3	Y249 Q250 Q251	Y249-K253 HydrophobicContact CE1-CD 4.24Å; Y249-K253 VanDerWaalsContact CE1-NZ 3.32Å; Y249-K253 PolarHBondContact O-N 2.92Å; Y249-K253 WeakPolarHBondContact OH-CE 2.94Å; Y249-K253 PolarHBondContact OH-NZ 3.41Å; Q250-K253 PolarHBondContact O-N 3.31Å; Q251-K253 PolarHBondContact O-N 3.41Å
254	L	70.2	Confident	64.5	Low	118 Å²	118	120.8 Å²	120.8	62%	0.618	60%	0.603	S	S	*	*	S	Bend	trans	-72.7	136.8	177.9	-68.6	171.1	0	0	0	109.7	Q251 V256	Q251-L254 WeakPolarHBondContact O-CB 3.27Å; Q251-L254 PolarHBondContact O-N 2.91Å; Q251-L254 VanDerWaalsContact O-N 3.08Å; L254-V256 PolarHBondContact O-N 2.98Å; L254-V256 VanDerWaalsContact O-N 3.09Å
255	P	55.6	Low	61.8	Low	119 Å²	119	123.9 Å²	123.9	77%	0.773	62%	0.624	S	S	*	*			trans	-60.3	119.3	176.7	22.4	-30.2	0	0	0	109.4	R257	P255-R257 PolarHBondContact O-N 3.49Å
256	V	58	Low	58.9	Low	128 Å²	128	126.4 Å²	126.4	78%	0.776	65%	0.651	S	S	*	*			trans	-62.2	108.5	174.4	179.9	0	0	0	0	107.2	L254 K258	L254-V256 PolarHBondContact O-N 2.98Å; L254-V256 VanDerWaalsContact O-N 3.09Å; V256-K258 VanDerWaalsContact C-N 3.29Å; V256-K258 PolarHBondContact O-N 3.38Å
257	R	47.2	Very low	56.2	Low	238 Å²	238	135.8 Å²	135.8	90%	0.898	70%	0.695	S	S	*	*			trans	-60.8	99.3	162.3	-85.5	-174.9	174.1	-178.6	-2.2	106.4	P255 E259	P255-R257 PolarHBondContact O-N 3.49Å; R257-E259 PolarHBondContact O-N 3.39Å
258	K	45.6	Very low	53.8	Low	188 Å²	188	141.4 Å²	141.4	82%	0.817	72%	0.719	S	S	*	*			trans	-58.7	111.5	164.4	-81.8	-178.7	176.4	175.3	0	106	V256 M260	V256-K258 VanDerWaalsContact C-N 3.29Å; V256-K258 PolarHBondContact O-N 3.38Å; K258-M260 PolarHBondContact O-N 2.97Å
259	E	36.2	Very low	51.4	Low	187 Å²	187	146.7 Å²	146.7	87%	0.874	74%	0.741	S	S	*	*			trans	-55.3	113.7	164.2	-71.5	-177	159.1	0	0	107.2	R257 K261	R257-E259 PolarHBondContact O-N 3.39Å; E259-K261 PolarHBondContact O-N 3.14Å
260	M	34.5	Very low	49	Very low	186 Å²	186	148.2 Å²	148.2	92%	0.916	76%	0.758	S	S	*	*			trans	-58.9	106.6	171.9	-76.5	172.6	147	0	0	107.8	K258 D262	K258-M260 PolarHBondContact O-N 2.97Å; M260-D262 PolarHBondContact O-N 3.04Å
261	K	38.5	Very low	47	Very low	201 Å²	201	151.7 Å²	151.7	87%	0.874	78%	0.778	S	S	*	*			trans	-80.2	109.7	153.7	-85.9	-176.4	175.4	178.4	0	106.6	E259 Q263	E259-K261 PolarHBondContact O-N 3.14Å; K261-Q263 PolarHBondContact O-N 3.13Å
262	D	31.6	Very low	45.1	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	79%	0.786	S	S	*	*			trans	-43	116.5	167.9	-86.7	-37.8	0	0	0	111.2	M260	M260-D262 PolarHBondContact O-N 3.04Å
263	Q	36.8	Very low	43.2	Very low	185 Å²	185	155 Å²	155	86%	0.864	79%	0.788	S	S	*	*			trans	-167.9	93.3	142.4	-102.9	164	31.3	0	0	108.7	K261	K261-Q263 PolarHBondContact O-N 3.13Å
264	S	30.6	Very low	41.5	Very low	107 Å²	107	158.9 Å²	158.9	75%	0.748	80%	0.8	S	S	*	*			trans	20.7	114.1	151.2	60	0	0	0	0	118.4
265	V	35.1	Very low	40.4	Very low	145 Å²	145	160.2 Å²	160.2	88%	0.879	81%	0.805	S	S	*	*				-169	136.9	111.4	167.8	0	0	0	0	106.4
266	A	31.5	Very low	40.4	Very low	87 Å²	87	161.4 Å²	161.4	72%	0.719	80%	0.8	S	S	*	*			trans	-61.3	139.3	-176.9	0	0	0	0	0	113
267	E	33.7	Very low	40	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	80%	0.796	S	S	*	*			trans	-172.3	96.9	141.9	-101.8	162.5	-155.8	0	0	107.2	E269	E267-E269 PolarHBondContact O-N 3.4Å
268	E	35.9	Very low	40.5	Very low	203 Å²	203	158.3 Å²	158.3	95%	0.949	78%	0.782	S	S	*	*			trans	-78	106.8	165.9	-88	176.2	152.4	0	0	107.8
269	E	38	Very low	41.5	Very low	194 Å²	194	152.2 Å²	152.2	91%	0.907	77%	0.767	S	S	*	*			trans	-91.1	114	164.4	-130	176.4	-170.4	0	0	108.2	E267	E267-E269 PolarHBondContact O-N 3.4Å
270	C	36	Very low	43.2	Very low	84 Å²	84	147.6 Å²	147.6	57%	0.568	75%	0.752	S	S	*	*			trans	-75	128.5	-168.5	-152.1	0	0	0	0	111.4	E272	C270-E272 PolarHBondContact O-N 3.49Å
271	I	41.8	Very low	44.9	Very low	157 Å²	157	145.1 Å²	145.1	81%	0.805	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	55.6	173.5	-57.6	167.9	0	0	0	109
272	E	46	Very low	46.3	Very low	143 Å²	143	139.9 Å²	139.9	67%	0.668	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	-24.3	173.7	-75.3	-175.6	155.9	0	0	112.1	C270 Y274 M275	C270-E272 PolarHBondContact O-N 3.49Å; E272-Y274 PolarHBondContact O-N 3.29Å; E272-M275 PolarHBondContact O-N 3.46Å
273	D	47.1	Very low	48.1	Very low	121 Å²	121	138.5 Å²	138.5	65%	0.647	70%	0.704	S	S	*	*	H	α-helix	trans	-71.8	-26.6	-177.1	-73.3	-14.2	0	0	0	114.4	M275	D273-M275 PolarHBondContact O-N 3.43Å
274	Y	42.3	Very low	49.4	Very low	193 Å²	193	134.4 Å²	134.4	76%	0.757	69%	0.685	S	S	*	*	H	α-helix	trans	-76.5	-19.6	-178.9	-84	-86.6	0	0	0	114.2	E272	E272-Y274 PolarHBondContact O-N 3.29Å
275	M	45.9	Very low	50.8	Low	147 Å²	147	133.3 Å²	133.3	72%	0.724	67%	0.674	S	S	*	*	H	α-helix	trans	-87.5	-28.9	-179.2	-65.4	-66.7	-95.3	0	0	111.8	E272 D273 A279	E272-M275 PolarHBondContact O-N 3.46Å; D273-M275 PolarHBondContact O-N 3.43Å; M275-A279 WeakPolarHBondContact O-CB 3.47Å; M275-A279 PolarHBondContact O-N 3.29Å; M275-A279 VanDerWaalsContact O-N 3.15Å
276	E	56	Low	52	Low	143 Å²	143	133.1 Å²	133.1	67%	0.668	66%	0.663	S	S	*	*	H	α-helix	trans	-75.6	-35.2	178.7	-139.4	171.4	-155.7	0	0	111.9	T280	E276-T280 WeakPolarHBondContact O-CB 3.22Å; E276-T280 PolarHBondContact O-N 3.09Å; E276-T280 PolarHBondContact O-OG1 3.39Å
277	E	50.4	Low	53.4	Low	145 Å²	145	133.1 Å²	133.1	68%	0.678	65%	0.65	S	S	*	*	H	α-helix	trans	-69.4	-39.4	176.1	-140.7	178.9	-163.5	0	0	112	T280 F281	E277-T280 PolarHBondContact O-N 3.21Å; E277-F281 WeakPolarHBondContact O-CB 3.34Å; E277-F281 PolarHBondContact O-N 3.35Å
278	Y	57.1	Low	54.4	Low	156 Å²	156	128.3 Å²	128.3	61%	0.612	63%	0.631	S	S	*	*	H	α-helix	trans	-70	-37.6	176.4	-160.9	-98	0	0	0	112.4	M282	Y278-M282 HydrophobicContact CD1-CG 4.19Å; Y278-M282 HydrophobicContact CE1-CG 4.02Å; Y278-M282 VanDerWaalsContact O-CG 3.31Å; Y278-M282 WeakPolarHBondContact O-CG 3.22Å; Y278-M282 PolarHBondContact O-N 2.71Å
279	A	67.1	Low	55.1	Low	60 Å²	60	121.2 Å²	121.2	50%	0.496	61%	0.612	S	S	.	*	H	α-helix	trans	-66.2	-40.1	174.9	0	0	0	0	0	112.1	M275 M282 H283	M275-A279 WeakPolarHBondContact O-CB 3.47Å; M275-A279 PolarHBondContact O-N 3.29Å; M275-A279 VanDerWaalsContact O-N 3.15Å; A279-M282 PolarHBondContact O-N 3.29Å; A279-H283 WeakPolarHBondContact O-CB 3.38Å; A279-H283 PolarHBondContact O-N 3.39Å; A279-H283 VanDerWaalsContact O-N 3.09Å
280	T	70.9	Confident	55.9	Low	91 Å²	91	117.2 Å²	117.2	56%	0.558	60%	0.601	S	S	*	*	H	α-helix	trans	-67.8	-40	177.2	-54.6	0	0	0	0	111.6	E276 E277 H283 Q284	E276-T280 WeakPolarHBondContact O-CB 3.22Å; E276-T280 PolarHBondContact O-N 3.09Å; E276-T280 PolarHBondContact O-OG1 3.39Å; E277-T280 PolarHBondContact O-N 3.21Å; T280-H283 PolarHBondContact O-N 2.88Å; T280-Q284 PolarHBondContact O-N 2.96Å; T280-Q284 VanDerWaalsContact O-N 3.12Å
281	F	69.8	Low	56.6	Low	133 Å²	133	117.5 Å²	117.5	58%	0.583	61%	0.609	S	S	*	*	H	α-helix	trans	-63.2	-44.4	175.2	-178.2	-102.2	0	0	0	112.5	E277 H283 Q284 V285	E277-F281 WeakPolarHBondContact O-CB 3.34Å; E277-F281 PolarHBondContact O-N 3.35Å; F281-H283 VanDerWaalsContact C-N 3.34Å; F281-H283 PolarHBondContact O-N 3.41Å; F281-Q284 PolarHBondContact O-N 3.35Å; F281-V285 HydrophobicContact CE1-CG2 4.22Å; F281-V285 HydrophobicContact CE2-CG2 4.49Å; F281-V285 HydrophobicContact CZ-CG2 4.18Å; F281-V285 WeakPolarHBondContact O-CG2 3.49Å; F281-V285 PolarHBondContact O-N 3.04Å
282	M	68	Low	57.1	Low	91 Å²	91	115 Å²	115	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-66.6	-34.7	178.3	-69.5	-64.4	-74.9	0	0	112.5	Y278 A279 Q286	Y278-M282 HydrophobicContact CD1-CG 4.19Å; Y278-M282 HydrophobicContact CE1-CG 4.02Å; Y278-M282 VanDerWaalsContact O-CG 3.31Å; Y278-M282 WeakPolarHBondContact O-CG 3.22Å; Y278-M282 PolarHBondContact O-N 2.71Å; A279-M282 PolarHBondContact O-N 3.29Å; M282-Q286 PolarHBondContact O-N 3.2Å
283	H	69.6	Low	57	Low	125 Å²	125	111.6 Å²	111.6	58%	0.579	61%	0.608	S	S	*	*	H	α-helix	trans	-69.8	-35.7	177.2	-159.8	-99.9	0	0	0	112.4	A279 T280 F281 Q286 I287	A279-H283 WeakPolarHBondContact O-CB 3.38Å; A279-H283 PolarHBondContact O-N 3.39Å; A279-H283 VanDerWaalsContact O-N 3.09Å; T280-H283 PolarHBondContact O-N 2.88Å; F281-H283 VanDerWaalsContact C-N 3.34Å; F281-H283 PolarHBondContact O-N 3.41Å; H283-Q286 PolarHBondContact O-N 2.81Å; H283-I287 WeakPolarHBondContact O-CG1 3.31Å; H283-I287 PolarHBondContact O-N 3.01Å
284	Q	64.2	Low	56.9	Low	100 Å²	100	110.9 Å²	110.9	47%	0.467	61%	0.613	S	S	.	*	H	α-helix	trans	-69	-39.3	176.7	-166.8	61.6	44.1	0	0	112.2	T280 F281 Q286 I287 D288	T280-Q284 PolarHBondContact O-N 2.96Å; T280-Q284 VanDerWaalsContact O-N 3.12Å; F281-Q284 PolarHBondContact O-N 3.35Å; Q284-Q286 VanDerWaalsContact C-N 3.29Å; Q284-Q286 PolarHBondContact O-N 3.48Å; Q284-I287 PolarHBondContact O-N 3.01Å; Q284-D288 PolarHBondContact NE2-OD2 3.38Å; Q284-D288 PolarHBondContact O-N 3.14Å; Q284-D288 VanDerWaalsContact O-N 3.13Å
285	V	61.3	Low	56.8	Low	84 Å²	84	110.2 Å²	110.2	51%	0.509	65%	0.647	S	S	.	*	H	α-helix	trans	-66.3	-28.8	178.1	174.3	0	0	0	0	112.5	F281 G289	F281-V285 HydrophobicContact CE1-CG2 4.22Å; F281-V285 HydrophobicContact CE2-CG2 4.49Å; F281-V285 HydrophobicContact CZ-CG2 4.18Å; F281-V285 WeakPolarHBondContact O-CG2 3.49Å; F281-V285 PolarHBondContact O-N 3.04Å; V285-G289 PolarHBondContact O-N 3.01Å
286	Q	59.6	Low	57.4	Low	140 Å²	140	108.4 Å²	108.4	65%	0.654	64%	0.644	S	S	*	*	H	α-helix	trans	-78.1	-25.5	174.3	-97.6	169.1	-52.1	0	0	114	M282 H283 Q284 V290	M282-Q286 PolarHBondContact O-N 3.2Å; H283-Q286 PolarHBondContact O-N 2.81Å; Q284-Q286 VanDerWaalsContact C-N 3.29Å; Q284-Q286 PolarHBondContact O-N 3.48Å; Q286-V290 WeakPolarHBondContact O-CG2 3.38Å
287	I	60.7	Low	57.4	Low	88 Å²	88	106.6 Å²	106.6	45%	0.451	64%	0.642	S	S	.	*	H	α-helix	trans	-80.1	-38.8	177.7	-68.4	173.5	0	0	0	110.8	H283 Q284	H283-I287 WeakPolarHBondContact O-CG1 3.31Å; H283-I287 PolarHBondContact O-N 3.01Å; Q284-I287 PolarHBondContact O-N 3.01Å
288	D	54.7	Low	57.8	Low	96 Å²	96	104.4 Å²	104.4	51%	0.513	64%	0.64	S	S	.	*	H	α-helix	trans	-80.6	-16.5	-178.1	-64.3	-33.5	0	0	0	113.3	Q284	Q284-D288 PolarHBondContact NE2-OD2 3.38Å; Q284-D288 PolarHBondContact O-N 3.14Å; Q284-D288 VanDerWaalsContact O-N 3.13Å
289	G	51.7	Low	57.9	Low	54 Å²	54	101.4 Å²	101.4	56%	0.557	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-13.3	174.1	0	0	0	0	0	115.6	V285	V285-G289 PolarHBondContact O-N 3.01Å
290	V	53.1	Low	57.3	Low	111 Å²	111	104 Å²	104	67%	0.673	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-19.1	179.9	-179.7	0	0	0	0	112	Q286 S292	Q286-V290 WeakPolarHBondContact O-CG2 3.38Å; V290-S292 VanDerWaalsContact C-N 3.3Å; V290-S292 PolarHBondContact O-N 3.47Å
291	A	52	Low	56.4	Low	89 Å²	89	104.9 Å²	104.9	74%	0.736	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	0.5	179.2	0	0	0	0	0	115.1
292	S	52.5	Low	55.4	Low	106 Å²	106	102.9 Å²	102.9	74%	0.741	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	15.2	179.5	50.6	0	0	0	0	114.3	V290	V290-S292 VanDerWaalsContact C-N 3.3Å; V290-S292 PolarHBondContact O-N 3.47Å
293	G	43.2	Very low	54.5	Low	70 Å²	70	103.8 Å²	103.8	72%	0.722	68%	0.679	S	S	*	*	S	Bend	trans	-129.7	15.3	-176.2	0	0	0	0	0	116.6
294	S	44.1	Very low	53.2	Low	107 Å²	107	102 Å²	102	75%	0.748	69%	0.688	S	S	*	*			trans	-153.2	84.6	172.6	64.1	0	0	0	0	112.4
295	A	41.6	Very low	52.2	Low	179 Å²	179	102.2 Å²	102.2	100%	1.479	71%	0.708	S	S	*	*			trans	-156.3	0	156.1	0	0	0	0	0	108.8

Retrieved 295 of 295 residues in 457.8 ms (Link to these results)

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