A0A096NNZ5_PAPAN Loading...

Vasohibin 2

AlphaFold DB , UniProt , Accession A0A096NNZ5, Species PAPAN (Papio anubis, Olive baboon), Gene VASH2, Length 355 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	33.6	Very low	34.2	Very low	229 Å²	229	135.3 Å²	135.3	100%	1.128	80%	0.802	S	S	*	*				0	100.6	0	-70.1	176	-179.6	0	0	105.8
2	T	33.6	Very low	34.8	Very low	144 Å²	144	135.2 Å²	135.2	88%	0.883	81%	0.807	S	S	*	*				72.8	127.9	88.2	53.3	0	0	0	0	112.5
3	G	30.3	Very low	34.8	Very low	65 Å²	65	137.9 Å²	137.9	67%	0.67	81%	0.806	S	S	*	*			cis	-154.7	167.1	-1.1	0	0	0	0	0	110.4
4	S	35.3	Very low	35.5	Very low	130 Å²	130	136.4 Å²	136.4	91%	0.909	80%	0.802	S	S	*	*				57.4	132.3	88.9	-58.1	0	0	0	0	114.7
5	A	37.5	Very low	35.3	Very low	102 Å²	102	140.5 Å²	140.5	84%	0.843	81%	0.806	S	S	*	*			cis	-160.4	-158.2	-5.5	0	0	0	0	0	107.7
6	A	37.6	Very low	34.8	Very low	77 Å²	77	136.7 Å²	136.7	64%	0.636	81%	0.808	S	S	*	*			cis	-164.9	169.4	5.7	0	0	0	0	0	111.7
7	D	34.3	Very low	34.6	Very low	146 Å²	146	134.5 Å²	134.5	78%	0.781	81%	0.808	S	S	*	*			trans	55.3	151.3	134.4	-70	10.3	0	0	0	125.1
8	T	36	Very low	34.5	Very low	98 Å²	98	138.9 Å²	138.9	60%	0.601	82%	0.815	S	S	*	*			cis	-163.4	177.9	-14.1	27.7	0	0	0	0	112.4
9	H	32.8	Very low	34.1	Very low	153 Å²	153	135.2 Å²	135.2	71%	0.708	81%	0.809	S	S	*	*			trans	94.8	140	160.6	-59.4	-19.3	0	0	0	117.2
10	R	31.3	Very low	33.8	Very low	223 Å²	223	135.1 Å²	135.1	84%	0.842	81%	0.81	S	S	*	*			cis	-155	148.1	-5.7	-119.6	175.3	-168.3	-164.9	3.4	110
11	C	33.8	Very low	33.5	Very low	121 Å²	121	139.5 Å²	139.5	82%	0.818	81%	0.812	S	S	*	*			trans	-100.3	171.9	167.6	-60.1	0	0	0	0	111.1
12	P	41.6	Very low	33.5	Very low	134 Å²	134	134.1 Å²	134.1	87%	0.87	80%	0.797	S	S	*	*				-142.8	168.8	102	38.3	-24.9	0	0	0	115.9
13	H	34.2	Very low	33.3	Very low	171 Å²	171	139 Å²	139	79%	0.792	80%	0.799	S	S	*	*			trans	-129.9	151.1	176.1	-137.2	-10.8	0	0	0	108
14	P	45.5	Very low	33.3	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	80%	0.8	S	S	*	*				-144.2	132.8	106.7	27.4	-8	0	0	0	113.6
15	K	32.6	Very low	33.6	Very low	198 Å²	198	139.9 Å²	139.9	86%	0.861	80%	0.795	S	S	*	*				63.6	116.6	89.7	-65.2	-173.5	-178.9	179.6	0	116.6
16	G	27.6	Very low	33.3	Very low	80 Å²	80	143.1 Å²	143.1	83%	0.825	79%	0.792	S	S	*	*			trans	-161.5	128.5	157.1	0	0	0	0	0	110.1
17	A	30.4	Very low	33.2	Very low	99 Å²	99	144.4 Å²	144.4	82%	0.818	80%	0.803	S	S	*	*			trans	-163.2	137.9	-175.2	0	0	0	0	0	113.7
18	K	32.2	Very low	33	Very low	215 Å²	215	148.7 Å²	148.7	94%	0.935	81%	0.808	S	S	*	*			trans	165.6	141.4	140.9	-96.2	169.7	-179.5	-178.6	0	112.8
19	G	27.7	Very low	32.7	Very low	68 Å²	68	149.6 Å²	149.6	70%	0.701	82%	0.815	S	S	*	*			trans	82.7	148.2	157.8	0	0	0	0	0	117.6
20	T	27.8	Very low	32.7	Very low	133 Å²	133	148.8 Å²	148.8	82%	0.816	82%	0.821	S	S	*	*			cis	-160	140.7	-8.5	-8	0	0	0	0	113.2
21	R	28.4	Very low	32.4	Very low	227 Å²	227	143.5 Å²	143.5	86%	0.857	82%	0.818	S	S	*	*			trans	54.4	94.5	152.5	-73.8	176.6	174.4	177.7	-2.3	121.1
22	S	33.2	Very low	32.2	Very low	116 Å²	116	145 Å²	145	81%	0.811	82%	0.818	S	S	*	*				47.8	125.3	115.6	-45.2	0	0	0	0	122.2
23	R	29.2	Very low	31.5	Very low	248 Å²	248	143.3 Å²	143.3	94%	0.936	81%	0.814	S	S	*	*			trans	-156.6	134.7	142.9	-126.5	174.4	-175.9	176.9	0.9	115
24	S	31	Very low	31.2	Very low	97 Å²	97	141.1 Å²	141.1	68%	0.678	81%	0.813	S	S	*	*			trans	48.9	118.5	154.7	-170.1	0	0	0	0	120.5	H26	S24-H26 PolarHBondContact OG-CD2 2.57Å
25	S	39.9	Very low	30.4	Very low	115 Å²	115	141 Å²	141	80%	0.804	82%	0.816	S	S	*	*			trans	-78	125.2	156.7	43	0	0	0	0	111.4
26	H	31.2	Very low	30.2	Very low	171 Å²	171	135.2 Å²	135.2	79%	0.792	81%	0.812	S	S	*	*			trans	-144.4	118.4	157	-90.5	-70.3	0	0	0	109.8	S24	S24-H26 PolarHBondContact OG-CD2 2.57Å
27	A	35.8	Very low	30.1	Very low	104 Å²	104	134.5 Å²	134.5	86%	0.86	81%	0.805	S	S	*	*			trans	-68.6	141	170.4	0	0	0	0	0	110.2
28	R	29.7	Very low	30	Very low	235 Å²	235	134.4 Å²	134.4	89%	0.887	80%	0.798	S	S	*	*			trans	-110.5	131.5	163.7	-77	-174.7	168.2	-166.5	-3.9	108.4
29	P	31	Very low	30.2	Very low	117 Å²	117	132.5 Å²	132.5	76%	0.76	79%	0.792	S	S	*	*			trans	-68.2	145.6	178.1	29.2	-34.4	0	0	0	110.5	S31	P29-S31 PolarHBondContact O-N 2.92Å
30	V	31.7	Very low	30.4	Very low	137 Å²	137	137.3 Å²	137.3	83%	0.83	80%	0.796	S	S	*	*			trans	-72.4	115.6	168.5	177.5	0	0	0	0	107.7	L32	V30-L32 PolarHBondContact O-N 3.15Å
31	S	25.8	Very low	31.1	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	78%	0.782	S	S	*	*			trans	-65.3	100.6	-179.9	-48.9	0	0	0	0	110.6	P29 A33	P29-S31 PolarHBondContact O-N 2.92Å; S31-A33 PolarHBondContact O-N 3.2Å
32	L	29.9	Very low	31.5	Very low	153 Å²	153	132.5 Å²	132.5	80%	0.801	78%	0.779	S	S	*	*			trans	-65.5	106.6	167.1	-135.4	77.1	0	0	0	107.8	V30 T34	V30-L32 PolarHBondContact O-N 3.15Å; L32-T34 VanDerWaalsContact C-N 3.29Å; L32-T34 PolarHBondContact O-N 3.21Å
33	A	26.4	Very low	31.8	Very low	97 Å²	97	133.8 Å²	133.8	80%	0.802	77%	0.77	S	S	*	*			trans	-71.8	88.9	173.6	0	0	0	0	0	108.6	S31 S35	S31-A33 PolarHBondContact O-N 3.2Å; A33-S35 PolarHBondContact O-N 3.01Å
34	T	28.2	Very low	32.4	Very low	125 Å²	125	124.8 Å²	124.8	77%	0.767	74%	0.74	S	S	*	*			trans	-59	99.7	167.7	41.8	0	0	0	0	108.6	L32 G36	L32-T34 VanDerWaalsContact C-N 3.29Å; L32-T34 PolarHBondContact O-N 3.21Å; T34-G36 PolarHBondContact O-N 2.79Å
35	S	28.6	Very low	33.1	Very low	115 Å²	115	121.1 Å²	121.1	80%	0.804	72%	0.718	S	S	*	*			trans	-60.7	111.4	165.6	42.1	0	0	0	0	107.1	A33 G37	A33-S35 PolarHBondContact O-N 3.01Å; S35-G37 VanDerWaalsContact C-N 3.25Å; S35-G37 PolarHBondContact O-N 3.46Å
36	G	27.6	Very low	33.5	Very low	76 Å²	76	118.5 Å²	118.5	78%	0.784	71%	0.709	S	S	*	*			trans	-65.7	84.3	-178.1	0	0	0	0	0	110.9	T34 S38	T34-G36 PolarHBondContact O-N 2.79Å; G36-S38 PolarHBondContact O-N 2.6Å
37	G	25.7	Very low	34.6	Very low	65 Å²	65	114.8 Å²	114.8	67%	0.67	70%	0.698	S	S	*	*			trans	-62.5	102.4	163.5	0	0	0	0	0	107.6	S35 E39	S35-G37 VanDerWaalsContact C-N 3.25Å; S35-G37 PolarHBondContact O-N 3.46Å; G37-E39 VanDerWaalsContact C-N 3.34Å; G37-E39 PolarHBondContact O-N 2.75Å
38	S	28.6	Very low	35.9	Very low	96 Å²	96	114.2 Å²	114.2	67%	0.671	68%	0.68	S	S	*	*			trans	-64.5	96.3	172.7	53.4	0	0	0	0	108.6	G36 E40	G36-S38 PolarHBondContact O-N 2.6Å; S38-E40 PolarHBondContact O-N 2.77Å
39	E	36.6	Very low	38.2	Very low	175 Å²	175	108 Å²	108	82%	0.818	66%	0.66	S	S	*	*			trans	-69.5	75.1	164.5	-65.3	-165.5	132.4	0	0	108.3	G37 E41	G37-E39 VanDerWaalsContact C-N 3.34Å; G37-E39 PolarHBondContact O-N 2.75Å; E39-E41 PolarHBondContact O-N 2.83Å
40	E	32.2	Very low	41.2	Very low	169 Å²	169	104 Å²	104	79%	0.79	63%	0.631	S	S	*	*			trans	-66.3	89.6	165.1	-67.3	-166.9	149.5	0	0	107.4	S38 D42	S38-E40 PolarHBondContact O-N 2.77Å; E40-D42 PolarHBondContact O-N 3.46Å
41	E	41.6	Very low	44.3	Very low	112 Å²	112	99.2 Å²	99.2	52%	0.523	60%	0.602	S	S	.	*			trans	-62	80.5	166.4	-70.9	-161.6	133.5	0	0	109.3	E39 K43	E39-E41 PolarHBondContact O-N 2.83Å; E41-K43 HydrophobicContact CB-CG 4.47Å; E41-K43 WeakPolarHBondContact O-CG 3.34Å; E41-K43 PolarHBondContact O-N 3.46Å; E41-K43 WeakPolarHBondContact OE2-CE 3.27Å; E41-K43 IonicContact OE2-NZ 2.71Å; E41-K43 PolarHBondContact OE2-NZ 3.2Å
42	D	38.2	Very low	47.7	Very low	147 Å²	147	94 Å²	94	79%	0.786	57%	0.566	S	S	*	*			trans	-71.1	91.6	175.4	-151.5	9.1	0	0	0	108.1	E40 D44	E40-D42 PolarHBondContact O-N 3.46Å; D42-D44 PolarHBondContact O-N 3.25Å
43	K	38.7	Very low	50.9	Low	144 Å²	144	93.9 Å²	93.9	63%	0.626	56%	0.558	S	S	*	*			trans	-73	63.9	-170.6	-73.4	174	-172.5	179	0	112.7	E41 G45	E41-K43 HydrophobicContact CB-CG 4.47Å; E41-K43 WeakPolarHBondContact O-CG 3.34Å; E41-K43 PolarHBondContact O-N 3.46Å; E41-K43 WeakPolarHBondContact OE2-CE 3.27Å; E41-K43 IonicContact OE2-NZ 2.71Å; E41-K43 PolarHBondContact OE2-NZ 3.2Å; K43-G45 PolarHBondContact O-N 3.36Å; K43-G45 VanDerWaalsContact O-N 3.08Å
44	D	42.3	Very low	54.2	Low	58 Å²	58	91.4 Å²	91.4	31%	0.31	54%	0.535	S	S	.	.	S	Bend	trans	-65.6	103	171.7	-152.4	69.2	0	0	0	109.3	D42 G46 V47 H192	D42-D44 PolarHBondContact O-N 3.25Å; D44-G46 VanDerWaalsContact C-N 3.27Å; D44-G46 PolarHBondContact O-N 3.31Å; D44-V47 PolarHBondContact O-N 2.89Å; D44-H192 IonicContact OD1-CE1 2.66Å; D44-H192 PolarHBondContact OD1-CE1 3.07Å; D44-H192 VanDerWaalsContact OD1-CE1 3.28Å; D44-H192 IonicContact OD1-CG 2.75Å; D44-H192 IonicContact OD1-ND1 3.88Å; D44-H192 PolarHBondContact OD1-ND1 3.26Å
45	G	46.6	Very low	57.4	Low	20 Å²	20	86.7 Å²	86.7	21%	0.206	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	6.1	175.7	0	0	0	0	0	116.7	K43 V47 N189	K43-G45 PolarHBondContact O-N 3.36Å; K43-G45 VanDerWaalsContact O-N 3.08Å; G45-V47 VanDerWaalsContact C-N 3.25Å; G45-V47 PolarHBondContact O-N 2.8Å; G45-N189 WeakPolarHBondContact CA-OD1 3.4Å
46	G	48.3	Very low	60.7	Low	60 Å²	60	83.6 Å²	83.6	62%	0.619	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	8.2	-174.4	0	0	0	0	0	115	D44	D44-G46 VanDerWaalsContact C-N 3.27Å; D44-G46 PolarHBondContact O-N 3.31Å
47	V	53.3	Low	64.1	Low	94 Å²	94	86 Å²	86	57%	0.57	49%	0.485	S	S	*	.			trans	-97.8	114.6	176.3	-179.1	0	0	0	0	108.9	D44 G45 F49	D44-V47 PolarHBondContact O-N 2.89Å; G45-V47 VanDerWaalsContact C-N 3.25Å; G45-V47 PolarHBondContact O-N 2.8Å; V47-F49 PolarHBondContact O-N 3.4Å
48	L	63.3	Low	67.5	Low	91 Å²	91	84.7 Å²	84.7	48%	0.476	46%	0.462	S	S	.	.			trans	-62.2	129.4	171.8	-84.9	86.7	0	0	0	109.7	H69	L48-H69 PolarHBondContact O-CE1 2.91Å
49	F	78.4	Confident	70.9	Confident	104 Å²	104	83.2 Å²	83.2	46%	0.456	45%	0.447	S	S	.	.			trans	-116	120	-177.4	-173.1	-88.4	0	0	0	109.6	V47 V51 Q129 K157	V47-F49 PolarHBondContact O-N 3.4Å; F49-V51 HydrophobicContact CD1-CG2 3.98Å; F49-V51 HydrophobicContact CE1-CG2 3.84Å; F49-Q129 HydrophobicContact CE1-CB 3.79Å; F49-Q129 HydrophobicContact CZ-CB 3.82Å; F49-Q129 HydrophobicContact CZ-CG 4.45Å; F49-Q129 VanDerWaalsContact CZ-OE1 3.29Å; F49-K157 HydrophobicContact CE2-CD 3.5Å; F49-K157 VanDerWaalsContact CE2-CD 3.5Å; F49-K157 HydrophobicContact CZ-CD 3.69Å
50	H	93.4	Very high	73.8	Confident	33 Å²	33	79.4 Å²	79.4	15%	0.153	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	149.3	-178.5	-56.7	-45.2	0	0	0	110.9	H69 G127 T128 Q129	H50-H69 AromaticContact CD2-ND1 3.92Å; H50-H69 AromaticContact NE2-ND1 3.71Å; H50-G127 PolarHBondContact N-O 3.31Å; H50-T128 HydrophobicContact CB-CG2 4.21Å; H50-T128 CarbonylContact O-C 3.57Å; H50-T128 WeakPolarHBondContact O-CA 3.44Å; H50-Q129 PolarHBondContact O-N 3.1Å
51	V	96.4	Very high	76.9	Confident	38 Å²	38	77.1 Å²	77.1	23%	0.23	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	125.5	177.4	-174.5	0	0	0	0	108.5	F49 Q129 E132	F49-V51 HydrophobicContact CD1-CG2 3.98Å; F49-V51 HydrophobicContact CE1-CG2 3.84Å; V51-Q129 HydrophobicContact CG1-CB 4.5Å; V51-Q129 HydrophobicContact CG2-CB 4.31Å; V51-E132 HydrophobicContact CG1-CB 4.14Å; V51-E132 HydrophobicContact CG1-CG 4.07Å
52	N	97.6	Very high	79.6	Confident	3 Å²	3	72 Å²	72	2%	0.016	41%	0.405	C	S	.	.			trans	-66.2	133	170	176.5	31.6	0	0	0	110.2	S54 G55 T62 Q129 F130	N52-S54 PolarHBondContact OD1-N 2.84Å; N52-S54 PolarHBondContact OD1-OG 3.23Å; N52-G55 PolarHBondContact ND2-O 3.05Å; N52-T62 HydrophobicContact CB-CG2 4.19Å; N52-Q129 WeakPolarHBondContact CB-O 3.44Å; N52-Q129 PolarHBondContact N-O 2.9Å; N52-F130 WeakPolarHBondContact CB-O 3.46Å; N52-F130 PolarHBondContact ND2-O 3Å; N52-F130 VanDerWaalsContact ND2-O 3.11Å
53	K	96.8	Very high	82.4	Confident	149 Å²	149	70 Å²	70	65%	0.648	39%	0.387	S	S	*	.			trans	-129.5	5.8	173.8	-51.5	-166.7	-173	-147.7	0	112.9	E132	K53-E132 WeakPolarHBondContact CD-OE1 3.49Å; K53-E132 WeakPolarHBondContact CE-OE1 3.48Å; K53-E132 IonicContact NZ-OE1 2.79Å; K53-E132 PolarHBondContact NZ-OE1 2.85Å
54	S	96.4	Very high	85.2	Confident	46 Å²	46	66.7 Å²	66.7	32%	0.322	37%	0.374	S	S	.	.	S	Bend	trans	-87.8	-12	-178	65.1	0	0	0	0	113.7	N52 D59	N52-S54 PolarHBondContact OD1-N 2.84Å; N52-S54 PolarHBondContact OD1-OG 3.23Å; S54-D59 VanDerWaalsContact CB-CG 3.48Å; S54-D59 WeakPolarHBondContact CB-OD2 3.49Å; S54-D59 PolarHBondContact OG-N 3.1Å
55	G	96.1	Very high	87.8	Confident	25 Å²	25	66.8 Å²	66.8	26%	0.258	37%	0.37	S	S	.	.			trans	80.1	-144.4	-170.6	0	0	0	0	0	111.1	N52	N52-G55 PolarHBondContact ND2-O 3.05Å
56	F	97.8	Very high	90.2	Very high	51 Å²	51	66.5 Å²	66.5	22%	0.224	36%	0.363	C	S	.	.	S	Bend	trans	-135.5	134	-179.7	-58.3	-77.4	0	0	0	110	I58 F130 F131 E148 E152 L154	F56-I58 HydrophobicContact CD1-CG1 4Å; F56-I58 HydrophobicContact CE1-CD1 4.3Å; F56-I58 HydrophobicContact CE1-CG1 4.08Å; F56-F130 HydrophobicContact CE1-CB 4.32Å; F56-F130 HydrophobicContact CZ-CB 4.13Å; F56-F130 VanDerWaalsContact CZ-O 3.29Å; F56-F130 WeakPolarHBondContact CZ-O 3.36Å; F56-F131 HydrophobicContact CD2-CE1 4.5Å; F56-F131 AromaticContact CE2-CD1 3.62Å; F56-F131 HydrophobicContact CE2-CD1 3.62Å; F56-F131 AromaticContact CE2-CE1 3.42Å; F56-F131 HydrophobicContact CE2-CE1 3.42Å; F56-F131 VanDerWaalsContact CE2-CE1 3.42Å; F56-F131 HydrophobicContact CE2-CZ 4.35Å; F56-F131 AromaticContact CZ-CD1 3.73Å; F56-F131 HydrophobicContact CZ-CD1 3.73Å; F56-F131 AromaticContact CZ-CE1 3.44Å; F56-F131 HydrophobicContact CZ-CE1 3.44Å; F56-F131 VanDerWaalsContact CZ-CE1 3.44Å; F56-F131 HydrophobicContact CZ-CG 4.45Å; F56-F131 AromaticContact CZ-CZ 3.97Å; F56-F131 HydrophobicContact CZ-CZ 3.97Å; F56-E148 HydrophobicContact CD2-CG 4.19Å; F56-E148 HydrophobicContact CE2-CG 4.1Å; F56-E152 HydrophobicContact CB-CG 4.42Å; F56-E152 HydrophobicContact CD1-CG 4.49Å; F56-E152 HydrophobicContact CD2-CG 3.74Å; F56-E152 HydrophobicContact CE2-CG 4.13Å; F56-E152 HydrophobicContact CG-CG 3.94Å; F56-L154 HydrophobicContact CD1-CD1 4.04Å; F56-L154 HydrophobicContact CE1-CD1 3.37Å; F56-L154 HydrophobicContact CZ-CD1 4.04Å
57	P	98	Very high	92.6	Very high	126 Å²	126	65 Å²	65	82%	0.818	34%	0.339	S	S	*	.	S	Bend	cis	-63.4	152.9	-4.1	29.7	-36.6	0	0	0	112.8
58	I	98.2	Very high	94.6	Very high	37 Å²	37	66.5 Å²	66.5	19%	0.19	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-68.1	136.4	-177.5	-57.6	177.3	0	0	0	109.9	F56 T62 F130	F56-I58 HydrophobicContact CD1-CG1 4Å; F56-I58 HydrophobicContact CE1-CD1 4.3Å; F56-I58 HydrophobicContact CE1-CG1 4.08Å; I58-T62 HydrophobicContact CG2-CG2 3.75Å; I58-F130 HydrophobicContact CD1-CD1 3.74Å; I58-F130 HydrophobicContact CD1-CE1 3.92Å
59	D	98.1	Very high	96.1	Very high	66 Å²	66	63.5 Å²	63.5	35%	0.353	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-63.9	151.4	177.9	72.5	18	0	0	0	113.4	S54 H61 T62 W63	S54-D59 VanDerWaalsContact CB-CG 3.48Å; S54-D59 WeakPolarHBondContact CB-OD2 3.49Å; S54-D59 PolarHBondContact OG-N 3.1Å; D59-H61 PolarHBondContact O-N 2.93Å; D59-T62 PolarHBondContact O-N 3.37Å; D59-T62 VanDerWaalsContact O-N 3.16Å; D59-T62 WeakPolarHBondContact OD1-CA 3.47Å; D59-T62 WeakPolarHBondContact OD1-CB 3.44Å; D59-T62 PolarHBondContact OD1-N 2.96Å; D59-T62 PolarHBondContact OD1-OG1 2.92Å; D59-W63 WeakPolarHBondContact O-CB 3.35Å; D59-W63 PolarHBondContact O-N 3.03Å
60	S	98.2	Very high	96.9	Very high	95 Å²	95	60 Å²	60	66%	0.664	31%	0.312	S	S	*	.	H	α-helix	trans	-56.8	-36	-176.9	-46.7	0	0	0	0	112.3	W63 E64	S60-W63 PolarHBondContact O-N 3.12Å; S60-E64 WeakPolarHBondContact O-CB 3.33Å; S60-E64 VanDerWaalsContact O-CG 3.32Å; S60-E64 WeakPolarHBondContact O-CG 3.5Å; S60-E64 PolarHBondContact O-N 2.88Å
61	H	97.9	Very high	97	Very high	121 Å²	121	60.2 Å²	60.2	56%	0.56	32%	0.319	S	S	*	.	H	α-helix	trans	-64.6	-46.4	178.9	169.3	-115.8	0	0	0	112.4	D59 R65	D59-H61 PolarHBondContact O-N 2.93Å; H61-R65 WeakPolarHBondContact O-CB 3.33Å; H61-R65 PolarHBondContact O-N 3.49Å
62	T	97.1	Very high	97	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-70.9	-35.9	177.5	-58.9	0	0	0	0	111.2	N52 I58 D59 R65 M66 T128	N52-T62 HydrophobicContact CB-CG2 4.19Å; I58-T62 HydrophobicContact CG2-CG2 3.75Å; D59-T62 PolarHBondContact O-N 3.37Å; D59-T62 VanDerWaalsContact O-N 3.16Å; D59-T62 WeakPolarHBondContact OD1-CA 3.47Å; D59-T62 WeakPolarHBondContact OD1-CB 3.44Å; D59-T62 PolarHBondContact OD1-N 2.96Å; D59-T62 PolarHBondContact OD1-OG1 2.92Å; T62-R65 PolarHBondContact O-N 2.99Å; T62-R65 PolarHBondContact OG1-NH2 2.86Å; T62-R65 VanDerWaalsContact OG1-NH2 3.16Å; T62-M66 WeakPolarHBondContact O-CB 3.48Å; T62-M66 PolarHBondContact O-N 3.12Å; T62-T128 HydrophobicContact CG2-CG2 4.21Å
63	W	98	Very high	96.8	Very high	103 Å²	103	71.6 Å²	71.6	39%	0.39	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-52.3	174.1	-175.6	-104.6	0	0	0	112.2	D59 S60 R65 M66 W67	D59-W63 WeakPolarHBondContact O-CB 3.35Å; D59-W63 PolarHBondContact O-N 3.03Å; S60-W63 PolarHBondContact O-N 3.12Å; W63-R65 PolarHBondContact O-N 2.97Å; W63-M66 HydrophobicContact CD2-CE 4.37Å; W63-M66 HydrophobicContact CE3-CE 3.67Å; W63-M66 HydrophobicContact CH2-CE 4.24Å; W63-M66 HydrophobicContact CZ3-CE 3.6Å; W63-M66 WeakPolarHBondContact O-CB 3.31Å; W63-M66 PolarHBondContact O-N 3.15Å; W63-W67 AromaticContact CD1-CD1 3.86Å; W63-W67 AromaticContact CD2-NE1 3.68Å; W63-W67 AromaticContact CE2-CD1 3.72Å; W63-W67 AromaticContact CE2-NE1 3.1Å; W63-W67 HydrophobicContact CH2-CZ2 4.34Å; W63-W67 AromaticContact CH2-NE1 3.78Å; W63-W67 AromaticContact CZ2-CE2 3.99Å; W63-W67 HydrophobicContact CZ2-CZ2 4.19Å; W63-W67 AromaticContact CZ2-NE1 3.18Å; W63-W67 AromaticContact NE1-CD1 3.6Å; W63-W67 AromaticContact NE1-NE1 3.39Å; W63-W67 PolarHBondContact O-N 3.07Å; W63-W67 VanDerWaalsContact O-N 3.13Å
64	E	97.8	Very high	96.6	Very high	75 Å²	75	68.3 Å²	68.3	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-42.5	175.9	-67.9	-45.2	130.6	0	0	111.7	S60 M66 W67 M68 R85	S60-E64 WeakPolarHBondContact O-CB 3.33Å; S60-E64 VanDerWaalsContact O-CG 3.32Å; S60-E64 WeakPolarHBondContact O-CG 3.5Å; S60-E64 PolarHBondContact O-N 2.88Å; E64-M66 VanDerWaalsContact C-N 3.33Å; E64-M66 PolarHBondContact O-N 3.36Å; E64-W67 PolarHBondContact O-N 3.03Å; E64-W67 VanDerWaalsContact O-N 3.16Å; E64-M68 HydrophobicContact CB-CE 4.41Å; E64-M68 WeakPolarHBondContact O-CB 3.4Å; E64-M68 WeakPolarHBondContact O-CG 3.32Å; E64-M68 PolarHBondContact O-N 3.17Å; E64-R85 VanDerWaalsContact CD-NH1 3.29Å; E64-R85 IonicContact OE1-CZ 2.93Å; E64-R85 IonicContact OE1-NH1 2.68Å; E64-R85 PolarHBondContact OE1-NH1 2.91Å; E64-R85 VanDerWaalsContact OE1-NH1 3.16Å; E64-R85 IonicContact OE1-NH2 3.74Å; E64-R85 PolarHBondContact OE1-NH2 3.28Å; E64-R85 IonicContact OE2-CZ 2.64Å; E64-R85 IonicContact OE2-NH1 3.62Å; E64-R85 PolarHBondContact OE2-NH1 3.46Å; E64-R85 IonicContact OE2-NH2 3.29Å
65	R	96.6	Very high	96.6	Very high	61 Å²	61	70 Å²	70	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-60.7	-39.2	177	179.3	172.4	55.6	-175.5	-6.2	112.7	H61 T62 W63 M68 H69	H61-R65 WeakPolarHBondContact O-CB 3.33Å; H61-R65 PolarHBondContact O-N 3.49Å; T62-R65 PolarHBondContact O-N 2.99Å; T62-R65 PolarHBondContact OG1-NH2 2.86Å; T62-R65 VanDerWaalsContact OG1-NH2 3.16Å; W63-R65 PolarHBondContact O-N 2.97Å; R65-M68 HydrophobicContact CB-CE 4.46Å; R65-H69 WeakPolarHBondContact O-CB 3.42Å; R65-H69 PolarHBondContact O-N 2.63Å
66	M	96.8	Very high	96.6	Very high	14 Å²	14	74.3 Å²	74.3	7%	0.069	38%	0.382	C	S	.	.	H	α-helix	trans	-60.6	-50.2	172.5	179.8	-179.6	69.2	0	0	110.7	T62 W63 E64 M68 H69 V70 T126 T128 F130	T62-M66 WeakPolarHBondContact O-CB 3.48Å; T62-M66 PolarHBondContact O-N 3.12Å; W63-M66 HydrophobicContact CD2-CE 4.37Å; W63-M66 HydrophobicContact CE3-CE 3.67Å; W63-M66 HydrophobicContact CH2-CE 4.24Å; W63-M66 HydrophobicContact CZ3-CE 3.6Å; W63-M66 WeakPolarHBondContact O-CB 3.31Å; W63-M66 PolarHBondContact O-N 3.15Å; E64-M66 VanDerWaalsContact C-N 3.33Å; E64-M66 PolarHBondContact O-N 3.36Å; M66-M68 PolarHBondContact O-N 2.93Å; M66-H69 WeakPolarHBondContact O-CB 3.42Å; M66-H69 PolarHBondContact O-N 3.46Å; M66-V70 WeakPolarHBondContact O-CG2 3.36Å; M66-V70 PolarHBondContact O-N 3.21Å; M66-T126 HydrophobicContact SD-CG2 4.45Å; M66-T128 HydrophobicContact CB-CG2 4.47Å; M66-T128 WeakPolarHBondContact CB-OG1 3.38Å; M66-T128 WeakPolarHBondContact CG-OG1 3.43Å; M66-F130 HydrophobicContact SD-CE1 3.79Å; M66-F130 HydrophobicContact SD-CZ 3.98Å
67	W	97.4	Very high	96.5	Very high	29 Å²	29	72.2 Å²	72.2	11%	0.11	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-38.2	-178.9	-73.7	115.3	0	0	0	113.3	W63 E64 V70 A71 V81 I84 R85	W63-W67 AromaticContact CD1-CD1 3.86Å; W63-W67 AromaticContact CD2-NE1 3.68Å; W63-W67 AromaticContact CE2-CD1 3.72Å; W63-W67 AromaticContact CE2-NE1 3.1Å; W63-W67 HydrophobicContact CH2-CZ2 4.34Å; W63-W67 AromaticContact CH2-NE1 3.78Å; W63-W67 AromaticContact CZ2-CE2 3.99Å; W63-W67 HydrophobicContact CZ2-CZ2 4.19Å; W63-W67 AromaticContact CZ2-NE1 3.18Å; W63-W67 AromaticContact NE1-CD1 3.6Å; W63-W67 AromaticContact NE1-NE1 3.39Å; W63-W67 PolarHBondContact O-N 3.07Å; W63-W67 VanDerWaalsContact O-N 3.13Å; E64-W67 PolarHBondContact O-N 3.03Å; E64-W67 VanDerWaalsContact O-N 3.16Å; W67-V70 PolarHBondContact O-N 3.33Å; W67-A71 VanDerWaalsContact O-CB 3.23Å; W67-A71 WeakPolarHBondContact O-CB 3.45Å; W67-A71 PolarHBondContact O-N 2.98Å; W67-V81 HydrophobicContact CB-CG1 4.22Å; W67-V81 HydrophobicContact CD2-CG1 4.11Å; W67-V81 HydrophobicContact CE3-CB 4.1Å; W67-V81 HydrophobicContact CE3-CG1 3.63Å; W67-V81 HydrophobicContact CE3-CG2 3.62Å; W67-V81 HydrophobicContact CG-CG1 4.39Å; W67-V81 HydrophobicContact CZ3-CB 4.43Å; W67-V81 HydrophobicContact CZ3-CG1 4.29Å; W67-V81 HydrophobicContact CZ3-CG2 4.01Å; W67-I84 HydrophobicContact CH2-CB 4.03Å; W67-I84 HydrophobicContact CH2-CD1 4.43Å; W67-I84 HydrophobicContact CH2-CG2 3.78Å; W67-I84 HydrophobicContact CZ2-CG2 4.39Å; W67-R85 HydrophobicContact CD2-CG 3.91Å; W67-R85 HydrophobicContact CE3-CG 4.34Å; W67-R85 HydrophobicContact CG-CG 4.39Å; W67-R85 HydrophobicContact CH2-CG 4.2Å; W67-R85 HydrophobicContact CZ2-CG 3.78Å; W67-R85 HydrophobicContact CZ3-CG 4.46Å
68	M	96.1	Very high	96.3	Very high	125 Å²	125	69.1 Å²	69.1	62%	0.616	37%	0.366	S	S	*	.	H	α-helix	trans	-62	-41.1	172.3	-72.7	-171.7	-69.8	0	0	112.2	E64 R65 M66 K72	E64-M68 HydrophobicContact CB-CE 4.41Å; E64-M68 WeakPolarHBondContact O-CB 3.4Å; E64-M68 WeakPolarHBondContact O-CG 3.32Å; E64-M68 PolarHBondContact O-N 3.17Å; R65-M68 HydrophobicContact CB-CE 4.46Å; M66-M68 PolarHBondContact O-N 2.93Å; M68-K72 WeakPolarHBondContact O-CB 3.45Å; M68-K72 PolarHBondContact O-N 3.46Å; M68-K72 VanDerWaalsContact O-N 3.1Å
69	H	94.7	Very high	96.2	Very high	27 Å²	27	73.1 Å²	73.1	13%	0.125	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-52.9	175	178	102.8	0	0	0	111.3	L48 H50 R65 M66 A71 K72 V73	L48-H69 PolarHBondContact O-CE1 2.91Å; H50-H69 AromaticContact CD2-ND1 3.92Å; H50-H69 AromaticContact NE2-ND1 3.71Å; R65-H69 WeakPolarHBondContact O-CB 3.42Å; R65-H69 PolarHBondContact O-N 2.63Å; M66-H69 WeakPolarHBondContact O-CB 3.42Å; M66-H69 PolarHBondContact O-N 3.46Å; H69-A71 VanDerWaalsContact C-N 3.32Å; H69-A71 PolarHBondContact O-N 3.49Å; H69-K72 PolarHBondContact O-N 3.29Å; H69-K72 VanDerWaalsContact O-N 3.11Å; H69-V73 WeakPolarHBondContact O-CG2 3.32Å; H69-V73 PolarHBondContact O-N 2.87Å; H69-V73 VanDerWaalsContact O-N 3.08Å
70	V	95.1	Very high	96.2	Very high	32 Å²	32	72 Å²	72	19%	0.194	38%	0.376	C	S	.	.	H	α-helix	trans	-65.9	-36.3	-177.7	-171.3	0	0	0	0	111.1	M66 W67 K72 V73 H74 M80 T126	M66-V70 WeakPolarHBondContact O-CG2 3.36Å; M66-V70 PolarHBondContact O-N 3.21Å; W67-V70 PolarHBondContact O-N 3.33Å; V70-K72 VanDerWaalsContact C-N 3.29Å; V70-K72 PolarHBondContact O-N 2.72Å; V70-V73 PolarHBondContact O-N 3.3Å; V70-H74 VanDerWaalsContact O-CB 3.26Å; V70-H74 WeakPolarHBondContact O-CB 3.29Å; V70-H74 PolarHBondContact O-N 3.42Å; V70-M80 HydrophobicContact CG1-CE 3.53Å; V70-T126 WeakPolarHBondContact CG2-O 3.45Å
71	A	96.2	Very high	96.2	Very high	37 Å²	37	68.2 Å²	68.2	31%	0.306	35%	0.35	S	S	.	.	H	α-helix	trans	-62.4	-32.2	173.5	0	0	0	0	0	113.4	W67 H69 G77 V81	W67-A71 VanDerWaalsContact O-CB 3.23Å; W67-A71 WeakPolarHBondContact O-CB 3.45Å; W67-A71 PolarHBondContact O-N 2.98Å; H69-A71 VanDerWaalsContact C-N 3.32Å; H69-A71 PolarHBondContact O-N 3.49Å; A71-G77 WeakPolarHBondContact O-CA 3.48Å; A71-V81 HydrophobicContact CB-CG2 4Å
72	K	95.4	Very high	96.1	Very high	182 Å²	182	63.7 Å²	63.7	79%	0.791	34%	0.335	S	S	*	.	H	α-helix	trans	-78.1	-32.2	176.7	-175.8	175.3	179.5	177.8	0	113.1	M68 H69 V70	M68-K72 WeakPolarHBondContact O-CB 3.45Å; M68-K72 PolarHBondContact O-N 3.46Å; M68-K72 VanDerWaalsContact O-N 3.1Å; H69-K72 PolarHBondContact O-N 3.29Å; H69-K72 VanDerWaalsContact O-N 3.11Å; V70-K72 VanDerWaalsContact C-N 3.29Å; V70-K72 PolarHBondContact O-N 2.72Å
73	V	93.3	Very high	96.2	Very high	98 Å²	98	66.7 Å²	66.7	59%	0.594	36%	0.361	S	S	*	.	H	α-helix	trans	-88.2	-36.5	-176.3	175	0	0	0	0	112.4	H69 V70	H69-V73 WeakPolarHBondContact O-CG2 3.32Å; H69-V73 PolarHBondContact O-N 2.87Å; H69-V73 VanDerWaalsContact O-N 3.08Å; V70-V73 PolarHBondContact O-N 3.3Å
74	H	94.1	Very high	96.2	Very high	79 Å²	79	65 Å²	65	37%	0.366	36%	0.359	S	S	.	.	S	Bend	trans	-78	130.2	-176.6	-172.5	-114	0	0	0	111.9	V70 K76 G77 M80	V70-H74 VanDerWaalsContact O-CB 3.26Å; V70-H74 WeakPolarHBondContact O-CB 3.29Å; V70-H74 PolarHBondContact O-N 3.42Å; H74-K76 VanDerWaalsContact ND1-C 3.3Å; H74-K76 PolarHBondContact ND1-N 2.98Å; H74-K76 PolarHBondContact ND1-O 3.23Å; H74-K76 VanDerWaalsContact ND1-O 3.12Å; H74-K76 PolarHBondContact O-N 3.06Å; H74-K76 VanDerWaalsContact O-N 3.08Å; H74-G77 WeakPolarHBondContact O-CA 3.35Å; H74-G77 PolarHBondContact O-N 3.11Å; H74-M80 HydrophobicContact CB-CE 3.94Å
75	P	96.1	Very high	96.1	Very high	82 Å²	82	65.7 Å²	65.7	53%	0.532	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.7	-177.5	-27.7	36.2	0	0	0	115.5
76	K	96.5	Very high	96.1	Very high	116 Å²	116	69.1 Å²	69.1	50%	0.504	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	52.6	171.3	-76.8	172.7	152.5	-98.2	0	109.7	H74 E79 M80	H74-K76 VanDerWaalsContact ND1-C 3.3Å; H74-K76 PolarHBondContact ND1-N 2.98Å; H74-K76 PolarHBondContact ND1-O 3.23Å; H74-K76 VanDerWaalsContact ND1-O 3.12Å; H74-K76 PolarHBondContact O-N 3.06Å; H74-K76 VanDerWaalsContact O-N 3.08Å; K76-E79 HydrophobicContact CB-CB 4.45Å; K76-E79 WeakPolarHBondContact CD-OE2 3.29Å; K76-E79 WeakPolarHBondContact CE-OE2 3.21Å; K76-E79 WeakPolarHBondContact CG-OE2 3.36Å; K76-E79 IonicContact NZ-OE1 2.68Å; K76-E79 PolarHBondContact NZ-OE1 2.84Å; K76-E79 IonicContact NZ-OE2 2.95Å; K76-E79 PolarHBondContact NZ-OE2 2.9Å; K76-M80 VanDerWaalsContact O-CB 3.27Å; K76-M80 WeakPolarHBondContact O-CB 3Å; K76-M80 PolarHBondContact O-N 3.42Å; K76-M80 VanDerWaalsContact O-N 3.1Å
77	G	95	Very high	96.1	Very high	7 Å²	7	70.3 Å²	70.3	7%	0.072	39%	0.393	C	S	.	.	H	α-helix	trans	-55.3	-66.9	-169.2	0	0	0	0	0	114.2	A71 H74 E79 M80 V81	A71-G77 WeakPolarHBondContact O-CA 3.48Å; H74-G77 WeakPolarHBondContact O-CA 3.35Å; H74-G77 PolarHBondContact O-N 3.11Å; G77-E79 PolarHBondContact O-N 2.82Å; G77-M80 PolarHBondContact O-N 3.38Å; G77-V81 WeakPolarHBondContact O-CB 3.45Å; G77-V81 WeakPolarHBondContact O-CG2 3.37Å; G77-V81 PolarHBondContact O-N 3.03Å
78	G	93.6	Very high	96.1	Very high	61 Å²	61	74.9 Å²	74.9	63%	0.629	42%	0.424	S	S	*	.	H	α-helix	trans	-59.6	-40.6	-176.5	0	0	0	0	0	114.1	G82	G78-G82 PolarHBondContact O-N 3.25Å
79	E	96.6	Very high	96.1	Very high	120 Å²	120	77.9 Å²	77.9	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-58.3	-53.6	175.9	-179.1	-171.2	160.4	0	0	111.6	K76 G77 G82 A83	K76-E79 HydrophobicContact CB-CB 4.45Å; K76-E79 WeakPolarHBondContact CD-OE2 3.29Å; K76-E79 WeakPolarHBondContact CE-OE2 3.21Å; K76-E79 WeakPolarHBondContact CG-OE2 3.36Å; K76-E79 IonicContact NZ-OE1 2.68Å; K76-E79 PolarHBondContact NZ-OE1 2.84Å; K76-E79 IonicContact NZ-OE2 2.95Å; K76-E79 PolarHBondContact NZ-OE2 2.9Å; G77-E79 PolarHBondContact O-N 2.82Å; E79-G82 PolarHBondContact O-N 3.32Å; E79-A83 VanDerWaalsContact O-CB 3.29Å; E79-A83 WeakPolarHBondContact O-CB 3.28Å; E79-A83 PolarHBondContact O-N 3.3Å
80	M	97.6	Very high	96.2	Very high	42 Å²	42	81.8 Å²	81.8	21%	0.207	46%	0.456	C	S	.	.	H	α-helix	trans	-67.7	-41	-178.3	175	-77.2	-61.4	0	0	112	V70 H74 K76 G77 A83 I84	V70-M80 HydrophobicContact CG1-CE 3.53Å; H74-M80 HydrophobicContact CB-CE 3.94Å; K76-M80 VanDerWaalsContact O-CB 3.27Å; K76-M80 WeakPolarHBondContact O-CB 3Å; K76-M80 PolarHBondContact O-N 3.42Å; K76-M80 VanDerWaalsContact O-N 3.1Å; G77-M80 PolarHBondContact O-N 3.38Å; M80-A83 PolarHBondContact O-N 3Å; M80-I84 HydrophobicContact CG-CD1 4.31Å; M80-I84 WeakPolarHBondContact O-CG1 3.16Å; M80-I84 PolarHBondContact O-N 2.95Å; M80-I84 HydrophobicContact SD-CD1 3.64Å; M80-I84 HydrophobicContact SD-CG1 4.48Å
81	V	97.8	Very high	96.3	Very high	17 Å²	17	84.9 Å²	84.9	10%	0.103	48%	0.484	C	S	.	.	H	α-helix	trans	-65.8	-42.5	177.7	172.1	0	0	0	0	111.1	W67 A71 G77 I84 R85	W67-V81 HydrophobicContact CB-CG1 4.22Å; W67-V81 HydrophobicContact CD2-CG1 4.11Å; W67-V81 HydrophobicContact CE3-CB 4.1Å; W67-V81 HydrophobicContact CE3-CG1 3.63Å; W67-V81 HydrophobicContact CE3-CG2 3.62Å; W67-V81 HydrophobicContact CG-CG1 4.39Å; W67-V81 HydrophobicContact CZ3-CB 4.43Å; W67-V81 HydrophobicContact CZ3-CG1 4.29Å; W67-V81 HydrophobicContact CZ3-CG2 4.01Å; A71-V81 HydrophobicContact CB-CG2 4Å; G77-V81 WeakPolarHBondContact O-CB 3.45Å; G77-V81 WeakPolarHBondContact O-CG2 3.37Å; G77-V81 PolarHBondContact O-N 3.03Å; V81-I84 PolarHBondContact O-N 3.03Å; V81-R85 HydrophobicContact CG1-CG 4.13Å; V81-R85 VanDerWaalsContact O-CB 3.26Å; V81-R85 WeakPolarHBondContact O-CB 3.37Å; V81-R85 WeakPolarHBondContact O-CG 3.42Å; V81-R85 PolarHBondContact O-N 2.77Å
82	G	97.4	Very high	96.3	Very high	25 Å²	25	92.1 Å²	92.1	26%	0.258	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-45	173.6	0	0	0	0	0	112.3	G78 E79 I84 N86	G78-G82 PolarHBondContact O-N 3.25Å; E79-G82 PolarHBondContact O-N 3.32Å; G82-I84 VanDerWaalsContact C-N 3.34Å; G82-I84 PolarHBondContact O-N 2.62Å; G82-N86 VanDerWaalsContact O-CB 3.3Å; G82-N86 WeakPolarHBondContact O-CB 3.31Å; G82-N86 PolarHBondContact O-N 3.43Å
83	A	97.8	Very high	96.3	Very high	69 Å²	69	88.6 Å²	88.6	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-61.5	-36.7	180	0	0	0	0	0	113.4	E79 M80 A87	E79-A83 VanDerWaalsContact O-CB 3.29Å; E79-A83 WeakPolarHBondContact O-CB 3.28Å; E79-A83 PolarHBondContact O-N 3.3Å; M80-A83 PolarHBondContact O-N 3Å; A83-A87 WeakPolarHBondContact O-CB 3.37Å
84	I	98	Very high	96.5	Very high	67 Å²	67	88.8 Å²	88.8	34%	0.344	51%	0.51	S	S	.	.	H	α-helix	trans	-83.2	-46.3	177.6	-59.2	174.5	0	0	0	111.4	W67 M80 V81 G82 N86 A87 L90	W67-I84 HydrophobicContact CH2-CB 4.03Å; W67-I84 HydrophobicContact CH2-CD1 4.43Å; W67-I84 HydrophobicContact CH2-CG2 3.78Å; W67-I84 HydrophobicContact CZ2-CG2 4.39Å; M80-I84 HydrophobicContact CG-CD1 4.31Å; M80-I84 WeakPolarHBondContact O-CG1 3.16Å; M80-I84 PolarHBondContact O-N 2.95Å; M80-I84 HydrophobicContact SD-CD1 3.64Å; M80-I84 HydrophobicContact SD-CG1 4.48Å; V81-I84 PolarHBondContact O-N 3.03Å; G82-I84 VanDerWaalsContact C-N 3.34Å; G82-I84 PolarHBondContact O-N 2.62Å; I84-N86 PolarHBondContact O-N 2.93Å; I84-A87 PolarHBondContact O-N 3.27Å; I84-L90 HydrophobicContact CG2-CD1 4Å; I84-L90 HydrophobicContact CG2-CD2 4.35Å
85	R	97.1	Very high	96.6	Very high	89 Å²	89	90.3 Å²	90.3	34%	0.336	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-30.7	-173.6	-72.5	-171	66.6	157.9	0.5	114.2	E64 W67 V81	E64-R85 VanDerWaalsContact CD-NH1 3.29Å; E64-R85 IonicContact OE1-CZ 2.93Å; E64-R85 IonicContact OE1-NH1 2.68Å; E64-R85 PolarHBondContact OE1-NH1 2.91Å; E64-R85 VanDerWaalsContact OE1-NH1 3.16Å; E64-R85 IonicContact OE1-NH2 3.74Å; E64-R85 PolarHBondContact OE1-NH2 3.28Å; E64-R85 IonicContact OE2-CZ 2.64Å; E64-R85 IonicContact OE2-NH1 3.62Å; E64-R85 PolarHBondContact OE2-NH1 3.46Å; E64-R85 IonicContact OE2-NH2 3.29Å; W67-R85 HydrophobicContact CD2-CG 3.91Å; W67-R85 HydrophobicContact CE3-CG 4.34Å; W67-R85 HydrophobicContact CG-CG 4.39Å; W67-R85 HydrophobicContact CH2-CG 4.2Å; W67-R85 HydrophobicContact CZ2-CG 3.78Å; W67-R85 HydrophobicContact CZ3-CG 4.46Å; V81-R85 HydrophobicContact CG1-CG 4.13Å; V81-R85 VanDerWaalsContact O-CB 3.26Å; V81-R85 WeakPolarHBondContact O-CB 3.37Å; V81-R85 WeakPolarHBondContact O-CG 3.42Å; V81-R85 PolarHBondContact O-N 2.77Å
86	N	96.4	Very high	96.7	Very high	134 Å²	134	87.5 Å²	87.5	72%	0.717	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	4.8	-176.9	-55.4	-16.6	0	0	0	112.2	G82 I84 T88	G82-N86 VanDerWaalsContact O-CB 3.3Å; G82-N86 WeakPolarHBondContact O-CB 3.31Å; G82-N86 PolarHBondContact O-N 3.43Å; I84-N86 PolarHBondContact O-N 2.93Å; N86-T88 PolarHBondContact O-N 2.99Å
87	A	97.1	Very high	96.8	Very high	39 Å²	39	90.3 Å²	90.3	32%	0.322	52%	0.517	S	S	.	.			trans	-69.3	120.9	176.1	0	0	0	0	0	111	A83 I84 F89 L90	A83-A87 WeakPolarHBondContact O-CB 3.37Å; I84-A87 PolarHBondContact O-N 3.27Å; A87-F89 PolarHBondContact O-N 3.45Å; A87-L90 HydrophobicContact CB-CD2 3.61Å; A87-L90 HydrophobicContact CB-CG 3.9Å
88	T	96.6	Very high	96.9	Very high	124 Å²	124	92.9 Å²	92.9	76%	0.761	53%	0.531	S	S	*	.	S	Bend	trans	-66.7	-27.1	171.2	46	0	0	0	0	112.7	N86	N86-T88 PolarHBondContact O-N 2.99Å
89	F	95.8	Very high	97.1	Very high	188 Å²	188	91.1 Å²	91.1	83%	0.825	51%	0.508	S	S	*	.			trans	-132.7	98.6	-178.2	-55.3	-69.1	0	0	0	110.8	A87	A87-F89 PolarHBondContact O-N 3.45Å
90	L	96.9	Very high	97	Very high	110 Å²	110	91.5 Å²	91.5	58%	0.576	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-98.5	141.1	163.6	-65.5	177.2	0	0	0	109.3	I84 A87 K92	I84-L90 HydrophobicContact CG2-CD1 4Å; I84-L90 HydrophobicContact CG2-CD2 4.35Å; A87-L90 HydrophobicContact CB-CD2 3.61Å; A87-L90 HydrophobicContact CB-CG 3.9Å; L90-K92 PolarHBondContact O-N 2.93Å
91	A	97	Very high	96.9	Very high	97 Å²	97	92.6 Å²	92.6	80%	0.802	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-63.8	118.5	174	0	0	0	0	0	109.9	P93	A91-P93 VanDerWaalsContact O-CD 3.28Å; A91-P93 WeakPolarHBondContact O-CD 3.35Å
92	K	96.3	Very high	96.8	Very high	189 Å²	189	100.1 Å²	100.1	82%	0.822	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-63.9	119.6	177.3	-177.9	176.4	179.1	177.7	0	109.5	L90	L90-K92 PolarHBondContact O-N 2.93Å
93	P	95.9	Very high	96.5	Very high	108 Å²	108	107.1 Å²	107.1	70%	0.701	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-61.4	143.5	177.5	-23.6	35.1	0	0	0	111.8	A91 I95	A91-P93 VanDerWaalsContact O-CD 3.28Å; A91-P93 WeakPolarHBondContact O-CD 3.35Å; P93-I95 PolarHBondContact O-N 2.86Å
94	S	96.4	Very high	96.4	Very high	102 Å²	102	109 Å²	109	71%	0.713	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.1	170.4	54.1	0	0	0	0	110.1	P96	S94-P96 VanDerWaalsContact O-CD 3.31Å; S94-P96 WeakPolarHBondContact O-CD 3.33Å
95	I	97.4	Very high	96.3	Very high	111 Å²	111	108 Å²	108	57%	0.569	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-72.8	116.1	173	-56.8	178.1	0	0	0	107.9	P93	P93-I95 PolarHBondContact O-N 2.86Å
96	P	97.5	Very high	96.3	Very high	23 Å²	23	107.2 Å²	107.2	15%	0.149	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-65.4	137.1	177	26.3	-32.7	0	0	0	110.7	S94 V98 Y117 T120 L121	S94-P96 VanDerWaalsContact O-CD 3.31Å; S94-P96 WeakPolarHBondContact O-CD 3.33Å; P96-V98 PolarHBondContact O-N 2.83Å; P96-Y117 HydrophobicContact CB-CD2 3.88Å; P96-Y117 HydrophobicContact CB-CE2 3.8Å; P96-Y117 HydrophobicContact CG-CD2 4.16Å; P96-Y117 HydrophobicContact CG-CE2 3.7Å; P96-T120 HydrophobicContact CB-CG2 3.79Å; P96-T120 HydrophobicContact CG-CG2 4.16Å; P96-L121 HydrophobicContact CG-CD2 3.98Å
97	Q	97.6	Very high	96.3	Very high	174 Å²	174	102.1 Å²	102.1	81%	0.813	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-64.6	129.6	172.4	-70.6	-63.2	-31.7	0	0	109.8	Y117	Q97-Y117 WeakPolarHBondContact O-CD2 3.42Å
98	V	98.3	Very high	96.4	Very high	61 Å²	61	103.7 Å²	103.7	37%	0.37	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-62.7	125.2	176.3	-172.8	0	0	0	0	108.1	P96 N100 Y117 T150 L168	P96-V98 PolarHBondContact O-N 2.83Å; V98-N100 PolarHBondContact O-N 2.83Å; V98-Y117 HydrophobicContact CG2-CE2 4.38Å; V98-T150 HydrophobicContact CG1-CG2 4.12Å; V98-T150 HydrophobicContact CG2-CG2 4.22Å; V98-L168 HydrophobicContact CG1-CD2 3.77Å
99	P	97.7	Very high	96.4	Very high	24 Å²	24	101.9 Å²	101.9	16%	0.156	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-64	139.7	-179.7	27.4	-34.9	0	0	0	109.2	W110 A113 I114 Y117 L168	P99-W110 HydrophobicContact CB-CH2 4.02Å; P99-W110 HydrophobicContact CB-CZ3 3.71Å; P99-W110 WeakPolarHBondContact O-CH2 3.27Å; P99-A113 HydrophobicContact CB-CB 4.38Å; P99-I114 HydrophobicContact CG-CG1 4.21Å; P99-Y117 VanDerWaalsContact CD-CG 3.43Å; P99-Y117 HydrophobicContact CG-CD1 4.45Å; P99-Y117 HydrophobicContact CG-CG 4.06Å; P99-L168 HydrophobicContact CG-CD1 4.26Å; P99-L168 HydrophobicContact CG-CD2 4.38Å
100	N	95.1	Very high	96.6	Very high	128 Å²	128	93.2 Å²	93.2	68%	0.684	51%	0.509	S	S	*	.			trans	-131.6	132.5	174.5	-173.1	12.1	0	0	0	109.6	V98 W110	V98-N100 PolarHBondContact O-N 2.83Å; N100-W110 VanDerWaalsContact C-CH2 3.47Å
101	Y	95.4	Very high	96.7	Very high	65 Å²	65	88.9 Å²	88.9	26%	0.255	49%	0.486	S	S	.	.			trans	-68.3	142.4	-174.9	-179.2	-103.9	0	0	0	111.1	L103 M105 I107 W110 Q172	Y101-L103 HydrophobicContact CE1-CD2 4.3Å; Y101-M105 HydrophobicContact CE2-CB 4.32Å; Y101-I107 HydrophobicContact CE2-CD1 4.1Å; Y101-W110 HydrophobicContact CD2-CB 3.89Å; Y101-W110 AromaticContact CD2-CD1 3.82Å; Y101-W110 AromaticContact CD2-CD2 3.72Å; Y101-W110 HydrophobicContact CD2-CD2 3.72Å; Y101-W110 HydrophobicContact CD2-CE3 4.23Å; Y101-W110 AromaticContact CD2-CG 3.54Å; Y101-W110 HydrophobicContact CD2-CG 3.54Å; Y101-W110 HydrophobicContact CE2-CB 4.16Å; Y101-W110 HydrophobicContact CE2-CG 4.19Å; Y101-W110 HydrophobicContact CG-CD2 4.34Å; Y101-W110 VanDerWaalsContact N-CZ3 3.26Å; Y101-Q172 VanDerWaalsContact CB-NE2 3.28Å; Y101-Q172 VanDerWaalsContact CD1-NE2 3.29Å; Y101-Q172 HydrophobicContact CG-CG 4.47Å
102	R	94.5	Very high	96.7	Very high	175 Å²	175	88.5 Å²	88.5	66%	0.66	47%	0.468	S	S	*	.			trans	-127.6	145.5	173.6	-57	-179.2	-176.5	-174.6	-0.4	108.4	S104 M105	R102-S104 PolarHBondContact O-N 3.43Å; R102-M105 HydrophobicContact CB-CG 4.21Å; R102-M105 HydrophobicContact CB-SD 4.35Å; R102-M105 WeakPolarHBondContact O-CB 3.26Å; R102-M105 PolarHBondContact O-N 3.05Å
103	L	91.5	Very high	96.8	Very high	173 Å²	173	80.9 Å²	80.9	91%	0.906	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-17.1	178.9	-63.5	175.1	0	0	0	113.6	Y101	Y101-L103 HydrophobicContact CE1-CD2 4.3Å
104	S	95	Very high	97	Very high	109 Å²	109	75.8 Å²	75.8	76%	0.762	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.8	174.5	64.5	0	0	0	0	114.8	R102	R102-S104 PolarHBondContact O-N 3.43Å
105	M	96.6	Very high	97.1	Very high	45 Å²	45	71 Å²	71	22%	0.222	37%	0.374	C	S	.	.	S	Bend	trans	-98.7	140.8	178.5	-62.8	179.2	72.5	0	0	110.5	Y101 R102 D109 W110 A113	Y101-M105 HydrophobicContact CE2-CB 4.32Å; R102-M105 HydrophobicContact CB-CG 4.21Å; R102-M105 HydrophobicContact CB-SD 4.35Å; R102-M105 WeakPolarHBondContact O-CB 3.26Å; R102-M105 PolarHBondContact O-N 3.05Å; M105-D109 HydrophobicContact CE-CB 4.41Å; M105-W110 HydrophobicContact CE-CE3 4.05Å; M105-W110 HydrophobicContact SD-CE3 4.26Å; M105-A113 HydrophobicContact CE-CB 4.05Å
106	T	97.1	Very high	97.2	Very high	72 Å²	72	69.3 Å²	69.3	44%	0.442	37%	0.366	S	S	.	.			trans	-76.2	159.9	167.8	78	0	0	0	0	110.6	P108 D109 W110	T106-P108 WeakPolarHBondContact OG1-CD 3.29Å; T106-D109 VanDerWaalsContact CB-OD2 3.27Å; T106-D109 WeakPolarHBondContact CB-OD2 3.23Å; T106-D109 WeakPolarHBondContact CG2-OD2 3.33Å; T106-D109 PolarHBondContact N-OD2 2.97Å; T106-D109 VanDerWaalsContact N-OD2 3.15Å; T106-D109 PolarHBondContact O-N 2.91Å; T106-D109 PolarHBondContact OG1-N 3.22Å; T106-D109 PolarHBondContact OG1-OD2 3.33Å; T106-W110 WeakPolarHBondContact O-CB 3.25Å; T106-W110 PolarHBondContact O-N 3.21Å
107	I	97.5	Very high	97.2	Very high	28 Å²	28	68.7 Å²	68.7	14%	0.144	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-40.3	175.3	-59.3	-61.7	0	0	0	112.2	Y101 W110 L111 Q172 I175	Y101-I107 HydrophobicContact CE2-CD1 4.1Å; I107-W110 PolarHBondContact O-N 3.23Å; I107-L111 HydrophobicContact CG2-CD1 4.04Å; I107-L111 HydrophobicContact CG2-CG 4.39Å; I107-L111 VanDerWaalsContact O-CG 3.32Å; I107-L111 WeakPolarHBondContact O-CG 3.47Å; I107-L111 PolarHBondContact O-N 2.96Å; I107-Q172 HydrophobicContact CD1-CG 4.43Å; I107-I175 HydrophobicContact CD1-CD1 4.31Å; I107-I175 HydrophobicContact CD1-CG1 4.5Å; I107-I175 HydrophobicContact CG2-CD1 3.76Å; I107-I175 HydrophobicContact CG2-CG1 3.87Å
108	P	97.9	Very high	97.3	Very high	71 Å²	71	60.4 Å²	60.4	46%	0.461	32%	0.322	S	S	.	.	H	α-helix	trans	-55.3	-48.4	167.9	-30	36.7	0	0	0	114.4	T106 W110 L111 Q112	T106-P108 WeakPolarHBondContact OG1-CD 3.29Å; P108-W110 VanDerWaalsContact C-N 3.27Å; P108-W110 PolarHBondContact O-N 3.48Å; P108-L111 PolarHBondContact O-N 3.13Å; P108-Q112 WeakPolarHBondContact O-CB 3.43Å; P108-Q112 PolarHBondContact O-N 3.1Å
109	D	98	Very high	97.3	Very high	86 Å²	86	60.9 Å²	60.9	46%	0.46	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-36.4	179.5	-53.5	-46.4	0	0	0	111.6	M105 T106 Q112 A113	M105-D109 HydrophobicContact CE-CB 4.41Å; T106-D109 VanDerWaalsContact CB-OD2 3.27Å; T106-D109 WeakPolarHBondContact CB-OD2 3.23Å; T106-D109 WeakPolarHBondContact CG2-OD2 3.33Å; T106-D109 PolarHBondContact N-OD2 2.97Å; T106-D109 VanDerWaalsContact N-OD2 3.15Å; T106-D109 PolarHBondContact O-N 2.91Å; T106-D109 PolarHBondContact OG1-N 3.22Å; T106-D109 PolarHBondContact OG1-OD2 3.33Å; D109-Q112 PolarHBondContact O-N 2.84Å; D109-A113 WeakPolarHBondContact O-CB 3.47Å; D109-A113 PolarHBondContact O-N 2.68Å
110	W	98.4	Very high	97.3	Very high	7 Å²	7	63.4 Å²	63.4	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-47.8	176.2	177.8	-129.8	0	0	0	112.5	P99 N100 Y101 M105 T106 I107 P108 Q112 A113 I114 L168	P99-W110 HydrophobicContact CB-CH2 4.02Å; P99-W110 HydrophobicContact CB-CZ3 3.71Å; P99-W110 WeakPolarHBondContact O-CH2 3.27Å; N100-W110 VanDerWaalsContact C-CH2 3.47Å; Y101-W110 HydrophobicContact CD2-CB 3.89Å; Y101-W110 AromaticContact CD2-CD1 3.82Å; Y101-W110 AromaticContact CD2-CD2 3.72Å; Y101-W110 HydrophobicContact CD2-CD2 3.72Å; Y101-W110 HydrophobicContact CD2-CE3 4.23Å; Y101-W110 AromaticContact CD2-CG 3.54Å; Y101-W110 HydrophobicContact CD2-CG 3.54Å; Y101-W110 HydrophobicContact CE2-CB 4.16Å; Y101-W110 HydrophobicContact CE2-CG 4.19Å; Y101-W110 HydrophobicContact CG-CD2 4.34Å; Y101-W110 VanDerWaalsContact N-CZ3 3.26Å; M105-W110 HydrophobicContact CE-CE3 4.05Å; M105-W110 HydrophobicContact SD-CE3 4.26Å; T106-W110 WeakPolarHBondContact O-CB 3.25Å; T106-W110 PolarHBondContact O-N 3.21Å; I107-W110 PolarHBondContact O-N 3.23Å; P108-W110 VanDerWaalsContact C-N 3.27Å; P108-W110 PolarHBondContact O-N 3.48Å; W110-Q112 VanDerWaalsContact C-N 3.28Å; W110-Q112 PolarHBondContact O-N 3.47Å; W110-A113 HydrophobicContact CE3-CB 4.46Å; W110-A113 PolarHBondContact O-N 2.7Å; W110-I114 HydrophobicContact CD2-CD1 4.02Å; W110-I114 HydrophobicContact CD2-CG1 4.37Å; W110-I114 HydrophobicContact CG-CD1 4.39Å; W110-I114 HydrophobicContact CH2-CD1 4.38Å; W110-I114 HydrophobicContact CH2-CG1 4.26Å; W110-I114 HydrophobicContact CZ2-CD1 3.74Å; W110-I114 HydrophobicContact CZ2-CG1 4.12Å; W110-I114 WeakPolarHBondContact O-CG1 2.93Å; W110-I114 PolarHBondContact O-N 3.25Å; W110-L168 VanDerWaalsContact CZ2-O 3.27Å; W110-L168 WeakPolarHBondContact CZ2-O 3.46Å
111	L	98.6	Very high	97.5	Very high	18 Å²	18	57.6 Å²	57.6	9%	0.094	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-38.4	174.1	-69.5	169.8	0	0	0	111.1	I107 P108 I114 Q115 T169 I175 I198 L207	I107-L111 HydrophobicContact CG2-CD1 4.04Å; I107-L111 HydrophobicContact CG2-CG 4.39Å; I107-L111 VanDerWaalsContact O-CG 3.32Å; I107-L111 WeakPolarHBondContact O-CG 3.47Å; I107-L111 PolarHBondContact O-N 2.96Å; P108-L111 PolarHBondContact O-N 3.13Å; L111-I114 PolarHBondContact O-N 3.32Å; L111-Q115 WeakPolarHBondContact O-CB 3.33Å; L111-Q115 PolarHBondContact O-N 3.23Å; L111-T169 HydrophobicContact CD2-CG2 4.37Å; L111-I175 HydrophobicContact CD2-CD1 4.34Å; L111-I198 HydrophobicContact CD1-CG2 4.12Å; L111-I198 HydrophobicContact CD2-CD1 4.49Å; L111-I198 HydrophobicContact CD2-CG1 4.41Å; L111-L207 HydrophobicContact CB-CD2 4.4Å; L111-L207 HydrophobicContact CD2-CD1 3.86Å; L111-L207 HydrophobicContact CD2-CD2 4.35Å; L111-L207 HydrophobicContact CD2-CG 4.22Å; L111-L207 WeakPolarHBondContact O-CD2 3.4Å
112	Q	98.6	Very high	97.7	Very high	89 Å²	89	60.4 Å²	60.4	42%	0.416	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-40.4	175.4	-167.2	63.6	65.3	0	0	111.9	P108 D109 W110 Q115 N116	P108-Q112 WeakPolarHBondContact O-CB 3.43Å; P108-Q112 PolarHBondContact O-N 3.1Å; D109-Q112 PolarHBondContact O-N 2.84Å; W110-Q112 VanDerWaalsContact C-N 3.28Å; W110-Q112 PolarHBondContact O-N 3.47Å; Q112-Q115 PolarHBondContact O-N 3.13Å; Q112-N116 PolarHBondContact NE2-OD1 3.15Å; Q112-N116 VanDerWaalsContact O-CB 3.28Å; Q112-N116 WeakPolarHBondContact O-CB 3.37Å; Q112-N116 PolarHBondContact O-N 3.48Å; Q112-N116 PolarHBondContact O-OD1 3.36Å
113	A	98.7	Very high	97.8	Very high	30 Å²	30	53.8 Å²	53.8	25%	0.248	29%	0.294	C	S	.	.	H	α-helix	trans	-63.3	-42.9	175.8	0	0	0	0	0	112	P99 M105 D109 W110 N116 Y117	P99-A113 HydrophobicContact CB-CB 4.38Å; M105-A113 HydrophobicContact CE-CB 4.05Å; D109-A113 WeakPolarHBondContact O-CB 3.47Å; D109-A113 PolarHBondContact O-N 2.68Å; W110-A113 HydrophobicContact CE3-CB 4.46Å; W110-A113 PolarHBondContact O-N 2.7Å; A113-N116 PolarHBondContact O-N 3.48Å; A113-Y117 WeakPolarHBondContact O-CB 3.28Å; A113-Y117 PolarHBondContact O-N 2.75Å
114	I	98.8	Very high	98.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-47.4	172.9	-70.5	166.4	0	0	0	111.1	P99 W110 L111 N116 Y117 M118 L168 T169 L207	P99-I114 HydrophobicContact CG-CG1 4.21Å; W110-I114 HydrophobicContact CD2-CD1 4.02Å; W110-I114 HydrophobicContact CD2-CG1 4.37Å; W110-I114 HydrophobicContact CG-CD1 4.39Å; W110-I114 HydrophobicContact CH2-CD1 4.38Å; W110-I114 HydrophobicContact CH2-CG1 4.26Å; W110-I114 HydrophobicContact CZ2-CD1 3.74Å; W110-I114 HydrophobicContact CZ2-CG1 4.12Å; W110-I114 WeakPolarHBondContact O-CG1 2.93Å; W110-I114 PolarHBondContact O-N 3.25Å; L111-I114 PolarHBondContact O-N 3.32Å; I114-N116 VanDerWaalsContact C-N 3.33Å; I114-N116 PolarHBondContact O-N 2.81Å; I114-Y117 WeakPolarHBondContact O-CB 3.43Å; I114-Y117 PolarHBondContact O-N 3.11Å; I114-M118 HydrophobicContact CG2-CE 3.83Å; I114-M118 WeakPolarHBondContact O-CG 3.47Å; I114-M118 PolarHBondContact O-N 2.87Å; I114-L168 HydrophobicContact CD1-CB 3.99Å; I114-L168 HydrophobicContact CG1-CB 4.01Å; I114-L168 HydrophobicContact CG1-CD1 4.4Å; I114-L168 HydrophobicContact CG2-CB 4.23Å; I114-L168 HydrophobicContact CG2-CD1 3.89Å; I114-T169 HydrophobicContact CD1-CG2 3.58Å; I114-L207 HydrophobicContact CG2-CD1 3.78Å; I114-L207 HydrophobicContact CG2-CD2 4.43Å
115	Q	98.8	Very high	98.2	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-35.1	-179.2	-173.7	58.7	70.4	0	0	112.4	L111 Q112 M118 K119 L207 G208 D217	L111-Q115 WeakPolarHBondContact O-CB 3.33Å; L111-Q115 PolarHBondContact O-N 3.23Å; Q112-Q115 PolarHBondContact O-N 3.13Å; Q115-M118 PolarHBondContact O-N 3.32Å; Q115-K119 HydrophobicContact CG-CD 4.17Å; Q115-K119 WeakPolarHBondContact O-CB 3.5Å; Q115-K119 WeakPolarHBondContact O-CD 3.42Å; Q115-K119 VanDerWaalsContact O-CG 3.28Å; Q115-K119 WeakPolarHBondContact O-CG 3.34Å; Q115-K119 PolarHBondContact O-N 3.01Å; Q115-L207 HydrophobicContact CB-CD2 3.85Å; Q115-G208 PolarHBondContact NE2-O 2.99Å; Q115-G208 PolarHBondContact OE1-O 2.66Å; Q115-D217 HydrophobicContact CG-CB 3.62Å; Q115-D217 VanDerWaalsContact CG-CG 3.47Å
116	N	98.8	Very high	98.2	Very high	75 Å²	75	46.5 Å²	46.5	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-67.1	-40.8	174.7	-70.5	-1.9	0	0	0	110.7	Q112 A113 I114 M118 K119 T120	Q112-N116 PolarHBondContact NE2-OD1 3.15Å; Q112-N116 VanDerWaalsContact O-CB 3.28Å; Q112-N116 WeakPolarHBondContact O-CB 3.37Å; Q112-N116 PolarHBondContact O-N 3.48Å; Q112-N116 PolarHBondContact O-OD1 3.36Å; A113-N116 PolarHBondContact O-N 3.48Å; I114-N116 VanDerWaalsContact C-N 3.33Å; I114-N116 PolarHBondContact O-N 2.81Å; N116-M118 PolarHBondContact O-N 2.75Å; N116-K119 CarbonylContact O-C 3.59Å; N116-K119 WeakPolarHBondContact O-CB 3.49Å; N116-K119 PolarHBondContact O-N 2.95Å; N116-K119 VanDerWaalsContact O-N 3.14Å; N116-T120 PolarHBondContact O-N 2.68Å; N116-T120 PolarHBondContact O-OG1 2.93Å
117	Y	98.9	Very high	98.1	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.039	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-47.2	171.7	177.6	-100.8	0	0	0	112	P96 Q97 V98 P99 A113 I114 K119 T120 L121 T150 L164 L168	P96-Y117 HydrophobicContact CB-CD2 3.88Å; P96-Y117 HydrophobicContact CB-CE2 3.8Å; P96-Y117 HydrophobicContact CG-CD2 4.16Å; P96-Y117 HydrophobicContact CG-CE2 3.7Å; Q97-Y117 WeakPolarHBondContact O-CD2 3.42Å; V98-Y117 HydrophobicContact CG2-CE2 4.38Å; P99-Y117 VanDerWaalsContact CD-CG 3.43Å; P99-Y117 HydrophobicContact CG-CD1 4.45Å; P99-Y117 HydrophobicContact CG-CG 4.06Å; A113-Y117 WeakPolarHBondContact O-CB 3.28Å; A113-Y117 PolarHBondContact O-N 2.75Å; I114-Y117 WeakPolarHBondContact O-CB 3.43Å; I114-Y117 PolarHBondContact O-N 3.11Å; Y117-K119 VanDerWaalsContact C-N 3.32Å; Y117-K119 PolarHBondContact O-N 2.64Å; Y117-T120 PolarHBondContact O-N 3.41Å; Y117-T120 VanDerWaalsContact O-N 3.17Å; Y117-L121 HydrophobicContact CD1-CD1 4.23Å; Y117-L121 HydrophobicContact CE1-CD1 3.71Å; Y117-L121 HydrophobicContact CE1-CG 4.26Å; Y117-L121 PolarHBondContact O-N 3.36Å; Y117-T150 HydrophobicContact CE1-CG2 4.18Å; Y117-T150 WeakPolarHBondContact OH-CA 3.29Å; Y117-L164 HydrophobicContact CD1-CD2 4.41Å; Y117-L164 HydrophobicContact CE1-CD1 4.46Å; Y117-L164 HydrophobicContact CE1-CD2 4.11Å; Y117-L168 HydrophobicContact CD1-CD1 3.96Å; Y117-L168 HydrophobicContact CE1-CD1 4.35Å
118	M	98.8	Very high	98.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-40.3	173.8	-65.3	-179.2	-176.2	0	0	112.6	I114 Q115 N116 T120 L121 Q122 I156 A161 L164 G165 M209	I114-M118 HydrophobicContact CG2-CE 3.83Å; I114-M118 WeakPolarHBondContact O-CG 3.47Å; I114-M118 PolarHBondContact O-N 2.87Å; Q115-M118 PolarHBondContact O-N 3.32Å; N116-M118 PolarHBondContact O-N 2.75Å; M118-T120 VanDerWaalsContact C-N 3.33Å; M118-T120 PolarHBondContact O-N 3.46Å; M118-L121 PolarHBondContact O-N 3.44Å; M118-Q122 PolarHBondContact O-N 3.1Å; M118-I156 HydrophobicContact CB-CD1 4.43Å; M118-I156 HydrophobicContact CG-CD1 4.41Å; M118-A161 WeakPolarHBondContact CE-O 3.26Å; M118-A161 HydrophobicContact SD-CB 4.05Å; M118-L164 HydrophobicContact CE-CB 4.37Å; M118-L164 HydrophobicContact CE-CG 4.3Å; M118-L164 HydrophobicContact CG-CD2 4.15Å; M118-G165 VanDerWaalsContact CE-N 3.34Å; M118-M209 HydrophobicContact CB-CG 3.85Å; M118-M209 HydrophobicContact CB-SD 3.74Å; M118-M209 WeakPolarHBondContact O-CE 3.41Å; M118-M209 HydrophobicContact SD-CG 4.45Å
119	K	98.7	Very high	98.1	Very high	71 Å²	71	39.8 Å²	39.8	31%	0.309	21%	0.205	S	C	.	.	H	α-helix	trans	-64.4	-36.3	175.8	-74.5	163	176.9	168.9	0	111.8	Q115 N116 Y117 Q122 M209 M216 D217	Q115-K119 HydrophobicContact CG-CD 4.17Å; Q115-K119 WeakPolarHBondContact O-CB 3.5Å; Q115-K119 WeakPolarHBondContact O-CD 3.42Å; Q115-K119 VanDerWaalsContact O-CG 3.28Å; Q115-K119 WeakPolarHBondContact O-CG 3.34Å; Q115-K119 PolarHBondContact O-N 3.01Å; N116-K119 CarbonylContact O-C 3.59Å; N116-K119 WeakPolarHBondContact O-CB 3.49Å; N116-K119 PolarHBondContact O-N 2.95Å; N116-K119 VanDerWaalsContact O-N 3.14Å; Y117-K119 VanDerWaalsContact C-N 3.32Å; Y117-K119 PolarHBondContact O-N 2.64Å; K119-Q122 WeakPolarHBondContact O-CA 3.21Å; K119-Q122 PolarHBondContact O-N 2.97Å; K119-Q122 VanDerWaalsContact O-N 3.11Å; K119-M209 HydrophobicContact CG-SD 4.32Å; K119-M216 VanDerWaalsContact CE-CE 3.43Å; K119-M216 HydrophobicContact CG-CE 4.48Å; K119-D217 WeakPolarHBondContact CE-OD1 3.17Å; K119-D217 IonicContact NZ-OD1 2.69Å; K119-D217 PolarHBondContact NZ-OD1 3.02Å; K119-D217 IonicContact NZ-OD2 3.6Å; K119-D217 PolarHBondContact NZ-OD2 2.75Å
120	T	98.6	Very high	98.1	Very high	78 Å²	78	36.4 Å²	36.4	48%	0.479	19%	0.186	S	C	.	.	H	α-helix	trans	-71.5	-32.2	175.3	-52.5	0	0	0	0	113.2	P96 N116 Y117 M118 Q122	P96-T120 HydrophobicContact CB-CG2 3.79Å; P96-T120 HydrophobicContact CG-CG2 4.16Å; N116-T120 PolarHBondContact O-N 2.68Å; N116-T120 PolarHBondContact O-OG1 2.93Å; Y117-T120 PolarHBondContact O-N 3.41Å; Y117-T120 VanDerWaalsContact O-N 3.17Å; M118-T120 VanDerWaalsContact C-N 3.33Å; M118-T120 PolarHBondContact O-N 3.46Å; T120-Q122 PolarHBondContact O-N 3.15Å
121	L	98.6	Very high	98.1	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-24.1	167.3	-67	177.2	0	0	0	112.4	P96 Y117 M118 P155 I156 L164	P96-L121 HydrophobicContact CG-CD2 3.98Å; Y117-L121 HydrophobicContact CD1-CD1 4.23Å; Y117-L121 HydrophobicContact CE1-CD1 3.71Å; Y117-L121 HydrophobicContact CE1-CG 4.26Å; Y117-L121 PolarHBondContact O-N 3.36Å; M118-L121 PolarHBondContact O-N 3.44Å; L121-P155 WeakPolarHBondContact O-CA 3.49Å; L121-P155 WeakPolarHBondContact O-CG 3.3Å; L121-I156 HydrophobicContact CB-CD1 4.5Å; L121-I156 HydrophobicContact CB-CG1 4.36Å; L121-I156 HydrophobicContact CD1-CD1 3.98Å; L121-L164 HydrophobicContact CD1-CD2 3.67Å
122	Q	98.6	Very high	98	Very high	125 Å²	125	38.3 Å²	38.3	58%	0.584	20%	0.195	S	C	*	.			trans	72.9	156.7	-178.9	-44.8	177.4	11	0	0	114.8	M118 K119 T120 I156 M209	M118-Q122 PolarHBondContact O-N 3.1Å; K119-Q122 WeakPolarHBondContact O-CA 3.21Å; K119-Q122 PolarHBondContact O-N 2.97Å; K119-Q122 VanDerWaalsContact O-N 3.11Å; T120-Q122 PolarHBondContact O-N 3.15Å; Q122-I156 PolarHBondContact O-N 3.02Å; Q122-I156 VanDerWaalsContact O-N 3.13Å; Q122-M209 VanDerWaalsContact C-CE 3.42Å
123	Y	98.4	Very high	98	Very high	36 Å²	36	34.7 Å²	34.7	14%	0.141	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-77.2	128	170	-170.4	-82.8	0	0	0	109.8	H125 I156 K157 M209 S210 R211	Y123-H125 AromaticContact CD1-CE1 3.57Å; Y123-H125 AromaticContact CD1-ND1 3.82Å; Y123-H125 AromaticContact CD1-NE2 3.82Å; Y123-H125 PolarHBondContact O-N 3.46Å; Y123-H125 PolarHBondContact O-ND1 2.94Å; Y123-I156 WeakPolarHBondContact CA-O 3.3Å; Y123-K157 HydrophobicContact CE1-CD 4.48Å; Y123-K157 HydrophobicContact CE1-CG 4.23Å; Y123-K157 HydrophobicContact CE2-CB 4.33Å; Y123-K157 HydrophobicContact CE2-CG 4.41Å; Y123-M209 HydrophobicContact CD2-CB 4.15Å; Y123-S210 VanDerWaalsContact CD2-C 3.42Å; Y123-R211 HydrophobicContact CD1-CG 3.73Å; Y123-R211 HydrophobicContact CE1-CG 3.37Å; Y123-R211 HydrophobicContact CE2-CG 4.38Å; Y123-R211 HydrophobicContact CG-CG 4.38Å
124	N	98.1	Very high	97.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.			trans	-70.3	110	-179	179.1	-46.4	0	0	0	112.3	T126 T128 F130 P155 I156 K157	N124-T126 PolarHBondContact OD1-N 3.14Å; N124-T126 PolarHBondContact OD1-OG1 3.47Å; N124-T126 VanDerWaalsContact OD1-OG1 3.07Å; N124-T128 PolarHBondContact ND2-O 3.03Å; N124-T128 PolarHBondContact OD1-O 3.29Å; N124-F130 WeakPolarHBondContact ND2-CD2 3.23Å; N124-F130 VanDerWaalsContact ND2-CE2 3.26Å; N124-F130 WeakPolarHBondContact ND2-CE2 3.15Å; N124-P155 HydrophobicContact CB-CB 3.83Å; N124-P155 WeakPolarHBondContact CB-O 3.16Å; N124-P155 PolarHBondContact ND2-O 2.86Å; N124-P155 VanDerWaalsContact ND2-O 3.16Å; N124-I156 PolarHBondContact N-O 3.19Å; N124-K157 HydrophobicContact CB-CG 3.83Å; N124-K157 VanDerWaalsContact CG-NZ 3.32Å; N124-K157 WeakPolarHBondContact O-CE 3.48Å; N124-K157 PolarHBondContact O-NZ 3.04Å; N124-K157 PolarHBondContact OD1-NZ 2.95Å
125	H	96.6	Very high	97.6	Very high	135 Å²	135	44.5 Å²	44.5	63%	0.625	21%	0.211	S	C	*	.			trans	-103.1	6.9	176.8	-68.8	90.4	0	0	0	114.1	Y123 G127	Y123-H125 AromaticContact CD1-CE1 3.57Å; Y123-H125 AromaticContact CD1-ND1 3.82Å; Y123-H125 AromaticContact CD1-NE2 3.82Å; Y123-H125 PolarHBondContact O-N 3.46Å; Y123-H125 PolarHBondContact O-ND1 2.94Å; H125-G127 VanDerWaalsContact C-N 3.25Å; H125-G127 PolarHBondContact O-N 3.41Å
126	T	96.3	Very high	97.3	Very high	39 Å²	39	50.3 Å²	50.3	24%	0.239	24%	0.24	C	C	.	.	S	Bend	trans	-79	2	-171.8	67.1	0	0	0	0	115.1	M66 V70 N124 T128 F130	M66-T126 HydrophobicContact SD-CG2 4.45Å; V70-T126 WeakPolarHBondContact CG2-O 3.45Å; N124-T126 PolarHBondContact OD1-N 3.14Å; N124-T126 PolarHBondContact OD1-OG1 3.47Å; N124-T126 VanDerWaalsContact OD1-OG1 3.07Å; T126-T128 PolarHBondContact O-N 3.41Å; T126-T128 PolarHBondContact OG1-N 3.18Å; T126-T128 PolarHBondContact OG1-O 2.82Å; T126-T128 VanDerWaalsContact OG1-O 3.11Å; T126-F130 HydrophobicContact CG2-CZ 4.17Å
127	G	94.1	Very high	97.1	Very high	12 Å²	12	51.9 Å²	51.9	12%	0.124	24%	0.24	C	C	.	.	S	Bend	trans	69.9	-11.9	-168	0	0	0	0	0	115.2	H50 H125	H50-G127 PolarHBondContact N-O 3.31Å; H125-G127 VanDerWaalsContact C-N 3.25Å; H125-G127 PolarHBondContact O-N 3.41Å
128	T	97.3	Very high	97.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	113	-176.4	-55.9	0	0	0	0	110.9	H50 T62 M66 N124 T126	H50-T128 HydrophobicContact CB-CG2 4.21Å; H50-T128 CarbonylContact O-C 3.57Å; H50-T128 WeakPolarHBondContact O-CA 3.44Å; T62-T128 HydrophobicContact CG2-CG2 4.21Å; M66-T128 HydrophobicContact CB-CG2 4.47Å; M66-T128 WeakPolarHBondContact CB-OG1 3.38Å; M66-T128 WeakPolarHBondContact CG-OG1 3.43Å; N124-T128 PolarHBondContact ND2-O 3.03Å; N124-T128 PolarHBondContact OD1-O 3.29Å; T126-T128 PolarHBondContact O-N 3.41Å; T126-T128 PolarHBondContact OG1-N 3.18Å; T126-T128 PolarHBondContact OG1-O 2.82Å; T126-T128 VanDerWaalsContact OG1-O 3.11Å
129	Q	97.7	Very high	97	Very high	17 Å²	17	53.9 Å²	53.9	8%	0.079	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	131.8	171.4	-171.9	176.9	-51	0	0	109.8	F49 H50 V51 N52 F131 E160	F49-Q129 HydrophobicContact CE1-CB 3.79Å; F49-Q129 HydrophobicContact CZ-CB 3.82Å; F49-Q129 HydrophobicContact CZ-CG 4.45Å; F49-Q129 VanDerWaalsContact CZ-OE1 3.29Å; H50-Q129 PolarHBondContact O-N 3.1Å; V51-Q129 HydrophobicContact CG1-CB 4.5Å; V51-Q129 HydrophobicContact CG2-CB 4.31Å; N52-Q129 WeakPolarHBondContact CB-O 3.44Å; N52-Q129 PolarHBondContact N-O 2.9Å; Q129-F131 PolarHBondContact NE2-O 3.02Å; Q129-E160 HydrophobicContact CG-CG 4.39Å; Q129-E160 WeakPolarHBondContact CG-OE1 3.44Å; Q129-E160 WeakPolarHBondContact CG-OE2 3.49Å
130	F	98.3	Very high	96.9	Very high	14 Å²	14	51.8 Å²	51.8	6%	0.061	25%	0.248	C	C	.	.	S	Bend	trans	-89.3	-27.2	-171.9	-63.5	-53.8	0	0	0	113.9	N52 F56 I58 M66 N124 T126 L154 P155	N52-F130 WeakPolarHBondContact CB-O 3.46Å; N52-F130 PolarHBondContact ND2-O 3Å; N52-F130 VanDerWaalsContact ND2-O 3.11Å; F56-F130 HydrophobicContact CE1-CB 4.32Å; F56-F130 HydrophobicContact CZ-CB 4.13Å; F56-F130 VanDerWaalsContact CZ-O 3.29Å; F56-F130 WeakPolarHBondContact CZ-O 3.36Å; I58-F130 HydrophobicContact CD1-CD1 3.74Å; I58-F130 HydrophobicContact CD1-CE1 3.92Å; M66-F130 HydrophobicContact SD-CE1 3.79Å; M66-F130 HydrophobicContact SD-CZ 3.98Å; N124-F130 WeakPolarHBondContact ND2-CD2 3.23Å; N124-F130 VanDerWaalsContact ND2-CE2 3.26Å; N124-F130 WeakPolarHBondContact ND2-CE2 3.15Å; T126-F130 HydrophobicContact CG2-CZ 4.17Å; F130-L154 HydrophobicContact CB-CD1 4.08Å; F130-L154 HydrophobicContact CD1-CD1 4.46Å; F130-L154 HydrophobicContact CD2-CB 3.78Å; F130-L154 HydrophobicContact CD2-CD1 4.12Å; F130-L154 HydrophobicContact CE2-CB 4.38Å; F130-L154 HydrophobicContact CG-CB 4.38Å; F130-L154 HydrophobicContact CG-CD1 3.98Å; F130-P155 WeakPolarHBondContact CD2-O 3.31Å
131	F	98.3	Very high	96.9	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	23%	0.231	C	C	.	.	S	Bend	trans	-118.5	122.9	-177.3	-50.3	-87.1	0	0	0	111.1	F56 Q129 I133 T145 E148 M149 E152 L154 I156 E160	F56-F131 HydrophobicContact CD2-CE1 4.5Å; F56-F131 AromaticContact CE2-CD1 3.62Å; F56-F131 HydrophobicContact CE2-CD1 3.62Å; F56-F131 AromaticContact CE2-CE1 3.42Å; F56-F131 HydrophobicContact CE2-CE1 3.42Å; F56-F131 VanDerWaalsContact CE2-CE1 3.42Å; F56-F131 HydrophobicContact CE2-CZ 4.35Å; F56-F131 AromaticContact CZ-CD1 3.73Å; F56-F131 HydrophobicContact CZ-CD1 3.73Å; F56-F131 AromaticContact CZ-CE1 3.44Å; F56-F131 HydrophobicContact CZ-CE1 3.44Å; F56-F131 VanDerWaalsContact CZ-CE1 3.44Å; F56-F131 HydrophobicContact CZ-CG 4.45Å; F56-F131 AromaticContact CZ-CZ 3.97Å; F56-F131 HydrophobicContact CZ-CZ 3.97Å; Q129-F131 PolarHBondContact NE2-O 3.02Å; F131-I133 PolarHBondContact O-N 2.92Å; F131-I133 VanDerWaalsContact O-N 3.16Å; F131-T145 HydrophobicContact CB-CG2 4.01Å; F131-E148 HydrophobicContact CD1-CG 4.24Å; F131-E148 HydrophobicContact CE1-CG 4.13Å; F131-M149 HydrophobicContact CB-CE 4.08Å; F131-M149 HydrophobicContact CB-CG 4.43Å; F131-M149 HydrophobicContact CD1-CG 3.86Å; F131-M149 HydrophobicContact CD2-CG 3.7Å; F131-M149 HydrophobicContact CE1-CB 4.35Å; F131-M149 HydrophobicContact CE1-CG 4Å; F131-M149 HydrophobicContact CE2-CB 4.33Å; F131-M149 HydrophobicContact CE2-CG 3.83Å; F131-M149 HydrophobicContact CG-CE 4.34Å; F131-M149 HydrophobicContact CG-CG 3.72Å; F131-M149 HydrophobicContact CZ-CB 4.19Å; F131-M149 HydrophobicContact CZ-CG 3.99Å; F131-E152 HydrophobicContact CE1-CB 4.2Å; F131-E152 HydrophobicContact CE1-CG 4.36Å; F131-E152 HydrophobicContact CZ-CB 4.14Å; F131-L154 HydrophobicContact CE2-CB 4.03Å; F131-L154 HydrophobicContact CZ-CB 4.01Å; F131-L154 HydrophobicContact CZ-CD1 4.41Å; F131-L154 HydrophobicContact CZ-CG 4.44Å; F131-I156 HydrophobicContact CD2-CG2 4.29Å; F131-I156 HydrophobicContact CE2-CG2 4.16Å; F131-E160 HydrophobicContact CB-CG 4.41Å; F131-E160 WeakPolarHBondContact CD2-OE1 3.4Å; F131-E160 PolarHBondContact N-OE1 3.16Å; F131-E160 VanDerWaalsContact N-OE1 3.14Å
132	E	97.7	Very high	96.8	Very high	64 Å²	64	48.4 Å²	48.4	30%	0.299	23%	0.23	S	C	.	.			trans	-74.7	106.1	-178.1	-167.5	-167.3	-138.5	0	0	112.4	V51 K53 R134	V51-E132 HydrophobicContact CG1-CB 4.14Å; V51-E132 HydrophobicContact CG1-CG 4.07Å; K53-E132 WeakPolarHBondContact CD-OE1 3.49Å; K53-E132 WeakPolarHBondContact CE-OE1 3.48Å; K53-E132 IonicContact NZ-OE1 2.79Å; K53-E132 PolarHBondContact NZ-OE1 2.85Å; E132-R134 HydrophobicContact CG-CG 4.05Å; E132-R134 PolarHBondContact O-N 3.05Å; E132-R134 WeakPolarHBondContact OE2-CD 3.34Å; E132-R134 WeakPolarHBondContact OE2-CG 3.38Å
133	I	97.3	Very high	96.8	Very high	14 Å²	14	42.7 Å²	42.7	7%	0.072	20%	0.203	C	C	.	.			trans	-93.9	86	176.4	-51.9	-53.4	0	0	0	112.1	F131 K135 L142 T145 M149 L159 E160 I163	F131-I133 PolarHBondContact O-N 2.92Å; F131-I133 VanDerWaalsContact O-N 3.16Å; I133-K135 PolarHBondContact O-N 2.9Å; I133-L142 HydrophobicContact CG2-CD2 4.18Å; I133-T145 HydrophobicContact CD1-CG2 3.75Å; I133-M149 HydrophobicContact CD1-CE 3.66Å; I133-M149 HydrophobicContact CG1-CE 4.46Å; I133-L159 HydrophobicContact CB-CD2 3.84Å; I133-L159 HydrophobicContact CB-CG 3.95Å; I133-L159 HydrophobicContact CG1-CG 4.43Å; I133-L159 HydrophobicContact CG2-CD1 4.11Å; I133-L159 HydrophobicContact CG2-CD2 3.85Å; I133-L159 HydrophobicContact CG2-CG 3.71Å; I133-E160 HydrophobicContact CD1-CG 4.34Å; I133-E160 HydrophobicContact CG1-CG 3.72Å; I133-I163 HydrophobicContact CD1-CG1 4.34Å; I133-I163 HydrophobicContact CG2-CD1 4.36Å; I133-I163 HydrophobicContact CG2-CG1 3.72Å
134	R	96.7	Very high	96.8	Very high	166 Å²	166	45.7 Å²	45.7	63%	0.626	22%	0.219	S	C	*	.			trans	-71.9	93.5	170.6	-66.1	179.9	64.9	-175.2	3	110.4	E132 M136 R137	E132-R134 HydrophobicContact CG-CG 4.05Å; E132-R134 PolarHBondContact O-N 3.05Å; E132-R134 WeakPolarHBondContact OE2-CD 3.34Å; E132-R134 WeakPolarHBondContact OE2-CG 3.38Å; R134-M136 PolarHBondContact O-N 2.77Å; R134-R137 HydrophobicContact CB-CB 4.38Å; R134-R137 WeakPolarHBondContact O-CB 3.36Å; R134-R137 PolarHBondContact O-N 2.63Å
135	K	93.6	Very high	96.8	Very high	70 Å²	70	46.2 Å²	46.2	30%	0.304	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-22.7	-170.3	-62.8	-166.1	66.7	162	0	117.4	I133 L159 W264	I133-K135 PolarHBondContact O-N 2.9Å; K135-L159 HydrophobicContact CD-CD1 4.03Å; K135-L159 HydrophobicContact CD-CD2 3.91Å; K135-L159 HydrophobicContact CG-CD1 4.18Å; K135-L159 HydrophobicContact CG-CD2 3.86Å; K135-W264 HydrophobicContact CB-CZ2 4.3Å; K135-W264 VanDerWaalsContact CE-CE3 3.47Å; K135-W264 HydrophobicContact CG-CZ2 4.36Å; K135-W264 VanDerWaalsContact NZ-CE3 3.35Å; K135-W264 PolarHBondContact O-NE1 2.66Å
136	M	92.6	Very high	96.9	Very high	124 Å²	124	39.8 Å²	39.8	61%	0.611	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	4.7	177.9	-59.2	-54.8	-56.6	0	0	113.6	R134	R134-M136 PolarHBondContact O-N 2.77Å
137	R	94.6	Very high	97	Very high	108 Å²	108	40.8 Å²	40.8	41%	0.408	19%	0.193	S	C	.	.	S	Bend	trans	-64.6	144.3	172.2	-168.8	178.1	-169.7	-173	1	109.3	R134 G141 L142 T145	R134-R137 HydrophobicContact CB-CB 4.38Å; R134-R137 WeakPolarHBondContact O-CB 3.36Å; R134-R137 PolarHBondContact O-N 2.63Å; R137-G141 PolarHBondContact NE-O 3.49Å; R137-G141 PolarHBondContact NH1-O 3.39Å; R137-L142 HydrophobicContact CB-CD2 4.06Å; R137-L142 HydrophobicContact CB-CG 4.15Å; R137-T145 PolarHBondContact NH1-OG1 2.87Å; R137-T145 VanDerWaalsContact NH1-OG1 3.12Å
138	P	97.3	Very high	97.3	Very high	50 Å²	50	43.3 Å²	43.3	33%	0.325	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-49.4	147.5	168.1	-31.7	38.3	0	0	0	113	S140 G141 L142 F259	P138-S140 VanDerWaalsContact C-N 3.27Å; P138-S140 PolarHBondContact O-N 3.1Å; P138-G141 PolarHBondContact O-N 3.41Å; P138-L142 PolarHBondContact O-N 3.06Å; P138-F259 WeakPolarHBondContact CB-O 3.33Å
139	L	97	Very high	97.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-53.9	-44	-178.5	-179.4	61.9	0	0	0	111.9	G141 L142 M143 I166 V252 P253 S258 Q260 I262	L139-G141 VanDerWaalsContact C-N 3.31Å; L139-G141 PolarHBondContact O-N 3.36Å; L139-L142 CarbonylContact O-C 3.55Å; L139-L142 WeakPolarHBondContact O-CA 3.17Å; L139-L142 WeakPolarHBondContact O-CB 3.36Å; L139-L142 PolarHBondContact O-N 3.16Å; L139-M143 HydrophobicContact CD1-CE 3.82Å; L139-M143 HydrophobicContact CD1-CG 4.34Å; L139-M143 HydrophobicContact CD1-SD 4.26Å; L139-M143 HydrophobicContact CG-CG 4.27Å; L139-M143 WeakPolarHBondContact O-CG 3.43Å; L139-M143 PolarHBondContact O-N 2.96Å; L139-I166 HydrophobicContact CD1-CG2 4.04Å; L139-V252 HydrophobicContact CD1-CG1 3.94Å; L139-V252 HydrophobicContact CD2-CG1 3.83Å; L139-P253 HydrophobicContact CD2-CB 4.4Å; L139-S258 PolarHBondContact N-O 3.11Å; L139-Q260 WeakPolarHBondContact CB-O 3.17Å; L139-Q260 PolarHBondContact N-O 3.34Å; L139-I262 HydrophobicContact CD1-CD1 4.23Å; L139-I262 HydrophobicContact CD1-CG1 4.2Å
140	S	97.3	Very high	97.4	Very high	27 Å²	27	43.3 Å²	43.3	19%	0.189	20%	0.202	C	C	.	.	H	α-helix	trans	-53	-43.4	174.9	56.8	0	0	0	0	114.1	P138 L142 M143 E144 P256 S258	P138-S140 VanDerWaalsContact C-N 3.27Å; P138-S140 PolarHBondContact O-N 3.1Å; S140-L142 VanDerWaalsContact C-N 3.29Å; S140-L142 PolarHBondContact O-N 2.78Å; S140-M143 PolarHBondContact O-N 3.23Å; S140-E144 PolarHBondContact O-N 2.76Å; S140-P256 WeakPolarHBondContact CA-O 3.32Å; S140-P256 WeakPolarHBondContact CB-O 3.26Å; S140-P256 PolarHBondContact N-O 3.05Å; S140-S258 PolarHBondContact N-O 2.95Å
141	G	97.8	Very high	97.4	Very high	11 Å²	11	50.9 Å²	50.9	11%	0.113	23%	0.231	C	C	.	.	H	α-helix	trans	-68.7	-25.2	174.8	0	0	0	0	0	113.8	R137 P138 L139	R137-G141 PolarHBondContact NE-O 3.49Å; R137-G141 PolarHBondContact NH1-O 3.39Å; P138-G141 PolarHBondContact O-N 3.41Å; L139-G141 VanDerWaalsContact C-N 3.31Å; L139-G141 PolarHBondContact O-N 3.36Å
142	L	98.3	Very high	97.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-80.9	-31.4	174.1	-63.4	170.6	0	0	0	111.8	I133 R137 P138 L139 S140 T145 A146 I163 I262	I133-L142 HydrophobicContact CG2-CD2 4.18Å; R137-L142 HydrophobicContact CB-CD2 4.06Å; R137-L142 HydrophobicContact CB-CG 4.15Å; P138-L142 PolarHBondContact O-N 3.06Å; L139-L142 CarbonylContact O-C 3.55Å; L139-L142 WeakPolarHBondContact O-CA 3.17Å; L139-L142 WeakPolarHBondContact O-CB 3.36Å; L139-L142 PolarHBondContact O-N 3.16Å; S140-L142 VanDerWaalsContact C-N 3.29Å; S140-L142 PolarHBondContact O-N 2.78Å; L142-T145 PolarHBondContact O-N 3.23Å; L142-A146 PolarHBondContact O-N 2.88Å; L142-I163 HydrophobicContact CB-CD1 4.38Å; L142-I163 HydrophobicContact CB-CG2 3.98Å; L142-I163 HydrophobicContact CD1-CD1 4Å; L142-I163 HydrophobicContact CD2-CD1 4.46Å; L142-I163 VanDerWaalsContact O-CG2 3.29Å; L142-I163 WeakPolarHBondContact O-CG2 3.14Å; L142-I262 HydrophobicContact CD1-CD1 3.84Å; L142-I262 HydrophobicContact CD1-CG1 4.35Å
143	M	98.5	Very high	97.4	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-69	-35.9	175.9	-62.5	-59.2	84.8	0	0	112.7	L139 S140 T145 A146 K147 I163 I166 Y167 N170 P256	L139-M143 HydrophobicContact CD1-CE 3.82Å; L139-M143 HydrophobicContact CD1-CG 4.34Å; L139-M143 HydrophobicContact CD1-SD 4.26Å; L139-M143 HydrophobicContact CG-CG 4.27Å; L139-M143 WeakPolarHBondContact O-CG 3.43Å; L139-M143 PolarHBondContact O-N 2.96Å; S140-M143 PolarHBondContact O-N 3.23Å; M143-T145 VanDerWaalsContact C-N 3.34Å; M143-A146 WeakPolarHBondContact O-CB 3.5Å; M143-A146 PolarHBondContact O-N 3.44Å; M143-K147 WeakPolarHBondContact O-CB 3.4Å; M143-K147 PolarHBondContact O-N 3.42Å; M143-I163 HydrophobicContact CE-CG2 4.03Å; M143-I166 HydrophobicContact CE-CB 4.23Å; M143-I166 HydrophobicContact CE-CG2 3.8Å; M143-I166 HydrophobicContact SD-CG2 4.05Å; M143-Y167 HydrophobicContact CB-CD2 4.26Å; M143-Y167 HydrophobicContact SD-CD2 4.05Å; M143-Y167 HydrophobicContact SD-CG 4.44Å; M143-N170 PolarHBondContact SD-ND2 3.28Å; M143-P256 HydrophobicContact CG-CB 4.17Å
144	E	98.3	Very high	97.5	Very high	99 Å²	99	54.6 Å²	54.6	46%	0.463	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-36	172	-70.4	-62.4	119.8	0	0	112.1	S140 K147 E148	S140-E144 PolarHBondContact O-N 2.76Å; E144-K147 WeakPolarHBondContact O-CB 3.43Å; E144-K147 PolarHBondContact O-N 2.79Å; E144-K147 WeakPolarHBondContact OE1-CD 3.34Å; E144-K147 IonicContact OE1-NZ 2.99Å; E144-K147 PolarHBondContact OE1-NZ 3.17Å; E144-K147 WeakPolarHBondContact OE2-CD 3.36Å; E144-K147 IonicContact OE2-NZ 3.96Å; E144-K147 PolarHBondContact OE2-NZ 3.28Å; E144-E148 PolarHBondContact O-N 3.29Å
145	T	98.4	Very high	97.6	Very high	10 Å²	10	48.2 Å²	48.2	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-31	172.2	-58.6	0	0	0	0	112.4	F131 I133 R137 L142 M143 K147 E148 M149	F131-T145 HydrophobicContact CB-CG2 4.01Å; I133-T145 HydrophobicContact CD1-CG2 3.75Å; R137-T145 PolarHBondContact NH1-OG1 2.87Å; R137-T145 VanDerWaalsContact NH1-OG1 3.12Å; L142-T145 PolarHBondContact O-N 3.23Å; M143-T145 VanDerWaalsContact C-N 3.34Å; T145-K147 VanDerWaalsContact C-N 3.34Å; T145-E148 WeakPolarHBondContact O-CB 3.29Å; T145-E148 PolarHBondContact O-N 2.8Å; T145-M149 HydrophobicContact CG2-CE 4.19Å; T145-M149 WeakPolarHBondContact O-CG 3.34Å; T145-M149 PolarHBondContact O-N 3.31Å
146	A	98.6	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.4	-38.3	171.2	0	0	0	0	0	112.7	L142 M143 E148 M149 T150 I163 Y167	L142-A146 PolarHBondContact O-N 2.88Å; M143-A146 WeakPolarHBondContact O-CB 3.5Å; M143-A146 PolarHBondContact O-N 3.44Å; A146-E148 VanDerWaalsContact C-N 3.32Å; A146-M149 WeakPolarHBondContact O-CB 3.48Å; A146-M149 PolarHBondContact O-N 2.84Å; A146-T150 PolarHBondContact O-N 3.45Å; A146-I163 HydrophobicContact CB-CG2 4.13Å; A146-Y167 HydrophobicContact CB-CD1 4.04Å; A146-Y167 HydrophobicContact CB-CD2 4.01Å; A146-Y167 HydrophobicContact CB-CG 3.55Å
147	K	98.4	Very high	98.1	Very high	60 Å²	60	39.8 Å²	39.8	26%	0.261	19%	0.191	S	C	.	.	H	α-helix	trans	-71.4	-24.4	175.3	175.4	-167.3	-179.5	-168.7	0	112.8	M143 E144 T145 T150 R151 Y167	M143-K147 WeakPolarHBondContact O-CB 3.4Å; M143-K147 PolarHBondContact O-N 3.42Å; E144-K147 WeakPolarHBondContact O-CB 3.43Å; E144-K147 PolarHBondContact O-N 2.79Å; E144-K147 WeakPolarHBondContact OE1-CD 3.34Å; E144-K147 IonicContact OE1-NZ 2.99Å; E144-K147 PolarHBondContact OE1-NZ 3.17Å; E144-K147 WeakPolarHBondContact OE2-CD 3.36Å; E144-K147 IonicContact OE2-NZ 3.96Å; E144-K147 PolarHBondContact OE2-NZ 3.28Å; T145-K147 VanDerWaalsContact C-N 3.34Å; K147-T150 PolarHBondContact O-OG1 3.12Å; K147-T150 VanDerWaalsContact O-OG1 3.12Å; K147-R151 WeakPolarHBondContact O-CD 3.41Å; K147-R151 VanDerWaalsContact O-CG 3.32Å; K147-R151 WeakPolarHBondContact O-CG 3.34Å; K147-Y167 HydrophobicContact CB-CE2 4.15Å
148	E	98.6	Very high	98.3	Very high	66 Å²	66	35.5 Å²	35.5	31%	0.308	18%	0.178	S	C	.	.	H	α-helix	trans	-70.5	-46.6	166.4	-171	178.3	-132.2	0	0	110.5	F56 F131 E144 T145 A146 T150 R151 E152	F56-E148 HydrophobicContact CD2-CG 4.19Å; F56-E148 HydrophobicContact CE2-CG 4.1Å; F131-E148 HydrophobicContact CD1-CG 4.24Å; F131-E148 HydrophobicContact CE1-CG 4.13Å; E144-E148 PolarHBondContact O-N 3.29Å; T145-E148 WeakPolarHBondContact O-CB 3.29Å; T145-E148 PolarHBondContact O-N 2.8Å; A146-E148 VanDerWaalsContact C-N 3.32Å; E148-T150 VanDerWaalsContact C-N 3.27Å; E148-T150 PolarHBondContact O-N 2.99Å; E148-R151 PolarHBondContact O-N 2.96Å; E148-E152 HydrophobicContact CG-CG 4.26Å; E148-E152 PolarHBondContact O-N 2.93Å
149	M	98.8	Very high	98.3	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-54.6	-41	175	-62.4	171.7	-160.6	0	0	113	F131 I133 T145 A146 R151 S153 I156 E160 L164	F131-M149 HydrophobicContact CB-CE 4.08Å; F131-M149 HydrophobicContact CB-CG 4.43Å; F131-M149 HydrophobicContact CD1-CG 3.86Å; F131-M149 HydrophobicContact CD2-CG 3.7Å; F131-M149 HydrophobicContact CE1-CB 4.35Å; F131-M149 HydrophobicContact CE1-CG 4Å; F131-M149 HydrophobicContact CE2-CB 4.33Å; F131-M149 HydrophobicContact CE2-CG 3.83Å; F131-M149 HydrophobicContact CG-CE 4.34Å; F131-M149 HydrophobicContact CG-CG 3.72Å; F131-M149 HydrophobicContact CZ-CB 4.19Å; F131-M149 HydrophobicContact CZ-CG 3.99Å; I133-M149 HydrophobicContact CD1-CE 3.66Å; I133-M149 HydrophobicContact CG1-CE 4.46Å; T145-M149 HydrophobicContact CG2-CE 4.19Å; T145-M149 WeakPolarHBondContact O-CG 3.34Å; T145-M149 PolarHBondContact O-N 3.31Å; A146-M149 WeakPolarHBondContact O-CB 3.48Å; A146-M149 PolarHBondContact O-N 2.84Å; M149-R151 VanDerWaalsContact C-N 3.29Å; M149-R151 PolarHBondContact O-N 3.41Å; M149-S153 WeakPolarHBondContact O-CA 3.18Å; M149-S153 PolarHBondContact O-N 3.19Å; M149-I156 HydrophobicContact SD-CG2 4.25Å; M149-E160 HydrophobicContact CE-CB 3.7Å; M149-E160 HydrophobicContact CE-CG 3.95Å; M149-E160 HydrophobicContact SD-CB 4.12Å; M149-L164 HydrophobicContact SD-CB 3.95Å
150	T	98.6	Very high	98.4	Very high	16 Å²	16	34.4 Å²	34.4	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-72.5	-20.6	-179.7	57.8	0	0	0	0	113.9	V98 Y117 A146 K147 E148 L164 Y167	V98-T150 HydrophobicContact CG1-CG2 4.12Å; V98-T150 HydrophobicContact CG2-CG2 4.22Å; Y117-T150 HydrophobicContact CE1-CG2 4.18Å; Y117-T150 WeakPolarHBondContact OH-CA 3.29Å; A146-T150 PolarHBondContact O-N 3.45Å; K147-T150 PolarHBondContact O-OG1 3.12Å; K147-T150 VanDerWaalsContact O-OG1 3.12Å; E148-T150 VanDerWaalsContact C-N 3.27Å; E148-T150 PolarHBondContact O-N 2.99Å; T150-L164 HydrophobicContact CG2-CD1 3.69Å; T150-Y167 HydrophobicContact CG2-CE1 4.2Å
151	R	98.2	Very high	98.5	Very high	174 Å²	174	33.1 Å²	33.1	66%	0.657	16%	0.16	S	C	*	.	H	α-helix	trans	-84.3	-50.9	175	-73	170.2	168.8	-164.9	-7.3	111.8	K147 E148 M149	K147-R151 WeakPolarHBondContact O-CD 3.41Å; K147-R151 VanDerWaalsContact O-CG 3.32Å; K147-R151 WeakPolarHBondContact O-CG 3.34Å; E148-R151 PolarHBondContact O-N 2.96Å; M149-R151 VanDerWaalsContact C-N 3.29Å; M149-R151 PolarHBondContact O-N 3.41Å
152	E	98.4	Very high	98.5	Very high	85 Å²	85	32.6 Å²	32.6	40%	0.397	16%	0.155	S	C	.	.	H	α-helix	trans	-77.5	-21.9	-175.9	-53.8	-50	121.9	0	0	112.7	F56 F131 E148 L154	F56-E152 HydrophobicContact CB-CG 4.42Å; F56-E152 HydrophobicContact CD1-CG 4.49Å; F56-E152 HydrophobicContact CD2-CG 3.74Å; F56-E152 HydrophobicContact CE2-CG 4.13Å; F56-E152 HydrophobicContact CG-CG 3.94Å; F131-E152 HydrophobicContact CE1-CB 4.2Å; F131-E152 HydrophobicContact CE1-CG 4.36Å; F131-E152 HydrophobicContact CZ-CB 4.14Å; E148-E152 HydrophobicContact CG-CG 4.26Å; E148-E152 PolarHBondContact O-N 2.93Å; E152-L154 VanDerWaalsContact C-N 3.28Å; E152-L154 HydrophobicContact CB-CD1 4.46Å; E152-L154 HydrophobicContact CB-CG 4.23Å; E152-L154 PolarHBondContact O-N 3.4Å
153	S	98.5	Very high	98.6	Very high	22 Å²	22	32.5 Å²	32.5	15%	0.154	15%	0.154	C	C	.	.			trans	52	38	174.9	-80.6	0	0	0	0	115.2	M149	M149-S153 WeakPolarHBondContact O-CA 3.18Å; M149-S153 PolarHBondContact O-N 3.19Å
154	L	98.7	Very high	98.6	Very high	49 Å²	49	32.2 Å²	32.2	26%	0.257	15%	0.153	S	C	.	.			trans	-92	157.4	179.8	-59.5	179.8	0	0	0	113	F56 F130 F131 E152	F56-L154 HydrophobicContact CD1-CD1 4.04Å; F56-L154 HydrophobicContact CE1-CD1 3.37Å; F56-L154 HydrophobicContact CZ-CD1 4.04Å; F130-L154 HydrophobicContact CB-CD1 4.08Å; F130-L154 HydrophobicContact CD1-CD1 4.46Å; F130-L154 HydrophobicContact CD2-CB 3.78Å; F130-L154 HydrophobicContact CD2-CD1 4.12Å; F130-L154 HydrophobicContact CE2-CB 4.38Å; F130-L154 HydrophobicContact CG-CB 4.38Å; F130-L154 HydrophobicContact CG-CD1 3.98Å; F131-L154 HydrophobicContact CE2-CB 4.03Å; F131-L154 HydrophobicContact CZ-CB 4.01Å; F131-L154 HydrophobicContact CZ-CD1 4.41Å; F131-L154 HydrophobicContact CZ-CG 4.44Å; E152-L154 VanDerWaalsContact C-N 3.28Å; E152-L154 HydrophobicContact CB-CD1 4.46Å; E152-L154 HydrophobicContact CB-CG 4.23Å; E152-L154 PolarHBondContact O-N 3.4Å
155	P	98.7	Very high	98.6	Very high	32 Å²	32	27.5 Å²	27.5	21%	0.208	13%	0.131	C	C	.	.			trans	-57.5	138.9	175.1	-27	35	0	0	0	114.9	L121 N124 F130	L121-P155 WeakPolarHBondContact O-CA 3.49Å; L121-P155 WeakPolarHBondContact O-CG 3.3Å; N124-P155 HydrophobicContact CB-CB 3.83Å; N124-P155 WeakPolarHBondContact CB-O 3.16Å; N124-P155 PolarHBondContact ND2-O 2.86Å; N124-P155 VanDerWaalsContact ND2-O 3.16Å; F130-P155 WeakPolarHBondContact CD2-O 3.31Å
156	I	98.8	Very high	98.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-120.3	161	-172.7	53.7	174.1	0	0	0	112.7	M118 L121 Q122 Y123 N124 F131 M149 E160 A161 L164 M209	M118-I156 HydrophobicContact CB-CD1 4.43Å; M118-I156 HydrophobicContact CG-CD1 4.41Å; L121-I156 HydrophobicContact CB-CD1 4.5Å; L121-I156 HydrophobicContact CB-CG1 4.36Å; L121-I156 HydrophobicContact CD1-CD1 3.98Å; Q122-I156 PolarHBondContact O-N 3.02Å; Q122-I156 VanDerWaalsContact O-N 3.13Å; Y123-I156 WeakPolarHBondContact CA-O 3.3Å; N124-I156 PolarHBondContact N-O 3.19Å; F131-I156 HydrophobicContact CD2-CG2 4.29Å; F131-I156 HydrophobicContact CE2-CG2 4.16Å; M149-I156 HydrophobicContact SD-CG2 4.25Å; I156-E160 HydrophobicContact CB-CB 3.88Å; I156-E160 HydrophobicContact CG2-CB 3.95Å; I156-A161 HydrophobicContact CD1-CB 3.96Å; I156-L164 HydrophobicContact CD1-CD2 3.79Å; I156-M209 HydrophobicContact CD1-CG 4.12Å; I156-M209 HydrophobicContact CG1-CG 4.25Å
157	K	98.3	Very high	98.6	Very high	17 Å²	17	30.5 Å²	30.5	7%	0.074	14%	0.142	C	C	.	.			trans	-110.4	178.6	171.1	-64.4	-164.3	162.5	81.6	0	111.7	F49 Y123 N124 L159 E160 A161	F49-K157 HydrophobicContact CE2-CD 3.5Å; F49-K157 VanDerWaalsContact CE2-CD 3.5Å; F49-K157 HydrophobicContact CZ-CD 3.69Å; Y123-K157 HydrophobicContact CE1-CD 4.48Å; Y123-K157 HydrophobicContact CE1-CG 4.23Å; Y123-K157 HydrophobicContact CE2-CB 4.33Å; Y123-K157 HydrophobicContact CE2-CG 4.41Å; N124-K157 HydrophobicContact CB-CG 3.83Å; N124-K157 VanDerWaalsContact CG-NZ 3.32Å; N124-K157 WeakPolarHBondContact O-CE 3.48Å; N124-K157 PolarHBondContact O-NZ 3.04Å; N124-K157 PolarHBondContact OD1-NZ 2.95Å; K157-L159 VanDerWaalsContact C-N 3.32Å; K157-L159 PolarHBondContact O-N 3.15Å; K157-E160 WeakPolarHBondContact CB-OE2 3.27Å; K157-E160 PolarHBondContact N-OE2 3.06Å; K157-E160 PolarHBondContact O-N 2.97Å; K157-A161 WeakPolarHBondContact O-CB 3.28Å; K157-A161 PolarHBondContact O-N 3Å
158	C	98.2	Very high	98.6	Very high	18 Å²	18	28.3 Å²	28.3	12%	0.122	13%	0.132	C	C	.	.	H	α-helix	trans	-51	-43.4	-175.6	55.3	0	0	0	0	114.3	V162 H193 V194 M209	C158-V162 WeakPolarHBondContact O-CG2 3.48Å; C158-V162 PolarHBondContact O-N 3.36Å; C158-V162 VanDerWaalsContact O-N 3.15Å; C158-H193 WeakPolarHBondContact CB-NE2 3.44Å; C158-V194 HydrophobicContact CB-CG1 4.31Å; C158-V194 WeakPolarHBondContact CB-O 3.24Å; C158-M209 VanDerWaalsContact CA-O 3.22Å; C158-M209 WeakPolarHBondContact CA-O 3.41Å; C158-M209 VanDerWaalsContact CB-O 3.26Å; C158-M209 WeakPolarHBondContact CB-O 3.28Å; C158-M209 PolarHBondContact N-O 2.86Å
159	L	98.4	Very high	98.6	Very high	28 Å²	28	25.1 Å²	25.1	15%	0.147	12%	0.118	C	C	.	.	H	α-helix	trans	-72.5	-39.8	-179.3	-179.5	60.3	0	0	0	112.8	I133 K135 K157 V162 I163 V194 W264	I133-L159 HydrophobicContact CB-CD2 3.84Å; I133-L159 HydrophobicContact CB-CG 3.95Å; I133-L159 HydrophobicContact CG1-CG 4.43Å; I133-L159 HydrophobicContact CG2-CD1 4.11Å; I133-L159 HydrophobicContact CG2-CD2 3.85Å; I133-L159 HydrophobicContact CG2-CG 3.71Å; K135-L159 HydrophobicContact CD-CD1 4.03Å; K135-L159 HydrophobicContact CD-CD2 3.91Å; K135-L159 HydrophobicContact CG-CD1 4.18Å; K135-L159 HydrophobicContact CG-CD2 3.86Å; K157-L159 VanDerWaalsContact C-N 3.32Å; K157-L159 PolarHBondContact O-N 3.15Å; L159-V162 PolarHBondContact O-N 3.17Å; L159-I163 PolarHBondContact O-N 3.41Å; L159-V194 HydrophobicContact CB-CG1 4.16Å; L159-V194 HydrophobicContact CD1-CG1 4.2Å; L159-W264 HydrophobicContact CD1-CH2 3.59Å; L159-W264 HydrophobicContact CD1-CZ2 4.32Å; L159-W264 HydrophobicContact CD1-CZ3 3.95Å
160	E	98.8	Very high	98.6	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.6	-44.4	175.2	-68.8	155.9	129.2	0	0	110.4	Q129 F131 I133 M149 I156 K157 V162 I163 L164	Q129-E160 HydrophobicContact CG-CG 4.39Å; Q129-E160 WeakPolarHBondContact CG-OE1 3.44Å; Q129-E160 WeakPolarHBondContact CG-OE2 3.49Å; F131-E160 HydrophobicContact CB-CG 4.41Å; F131-E160 WeakPolarHBondContact CD2-OE1 3.4Å; F131-E160 PolarHBondContact N-OE1 3.16Å; F131-E160 VanDerWaalsContact N-OE1 3.14Å; I133-E160 HydrophobicContact CD1-CG 4.34Å; I133-E160 HydrophobicContact CG1-CG 3.72Å; M149-E160 HydrophobicContact CE-CB 3.7Å; M149-E160 HydrophobicContact CE-CG 3.95Å; M149-E160 HydrophobicContact SD-CB 4.12Å; I156-E160 HydrophobicContact CB-CB 3.88Å; I156-E160 HydrophobicContact CG2-CB 3.95Å; K157-E160 WeakPolarHBondContact CB-OE2 3.27Å; K157-E160 PolarHBondContact N-OE2 3.06Å; K157-E160 PolarHBondContact O-N 2.97Å; E160-V162 VanDerWaalsContact C-N 3.28Å; E160-V162 PolarHBondContact O-N 3.49Å; E160-I163 PolarHBondContact O-N 3.11Å; E160-I163 VanDerWaalsContact O-N 3.08Å; E160-L164 WeakPolarHBondContact O-CB 3.31Å; E160-L164 PolarHBondContact O-N 3Å
161	A	98.9	Very high	98.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-32.3	175.8	0	0	0	0	0	113.7	M118 I156 K157 G165 M209	M118-A161 WeakPolarHBondContact CE-O 3.26Å; M118-A161 HydrophobicContact SD-CB 4.05Å; I156-A161 HydrophobicContact CD1-CB 3.96Å; K157-A161 WeakPolarHBondContact O-CB 3.28Å; K157-A161 PolarHBondContact O-N 3Å; A161-G165 PolarHBondContact O-N 3.33Å; A161-M209 HydrophobicContact CB-CB 3.64Å; A161-M209 HydrophobicContact CB-CG 3.59Å
162	V	98.9	Very high	98.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.4	-43.2	172.8	167.3	0	0	0	0	111.6	C158 L159 E160 G165 I166 V194 V195 L196 W264	C158-V162 WeakPolarHBondContact O-CG2 3.48Å; C158-V162 PolarHBondContact O-N 3.36Å; C158-V162 VanDerWaalsContact O-N 3.15Å; L159-V162 PolarHBondContact O-N 3.17Å; E160-V162 VanDerWaalsContact C-N 3.28Å; E160-V162 PolarHBondContact O-N 3.49Å; V162-G165 PolarHBondContact O-N 3.35Å; V162-I166 HydrophobicContact CG1-CD1 4.12Å; V162-I166 WeakPolarHBondContact O-CD1 3.43Å; V162-I166 VanDerWaalsContact O-CG1 3.29Å; V162-I166 WeakPolarHBondContact O-CG1 3.21Å; V162-I166 PolarHBondContact O-N 3.38Å; V162-V194 HydrophobicContact CG2-CG1 4.02Å; V162-V194 HydrophobicContact CG2-CG2 4.13Å; V162-V195 VanDerWaalsContact CG2-C 3.49Å; V162-L196 HydrophobicContact CG1-CB 4.47Å; V162-L196 HydrophobicContact CG1-CD1 4.31Å; V162-L196 HydrophobicContact CG2-CB 4.28Å; V162-W264 HydrophobicContact CG1-CH2 4.07Å; V162-W264 HydrophobicContact CG1-CZ3 4.01Å
163	I	98.9	Very high	98.2	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.5	-42.4	178.6	-61.7	-52.2	0	0	0	111.2	I133 L142 M143 A146 L159 E160 I166 Y167 I262 W264	I133-I163 HydrophobicContact CD1-CG1 4.34Å; I133-I163 HydrophobicContact CG2-CD1 4.36Å; I133-I163 HydrophobicContact CG2-CG1 3.72Å; L142-I163 HydrophobicContact CB-CD1 4.38Å; L142-I163 HydrophobicContact CB-CG2 3.98Å; L142-I163 HydrophobicContact CD1-CD1 4Å; L142-I163 HydrophobicContact CD2-CD1 4.46Å; L142-I163 VanDerWaalsContact O-CG2 3.29Å; L142-I163 WeakPolarHBondContact O-CG2 3.14Å; M143-I163 HydrophobicContact CE-CG2 4.03Å; A146-I163 HydrophobicContact CB-CG2 4.13Å; L159-I163 PolarHBondContact O-N 3.41Å; E160-I163 PolarHBondContact O-N 3.11Å; E160-I163 VanDerWaalsContact O-N 3.08Å; I163-I166 HydrophobicContact CD1-CD1 4.45Å; I163-I166 PolarHBondContact O-N 2.83Å; I163-Y167 PolarHBondContact O-N 3.24Å; I163-I262 HydrophobicContact CD1-CD1 3.62Å; I163-W264 HydrophobicContact CD1-CH2 4.03Å; I163-W264 HydrophobicContact CD1-CZ2 4.22Å
164	L	98.9	Very high	98.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.2	-40.4	173.3	-178.8	59.8	0	0	0	112.2	Y117 M118 L121 M149 T150 I156 E160 I166 Y167 L168	Y117-L164 HydrophobicContact CD1-CD2 4.41Å; Y117-L164 HydrophobicContact CE1-CD1 4.46Å; Y117-L164 HydrophobicContact CE1-CD2 4.11Å; M118-L164 HydrophobicContact CE-CB 4.37Å; M118-L164 HydrophobicContact CE-CG 4.3Å; M118-L164 HydrophobicContact CG-CD2 4.15Å; L121-L164 HydrophobicContact CD1-CD2 3.67Å; M149-L164 HydrophobicContact SD-CB 3.95Å; T150-L164 HydrophobicContact CG2-CD1 3.69Å; I156-L164 HydrophobicContact CD1-CD2 3.79Å; E160-L164 WeakPolarHBondContact O-CB 3.31Å; E160-L164 PolarHBondContact O-N 3Å; L164-I166 PolarHBondContact O-N 3.15Å; L164-Y167 HydrophobicContact CD1-CD1 4.37Å; L164-Y167 PolarHBondContact O-N 3.19Å; L164-L168 HydrophobicContact CD1-CD1 3.86Å; L164-L168 HydrophobicContact CD1-CG 4.04Å; L164-L168 HydrophobicContact CG-CD1 3.89Å; L164-L168 HydrophobicContact CG-CG 4.43Å; L164-L168 WeakPolarHBondContact O-CG 3.23Å; L164-L168 PolarHBondContact O-N 3.3Å
165	G	98.9	Very high	98.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-39.4	176.8	0	0	0	0	0	112.7	M118 A161 V162 T169 L196	M118-G165 VanDerWaalsContact CE-N 3.34Å; A161-G165 PolarHBondContact O-N 3.33Å; V162-G165 PolarHBondContact O-N 3.35Å; G165-T169 WeakPolarHBondContact O-CB 3.21Å; G165-T169 WeakPolarHBondContact O-CG2 3.43Å; G165-T169 PolarHBondContact O-N 2.92Å; G165-T169 PolarHBondContact O-OG1 2.8Å; G165-L196 VanDerWaalsContact C-CD2 3.49Å
166	I	98.8	Very high	98.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.4	-50.8	172.3	-69.7	161.3	0	0	0	109.9	L139 M143 V162 I163 L164 L168 T169 N170 R177 L196 V252 I262	L139-I166 HydrophobicContact CD1-CG2 4.04Å; M143-I166 HydrophobicContact CE-CB 4.23Å; M143-I166 HydrophobicContact CE-CG2 3.8Å; M143-I166 HydrophobicContact SD-CG2 4.05Å; V162-I166 HydrophobicContact CG1-CD1 4.12Å; V162-I166 WeakPolarHBondContact O-CD1 3.43Å; V162-I166 VanDerWaalsContact O-CG1 3.29Å; V162-I166 WeakPolarHBondContact O-CG1 3.21Å; V162-I166 PolarHBondContact O-N 3.38Å; I163-I166 HydrophobicContact CD1-CD1 4.45Å; I163-I166 PolarHBondContact O-N 2.83Å; L164-I166 PolarHBondContact O-N 3.15Å; I166-L168 PolarHBondContact O-N 2.88Å; I166-T169 PolarHBondContact O-N 2.93Å; I166-T169 VanDerWaalsContact O-N 3.1Å; I166-T169 PolarHBondContact O-OG1 2.93Å; I166-T169 VanDerWaalsContact O-OG1 3.11Å; I166-N170 PolarHBondContact O-N 3.29Å; I166-N170 VanDerWaalsContact O-N 3.13Å; I166-N170 PolarHBondContact O-OD1 2.89Å; I166-R177 PolarHBondContact O-NH1 3.37Å; I166-L196 HydrophobicContact CD1-CD1 4.11Å; I166-L196 HydrophobicContact CG1-CD1 3.68Å; I166-L196 HydrophobicContact CG1-CD2 3.9Å; I166-L196 HydrophobicContact CG1-CG 4.47Å; I166-V252 HydrophobicContact CD1-CG1 4.27Å; I166-V252 HydrophobicContact CD1-CG2 4Å; I166-V252 HydrophobicContact CG1-CG1 4.47Å; I166-V252 HydrophobicContact CG1-CG2 4.44Å; I166-V252 HydrophobicContact CG2-CG1 3.79Å; I166-I262 HydrophobicContact CD1-CD1 3.61Å
167	Y	98.8	Very high	98.1	Very high	73 Å²	73	21.5 Å²	21.5	29%	0.286	13%	0.133	S	C	.	.	H	α-helix	trans	-54.8	-50.9	179.9	174.3	-103.9	0	0	0	112.6	M143 A146 K147 T150 I163 L164 T169 N170	M143-Y167 HydrophobicContact CB-CD2 4.26Å; M143-Y167 HydrophobicContact SD-CD2 4.05Å; M143-Y167 HydrophobicContact SD-CG 4.44Å; A146-Y167 HydrophobicContact CB-CD1 4.04Å; A146-Y167 HydrophobicContact CB-CD2 4.01Å; A146-Y167 HydrophobicContact CB-CG 3.55Å; K147-Y167 HydrophobicContact CB-CE2 4.15Å; T150-Y167 HydrophobicContact CG2-CE1 4.2Å; I163-Y167 PolarHBondContact O-N 3.24Å; L164-Y167 HydrophobicContact CD1-CD1 4.37Å; L164-Y167 PolarHBondContact O-N 3.19Å; Y167-T169 PolarHBondContact O-N 2.84Å; Y167-T169 VanDerWaalsContact O-N 3.16Å; Y167-N170 PolarHBondContact O-N 3.18Å
168	L	98.7	Very high	98.1	Very high	13 Å²	13	20.7 Å²	20.7	7%	0.068	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.7	-179	-64.3	172.3	0	0	0	114.2	V98 P99 W110 I114 Y117 L164 I166	V98-L168 HydrophobicContact CG1-CD2 3.77Å; P99-L168 HydrophobicContact CG-CD1 4.26Å; P99-L168 HydrophobicContact CG-CD2 4.38Å; W110-L168 VanDerWaalsContact CZ2-O 3.27Å; W110-L168 WeakPolarHBondContact CZ2-O 3.46Å; I114-L168 HydrophobicContact CD1-CB 3.99Å; I114-L168 HydrophobicContact CG1-CB 4.01Å; I114-L168 HydrophobicContact CG1-CD1 4.4Å; I114-L168 HydrophobicContact CG2-CB 4.23Å; I114-L168 HydrophobicContact CG2-CD1 3.89Å; Y117-L168 HydrophobicContact CD1-CD1 3.96Å; Y117-L168 HydrophobicContact CE1-CD1 4.35Å; L164-L168 HydrophobicContact CD1-CD1 3.86Å; L164-L168 HydrophobicContact CD1-CG 4.04Å; L164-L168 HydrophobicContact CG-CD1 3.89Å; L164-L168 HydrophobicContact CG-CG 4.43Å; L164-L168 WeakPolarHBondContact O-CG 3.23Å; L164-L168 PolarHBondContact O-N 3.3Å; I166-L168 PolarHBondContact O-N 2.88Å
169	T	98.6	Very high	98.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120	1.2	-179.2	53.1	0	0	0	0	114.3	L111 I114 G165 I166 Y167 G171 Q172 R177 L207	L111-T169 HydrophobicContact CD2-CG2 4.37Å; I114-T169 HydrophobicContact CD1-CG2 3.58Å; G165-T169 WeakPolarHBondContact O-CB 3.21Å; G165-T169 WeakPolarHBondContact O-CG2 3.43Å; G165-T169 PolarHBondContact O-N 2.92Å; G165-T169 PolarHBondContact O-OG1 2.8Å; I166-T169 PolarHBondContact O-N 2.93Å; I166-T169 VanDerWaalsContact O-N 3.1Å; I166-T169 PolarHBondContact O-OG1 2.93Å; I166-T169 VanDerWaalsContact O-OG1 3.11Å; Y167-T169 PolarHBondContact O-N 2.84Å; Y167-T169 VanDerWaalsContact O-N 3.16Å; T169-G171 PolarHBondContact O-N 3.08Å; T169-Q172 PolarHBondContact O-N 2.92Å; T169-R177 WeakPolarHBondContact OG1-CD 3.39Å; T169-R177 PolarHBondContact OG1-NH1 2.87Å; T169-L207 HydrophobicContact CG2-CD1 4.33Å
170	N	97.7	Very high	98.2	Very high	18 Å²	18	18.5 Å²	18.5	10%	0.096	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-39.2	179.2	-78	-28.2	0	0	0	112.5	M143 I166 Y167 Q172 R177 H254	M143-N170 PolarHBondContact SD-ND2 3.28Å; I166-N170 PolarHBondContact O-N 3.29Å; I166-N170 VanDerWaalsContact O-N 3.13Å; I166-N170 PolarHBondContact O-OD1 2.89Å; Y167-N170 PolarHBondContact O-N 3.18Å; N170-Q172 VanDerWaalsContact C-N 3.25Å; N170-Q172 PolarHBondContact O-N 3Å; N170-R177 PolarHBondContact OD1-NH1 3.04Å; N170-R177 PolarHBondContact OD1-NH2 3.33Å; N170-H254 PolarHBondContact O-ND1 3.42Å
171	G	95.3	Very high	98.2	Very high	59 Å²	59	19.1 Å²	19.1	61%	0.608	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-4.9	-176.8	0	0	0	0	0	116.4	T169 P173	T169-G171 PolarHBondContact O-N 3.08Å; G171-P173 VanDerWaalsContact O-CD 3.29Å; G171-P173 WeakPolarHBondContact O-CD 3.35Å
172	Q	96.8	Very high	98.2	Very high	25 Å²	25	19.3 Å²	19.3	12%	0.117	12%	0.122	C	C	.	.			trans	-114.6	87.7	-175.3	-79.9	65.9	40.5	0	0	110.8	Y101 I107 T169 N170 S174 I175 H254	Y101-Q172 VanDerWaalsContact CB-NE2 3.28Å; Y101-Q172 VanDerWaalsContact CD1-NE2 3.29Å; Y101-Q172 HydrophobicContact CG-CG 4.47Å; I107-Q172 HydrophobicContact CD1-CG 4.43Å; T169-Q172 PolarHBondContact O-N 2.92Å; N170-Q172 VanDerWaalsContact C-N 3.25Å; N170-Q172 PolarHBondContact O-N 3Å; Q172-S174 PolarHBondContact O-N 3.12Å; Q172-I175 HydrophobicContact CB-CB 4.43Å; Q172-I175 HydrophobicContact CB-CD1 3.59Å; Q172-I175 HydrophobicContact CB-CG1 3.85Å; Q172-I175 HydrophobicContact CG-CD1 4.14Å; Q172-I175 WeakPolarHBondContact O-CB 3.41Å; Q172-I175 PolarHBondContact O-N 2.99Å; Q172-H254 PolarHBondContact O-CE1 3.05Å
173	P	95.4	Very high	98.2	Very high	107 Å²	107	21.9 Å²	21.9	70%	0.695	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-5	-176.8	28.8	-36.6	0	0	0	114.4	G171 I175	G171-P173 VanDerWaalsContact O-CD 3.29Å; G171-P173 WeakPolarHBondContact O-CD 3.35Å; P173-I175 VanDerWaalsContact C-N 3.3Å
174	S	96.6	Very high	98.1	Very high	63 Å²	63	22 Å²	22	44%	0.441	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.8	169.5	54.1	0	0	0	0	113.6	Q172 C200	Q172-S174 PolarHBondContact O-N 3.12Å; S174-C200 WeakPolarHBondContact O-CB 3.26Å; S174-C200 PolarHBondContact O-SG 3Å
175	I	98.3	Very high	98.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.149	C	C	.	.			trans	-110.7	96.4	-177.4	-52.1	-180	0	0	0	108.7	I107 L111 Q172 P173 R177 I198 H254	I107-I175 HydrophobicContact CD1-CD1 4.31Å; I107-I175 HydrophobicContact CD1-CG1 4.5Å; I107-I175 HydrophobicContact CG2-CD1 3.76Å; I107-I175 HydrophobicContact CG2-CG1 3.87Å; L111-I175 HydrophobicContact CD2-CD1 4.34Å; Q172-I175 HydrophobicContact CB-CB 4.43Å; Q172-I175 HydrophobicContact CB-CD1 3.59Å; Q172-I175 HydrophobicContact CB-CG1 3.85Å; Q172-I175 HydrophobicContact CG-CD1 4.14Å; Q172-I175 WeakPolarHBondContact O-CB 3.41Å; Q172-I175 PolarHBondContact O-N 2.99Å; P173-I175 VanDerWaalsContact C-N 3.3Å; I175-R177 HydrophobicContact CG2-CG 3.9Å; I175-R177 WeakPolarHBondContact O-CG 3.24Å; I175-I198 HydrophobicContact CG2-CD1 4.08Å; I175-I198 HydrophobicContact CG2-CG2 3.6Å; I175-H254 PolarHBondContact O-CE1 3.35Å; I175-H254 PolarHBondContact O-NE2 3.24Å; I175-H254 VanDerWaalsContact O-NE2 3.13Å
176	E	98.5	Very high	98	Very high	31 Å²	31	29.2 Å²	29.2	15%	0.145	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137	171.4	-66.6	-81.5	-160.5	0	0	109.6	Y199 Y251 K293	E176-Y199 HydrophobicContact CB-CD1 4.21Å; E176-Y199 HydrophobicContact CG-CD1 4.41Å; E176-Y199 PolarHBondContact N-O 3.04Å; E176-Y199 PolarHBondContact O-N 3.29Å; E176-Y251 HydrophobicContact CB-CD1 3.88Å; E176-Y251 HydrophobicContact CB-CD2 4.12Å; E176-Y251 HydrophobicContact CB-CE1 3.71Å; E176-Y251 HydrophobicContact CB-CE2 3.97Å; E176-Y251 HydrophobicContact CB-CG 4.08Å; E176-Y251 VanDerWaalsContact CD-CD2 3.49Å; E176-Y251 HydrophobicContact CG-CD2 4.1Å; E176-Y251 HydrophobicContact CG-CE2 3.91Å; E176-Y251 VanDerWaalsContact OE2-CD2 3.28Å; E176-Y251 WeakPolarHBondContact OE2-CD2 3.3Å; E176-K293 WeakPolarHBondContact OE1-CE 3.48Å; E176-K293 IonicContact OE1-NZ 2.77Å; E176-K293 PolarHBondContact OE1-NZ 3.37Å
177	R	98.8	Very high	97.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	130.1	-162.3	-56.4	154.9	-58.9	145.6	12.1	111.2	I166 T169 N170 I175 L196 G197 I198 Y251 V252 P253 H254	I166-R177 PolarHBondContact O-NH1 3.37Å; T169-R177 WeakPolarHBondContact OG1-CD 3.39Å; T169-R177 PolarHBondContact OG1-NH1 2.87Å; N170-R177 PolarHBondContact OD1-NH1 3.04Å; N170-R177 PolarHBondContact OD1-NH2 3.33Å; I175-R177 HydrophobicContact CG2-CG 3.9Å; I175-R177 WeakPolarHBondContact O-CG 3.24Å; R177-L196 HydrophobicContact CB-CD1 4.13Å; R177-L196 HydrophobicContact CB-CG 4.47Å; R177-G197 WeakPolarHBondContact CA-O 3.5Å; R177-I198 HydrophobicContact CB-CD1 4.42Å; R177-I198 HydrophobicContact CG-CD1 3.9Å; R177-Y251 CarbonylContact O-C 3.55Å; R177-Y251 VanDerWaalsContact O-CA 3.29Å; R177-Y251 WeakPolarHBondContact O-CA 3.49Å; R177-V252 PolarHBondContact NH2-O 2.89Å; R177-V252 PolarHBondContact O-N 3.31Å; R177-P253 VanDerWaalsContact NH2-C 3.3Å; R177-P253 PolarHBondContact NH2-O 3.49Å; R177-H254 PolarHBondContact NE-CE1 3.47Å; R177-H254 PolarHBondContact NE-NE2 3.2Å
178	F	98.8	Very high	97.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	138.8	-173	54.7	-79.9	0	0	0	111.7	I180 G197 Y204 L225 I248 L250 Y251 M290	F178-I180 HydrophobicContact CD2-CD1 4.47Å; F178-I180 HydrophobicContact CD2-CG1 3.93Å; F178-I180 HydrophobicContact CE2-CD1 3.76Å; F178-I180 HydrophobicContact CE2-CG1 3.69Å; F178-I180 HydrophobicContact CZ-CD1 4.41Å; F178-G197 WeakPolarHBondContact CD1-O 3.47Å; F178-G197 PolarHBondContact N-O 3.28Å; F178-G197 WeakPolarHBondContact O-CA 3.34Å; F178-G197 PolarHBondContact O-N 3.5Å; F178-Y204 HydrophobicContact CE1-CD1 4.26Å; F178-Y204 HydrophobicContact CE1-CE1 4.12Å; F178-Y204 AromaticContact CZ-CD1 3.89Å; F178-Y204 HydrophobicContact CZ-CD1 3.89Å; F178-Y204 AromaticContact CZ-CE1 3.89Å; F178-Y204 HydrophobicContact CZ-CE1 3.89Å; F178-L225 HydrophobicContact CE2-CD1 3.79Å; F178-L225 HydrophobicContact CZ-CD1 3.89Å; F178-I248 HydrophobicContact CD2-CG2 3.58Å; F178-I248 HydrophobicContact CE2-CG2 3.95Å; F178-L250 WeakPolarHBondContact CB-O 3.39Å; F178-Y251 HydrophobicContact CB-CD1 4.13Å; F178-Y251 AromaticContact CD1-CD1 3.79Å; F178-Y251 HydrophobicContact CD1-CD1 3.79Å; F178-Y251 AromaticContact CD1-CE1 3.66Å; F178-Y251 HydrophobicContact CD1-CE1 3.66Å; F178-Y251 HydrophobicContact CE1-CE1 4.17Å; F178-Y251 HydrophobicContact CG-CD1 4.29Å; F178-Y251 HydrophobicContact CG-CE1 4.42Å; F178-M290 HydrophobicContact CD2-CE 4.41Å; F178-M290 HydrophobicContact CE2-CE 4.41Å; F178-M290 HydrophobicContact CG-CE 4.48Å
179	P	98.8	Very high	97.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133	-179.6	30.2	-34.7	0	0	0	111.4	V194 G249 I262 W264	P179-V194 HydrophobicContact CB-CG2 4.32Å; P179-G249 PolarHBondContact O-N 3.41Å; P179-I262 HydrophobicContact CG-CG2 3.83Å; P179-W264 HydrophobicContact CB-CE3 3.5Å; P179-W264 HydrophobicContact CB-CZ3 3.65Å; P179-W264 HydrophobicContact CG-CD2 4.33Å; P179-W264 HydrophobicContact CG-CE3 3.77Å; P179-W264 HydrophobicContact CG-CZ3 4.26Å
180	I	98.9	Very high	97.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.3	171.2	-54.1	171.8	0	0	0	107.5	F178 F182 V194 V195 L228 I229 V246	F178-I180 HydrophobicContact CD2-CD1 4.47Å; F178-I180 HydrophobicContact CD2-CG1 3.93Å; F178-I180 HydrophobicContact CE2-CD1 3.76Å; F178-I180 HydrophobicContact CE2-CG1 3.69Å; F178-I180 HydrophobicContact CZ-CD1 4.41Å; I180-F182 HydrophobicContact CB-CE2 4.45Å; I180-F182 HydrophobicContact CG2-CD2 4.41Å; I180-F182 HydrophobicContact CG2-CE1 4.39Å; I180-F182 HydrophobicContact CG2-CE2 3.62Å; I180-F182 HydrophobicContact CG2-CZ 3.6Å; I180-V194 CarbonylContact O-C 3.6Å; I180-V194 VanDerWaalsContact O-CA 3.3Å; I180-V194 WeakPolarHBondContact O-CA 3.48Å; I180-V194 WeakPolarHBondContact O-CG2 3.48Å; I180-V195 HydrophobicContact CB-CG2 3.89Å; I180-V195 HydrophobicContact CD1-CG2 4.37Å; I180-V195 PolarHBondContact N-O 3.35Å; I180-V195 PolarHBondContact O-N 2.98Å; I180-L228 HydrophobicContact CD1-CD2 4.06Å; I180-I229 HydrophobicContact CD1-CD1 4.05Å; I180-I229 HydrophobicContact CG1-CD1 4.49Å; I180-I229 HydrophobicContact CG2-CD1 3.43Å; I180-I229 VanDerWaalsContact CG2-CD1 3.43Å; I180-V246 HydrophobicContact CG2-CG1 4.49Å
181	S	98.8	Very high	97.3	Very high	13 Å²	13	40.4 Å²	40.4	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.4	178.9	-46.9	0	0	0	0	111.9	H193 V194 V246 K247	S181-H193 CarbonylContact C-O 3.58Å; S181-H193 VanDerWaalsContact CA-O 3.32Å; S181-H193 WeakPolarHBondContact CA-O 3.4Å; S181-V194 WeakPolarHBondContact OG-CG2 3.25Å; S181-V246 CarbonylContact O-C 3.5Å; S181-K247 PolarHBondContact N-O 2.9Å; S181-K247 PolarHBondContact O-N 3.42Å
182	F	98.8	Very high	97.4	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.6	175.6	-58.2	-91.2	0	0	0	109.9	I180 T184 H193 V195 I229 F232 Y236 V243 V246	I180-F182 HydrophobicContact CB-CE2 4.45Å; I180-F182 HydrophobicContact CG2-CD2 4.41Å; I180-F182 HydrophobicContact CG2-CE1 4.39Å; I180-F182 HydrophobicContact CG2-CE2 3.62Å; I180-F182 HydrophobicContact CG2-CZ 3.6Å; F182-T184 HydrophobicContact CB-CG2 4.22Å; F182-H193 PolarHBondContact N-O 2.93Å; F182-H193 PolarHBondContact O-N 3.41Å; F182-V195 HydrophobicContact CE2-CG2 4.27Å; F182-I229 HydrophobicContact CZ-CD1 4.28Å; F182-F232 HydrophobicContact CE1-CB 3.78Å; F182-F232 HydrophobicContact CE1-CG 4.37Å; F182-F232 HydrophobicContact CE2-CB 4.29Å; F182-F232 HydrophobicContact CE2-CD1 4.05Å; F182-F232 HydrophobicContact CE2-CD2 4.42Å; F182-F232 HydrophobicContact CE2-CE1 4.5Å; F182-F232 HydrophobicContact CE2-CG 4.01Å; F182-F232 HydrophobicContact CZ-CB 3.45Å; F182-F232 VanDerWaalsContact CZ-CB 3.45Å; F182-F232 HydrophobicContact CZ-CD1 4.05Å; F182-F232 AromaticContact CZ-CD2 3.94Å; F182-F232 HydrophobicContact CZ-CD2 3.94Å; F182-F232 AromaticContact CZ-CG 3.56Å; F182-F232 HydrophobicContact CZ-CG 3.56Å; F182-Y236 HydrophobicContact CB-CE2 3.98Å; F182-Y236 AromaticContact CD1-CE2 3.84Å; F182-Y236 HydrophobicContact CD1-CE2 3.84Å; F182-Y236 HydrophobicContact CD2-CE2 4.16Å; F182-Y236 HydrophobicContact CE1-CE2 4.37Å; F182-Y236 AromaticContact CG-CE2 3.73Å; F182-Y236 HydrophobicContact CG-CE2 3.73Å; F182-V243 HydrophobicContact CD1-CG1 4.15Å; F182-V246 HydrophobicContact CD1-CG2 3.97Å; F182-V246 HydrophobicContact CE1-CG2 4.08Å
183	K	98.6	Very high	97.5	Very high	54 Å²	54	41.8 Å²	41.8	24%	0.235	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.3	158.9	-177.2	171.9	-177	124.5	0	107.5	Y190 F191 H192 K244 K245	K183-Y190 HydrophobicContact CD-CD1 4.15Å; K183-Y190 HydrophobicContact CG-CD1 4.09Å; K183-F191 WeakPolarHBondContact CA-O 3.44Å; K183-H192 WeakPolarHBondContact CD-NE2 3.49Å; K183-H192 WeakPolarHBondContact CE-NE2 3.38Å; K183-H192 PolarHBondContact NZ-CE1 2.9Å; K183-H192 VanDerWaalsContact NZ-CE1 3.27Å; K183-H192 PolarHBondContact NZ-NE2 3.29Å; K183-K244 PolarHBondContact O-N 2.71Å; K183-K245 HydrophobicContact CB-CB 4.27Å; K183-K245 PolarHBondContact N-O 3.23Å; K183-K245 PolarHBondContact O-N 3.17Å
184	T	98.5	Very high	97.6	Very high	3 Å²	3	37 Å²	37	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	170.7	179.6	70.8	0	0	0	0	110.6	F182 Y190 F191 Y236 H241 T242 V243	F182-T184 HydrophobicContact CB-CG2 4.22Å; T184-Y190 WeakPolarHBondContact O-CA 3.48Å; T184-Y190 WeakPolarHBondContact O-CD1 3.45Å; T184-F191 PolarHBondContact N-O 3.32Å; T184-F191 PolarHBondContact O-N 3.44Å; T184-Y236 HydrophobicContact CG2-CD1 3.86Å; T184-Y236 HydrophobicContact CG2-CD2 4.13Å; T184-Y236 HydrophobicContact CG2-CE1 3.69Å; T184-Y236 HydrophobicContact CG2-CE2 3.99Å; T184-Y236 HydrophobicContact CG2-CG 4.08Å; T184-H241 PolarHBondContact OG1-ND1 2.87Å; T184-T242 CarbonylContact C-O 3.54Å; T184-T242 VanDerWaalsContact CA-O 3.25Å; T184-T242 WeakPolarHBondContact CA-O 3Å; T184-T242 WeakPolarHBondContact CB-O 3.35Å; T184-V243 HydrophobicContact CG2-CB 4.47Å; T184-V243 HydrophobicContact CG2-CG1 4.47Å; T184-V243 HydrophobicContact CG2-CG2 4.15Å
185	Y	97.9	Very high	97.7	Very high	80 Å²	80	34 Å²	34	31%	0.314	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134.1	178.8	174.1	-91.4	0	0	0	109.8	G188 N189 Y190 T242	Y185-G188 VanDerWaalsContact CE2-C 3.48Å; Y185-G188 WeakPolarHBondContact CE2-O 3.13Å; Y185-G188 WeakPolarHBondContact OH-CA 3.45Å; Y185-N189 CarbonylContact C-O 3.58Å; Y185-N189 VanDerWaalsContact CA-O 3.28Å; Y185-N189 WeakPolarHBondContact CA-O 3.16Å; Y185-N189 VanDerWaalsContact CD2-O 3.27Å; Y185-N189 WeakPolarHBondContact CD2-O 3.33Å; Y185-Y190 HydrophobicContact CD2-CD1 4.17Å; Y185-Y190 HydrophobicContact CD2-CD2 4.39Å; Y185-Y190 HydrophobicContact CD2-CE1 4.03Å; Y185-Y190 HydrophobicContact CD2-CE2 4.22Å; Y185-Y190 HydrophobicContact CD2-CG 4.36Å; Y185-T242 PolarHBondContact N-O 2.75Å; Y185-T242 PolarHBondContact O-N 2.95Å
186	F	96.9	Very high	97.8	Very high	70 Å²	70	34 Å²	34	31%	0.307	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	138.6	177.6	168	-107	0	0	0	109.4	G188 N189 F191 L240	F186-G188 PolarHBondContact O-N 2.58Å; F186-N189 PolarHBondContact N-O 2.9Å; F186-N189 PolarHBondContact O-N 2.68Å; F186-N189 VanDerWaalsContact O-O 3.1Å; F186-F191 HydrophobicContact CB-CD2 4.33Å; F186-F191 HydrophobicContact CB-CE2 4Å; F186-F191 HydrophobicContact CD1-CE2 4.19Å; F186-L240 HydrophobicContact CD2-CB 3.89Å; F186-L240 HydrophobicContact CE2-CB 3.83Å; F186-L240 HydrophobicContact CE2-CD1 4.28Å
187	S	95.4	Very high	97.8	Very high	71 Å²	71	32.5 Å²	32.5	50%	0.497	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.1	59.5	174	-166.8	0	0	0	0	114.8	N189	S187-N189 PolarHBondContact O-N 2.71Å; S187-N189 VanDerWaalsContact O-N 3.1Å; S187-N189 PolarHBondContact O-ND2 3.39Å
188	G	94.5	Very high	97.8	Very high	54 Å²	54	32.6 Å²	32.6	56%	0.557	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.8	-18.6	-179.3	0	0	0	0	0	115.4	Y185 F186	Y185-G188 VanDerWaalsContact CE2-C 3.48Å; Y185-G188 WeakPolarHBondContact CE2-O 3.13Å; Y185-G188 WeakPolarHBondContact OH-CA 3.45Å; F186-G188 PolarHBondContact O-N 2.58Å
189	N	94.8	Very high	97.8	Very high	60 Å²	60	34.9 Å²	34.9	32%	0.321	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	150.7	-165.6	-72.7	-80.9	0	0	0	112.9	G45 Y185 F186 S187 F191	G45-N189 WeakPolarHBondContact CA-OD1 3.4Å; Y185-N189 CarbonylContact C-O 3.58Å; Y185-N189 VanDerWaalsContact CA-O 3.28Å; Y185-N189 WeakPolarHBondContact CA-O 3.16Å; Y185-N189 VanDerWaalsContact CD2-O 3.27Å; Y185-N189 WeakPolarHBondContact CD2-O 3.33Å; F186-N189 PolarHBondContact N-O 2.9Å; F186-N189 PolarHBondContact O-N 2.68Å; F186-N189 VanDerWaalsContact O-O 3.1Å; S187-N189 PolarHBondContact O-N 2.71Å; S187-N189 VanDerWaalsContact O-N 3.1Å; S187-N189 PolarHBondContact O-ND2 3.39Å; N189-F191 HydrophobicContact CB-CE2 3.71Å; N189-F191 HydrophobicContact CB-CZ 3.81Å
190	Y	95.8	Very high	97.8	Very high	110 Å²	110	35.4 Å²	35.4	43%	0.431	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	150.9	166.7	-73.2	-79.3	0	0	0	110.4	K183 T184 Y185 K244	K183-Y190 HydrophobicContact CD-CD1 4.15Å; K183-Y190 HydrophobicContact CG-CD1 4.09Å; T184-Y190 WeakPolarHBondContact O-CA 3.48Å; T184-Y190 WeakPolarHBondContact O-CD1 3.45Å; Y185-Y190 HydrophobicContact CD2-CD1 4.17Å; Y185-Y190 HydrophobicContact CD2-CD2 4.39Å; Y185-Y190 HydrophobicContact CD2-CE1 4.03Å; Y185-Y190 HydrophobicContact CD2-CE2 4.22Å; Y185-Y190 HydrophobicContact CD2-CG 4.36Å; Y190-K244 HydrophobicContact CE1-CG 4.15Å
191	F	96.8	Very high	97.6	Very high	44 Å²	44	42.8 Å²	42.8	19%	0.193	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.3	175.6	-61.6	-84.5	0	0	0	110.5	K183 T184 F186 N189 H241	K183-F191 WeakPolarHBondContact CA-O 3.44Å; T184-F191 PolarHBondContact N-O 3.32Å; T184-F191 PolarHBondContact O-N 3.44Å; F186-F191 HydrophobicContact CB-CD2 4.33Å; F186-F191 HydrophobicContact CB-CE2 4Å; F186-F191 HydrophobicContact CD1-CE2 4.19Å; N189-F191 HydrophobicContact CB-CE2 3.71Å; N189-F191 HydrophobicContact CB-CZ 3.81Å; F191-H241 AromaticContact CD2-CE1 3.46Å; F191-H241 VanDerWaalsContact CD2-CE1 3.46Å; F191-H241 WeakPolarHBondContact CD2-CE1 3.42Å; F191-H241 AromaticContact CD2-ND1 3.95Å; F191-H241 AromaticContact CE2-CE1 3.98Å; F191-H241 AromaticContact CG-CE1 3.89Å
192	H	97.4	Very high	97.6	Very high	91 Å²	91	44 Å²	44	42%	0.421	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.1	-178.3	-59.1	93.3	0	0	0	111.6	D44 K183	D44-H192 IonicContact OD1-CE1 2.66Å; D44-H192 PolarHBondContact OD1-CE1 3.07Å; D44-H192 VanDerWaalsContact OD1-CE1 3.28Å; D44-H192 IonicContact OD1-CG 2.75Å; D44-H192 IonicContact OD1-ND1 3.88Å; D44-H192 PolarHBondContact OD1-ND1 3.26Å; K183-H192 WeakPolarHBondContact CD-NE2 3.49Å; K183-H192 WeakPolarHBondContact CE-NE2 3.38Å; K183-H192 PolarHBondContact NZ-CE1 2.9Å; K183-H192 VanDerWaalsContact NZ-CE1 3.27Å; K183-H192 PolarHBondContact NZ-NE2 3.29Å
193	H	98.6	Very high	97.5	Very high	23 Å²	23	48.7 Å²	48.7	11%	0.106	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	156.4	-178.4	-169.3	-104.2	0	0	0	111.5	C158 S181 F182 L215 Y236	C158-H193 WeakPolarHBondContact CB-NE2 3.44Å; S181-H193 CarbonylContact C-O 3.58Å; S181-H193 VanDerWaalsContact CA-O 3.32Å; S181-H193 WeakPolarHBondContact CA-O 3.4Å; F182-H193 PolarHBondContact N-O 2.93Å; F182-H193 PolarHBondContact O-N 3.41Å; H193-L215 PolarHBondContact CE1-O 2.97Å; H193-Y236 VanDerWaalsContact CB-OH 3.24Å; H193-Y236 WeakPolarHBondContact CB-OH 3.37Å; H193-Y236 PolarHBondContact ND1-OH 2.87Å
194	V	98.8	Very high	97.5	Very high	6 Å²	6	46.2 Å²	46.2	4%	0.036	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	142	178.4	66.7	0	0	0	0	111.1	C158 L159 V162 P179 I180 S181 W264	C158-V194 HydrophobicContact CB-CG1 4.31Å; C158-V194 WeakPolarHBondContact CB-O 3.24Å; L159-V194 HydrophobicContact CB-CG1 4.16Å; L159-V194 HydrophobicContact CD1-CG1 4.2Å; V162-V194 HydrophobicContact CG2-CG1 4.02Å; V162-V194 HydrophobicContact CG2-CG2 4.13Å; P179-V194 HydrophobicContact CB-CG2 4.32Å; I180-V194 CarbonylContact O-C 3.6Å; I180-V194 VanDerWaalsContact O-CA 3.3Å; I180-V194 WeakPolarHBondContact O-CA 3.48Å; I180-V194 WeakPolarHBondContact O-CG2 3.48Å; S181-V194 WeakPolarHBondContact OG-CG2 3.25Å; V194-W264 HydrophobicContact CG2-CE3 4.48Å; V194-W264 HydrophobicContact CG2-CZ3 4.14Å
195	V	98.9	Very high	97.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.9	170.6	-60.4	0	0	0	0	109.7	V162 I180 F182 F232	V162-V195 VanDerWaalsContact CG2-C 3.49Å; I180-V195 HydrophobicContact CB-CG2 3.89Å; I180-V195 HydrophobicContact CD1-CG2 4.37Å; I180-V195 PolarHBondContact N-O 3.35Å; I180-V195 PolarHBondContact O-N 2.98Å; F182-V195 HydrophobicContact CE2-CG2 4.27Å; V195-F232 HydrophobicContact CB-CZ 4.33Å; V195-F232 HydrophobicContact CG1-CE1 4.01Å; V195-F232 HydrophobicContact CG1-CZ 3.95Å; V195-F232 HydrophobicContact CG2-CE1 4.37Å; V195-F232 HydrophobicContact CG2-CE2 4.09Å; V195-F232 HydrophobicContact CG2-CZ 3.76Å
196	L	98.9	Very high	97.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	104	171.9	-174.2	64.8	0	0	0	107.8	V162 G165 I166 R177 I198 S206 L207	V162-L196 HydrophobicContact CG1-CB 4.47Å; V162-L196 HydrophobicContact CG1-CD1 4.31Å; V162-L196 HydrophobicContact CG2-CB 4.28Å; G165-L196 VanDerWaalsContact C-CD2 3.49Å; I166-L196 HydrophobicContact CD1-CD1 4.11Å; I166-L196 HydrophobicContact CG1-CD1 3.68Å; I166-L196 HydrophobicContact CG1-CD2 3.9Å; I166-L196 HydrophobicContact CG1-CG 4.47Å; R177-L196 HydrophobicContact CB-CD1 4.13Å; R177-L196 HydrophobicContact CB-CG 4.47Å; L196-I198 HydrophobicContact CD2-CD1 4.07Å; L196-I198 HydrophobicContact CG-CD1 4.04Å; L196-S206 CarbonylContact O-C 3.5Å; L196-S206 WeakPolarHBondContact O-CA 3.39Å; L196-S206 WeakPolarHBondContact O-CB 3.14Å; L196-L207 HydrophobicContact CB-CB 4.43Å; L196-L207 PolarHBondContact N-O 3.4Å; L196-L207 PolarHBondContact O-N 2.96Å
197	G	98.9	Very high	97.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.9	168.8	0	0	0	0	0	110.3	R177 F178	R177-G197 WeakPolarHBondContact CA-O 3.5Å; F178-G197 WeakPolarHBondContact CD1-O 3.47Å; F178-G197 PolarHBondContact N-O 3.28Å; F178-G197 WeakPolarHBondContact O-CA 3.34Å; F178-G197 PolarHBondContact O-N 3.5Å
198	I	98.8	Very high	97.9	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138	179.9	-58.8	-61.5	0	0	0	108.6	L111 I175 R177 L196 Y204 G205 L207 L220	L111-I198 HydrophobicContact CD1-CG2 4.12Å; L111-I198 HydrophobicContact CD2-CD1 4.49Å; L111-I198 HydrophobicContact CD2-CG1 4.41Å; I175-I198 HydrophobicContact CG2-CD1 4.08Å; I175-I198 HydrophobicContact CG2-CG2 3.6Å; R177-I198 HydrophobicContact CB-CD1 4.42Å; R177-I198 HydrophobicContact CG-CD1 3.9Å; L196-I198 HydrophobicContact CD2-CD1 4.07Å; L196-I198 HydrophobicContact CG-CD1 4.04Å; I198-Y204 WeakPolarHBondContact O-CA 3.47Å; I198-G205 PolarHBondContact N-O 3.27Å; I198-G205 PolarHBondContact O-N 3.44Å; I198-L207 HydrophobicContact CD1-CD1 4.36Å; I198-L207 HydrophobicContact CG1-CG 4.3Å; I198-L220 HydrophobicContact CG2-CD1 3.99Å
199	Y	98.7	Very high	98.1	Very high	49 Å²	49	33.8 Å²	33.8	19%	0.192	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.5	167.7	175.2	-104	0	0	0	110	E176 G202 R203 Y204 Y251 R291	E176-Y199 HydrophobicContact CB-CD1 4.21Å; E176-Y199 HydrophobicContact CG-CD1 4.41Å; E176-Y199 PolarHBondContact N-O 3.04Å; E176-Y199 PolarHBondContact O-N 3.29Å; Y199-G202 WeakPolarHBondContact OH-CA 3.22Å; Y199-R203 WeakPolarHBondContact CA-O 3.48Å; Y199-R203 WeakPolarHBondContact CD2-O 3.32Å; Y199-Y204 AromaticContact CD2-CD1 3.92Å; Y199-Y204 HydrophobicContact CD2-CD1 3.92Å; Y199-Y204 AromaticContact CD2-CD2 3.96Å; Y199-Y204 HydrophobicContact CD2-CD2 3.96Å; Y199-Y204 AromaticContact CD2-CE1 3.54Å; Y199-Y204 HydrophobicContact CD2-CE1 3.54Å; Y199-Y204 AromaticContact CD2-CE2 3.57Å; Y199-Y204 HydrophobicContact CD2-CE2 3.57Å; Y199-Y204 HydrophobicContact CD2-CG 4.12Å; Y199-Y204 AromaticContact CD2-CZ 3.32Å; Y199-Y204 HydrophobicContact CE2-CD2 4.4Å; Y199-Y204 HydrophobicContact CE2-CE1 4.48Å; Y199-Y204 AromaticContact CE2-CE2 3.81Å; Y199-Y204 HydrophobicContact CE2-CE2 3.81Å; Y199-Y204 AromaticContact CE2-CZ 3.85Å; Y199-Y204 HydrophobicContact CG-CD1 4.42Å; Y199-Y204 AromaticContact CG-CE1 3.93Å; Y199-Y204 HydrophobicContact CG-CE1 3.93Å; Y199-Y251 WeakPolarHBondContact CD1-OH 3.17Å; Y199-R291 HydrophobicContact CE1-CG 4Å; Y199-R291 VanDerWaalsContact CZ-CD 3.47Å; Y199-R291 WeakPolarHBondContact OH-CD 3.36Å
200	C	98.1	Very high	98.2	Very high	10 Å²	10	31.7 Å²	31.7	7%	0.068	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	138.1	177.9	178.9	0	0	0	0	109.3	S174 G202 R203 L220	S174-C200 WeakPolarHBondContact O-CB 3.26Å; S174-C200 PolarHBondContact O-SG 3Å; C200-G202 VanDerWaalsContact C-N 3.35Å; C200-G202 PolarHBondContact O-N 2.89Å; C200-R203 PolarHBondContact N-O 3.33Å; C200-R203 PolarHBondContact O-N 3.18Å; C200-L220 HydrophobicContact CB-CD1 4.17Å; C200-L220 HydrophobicContact CB-CD2 3.86Å
201	N	96.3	Very high	98.3	Very high	155 Å²	155	33.1 Å²	33.1	83%	0.829	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.3	51	178	-163.9	18.5	0	0	0	115.1	R203	N201-R203 PolarHBondContact O-N 3.44Å
202	G	96.9	Very high	98.4	Very high	39 Å²	39	35.6 Å²	35.6	40%	0.402	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	6.8	178.5	0	0	0	0	0	115.4	Y199 C200	Y199-G202 WeakPolarHBondContact OH-CA 3.22Å; C200-G202 VanDerWaalsContact C-N 3.35Å; C200-G202 PolarHBondContact O-N 2.89Å
203	R	98.5	Very high	98.4	Very high	103 Å²	103	34.2 Å²	34.2	39%	0.389	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	152.3	-179.5	-62.2	-60.9	179.3	114.7	12.8	112.3	Y199 C200 N201 L220 T221 F222	Y199-R203 WeakPolarHBondContact CA-O 3.48Å; Y199-R203 WeakPolarHBondContact CD2-O 3.32Å; C200-R203 PolarHBondContact N-O 3.33Å; C200-R203 PolarHBondContact O-N 3.18Å; N201-R203 PolarHBondContact O-N 3.44Å; R203-L220 HydrophobicContact CB-CD1 4.37Å; R203-L220 HydrophobicContact CB-CG 3.94Å; R203-L220 WeakPolarHBondContact CB-O 3.27Å; R203-T221 PolarHBondContact NH1-O 2.96Å; R203-F222 CarbonylContact C-O 3.57Å; R203-F222 WeakPolarHBondContact CA-O 3.26Å
204	Y	98.9	Very high	98.4	Very high	1 Å²	1	36 Å²	36	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	151.2	176.9	-71.9	-84.2	0	0	0	111.2	F178 I198 Y199 T221 F222 T224 L225 R291	F178-Y204 HydrophobicContact CE1-CD1 4.26Å; F178-Y204 HydrophobicContact CE1-CE1 4.12Å; F178-Y204 AromaticContact CZ-CD1 3.89Å; F178-Y204 HydrophobicContact CZ-CD1 3.89Å; F178-Y204 AromaticContact CZ-CE1 3.89Å; F178-Y204 HydrophobicContact CZ-CE1 3.89Å; I198-Y204 WeakPolarHBondContact O-CA 3.47Å; Y199-Y204 AromaticContact CD2-CD1 3.92Å; Y199-Y204 HydrophobicContact CD2-CD1 3.92Å; Y199-Y204 AromaticContact CD2-CD2 3.96Å; Y199-Y204 HydrophobicContact CD2-CD2 3.96Å; Y199-Y204 AromaticContact CD2-CE1 3.54Å; Y199-Y204 HydrophobicContact CD2-CE1 3.54Å; Y199-Y204 AromaticContact CD2-CE2 3.57Å; Y199-Y204 HydrophobicContact CD2-CE2 3.57Å; Y199-Y204 HydrophobicContact CD2-CG 4.12Å; Y199-Y204 AromaticContact CD2-CZ 3.32Å; Y199-Y204 HydrophobicContact CE2-CD2 4.4Å; Y199-Y204 HydrophobicContact CE2-CE1 4.48Å; Y199-Y204 AromaticContact CE2-CE2 3.81Å; Y199-Y204 HydrophobicContact CE2-CE2 3.81Å; Y199-Y204 AromaticContact CE2-CZ 3.85Å; Y199-Y204 HydrophobicContact CG-CD1 4.42Å; Y199-Y204 AromaticContact CG-CE1 3.93Å; Y199-Y204 HydrophobicContact CG-CE1 3.93Å; Y204-T221 PolarHBondContact O-N 3.23Å; Y204-F222 PolarHBondContact N-O 3.03Å; Y204-F222 WeakPolarHBondContact O-CB 3.28Å; Y204-F222 PolarHBondContact O-N 3.43Å; Y204-T224 VanDerWaalsContact CD2-C 3.46Å; Y204-L225 HydrophobicContact CD1-CD1 4.21Å; Y204-L225 HydrophobicContact CE1-CB 4.21Å; Y204-L225 HydrophobicContact CE1-CD1 4.24Å; Y204-L225 HydrophobicContact CE2-CB 4.37Å; Y204-R291 PolarHBondContact OH-NH1 3.16Å
205	G	98.8	Very high	98.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	-167.8	174.5	0	0	0	0	0	110.4	I198 K218 L228	I198-G205 PolarHBondContact N-O 3.27Å; I198-G205 PolarHBondContact O-N 3.44Å; G205-K218 CarbonylContact C-O 3.58Å; G205-K218 VanDerWaalsContact CA-O 3.31Å; G205-K218 WeakPolarHBondContact CA-O 3.28Å; G205-L228 WeakPolarHBondContact O-CD2 3.41Å
206	S	98.9	Very high	98.4	Very high	6 Å²	6	37.1 Å²	37.1	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	157.9	174.6	60.9	0	0	0	0	114.5	L196 M216 D217 K218 F232	L196-S206 CarbonylContact O-C 3.5Å; L196-S206 WeakPolarHBondContact O-CA 3.39Å; L196-S206 WeakPolarHBondContact O-CB 3.14Å; S206-M216 PolarHBondContact OG-O 2.88Å; S206-D217 WeakPolarHBondContact O-CA 3.44Å; S206-K218 PolarHBondContact N-O 3.18Å; S206-K218 PolarHBondContact O-N 3.2Å; S206-K218 VanDerWaalsContact O-N 3.1Å; S206-K218 WeakPolarHBondContact OG-CB 3.46Å; S206-K218 VanDerWaalsContact OG-CG 3.3Å; S206-K218 WeakPolarHBondContact OG-CG 3.38Å; S206-K218 PolarHBondContact OG-N 2.92Å; S206-F232 WeakPolarHBondContact OG-CZ 3.46Å
207	L	98.9	Very high	98.3	Very high	4 Å²	4	39 Å²	39	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	152.2	164.7	-63.8	174.8	0	0	0	109.8	L111 I114 Q115 T169 L196 I198	L111-L207 HydrophobicContact CB-CD2 4.4Å; L111-L207 HydrophobicContact CD2-CD1 3.86Å; L111-L207 HydrophobicContact CD2-CD2 4.35Å; L111-L207 HydrophobicContact CD2-CG 4.22Å; L111-L207 WeakPolarHBondContact O-CD2 3.4Å; I114-L207 HydrophobicContact CG2-CD1 3.78Å; I114-L207 HydrophobicContact CG2-CD2 4.43Å; Q115-L207 HydrophobicContact CB-CD2 3.85Å; T169-L207 HydrophobicContact CG2-CD1 4.33Å; L196-L207 HydrophobicContact CB-CB 4.43Å; L196-L207 PolarHBondContact N-O 3.4Å; L196-L207 PolarHBondContact O-N 2.96Å; I198-L207 HydrophobicContact CD1-CD1 4.36Å; I198-L207 HydrophobicContact CG1-CG 4.3Å
208	G	98.6	Very high	98.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.			trans	171.7	-170.6	171.9	0	0	0	0	0	114	Q115	Q115-G208 PolarHBondContact NE2-O 2.99Å; Q115-G208 PolarHBondContact OE1-O 2.66Å
209	M	98.7	Very high	98.3	Very high	6 Å²	6	44 Å²	44	3%	0.03	23%	0.228	C	C	.	.			trans	-140.3	130.5	173.3	-75.3	-63.8	-75.8	0	0	110.3	M118 K119 Q122 Y123 I156 C158 A161 M216	M118-M209 HydrophobicContact CB-CG 3.85Å; M118-M209 HydrophobicContact CB-SD 3.74Å; M118-M209 WeakPolarHBondContact O-CE 3.41Å; M118-M209 HydrophobicContact SD-CG 4.45Å; K119-M209 HydrophobicContact CG-SD 4.32Å; Q122-M209 VanDerWaalsContact C-CE 3.42Å; Y123-M209 HydrophobicContact CD2-CB 4.15Å; I156-M209 HydrophobicContact CD1-CG 4.12Å; I156-M209 HydrophobicContact CG1-CG 4.25Å; C158-M209 VanDerWaalsContact CA-O 3.22Å; C158-M209 WeakPolarHBondContact CA-O 3.41Å; C158-M209 VanDerWaalsContact CB-O 3.26Å; C158-M209 WeakPolarHBondContact CB-O 3.28Å; C158-M209 PolarHBondContact N-O 2.86Å; A161-M209 HydrophobicContact CB-CB 3.64Å; A161-M209 HydrophobicContact CB-CG 3.59Å; M209-M216 HydrophobicContact SD-SD 4.36Å
210	S	98.6	Very high	98.3	Very high	16 Å²	16	43.3 Å²	43.3	11%	0.112	23%	0.227	C	C	.	.			trans	-143.9	163	-177.8	-174.7	0	0	0	0	111.3	Y123 R212 L215	Y123-S210 VanDerWaalsContact CD2-C 3.42Å; S210-R212 WeakPolarHBondContact CB-O 3.32Å; S210-R212 PolarHBondContact O-N 2.85Å; S210-R212 PolarHBondContact OG-N 2.91Å; S210-L215 VanDerWaalsContact CB-O 3.26Å; S210-L215 WeakPolarHBondContact CB-O 3.39Å
211	R	97.7	Very high	98.3	Very high	141 Å²	141	46.6 Å²	46.6	53%	0.532	25%	0.247	S	C	.	.	S	Bend	trans	-70.7	-9.4	170.8	-67	-177.3	-80	166.1	-5.4	113	Y123	Y123-R211 HydrophobicContact CD1-CG 3.73Å; Y123-R211 HydrophobicContact CE1-CG 3.37Å; Y123-R211 HydrophobicContact CE2-CG 4.38Å; Y123-R211 HydrophobicContact CG-CG 4.38Å
212	R	98.2	Very high	98.4	Very high	96 Å²	96	40.9 Å²	40.9	36%	0.362	22%	0.215	S	C	.	.	S	Bend	trans	-130.7	132.4	-177.6	-58.1	-57.9	-170.9	-149.3	3.3	109.6	S210 E214 L215 Y239	S210-R212 WeakPolarHBondContact CB-O 3.32Å; S210-R212 PolarHBondContact O-N 2.85Å; S210-R212 PolarHBondContact OG-N 2.91Å; R212-E214 PolarHBondContact O-N 3.13Å; R212-L215 HydrophobicContact CB-CB 4.27Å; R212-L215 HydrophobicContact CB-CD1 4.01Å; R212-L215 HydrophobicContact CB-CG 4.23Å; R212-L215 HydrophobicContact CG-CD1 4.27Å; R212-L215 PolarHBondContact O-N 2.83Å; R212-L215 VanDerWaalsContact O-N 3.15Å; R212-Y239 HydrophobicContact CB-CD2 4.33Å; R212-Y239 HydrophobicContact CB-CE2 3.58Å; R212-Y239 VanDerWaalsContact CD-CE1 3.49Å; R212-Y239 HydrophobicContact CG-CD1 4.32Å; R212-Y239 HydrophobicContact CG-CD2 3.93Å; R212-Y239 HydrophobicContact CG-CE1 4.03Å; R212-Y239 HydrophobicContact CG-CE2 3.58Å; R212-Y239 HydrophobicContact CG-CG 4.27Å
213	A	97.8	Very high	98.5	Very high	61 Å²	61	48 Å²	48	50%	0.504	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-64.9	-39.9	-171	0	0	0	0	0	112.7	L215 M216	A213-L215 PolarHBondContact O-N 3.48Å; A213-L215 VanDerWaalsContact O-N 3.11Å; A213-M216 HydrophobicContact CB-CE 4.27Å; A213-M216 VanDerWaalsContact O-CG 3.23Å; A213-M216 WeakPolarHBondContact O-CG 3.41Å
214	E	98.1	Very high	98.5	Very high	62 Å²	62	44.6 Å²	44.6	29%	0.29	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-77.1	7.5	179.6	-50.5	100	106.4	0	0	113.8	R212 K218 S235 K238 Y239	R212-E214 PolarHBondContact O-N 3.13Å; E214-K218 WeakPolarHBondContact O-CE 3.29Å; E214-K218 PolarHBondContact O-NZ 2.92Å; E214-S235 WeakPolarHBondContact O-CB 3.5Å; E214-S235 PolarHBondContact O-OG 3.19Å; E214-K238 WeakPolarHBondContact OE1-CD 3.4Å; E214-K238 IonicContact OE1-NZ 2.71Å; E214-K238 PolarHBondContact OE1-NZ 3.45Å; E214-Y239 PolarHBondContact OE2-OH 3.03Å
215	L	98.8	Very high	98.5	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.042	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-119.7	28.4	178.3	-64	178.7	0	0	0	112.6	H193 S210 R212 A213 F232 Y236 Y239	H193-L215 PolarHBondContact CE1-O 2.97Å; S210-L215 VanDerWaalsContact CB-O 3.26Å; S210-L215 WeakPolarHBondContact CB-O 3.39Å; R212-L215 HydrophobicContact CB-CB 4.27Å; R212-L215 HydrophobicContact CB-CD1 4.01Å; R212-L215 HydrophobicContact CB-CG 4.23Å; R212-L215 HydrophobicContact CG-CD1 4.27Å; R212-L215 PolarHBondContact O-N 2.83Å; R212-L215 VanDerWaalsContact O-N 3.15Å; A213-L215 PolarHBondContact O-N 3.48Å; A213-L215 VanDerWaalsContact O-N 3.11Å; L215-F232 HydrophobicContact CD2-CD1 4.04Å; L215-Y236 HydrophobicContact CD1-CD1 3.67Å; L215-Y236 HydrophobicContact CD1-CE1 3.51Å; L215-Y236 HydrophobicContact CD1-CG 4.4Å; L215-Y236 HydrophobicContact CD2-CD1 4Å; L215-Y236 HydrophobicContact CD2-CD2 3.88Å; L215-Y236 HydrophobicContact CD2-CE1 3.99Å; L215-Y236 HydrophobicContact CD2-CE2 3.85Å; L215-Y236 HydrophobicContact CD2-CG 3.93Å; L215-Y236 HydrophobicContact CG-CE1 4.39Å; L215-Y239 HydrophobicContact CD1-CD2 3.96Å; L215-Y239 HydrophobicContact CD1-CE2 4.11Å; L215-Y239 HydrophobicContact CG-CE2 4.39Å
216	M	98.3	Very high	98.5	Very high	20 Å²	20	44.5 Å²	44.5	10%	0.099	22%	0.22	C	C	.	.	S	Bend	trans	-136	-92.9	177.1	44.4	177.9	-159.4	0	0	113.3	K119 S206 M209 A213	K119-M216 VanDerWaalsContact CE-CE 3.43Å; K119-M216 HydrophobicContact CG-CE 4.48Å; S206-M216 PolarHBondContact OG-O 2.88Å; M209-M216 HydrophobicContact SD-SD 4.36Å; A213-M216 HydrophobicContact CB-CE 4.27Å; A213-M216 VanDerWaalsContact O-CG 3.23Å; A213-M216 WeakPolarHBondContact O-CG 3.41Å
217	D	98.5	Very high	98.5	Very high	39 Å²	39	46.6 Å²	46.6	21%	0.209	23%	0.231	C	C	.	.			trans	-74.2	145.6	175.2	43.6	-55.3	0	0	0	113.6	Q115 K119 S206	Q115-D217 HydrophobicContact CG-CB 3.62Å; Q115-D217 VanDerWaalsContact CG-CG 3.47Å; K119-D217 WeakPolarHBondContact CE-OD1 3.17Å; K119-D217 IonicContact NZ-OD1 2.69Å; K119-D217 PolarHBondContact NZ-OD1 3.02Å; K119-D217 IonicContact NZ-OD2 3.6Å; K119-D217 PolarHBondContact NZ-OD2 2.75Å; S206-D217 WeakPolarHBondContact O-CA 3.44Å
218	K	98.8	Very high	98.5	Very high	21 Å²	21	46.4 Å²	46.4	9%	0.091	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127.4	171.1	-62	-66.9	171.2	173	0	108.1	G205 S206 E214 F222 L228 D231 F232 S235	G205-K218 CarbonylContact C-O 3.58Å; G205-K218 VanDerWaalsContact CA-O 3.31Å; G205-K218 WeakPolarHBondContact CA-O 3.28Å; S206-K218 PolarHBondContact N-O 3.18Å; S206-K218 PolarHBondContact O-N 3.2Å; S206-K218 VanDerWaalsContact O-N 3.1Å; S206-K218 WeakPolarHBondContact OG-CB 3.46Å; S206-K218 VanDerWaalsContact OG-CG 3.3Å; S206-K218 WeakPolarHBondContact OG-CG 3.38Å; S206-K218 PolarHBondContact OG-N 2.92Å; E214-K218 WeakPolarHBondContact O-CE 3.29Å; E214-K218 PolarHBondContact O-NZ 2.92Å; K218-F222 HydrophobicContact CB-CE2 3.92Å; K218-L228 HydrophobicContact CB-CD1 3.6Å; K218-L228 HydrophobicContact CG-CD1 3.74Å; K218-D231 VanDerWaalsContact CD-OD1 3.3Å; K218-D231 WeakPolarHBondContact CD-OD1 3.44Å; K218-D231 WeakPolarHBondContact CE-OD1 3.45Å; K218-D231 IonicContact NZ-OD1 3.61Å; K218-D231 PolarHBondContact NZ-OD1 3.01Å; K218-F232 HydrophobicContact CD-CE2 4.5Å; K218-F232 HydrophobicContact CG-CD2 4.37Å; K218-F232 HydrophobicContact CG-CE2 3.59Å; K218-F232 HydrophobicContact CG-CZ 3.72Å; K218-S235 PolarHBondContact NZ-OG 3.07Å
219	P	98.3	Very high	98.5	Very high	86 Å²	86	46.6 Å²	46.6	56%	0.558	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	157	-176.2	27.9	-35.8	0	0	0	111.1	T221 F222	P219-T221 HydrophobicContact CB-CG2 4.19Å; P219-T221 HydrophobicContact CG-CG2 4.42Å; P219-T221 PolarHBondContact O-N 2.74Å; P219-F222 WeakPolarHBondContact O-CD2 3.24Å
220	L	98.1	Very high	98.5	Very high	34 Å²	34	46.6 Å²	46.6	18%	0.178	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	52.2	-175.7	-165.7	75	0	0	0	112.3	I198 C200 R203	I198-L220 HydrophobicContact CG2-CD1 3.99Å; C200-L220 HydrophobicContact CB-CD1 4.17Å; C200-L220 HydrophobicContact CB-CD2 3.86Å; R203-L220 HydrophobicContact CB-CD1 4.37Å; R203-L220 HydrophobicContact CB-CG 3.94Å; R203-L220 WeakPolarHBondContact CB-O 3.27Å
221	T	98.4	Very high	98.5	Very high	80 Å²	80	48.5 Å²	48.5	49%	0.491	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-21.3	-171.9	55.9	0	0	0	0	113.4	R203 Y204 P219 R223	R203-T221 PolarHBondContact NH1-O 2.96Å; Y204-T221 PolarHBondContact O-N 3.23Å; P219-T221 HydrophobicContact CB-CG2 4.19Å; P219-T221 HydrophobicContact CG-CG2 4.42Å; P219-T221 PolarHBondContact O-N 2.74Å; T221-R223 PolarHBondContact O-N 2.96Å
222	F	98.7	Very high	98.5	Very high	34 Å²	34	41.8 Å²	41.8	15%	0.149	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	131.5	-176.8	-63.5	-93.1	0	0	0	110.5	R203 Y204 K218 P219 D227 L228 D231	R203-F222 CarbonylContact C-O 3.57Å; R203-F222 WeakPolarHBondContact CA-O 3.26Å; Y204-F222 PolarHBondContact N-O 3.03Å; Y204-F222 WeakPolarHBondContact O-CB 3.28Å; Y204-F222 PolarHBondContact O-N 3.43Å; K218-F222 HydrophobicContact CB-CE2 3.92Å; P219-F222 WeakPolarHBondContact O-CD2 3.24Å; F222-D227 HydrophobicContact CD1-CB 4.02Å; F222-L228 HydrophobicContact CB-CB 4.18Å; F222-L228 HydrophobicContact CD1-CB 4.25Å; F222-L228 HydrophobicContact CD2-CD1 3.86Å; F222-L228 HydrophobicContact CE2-CD1 4.01Å; F222-L228 HydrophobicContact CG-CB 4.06Å; F222-L228 HydrophobicContact CG-CD1 4.21Å; F222-L228 HydrophobicContact CZ-CD1 4.44Å; F222-D231 HydrophobicContact CE1-CB 3.6Å; F222-D231 HydrophobicContact CZ-CB 3.92Å
223	R	98.3	Very high	98.5	Very high	189 Å²	189	38.8 Å²	38.8	71%	0.713	20%	0.204	S	C	*	.	S	Bend	trans	-82.1	-22.5	-176.7	-63.2	-176.3	-174.1	-171.6	2.3	113	T221	T221-R223 PolarHBondContact O-N 2.96Å
224	T	98.8	Very high	98.6	Very high	32 Å²	32	38.7 Å²	38.7	20%	0.196	20%	0.195	C	C	.	.	S	Bend	trans	-137.7	160.8	-175.1	76.9	0	0	0	0	110.5	Y204 S226 D227 R280 E284	Y204-T224 VanDerWaalsContact CD2-C 3.46Å; T224-S226 VanDerWaalsContact C-N 3.34Å; T224-S226 PolarHBondContact OG1-OG 3.23Å; T224-S226 VanDerWaalsContact OG1-OG 3.05Å; T224-D227 WeakPolarHBondContact CB-OD2 3.49Å; T224-D227 WeakPolarHBondContact CG2-OD2 3.49Å; T224-D227 PolarHBondContact OG1-N 3.06Å; T224-D227 VanDerWaalsContact OG1-N 3.1Å; T224-D227 PolarHBondContact OG1-OD1 3.24Å; T224-D227 PolarHBondContact OG1-OD2 3.41Å; T224-R280 PolarHBondContact OG1-NH1 3.38Å; T224-E284 VanDerWaalsContact CB-OE1 3.31Å; T224-E284 WeakPolarHBondContact CB-OE1 3.44Å
225	L	98.8	Very high	98.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69.6	-38.5	177.9	177.4	58.4	0	0	0	110.5	F178 Y204 L228 I229 I248 L283 E284 Y286 A287 M290	F178-L225 HydrophobicContact CE2-CD1 3.79Å; F178-L225 HydrophobicContact CZ-CD1 3.89Å; Y204-L225 HydrophobicContact CD1-CD1 4.21Å; Y204-L225 HydrophobicContact CE1-CB 4.21Å; Y204-L225 HydrophobicContact CE1-CD1 4.24Å; Y204-L225 HydrophobicContact CE2-CB 4.37Å; L225-L228 PolarHBondContact O-N 3.21Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CG1 4.36Å; L225-I229 WeakPolarHBondContact O-CG1 3.01Å; L225-I229 PolarHBondContact O-N 2.96Å; L225-I248 HydrophobicContact CD1-CD1 4.41Å; L225-I248 HydrophobicContact CD2-CD1 3.83Å; L225-I248 HydrophobicContact CG-CD1 4.29Å; L225-L283 HydrophobicContact CD2-CD2 4.45Å; L225-E284 PolarHBondContact N-OE1 3.33Å; L225-Y286 HydrophobicContact CD2-CD1 4.32Å; L225-A287 HydrophobicContact CB-CB 3.81Å; L225-A287 HydrophobicContact CD2-CB 3.83Å; L225-M290 HydrophobicContact CD2-CE 4.19Å
226	S	98.7	Very high	98.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-41.3	176.9	49	0	0	0	0	113.1	T224 L228 I229 F230 R280 E284	T224-S226 VanDerWaalsContact C-N 3.34Å; T224-S226 PolarHBondContact OG1-OG 3.23Å; T224-S226 VanDerWaalsContact OG1-OG 3.05Å; S226-L228 VanDerWaalsContact C-N 3.33Å; S226-L228 PolarHBondContact O-N 2.96Å; S226-I229 PolarHBondContact O-N 3.34Å; S226-F230 WeakPolarHBondContact O-CB 3.47Å; S226-F230 WeakPolarHBondContact O-CD2 3.42Å; S226-F230 WeakPolarHBondContact O-CG 3.04Å; S226-F230 PolarHBondContact O-N 3.21Å; S226-R280 PolarHBondContact OG-NH1 3.44Å; S226-E284 VanDerWaalsContact CB-OE1 3.26Å; S226-E284 WeakPolarHBondContact CB-OE1 3.3Å; S226-E284 PolarHBondContact N-OE1 3.4Å; S226-E284 PolarHBondContact OG-OE1 2.93Å
227	D	98.8	Very high	98.6	Very high	50 Å²	50	40.1 Å²	40.1	27%	0.267	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-40.5	176.4	-57.5	-37.3	0	0	0	111.8	F222 T224 F230 D231 R280	F222-D227 HydrophobicContact CD1-CB 4.02Å; T224-D227 WeakPolarHBondContact CB-OD2 3.49Å; T224-D227 WeakPolarHBondContact CG2-OD2 3.49Å; T224-D227 PolarHBondContact OG1-N 3.06Å; T224-D227 VanDerWaalsContact OG1-N 3.1Å; T224-D227 PolarHBondContact OG1-OD1 3.24Å; T224-D227 PolarHBondContact OG1-OD2 3.41Å; D227-F230 PolarHBondContact O-N 2.85Å; D227-D231 WeakPolarHBondContact O-CB 3.16Å; D227-D231 PolarHBondContact O-N 3.3Å; D227-R280 IonicContact OD1-CZ 3.94Å; D227-R280 VanDerWaalsContact OD1-CZ 3.24Å; D227-R280 IonicContact OD1-NH1 2.75Å; D227-R280 PolarHBondContact OD1-NH1 3.01Å; D227-R280 IonicContact OD1-NH2 3.24Å; D227-R280 PolarHBondContact OD1-NH2 3.11Å; D227-R280 IonicContact OD2-NH1 3.28Å
228	L	98.9	Very high	98.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-46.3	175.1	177.4	66.9	0	0	0	111.8	I180 G205 K218 F222 L225 S226 F230 D231 F232	I180-L228 HydrophobicContact CD1-CD2 4.06Å; G205-L228 WeakPolarHBondContact O-CD2 3.41Å; K218-L228 HydrophobicContact CB-CD1 3.6Å; K218-L228 HydrophobicContact CG-CD1 3.74Å; F222-L228 HydrophobicContact CB-CB 4.18Å; F222-L228 HydrophobicContact CD1-CB 4.25Å; F222-L228 HydrophobicContact CD2-CD1 3.86Å; F222-L228 HydrophobicContact CE2-CD1 4.01Å; F222-L228 HydrophobicContact CG-CB 4.06Å; F222-L228 HydrophobicContact CG-CD1 4.21Å; F222-L228 HydrophobicContact CZ-CD1 4.44Å; L225-L228 PolarHBondContact O-N 3.21Å; S226-L228 VanDerWaalsContact C-N 3.33Å; S226-L228 PolarHBondContact O-N 2.96Å; L228-F230 VanDerWaalsContact C-N 3.3Å; L228-F230 PolarHBondContact O-N 2.9Å; L228-D231 PolarHBondContact O-N 3.36Å; L228-F232 HydrophobicContact CD1-CD2 4.23Å; L228-F232 HydrophobicContact CD1-CE2 3.96Å; L228-F232 HydrophobicContact CG-CD2 4.34Å; L228-F232 HydrophobicContact CG-CE2 4.32Å; L228-F232 WeakPolarHBondContact O-CD2 3.38Å; L228-F232 PolarHBondContact O-N 3.32Å; L228-F232 VanDerWaalsContact O-N 3.15Å
229	I	98.8	Very high	98.6	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-36.2	178.8	-64.8	-62	0	0	0	111.5	I180 F182 L225 S226 F232 E233 V246 I248 L283	I180-I229 HydrophobicContact CD1-CD1 4.05Å; I180-I229 HydrophobicContact CG1-CD1 4.49Å; I180-I229 HydrophobicContact CG2-CD1 3.43Å; I180-I229 VanDerWaalsContact CG2-CD1 3.43Å; F182-I229 HydrophobicContact CZ-CD1 4.28Å; L225-I229 HydrophobicContact CD1-CG1 4.23Å; L225-I229 HydrophobicContact CG-CG1 4.36Å; L225-I229 WeakPolarHBondContact O-CG1 3.01Å; L225-I229 PolarHBondContact O-N 2.96Å; S226-I229 PolarHBondContact O-N 3.34Å; I229-F232 PolarHBondContact O-N 3.27Å; I229-E233 PolarHBondContact O-N 3.15Å; I229-V246 HydrophobicContact CD1-CG1 4.1Å; I229-V246 HydrophobicContact CG2-CG1 4.2Å; I229-V246 HydrophobicContact CG2-CG2 4.13Å; I229-I248 HydrophobicContact CD1-CD1 4.1Å; I229-I248 HydrophobicContact CG1-CD1 4.26Å; I229-L283 HydrophobicContact CB-CD1 3.87Å; I229-L283 HydrophobicContact CG1-CD1 4.05Å; I229-L283 HydrophobicContact CG1-CD2 4.31Å; I229-L283 HydrophobicContact CG2-CD1 3.89Å
230	F	98.7	Very high	98.6	Very high	6 Å²	6	48 Å²	48	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-71.2	-38	176.4	-67.3	-36.1	0	0	0	112.8	S226 D227 L228 F232 E233 D234 R276 I279 R280	S226-F230 WeakPolarHBondContact O-CB 3.47Å; S226-F230 WeakPolarHBondContact O-CD2 3.42Å; S226-F230 WeakPolarHBondContact O-CG 3.04Å; S226-F230 PolarHBondContact O-N 3.21Å; D227-F230 PolarHBondContact O-N 2.85Å; L228-F230 VanDerWaalsContact C-N 3.3Å; L228-F230 PolarHBondContact O-N 2.9Å; F230-F232 VanDerWaalsContact C-N 3.29Å; F230-F232 PolarHBondContact O-N 3.08Å; F230-E233 WeakPolarHBondContact O-CB 3.36Å; F230-E233 PolarHBondContact O-N 2.82Å; F230-E233 VanDerWaalsContact O-N 3.1Å; F230-D234 WeakPolarHBondContact O-CB 3.34Å; F230-D234 VanDerWaalsContact O-CG 3.26Å; F230-D234 PolarHBondContact O-N 2.77Å; F230-R276 HydrophobicContact CD1-CG 4.01Å; F230-R276 HydrophobicContact CD2-CG 4.49Å; F230-R276 HydrophobicContact CE1-CG 3.5Å; F230-R276 VanDerWaalsContact CE1-CG 3.5Å; F230-R276 HydrophobicContact CE2-CG 4.02Å; F230-R276 HydrophobicContact CZ-CG 3.5Å; F230-R276 WeakPolarHBondContact CZ-O 3.29Å; F230-I279 HydrophobicContact CE1-CB 4.1Å; F230-I279 HydrophobicContact CE1-CG2 3.62Å; F230-I279 HydrophobicContact CZ-CB 4.15Å; F230-I279 HydrophobicContact CZ-CG2 3.91Å; F230-R280 HydrophobicContact CE2-CB 4.05Å; F230-R280 HydrophobicContact CZ-CB 4.09Å
231	D	98.8	Very high	98.6	Very high	55 Å²	55	48.2 Å²	48.2	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-37.1	172.9	-179.6	-80.1	0	0	0	112	K218 F222 D227 L228 S235	K218-D231 VanDerWaalsContact CD-OD1 3.3Å; K218-D231 WeakPolarHBondContact CD-OD1 3.44Å; K218-D231 WeakPolarHBondContact CE-OD1 3.45Å; K218-D231 IonicContact NZ-OD1 3.61Å; K218-D231 PolarHBondContact NZ-OD1 3.01Å; F222-D231 HydrophobicContact CE1-CB 3.6Å; F222-D231 HydrophobicContact CZ-CB 3.92Å; D227-D231 WeakPolarHBondContact O-CB 3.16Å; D227-D231 PolarHBondContact O-N 3.3Å; L228-D231 PolarHBondContact O-N 3.36Å; D231-S235 WeakPolarHBondContact O-CB 3.41Å; D231-S235 PolarHBondContact O-N 3.2Å; D231-S235 PolarHBondContact O-OG 3.22Å
232	F	98.8	Very high	98.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-44.2	168.2	-87.3	-75.1	0	0	0	112.9	F182 V195 S206 L215 K218 L228 I229 F230 D234 S235 Y236	F182-F232 HydrophobicContact CE1-CB 3.78Å; F182-F232 HydrophobicContact CE1-CG 4.37Å; F182-F232 HydrophobicContact CE2-CB 4.29Å; F182-F232 HydrophobicContact CE2-CD1 4.05Å; F182-F232 HydrophobicContact CE2-CD2 4.42Å; F182-F232 HydrophobicContact CE2-CE1 4.5Å; F182-F232 HydrophobicContact CE2-CG 4.01Å; F182-F232 HydrophobicContact CZ-CB 3.45Å; F182-F232 VanDerWaalsContact CZ-CB 3.45Å; F182-F232 HydrophobicContact CZ-CD1 4.05Å; F182-F232 AromaticContact CZ-CD2 3.94Å; F182-F232 HydrophobicContact CZ-CD2 3.94Å; F182-F232 AromaticContact CZ-CG 3.56Å; F182-F232 HydrophobicContact CZ-CG 3.56Å; V195-F232 HydrophobicContact CB-CZ 4.33Å; V195-F232 HydrophobicContact CG1-CE1 4.01Å; V195-F232 HydrophobicContact CG1-CZ 3.95Å; V195-F232 HydrophobicContact CG2-CE1 4.37Å; V195-F232 HydrophobicContact CG2-CE2 4.09Å; V195-F232 HydrophobicContact CG2-CZ 3.76Å; S206-F232 WeakPolarHBondContact OG-CZ 3.46Å; L215-F232 HydrophobicContact CD2-CD1 4.04Å; K218-F232 HydrophobicContact CD-CE2 4.5Å; K218-F232 HydrophobicContact CG-CD2 4.37Å; K218-F232 HydrophobicContact CG-CE2 3.59Å; K218-F232 HydrophobicContact CG-CZ 3.72Å; L228-F232 HydrophobicContact CD1-CD2 4.23Å; L228-F232 HydrophobicContact CD1-CE2 3.96Å; L228-F232 HydrophobicContact CG-CD2 4.34Å; L228-F232 HydrophobicContact CG-CE2 4.32Å; L228-F232 WeakPolarHBondContact O-CD2 3.38Å; L228-F232 PolarHBondContact O-N 3.32Å; L228-F232 VanDerWaalsContact O-N 3.15Å; I229-F232 PolarHBondContact O-N 3.27Å; F230-F232 VanDerWaalsContact C-N 3.29Å; F230-F232 PolarHBondContact O-N 3.08Å; F232-D234 VanDerWaalsContact C-N 3.35Å; F232-D234 PolarHBondContact O-N 2.84Å; F232-S235 PolarHBondContact O-N 3Å; F232-Y236 WeakPolarHBondContact O-CD2 3.14Å; F232-Y236 PolarHBondContact O-N 3.33Å
233	E	98.4	Very high	98.6	Very high	33 Å²	33	46.3 Å²	46.3	15%	0.154	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-46.4	175.9	-177.2	-171.3	-113.7	0	0	111.5	I229 F230 S235 Y236 K237 V243 R276	I229-E233 PolarHBondContact O-N 3.15Å; F230-E233 WeakPolarHBondContact O-CB 3.36Å; F230-E233 PolarHBondContact O-N 2.82Å; F230-E233 VanDerWaalsContact O-N 3.1Å; E233-S235 VanDerWaalsContact C-N 3.33Å; E233-Y236 PolarHBondContact O-N 2.74Å; E233-K237 WeakPolarHBondContact O-CG 3.4Å; E233-K237 PolarHBondContact O-N 3.16Å; E233-K237 IonicContact OE2-NZ 3.36Å; E233-K237 PolarHBondContact OE2-NZ 3.27Å; E233-V243 HydrophobicContact CB-CG2 4.31Å; E233-V243 HydrophobicContact CG-CG2 4.05Å; E233-R276 IonicContact OE2-CZ 3.97Å; E233-R276 IonicContact OE2-NH1 2.68Å; E233-R276 PolarHBondContact OE2-NH1 3.31Å
234	D	98.6	Very high	98.6	Very high	60 Å²	60	40.1 Å²	40.1	32%	0.321	20%	0.197	S	C	.	.	H	α-helix	trans	-71.7	-30.6	-179.1	-62.7	-33.6	0	0	0	111.2	F230 F232 K237 R276	F230-D234 WeakPolarHBondContact O-CB 3.34Å; F230-D234 VanDerWaalsContact O-CG 3.26Å; F230-D234 PolarHBondContact O-N 2.77Å; F232-D234 VanDerWaalsContact C-N 3.35Å; F232-D234 PolarHBondContact O-N 2.84Å; D234-K237 PolarHBondContact O-N 3.03Å; D234-K237 IonicContact OD1-NZ 3.36Å; D234-K237 PolarHBondContact OD1-NZ 2.92Å; D234-R276 IonicContact OD1-CZ 2.66Å; D234-R276 IonicContact OD1-NH1 2.72Å; D234-R276 PolarHBondContact OD1-NH1 2.92Å; D234-R276 IonicContact OD1-NH2 2.72Å; D234-R276 IonicContact OD2-CZ 3.92Å; D234-R276 IonicContact OD2-NH1 2.68Å; D234-R276 PolarHBondContact OD2-NH1 2.83Å; D234-R276 IonicContact OD2-NH2 2.63Å; D234-R276 PolarHBondContact OD2-NH2 3.08Å
235	S	98.8	Very high	98.6	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-33.1	168.4	-61.6	0	0	0	0	113.1	E214 K218 D231 F232 E233 K238 Y239	E214-S235 WeakPolarHBondContact O-CB 3.5Å; E214-S235 PolarHBondContact O-OG 3.19Å; K218-S235 PolarHBondContact NZ-OG 3.07Å; D231-S235 WeakPolarHBondContact O-CB 3.41Å; D231-S235 PolarHBondContact O-N 3.2Å; D231-S235 PolarHBondContact O-OG 3.22Å; F232-S235 PolarHBondContact O-N 3Å; E233-S235 VanDerWaalsContact C-N 3.33Å; S235-K238 WeakPolarHBondContact O-CB 3.49Å; S235-Y239 WeakPolarHBondContact O-CD2 3.43Å
236	Y	98.8	Very high	98.6	Very high	8 Å²	8	42.5 Å²	42.5	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-69.5	-34.2	173.4	-84.5	-66.6	0	0	0	112.7	F182 T184 H193 L215 F232 E233 K238 Y239 L240 H241 V243	F182-Y236 HydrophobicContact CB-CE2 3.98Å; F182-Y236 AromaticContact CD1-CE2 3.84Å; F182-Y236 HydrophobicContact CD1-CE2 3.84Å; F182-Y236 HydrophobicContact CD2-CE2 4.16Å; F182-Y236 HydrophobicContact CE1-CE2 4.37Å; F182-Y236 AromaticContact CG-CE2 3.73Å; F182-Y236 HydrophobicContact CG-CE2 3.73Å; T184-Y236 HydrophobicContact CG2-CD1 3.86Å; T184-Y236 HydrophobicContact CG2-CD2 4.13Å; T184-Y236 HydrophobicContact CG2-CE1 3.69Å; T184-Y236 HydrophobicContact CG2-CE2 3.99Å; T184-Y236 HydrophobicContact CG2-CG 4.08Å; H193-Y236 VanDerWaalsContact CB-OH 3.24Å; H193-Y236 WeakPolarHBondContact CB-OH 3.37Å; H193-Y236 PolarHBondContact ND1-OH 2.87Å; L215-Y236 HydrophobicContact CD1-CD1 3.67Å; L215-Y236 HydrophobicContact CD1-CE1 3.51Å; L215-Y236 HydrophobicContact CD1-CG 4.4Å; L215-Y236 HydrophobicContact CD2-CD1 4Å; L215-Y236 HydrophobicContact CD2-CD2 3.88Å; L215-Y236 HydrophobicContact CD2-CE1 3.99Å; L215-Y236 HydrophobicContact CD2-CE2 3.85Å; L215-Y236 HydrophobicContact CD2-CG 3.93Å; L215-Y236 HydrophobicContact CG-CE1 4.39Å; F232-Y236 WeakPolarHBondContact O-CD2 3.14Å; F232-Y236 PolarHBondContact O-N 3.33Å; E233-Y236 PolarHBondContact O-N 2.74Å; Y236-K238 PolarHBondContact O-N 2.71Å; Y236-Y239 CarbonylContact O-C 3.48Å; Y236-Y239 PolarHBondContact O-N 3.14Å; Y236-L240 PolarHBondContact O-N 3.12Å; Y236-H241 HydrophobicContact CD1-CB 3.75Å; Y236-H241 HydrophobicContact CG-CB 4.27Å; Y236-H241 PolarHBondContact O-N 3.33Å; Y236-V243 HydrophobicContact CD2-CG2 3.63Å; Y236-V243 HydrophobicContact CE2-CG2 4.43Å; Y236-V243 HydrophobicContact CG-CG2 4.06Å
237	K	98.1	Very high	98.6	Very high	106 Å²	106	45.9 Å²	45.9	46%	0.461	22%	0.22	S	C	.	.	H	α-helix	trans	-59.5	-34.6	178	-69.1	169.6	-168.3	156.5	0	112.1	E233 D234 Y239 L240	E233-K237 WeakPolarHBondContact O-CG 3.4Å; E233-K237 PolarHBondContact O-N 3.16Å; E233-K237 IonicContact OE2-NZ 3.36Å; E233-K237 PolarHBondContact OE2-NZ 3.27Å; D234-K237 PolarHBondContact O-N 3.03Å; D234-K237 IonicContact OD1-NZ 3.36Å; D234-K237 PolarHBondContact OD1-NZ 2.92Å; K237-Y239 PolarHBondContact O-N 2.92Å; K237-Y239 VanDerWaalsContact O-N 3.12Å; K237-L240 PolarHBondContact O-N 3.28Å
238	K	98.6	Very high	98.6	Very high	122 Å²	122	43.5 Å²	43.5	53%	0.53	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.9	172.8	-63.2	177.3	169.9	-179.9	0	113.9	E214 S235 Y236	E214-K238 WeakPolarHBondContact OE1-CD 3.4Å; E214-K238 IonicContact OE1-NZ 2.71Å; E214-K238 PolarHBondContact OE1-NZ 3.45Å; S235-K238 WeakPolarHBondContact O-CB 3.49Å; Y236-K238 PolarHBondContact O-N 2.71Å
239	Y	98	Very high	98.5	Very high	57 Å²	57	43.5 Å²	43.5	22%	0.224	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	19.6	-179.6	-52.5	-64.1	0	0	0	112.4	R212 E214 L215 S235 Y236 K237 H241	R212-Y239 HydrophobicContact CB-CD2 4.33Å; R212-Y239 HydrophobicContact CB-CE2 3.58Å; R212-Y239 VanDerWaalsContact CD-CE1 3.49Å; R212-Y239 HydrophobicContact CG-CD1 4.32Å; R212-Y239 HydrophobicContact CG-CD2 3.93Å; R212-Y239 HydrophobicContact CG-CE1 4.03Å; R212-Y239 HydrophobicContact CG-CE2 3.58Å; R212-Y239 HydrophobicContact CG-CG 4.27Å; E214-Y239 PolarHBondContact OE2-OH 3.03Å; L215-Y239 HydrophobicContact CD1-CD2 3.96Å; L215-Y239 HydrophobicContact CD1-CE2 4.11Å; L215-Y239 HydrophobicContact CG-CE2 4.39Å; S235-Y239 WeakPolarHBondContact O-CD2 3.43Å; Y236-Y239 CarbonylContact O-C 3.48Å; Y236-Y239 PolarHBondContact O-N 3.14Å; K237-Y239 PolarHBondContact O-N 2.92Å; K237-Y239 VanDerWaalsContact O-N 3.12Å; Y239-H241 PolarHBondContact O-CD2 2.79Å; Y239-H241 VanDerWaalsContact O-CD2 3.29Å; Y239-H241 PolarHBondContact O-N 3.16Å
240	L	98.2	Very high	98.5	Very high	133 Å²	133	44.5 Å²	44.5	70%	0.696	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	11.9	-179.9	-48	177.7	0	0	0	114.7	F186 Y236 K237	F186-L240 HydrophobicContact CD2-CB 3.89Å; F186-L240 HydrophobicContact CE2-CB 3.83Å; F186-L240 HydrophobicContact CE2-CD1 4.28Å; Y236-L240 PolarHBondContact O-N 3.12Å; K237-L240 PolarHBondContact O-N 3.28Å
241	H	98.4	Very high	98.5	Very high	37 Å²	37	46 Å²	46	17%	0.171	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-78.3	122.7	175.6	-81.4	-102.2	0	0	0	110.6	T184 F191 Y236 Y239	T184-H241 PolarHBondContact OG1-ND1 2.87Å; F191-H241 AromaticContact CD2-CE1 3.46Å; F191-H241 VanDerWaalsContact CD2-CE1 3.46Å; F191-H241 WeakPolarHBondContact CD2-CE1 3.42Å; F191-H241 AromaticContact CD2-ND1 3.95Å; F191-H241 AromaticContact CE2-CE1 3.98Å; F191-H241 AromaticContact CG-CE1 3.89Å; Y236-H241 HydrophobicContact CD1-CB 3.75Å; Y236-H241 HydrophobicContact CG-CB 4.27Å; Y236-H241 PolarHBondContact O-N 3.33Å; Y239-H241 PolarHBondContact O-CD2 2.79Å; Y239-H241 VanDerWaalsContact O-CD2 3.29Å; Y239-H241 PolarHBondContact O-N 3.16Å
242	T	98.4	Very high	98.4	Very high	66 Å²	66	43.6 Å²	43.6	41%	0.405	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.9	167.1	-57	0	0	0	0	109.1	T184 Y185 K244	T184-T242 CarbonylContact C-O 3.54Å; T184-T242 VanDerWaalsContact CA-O 3.25Å; T184-T242 WeakPolarHBondContact CA-O 3Å; T184-T242 WeakPolarHBondContact CB-O 3.35Å; Y185-T242 PolarHBondContact N-O 2.75Å; Y185-T242 PolarHBondContact O-N 2.95Å; T242-K244 HydrophobicContact CG2-CD 3.95Å; T242-K244 PolarHBondContact O-N 3.31Å
243	V	98.6	Very high	98.3	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.048	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	126.3	169.9	-168.9	0	0	0	0	108.8	F182 T184 E233 Y236 V246 V271 S272	F182-V243 HydrophobicContact CD1-CG1 4.15Å; T184-V243 HydrophobicContact CG2-CB 4.47Å; T184-V243 HydrophobicContact CG2-CG1 4.47Å; T184-V243 HydrophobicContact CG2-CG2 4.15Å; E233-V243 HydrophobicContact CB-CG2 4.31Å; E233-V243 HydrophobicContact CG-CG2 4.05Å; Y236-V243 HydrophobicContact CD2-CG2 3.63Å; Y236-V243 HydrophobicContact CE2-CG2 4.43Å; Y236-V243 HydrophobicContact CG-CG2 4.06Å; V243-V246 HydrophobicContact CG1-CG2 3.92Å; V243-V271 HydrophobicContact CB-CG2 4.01Å; V243-V271 HydrophobicContact CG1-CG2 3.64Å; V243-S272 WeakPolarHBondContact O-CB 3.44Å
244	K	98.4	Very high	98.3	Very high	59 Å²	59	46.4 Å²	46.4	26%	0.257	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-38.7	-178.1	-63	-64.8	-173.1	-178.8	0	111.8	K183 Y190 T242 N270 V271 S272	K183-K244 PolarHBondContact O-N 2.71Å; Y190-K244 HydrophobicContact CE1-CG 4.15Å; T242-K244 HydrophobicContact CG2-CD 3.95Å; T242-K244 PolarHBondContact O-N 3.31Å; K244-N270 CarbonylContact O-C 3.56Å; K244-V271 PolarHBondContact O-N 3.07Å; K244-S272 WeakPolarHBondContact CD-OG 3.29Å
245	K	98.6	Very high	98.1	Very high	78 Å²	78	48.4 Å²	48.4	34%	0.339	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143	171.2	-51.6	-166.2	-174.5	-138.2	0	112.1	K183 L269 N270	K183-K245 HydrophobicContact CB-CB 4.27Å; K183-K245 PolarHBondContact N-O 3.23Å; K183-K245 PolarHBondContact O-N 3.17Å; K245-L269 VanDerWaalsContact CA-O 3.23Å; K245-L269 WeakPolarHBondContact CA-O 3.47Å; K245-N270 WeakPolarHBondContact CD-OD1 3.47Å; K245-N270 WeakPolarHBondContact CE-OD1 3.47Å; K245-N270 PolarHBondContact NZ-OD1 2.93Å
246	V	98.8	Very high	97.8	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.7	165	177.3	0	0	0	0	107.6	I180 S181 F182 I229 V243 I248 V268 L269 V271	I180-V246 HydrophobicContact CG2-CG1 4.49Å; S181-V246 CarbonylContact O-C 3.5Å; F182-V246 HydrophobicContact CD1-CG2 3.97Å; F182-V246 HydrophobicContact CE1-CG2 4.08Å; I229-V246 HydrophobicContact CD1-CG1 4.1Å; I229-V246 HydrophobicContact CG2-CG1 4.2Å; I229-V246 HydrophobicContact CG2-CG2 4.13Å; V243-V246 HydrophobicContact CG1-CG2 3.92Å; V246-I248 HydrophobicContact CG1-CD1 4.32Å; V246-I248 HydrophobicContact CG1-CG1 4.03Å; V246-V268 WeakPolarHBondContact O-CA 3.4Å; V246-L269 PolarHBondContact N-O 2.93Å; V246-L269 PolarHBondContact O-N 3.38Å; V246-V271 HydrophobicContact CB-CG1 4.21Å; V246-V271 HydrophobicContact CG2-CG1 3.82Å; V246-V271 HydrophobicContact CG2-CG2 4.24Å
247	K	98.8	Very high	97.4	Very high	72 Å²	72	56 Å²	56	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.1	172.4	-46.4	177.5	-177.8	170.7	0	108.7	S181 K265 L267 V268	S181-K247 PolarHBondContact N-O 2.9Å; S181-K247 PolarHBondContact O-N 3.42Å; K247-K265 HydrophobicContact CD-CB 4.42Å; K247-L267 CarbonylContact C-O 3.57Å; K247-L267 VanDerWaalsContact CA-O 3.24Å; K247-L267 WeakPolarHBondContact CA-O 3.46Å; K247-V268 HydrophobicContact CB-CG2 4.38Å; K247-V268 HydrophobicContact CG-CG1 4.28Å; K247-V268 HydrophobicContact CG-CG2 4.12Å
248	I	98.7	Very high	97.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.6	178.4	-46.9	-171.2	0	0	0	108.4	F178 L225 I229 V246 Q266 L267 L283 Y286	F178-I248 HydrophobicContact CD2-CG2 3.58Å; F178-I248 HydrophobicContact CE2-CG2 3.95Å; L225-I248 HydrophobicContact CD1-CD1 4.41Å; L225-I248 HydrophobicContact CD2-CD1 3.83Å; L225-I248 HydrophobicContact CG-CD1 4.29Å; I229-I248 HydrophobicContact CD1-CD1 4.1Å; I229-I248 HydrophobicContact CG1-CD1 4.26Å; V246-I248 HydrophobicContact CG1-CD1 4.32Å; V246-I248 HydrophobicContact CG1-CG1 4.03Å; I248-Q266 PolarHBondContact O-N 2.91Å; I248-L267 HydrophobicContact CB-CB 4.29Å; I248-L267 HydrophobicContact CD1-CD2 4.31Å; I248-L267 PolarHBondContact N-O 3.1Å; I248-L267 PolarHBondContact O-N 3.3Å; I248-L283 HydrophobicContact CD1-CD2 3.41Å; I248-L283 VanDerWaalsContact CD1-CD2 3.41Å; I248-Y286 HydrophobicContact CB-CE1 3.95Å; I248-Y286 HydrophobicContact CG2-CD1 4.44Å; I248-Y286 HydrophobicContact CG2-CE1 3.73Å
249	G	98.3	Very high	97	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.			trans	-85.3	175.4	175.5	0	0	0	0	0	113.7	P179 E263 Y286	P179-G249 PolarHBondContact O-N 3.41Å; G249-E263 WeakPolarHBondContact CA-O 3.27Å; G249-Y286 PolarHBondContact O-OH 3.44Å
250	L	97.8	Very high	96.7	Very high	25 Å²	25	57 Å²	57	13%	0.131	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76	169	168.7	-67.9	175	0	0	0	111.3	F178 V252 E263 Q266 L295 P297	F178-L250 WeakPolarHBondContact CB-O 3.39Å; L250-V252 PolarHBondContact O-N 3.08Å; L250-E263 HydrophobicContact CB-CB 4.27Å; L250-E263 HydrophobicContact CD1-CB 4.15Å; L250-E263 HydrophobicContact CD1-CG 4.14Å; L250-E263 HydrophobicContact CG-CB 4.22Å; L250-E263 HydrophobicContact CG-CG 4.07Å; L250-E263 PolarHBondContact N-O 3.21Å; L250-Q266 HydrophobicContact CD2-CB 4.32Å; L250-Q266 HydrophobicContact CD2-CG 3.75Å; L250-Q266 HydrophobicContact CG-CB 4.17Å; L250-Q266 HydrophobicContact CG-CG 4.04Å; L250-L295 HydrophobicContact CD2-CB 3.6Å; L250-L295 HydrophobicContact CD2-CD1 3.83Å; L250-L295 HydrophobicContact CD2-CG 4.39Å; L250-P297 HydrophobicContact CD1-CB 4.2Å; L250-P297 HydrophobicContact CD1-CG 3.91Å
251	Y	98	Very high	96.6	Very high	36 Å²	36	53.5 Å²	53.5	14%	0.141	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-59.6	131.9	165.5	-63.4	-29.7	0	0	0	110.8	E176 R177 F178 Y199 M290	E176-Y251 HydrophobicContact CB-CD1 3.88Å; E176-Y251 HydrophobicContact CB-CD2 4.12Å; E176-Y251 HydrophobicContact CB-CE1 3.71Å; E176-Y251 HydrophobicContact CB-CE2 3.97Å; E176-Y251 HydrophobicContact CB-CG 4.08Å; E176-Y251 VanDerWaalsContact CD-CD2 3.49Å; E176-Y251 HydrophobicContact CG-CD2 4.1Å; E176-Y251 HydrophobicContact CG-CE2 3.91Å; E176-Y251 VanDerWaalsContact OE2-CD2 3.28Å; E176-Y251 WeakPolarHBondContact OE2-CD2 3.3Å; R177-Y251 CarbonylContact O-C 3.55Å; R177-Y251 VanDerWaalsContact O-CA 3.29Å; R177-Y251 WeakPolarHBondContact O-CA 3.49Å; F178-Y251 HydrophobicContact CB-CD1 4.13Å; F178-Y251 AromaticContact CD1-CD1 3.79Å; F178-Y251 HydrophobicContact CD1-CD1 3.79Å; F178-Y251 AromaticContact CD1-CE1 3.66Å; F178-Y251 HydrophobicContact CD1-CE1 3.66Å; F178-Y251 HydrophobicContact CE1-CE1 4.17Å; F178-Y251 HydrophobicContact CG-CD1 4.29Å; F178-Y251 HydrophobicContact CG-CE1 4.42Å; Y199-Y251 WeakPolarHBondContact CD1-OH 3.17Å; Y251-M290 HydrophobicContact CD1-SD 4.17Å; Y251-M290 HydrophobicContact CE1-CB 4.4Å; Y251-M290 HydrophobicContact CE1-CE 4.06Å; Y251-M290 HydrophobicContact CE1-SD 3.98Å; Y251-M290 HydrophobicContact CE2-CB 4.19Å
252	V	98.1	Very high	96.5	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.03	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-81.6	127.8	178.3	-178.2	0	0	0	0	109	L139 I166 R177 L250 I262	L139-V252 HydrophobicContact CD1-CG1 3.94Å; L139-V252 HydrophobicContact CD2-CG1 3.83Å; I166-V252 HydrophobicContact CD1-CG1 4.27Å; I166-V252 HydrophobicContact CD1-CG2 4Å; I166-V252 HydrophobicContact CG1-CG1 4.47Å; I166-V252 HydrophobicContact CG1-CG2 4.44Å; I166-V252 HydrophobicContact CG2-CG1 3.79Å; R177-V252 PolarHBondContact NH2-O 2.89Å; R177-V252 PolarHBondContact O-N 3.31Å; L250-V252 PolarHBondContact O-N 3.08Å; V252-I262 HydrophobicContact CG1-CG1 4.35Å; V252-I262 HydrophobicContact CG2-CG1 4.35Å; V252-I262 HydrophobicContact CG2-CG2 4.19Å
253	P	96.7	Very high	96.5	Very high	47 Å²	47	49.7 Å²	49.7	31%	0.305	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-52.9	142.9	176.7	-28.3	35.8	0	0	0	113	L139 R177 E255	L139-P253 HydrophobicContact CD2-CB 4.4Å; R177-P253 VanDerWaalsContact NH2-C 3.3Å; R177-P253 PolarHBondContact NH2-O 3.49Å; P253-E255 VanDerWaalsContact C-N 3.31Å
254	H	97.1	Very high	96.4	Very high	46 Å²	46	50.1 Å²	50.1	21%	0.213	24%	0.242	C	C	.	.	S	Bend	trans	-75.5	-21.2	175.8	-77.5	-95.9	0	0	0	113.2	N170 Q172 I175 R177 P256	N170-H254 PolarHBondContact O-ND1 3.42Å; Q172-H254 PolarHBondContact O-CE1 3.05Å; I175-H254 PolarHBondContact O-CE1 3.35Å; I175-H254 PolarHBondContact O-NE2 3.24Å; I175-H254 VanDerWaalsContact O-NE2 3.13Å; R177-H254 PolarHBondContact NE-CE1 3.47Å; R177-H254 PolarHBondContact NE-NE2 3.2Å; H254-P256 WeakPolarHBondContact O-CD 3.43Å
255	E	94.9	Very high	96.3	Very high	101 Å²	101	52.9 Å²	52.9	47%	0.472	26%	0.255	S	S	.	.			trans	-69.1	106.4	177.2	176.9	43.6	-111.8	0	0	110.8	P253 H257 S258	P253-E255 VanDerWaalsContact C-N 3.31Å; E255-H257 PolarHBondContact O-N 3.11Å; E255-H257 WeakPolarHBondContact OE1-CA 3.26Å; E255-H257 VanDerWaalsContact OE1-CB 3.27Å; E255-H257 WeakPolarHBondContact OE1-CB 3.44Å; E255-H257 IonicContact OE1-CD2 3.01Å; E255-H257 PolarHBondContact OE1-CD2 2.81Å; E255-H257 VanDerWaalsContact OE1-CD2 3.29Å; E255-H257 IonicContact OE1-CG 3.16Å; E255-H257 PolarHBondContact OE1-N 2.85Å; E255-S258 VanDerWaalsContact O-CB 3.31Å; E255-S258 WeakPolarHBondContact O-CB 3.4Å; E255-S258 PolarHBondContact O-N 3.25Å; E255-S258 VanDerWaalsContact O-N 3.17Å
256	P	92.1	Very high	96.3	Very high	42 Å²	42	51 Å²	51	27%	0.273	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.9	-176.7	27.9	-36.3	0	0	0	112.9	S140 M143 H254 S258	S140-P256 WeakPolarHBondContact CA-O 3.32Å; S140-P256 WeakPolarHBondContact CB-O 3.26Å; S140-P256 PolarHBondContact N-O 3.05Å; M143-P256 HydrophobicContact CG-CB 4.17Å; H254-P256 WeakPolarHBondContact O-CD 3.43Å; P256-S258 PolarHBondContact O-N 3.04Å
257	H	91.7	Very high	96.2	Very high	131 Å²	131	52 Å²	52	61%	0.606	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	5.6	179.5	-57.3	-69.5	0	0	0	113.5	E255 F259	E255-H257 PolarHBondContact O-N 3.11Å; E255-H257 WeakPolarHBondContact OE1-CA 3.26Å; E255-H257 VanDerWaalsContact OE1-CB 3.27Å; E255-H257 WeakPolarHBondContact OE1-CB 3.44Å; E255-H257 IonicContact OE1-CD2 3.01Å; E255-H257 PolarHBondContact OE1-CD2 2.81Å; E255-H257 VanDerWaalsContact OE1-CD2 3.29Å; E255-H257 IonicContact OE1-CG 3.16Å; E255-H257 PolarHBondContact OE1-N 2.85Å; H257-F259 PolarHBondContact O-N 3.11Å
258	S	92.8	Very high	96.2	Very high	18 Å²	18	51.6 Å²	51.6	13%	0.126	26%	0.256	C	S	.	.			trans	-57.2	130.3	178.6	-177.6	0	0	0	0	112.5	L139 S140 E255 P256 Q260	L139-S258 PolarHBondContact N-O 3.11Å; S140-S258 PolarHBondContact N-O 2.95Å; E255-S258 VanDerWaalsContact O-CB 3.31Å; E255-S258 WeakPolarHBondContact O-CB 3.4Å; E255-S258 PolarHBondContact O-N 3.25Å; E255-S258 VanDerWaalsContact O-N 3.17Å; P256-S258 PolarHBondContact O-N 3.04Å; S258-Q260 VanDerWaalsContact C-N 3.27Å; S258-Q260 PolarHBondContact O-N 2.88Å; S258-Q260 PolarHBondContact OG-N 2.69Å
259	F	93.8	Very high	96.2	Very high	169 Å²	169	52.2 Å²	52.2	74%	0.741	26%	0.259	S	S	*	.			trans	-81.3	-4.4	174.7	-69.9	-84.1	0	0	0	113.5	P138 H257	P138-F259 WeakPolarHBondContact CB-O 3.33Å; H257-F259 PolarHBondContact O-N 3.11Å
260	Q	92.6	Very high	96.1	Very high	121 Å²	121	55.4 Å²	55.4	57%	0.565	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-72.8	138	177.6	-62.4	179.9	-4.9	0	0	110.5	L139 S258	L139-Q260 WeakPolarHBondContact CB-O 3.17Å; L139-Q260 PolarHBondContact N-O 3.34Å; S258-Q260 VanDerWaalsContact C-N 3.27Å; S258-Q260 PolarHBondContact O-N 2.88Å; S258-Q260 PolarHBondContact OG-N 2.69Å
261	P	95.6	Very high	96	Very high	58 Å²	58	54.6 Å²	54.6	38%	0.377	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-73	158	168	32.8	-34.9	0	0	0	110.3	E263	P261-E263 PolarHBondContact O-N 2.94Å
262	I	97.3	Very high	95.7	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.041	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-67	128	170.2	-63.9	168.4	0	0	0	108.8	L139 L142 I163 I166 P179 V252 W264	L139-I262 HydrophobicContact CD1-CD1 4.23Å; L139-I262 HydrophobicContact CD1-CG1 4.2Å; L142-I262 HydrophobicContact CD1-CD1 3.84Å; L142-I262 HydrophobicContact CD1-CG1 4.35Å; I163-I262 HydrophobicContact CD1-CD1 3.62Å; I166-I262 HydrophobicContact CD1-CD1 3.61Å; P179-I262 HydrophobicContact CG-CG2 3.83Å; V252-I262 HydrophobicContact CG1-CG1 4.35Å; V252-I262 HydrophobicContact CG2-CG1 4.35Å; V252-I262 HydrophobicContact CG2-CG2 4.19Å; I262-W264 HydrophobicContact CB-CD2 4.49Å; I262-W264 HydrophobicContact CB-CZ2 4Å; I262-W264 HydrophobicContact CD1-CH2 4.26Å; I262-W264 HydrophobicContact CD1-CZ2 3.87Å; I262-W264 HydrophobicContact CG2-CD2 3.87Å; I262-W264 HydrophobicContact CG2-CE3 4.34Å; I262-W264 HydrophobicContact CG2-CG 4.28Å; I262-W264 HydrophobicContact CG2-CH2 4.41Å; I262-W264 HydrophobicContact CG2-CZ2 3.96Å; I262-W264 PolarHBondContact O-N 3.2Å; I262-W264 PolarHBondContact O-NE1 2.72Å
263	E	97.6	Very high	95.6	Very high	16 Å²	16	64.5 Å²	64.5	8%	0.075	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-80.3	116.4	168.4	176.5	53.8	-91.8	0	0	109.2	G249 L250 P261 K265 Q266 A298 S299	G249-E263 WeakPolarHBondContact CA-O 3.27Å; L250-E263 HydrophobicContact CB-CB 4.27Å; L250-E263 HydrophobicContact CD1-CB 4.15Å; L250-E263 HydrophobicContact CD1-CG 4.14Å; L250-E263 HydrophobicContact CG-CB 4.22Å; L250-E263 HydrophobicContact CG-CG 4.07Å; L250-E263 PolarHBondContact N-O 3.21Å; P261-E263 PolarHBondContact O-N 2.94Å; E263-K265 VanDerWaalsContact OE1-CG 3.28Å; E263-K265 WeakPolarHBondContact OE1-CG 3.46Å; E263-K265 PolarHBondContact OE1-N 3.08Å; E263-Q266 HydrophobicContact CG-CB 3.98Å; E263-A298 PolarHBondContact OE2-N 2.69Å; E263-S299 WeakPolarHBondContact OE2-CB 3.32Å; E263-S299 PolarHBondContact OE2-N 2.68Å; E263-S299 PolarHBondContact OE2-OG 3.24Å
264	W	97.6	Very high	95.6	Very high	16 Å²	16	65 Å²	65	6%	0.061	32%	0.322	C	S	.	.			trans	-100.8	-10	-172	-61.9	93.3	0	0	0	114.4	K135 L159 V162 I163 P179 V194 I262	K135-W264 HydrophobicContact CB-CZ2 4.3Å; K135-W264 VanDerWaalsContact CE-CE3 3.47Å; K135-W264 HydrophobicContact CG-CZ2 4.36Å; K135-W264 VanDerWaalsContact NZ-CE3 3.35Å; K135-W264 PolarHBondContact O-NE1 2.66Å; L159-W264 HydrophobicContact CD1-CH2 3.59Å; L159-W264 HydrophobicContact CD1-CZ2 4.32Å; L159-W264 HydrophobicContact CD1-CZ3 3.95Å; V162-W264 HydrophobicContact CG1-CH2 4.07Å; V162-W264 HydrophobicContact CG1-CZ3 4.01Å; I163-W264 HydrophobicContact CD1-CH2 4.03Å; I163-W264 HydrophobicContact CD1-CZ2 4.22Å; P179-W264 HydrophobicContact CB-CE3 3.5Å; P179-W264 HydrophobicContact CB-CZ3 3.65Å; P179-W264 HydrophobicContact CG-CD2 4.33Å; P179-W264 HydrophobicContact CG-CE3 3.77Å; P179-W264 HydrophobicContact CG-CZ3 4.26Å; V194-W264 HydrophobicContact CG2-CE3 4.48Å; V194-W264 HydrophobicContact CG2-CZ3 4.14Å; I262-W264 HydrophobicContact CB-CD2 4.49Å; I262-W264 HydrophobicContact CB-CZ2 4Å; I262-W264 HydrophobicContact CD1-CH2 4.26Å; I262-W264 HydrophobicContact CD1-CZ2 3.87Å; I262-W264 HydrophobicContact CG2-CD2 3.87Å; I262-W264 HydrophobicContact CG2-CE3 4.34Å; I262-W264 HydrophobicContact CG2-CG 4.28Å; I262-W264 HydrophobicContact CG2-CH2 4.41Å; I262-W264 HydrophobicContact CG2-CZ2 3.96Å; I262-W264 PolarHBondContact O-N 3.2Å; I262-W264 PolarHBondContact O-NE1 2.72Å
265	K	96.2	Very high	95.6	Very high	118 Å²	118	68.9 Å²	68.9	51%	0.513	34%	0.343	S	S	.	.			trans	-150.2	35.5	-161.8	57.7	171.5	-178.8	176	0	113.1	K247 E263 V268	K247-K265 HydrophobicContact CD-CB 4.42Å; E263-K265 VanDerWaalsContact OE1-CG 3.28Å; E263-K265 WeakPolarHBondContact OE1-CG 3.46Å; E263-K265 PolarHBondContact OE1-N 3.08Å; K265-V268 HydrophobicContact CB-CG2 4.09Å
266	Q	97.1	Very high	95.6	Very high	38 Å²	38	69.2 Å²	69.2	18%	0.178	34%	0.34	C	S	.	.	S	Bend	trans	-61.2	-48.9	176.7	-173.7	75.5	23.9	0	0	111.5	I248 L250 E263 Y286 K296	I248-Q266 PolarHBondContact O-N 2.91Å; L250-Q266 HydrophobicContact CD2-CB 4.32Å; L250-Q266 HydrophobicContact CD2-CG 3.75Å; L250-Q266 HydrophobicContact CG-CB 4.17Å; L250-Q266 HydrophobicContact CG-CG 4.04Å; E263-Q266 HydrophobicContact CG-CB 3.98Å; Q266-Y286 HydrophobicContact CB-CE2 4.17Å; Q266-Y286 WeakPolarHBondContact CB-OH 3.47Å; Q266-Y286 HydrophobicContact CG-CE2 3.61Å; Q266-Y286 WeakPolarHBondContact CG-OH 3.37Å; Q266-K296 PolarHBondContact NE2-O 3.43Å; Q266-K296 PolarHBondContact OE1-O 3.03Å
267	L	97.9	Very high	95.9	Very high	24 Å²	24	70.7 Å²	70.7	13%	0.126	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	137.7	168.7	-173.5	71.8	0	0	0	109.1	K247 I248 L269 L283 Y286	K247-L267 CarbonylContact C-O 3.57Å; K247-L267 VanDerWaalsContact CA-O 3.24Å; K247-L267 WeakPolarHBondContact CA-O 3.46Å; I248-L267 HydrophobicContact CB-CB 4.29Å; I248-L267 HydrophobicContact CD1-CD2 4.31Å; I248-L267 PolarHBondContact N-O 3.1Å; I248-L267 PolarHBondContact O-N 3.3Å; L267-L269 HydrophobicContact CD1-CD2 4.06Å; L267-L269 HydrophobicContact CD2-CD1 4.14Å; L267-L269 HydrophobicContact CD2-CD2 4.37Å; L267-L269 HydrophobicContact CD2-CG 4.03Å; L267-L269 HydrophobicContact CG-CD2 4.2Å; L267-L269 HydrophobicContact CG-CG 4.11Å; L267-L283 HydrophobicContact CD2-CD2 3.88Å; L267-Y286 HydrophobicContact CB-CD1 4.14Å; L267-Y286 HydrophobicContact CB-CD2 3.9Å; L267-Y286 HydrophobicContact CB-CE1 4.18Å; L267-Y286 HydrophobicContact CB-CE2 3.94Å; L267-Y286 HydrophobicContact CB-CG 4.01Å; L267-Y286 HydrophobicContact CD1-CD2 4.31Å; L267-Y286 HydrophobicContact CD1-CG 4.38Å; L267-Y286 HydrophobicContact CD2-CD1 3.91Å; L267-Y286 HydrophobicContact CD2-CD2 4.43Å; L267-Y286 HydrophobicContact CD2-CG 3.79Å; L267-Y286 HydrophobicContact CG-CD2 4.43Å; L267-Y286 HydrophobicContact CG-CG 4.27Å
268	V	98.3	Very high	96.2	Very high	65 Å²	65	67.8 Å²	67.8	39%	0.394	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	107.1	173.4	-179.1	0	0	0	0	109.7	V246 K247 K265	V246-V268 WeakPolarHBondContact O-CA 3.4Å; K247-V268 HydrophobicContact CB-CG2 4.38Å; K247-V268 HydrophobicContact CG-CG1 4.28Å; K247-V268 HydrophobicContact CG-CG2 4.12Å; K265-V268 HydrophobicContact CB-CG2 4.09Å
269	L	97.9	Very high	96.5	Very high	12 Å²	12	67.1 Å²	67.1	6%	0.063	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.1	178.3	-59.2	-175.5	0	0	0	110.8	K245 V246 L267 V271 M274 I279 E282 L283	K245-L269 VanDerWaalsContact CA-O 3.23Å; K245-L269 WeakPolarHBondContact CA-O 3.47Å; V246-L269 PolarHBondContact N-O 2.93Å; V246-L269 PolarHBondContact O-N 3.38Å; L267-L269 HydrophobicContact CD1-CD2 4.06Å; L267-L269 HydrophobicContact CD2-CD1 4.14Å; L267-L269 HydrophobicContact CD2-CD2 4.37Å; L267-L269 HydrophobicContact CD2-CG 4.03Å; L267-L269 HydrophobicContact CG-CD2 4.2Å; L267-L269 HydrophobicContact CG-CG 4.11Å; L269-V271 VanDerWaalsContact C-N 3.28Å; L269-V271 HydrophobicContact CB-CG1 3.89Å; L269-V271 PolarHBondContact O-N 3.35Å; L269-M274 HydrophobicContact CB-SD 4.23Å; L269-M274 HydrophobicContact CD2-CE 4.32Å; L269-M274 HydrophobicContact CD2-SD 4.37Å; L269-I279 HydrophobicContact CD1-CG2 4.19Å; L269-E282 HydrophobicContact CD1-CB 4.45Å; L269-E282 HydrophobicContact CD2-CB 4.06Å; L269-L283 HydrophobicContact CD1-CD2 3.84Å; L269-L283 HydrophobicContact CD1-CG 3.83Å
270	N	97.4	Very high	96.7	Very high	68 Å²	68	63.6 Å²	63.6	36%	0.364	32%	0.322	S	S	.	.			trans	-89.5	65.4	173.2	-58.5	-71.2	0	0	0	109.4	K244 K245 S272 K273	K244-N270 CarbonylContact O-C 3.56Å; K245-N270 WeakPolarHBondContact CD-OD1 3.47Å; K245-N270 WeakPolarHBondContact CE-OD1 3.47Å; K245-N270 PolarHBondContact NZ-OD1 2.93Å; N270-S272 PolarHBondContact O-N 2.94Å; N270-K273 PolarHBondContact O-N 3.12Å
271	V	95.3	Very high	97	Very high	7 Å²	7	64.5 Å²	64.5	4%	0.042	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-53.1	-33.1	-165.3	-63.8	0	0	0	0	114.6	V243 K244 V246 L269 K273 M274 I279	V243-V271 HydrophobicContact CB-CG2 4.01Å; V243-V271 HydrophobicContact CG1-CG2 3.64Å; K244-V271 PolarHBondContact O-N 3.07Å; V246-V271 HydrophobicContact CB-CG1 4.21Å; V246-V271 HydrophobicContact CG2-CG1 3.82Å; V246-V271 HydrophobicContact CG2-CG2 4.24Å; L269-V271 VanDerWaalsContact C-N 3.28Å; L269-V271 HydrophobicContact CB-CG1 3.89Å; L269-V271 PolarHBondContact O-N 3.35Å; V271-K273 PolarHBondContact O-N 3.32Å; V271-M274 PolarHBondContact O-N 3.1Å; V271-M274 VanDerWaalsContact O-N 3.16Å; V271-I279 HydrophobicContact CB-CD1 3.79Å; V271-I279 HydrophobicContact CB-CG1 4.46Å; V271-I279 HydrophobicContact CG1-CD1 3.98Å; V271-I279 HydrophobicContact CG1-CG1 4.21Å; V271-I279 HydrophobicContact CG1-CG2 4.21Å
272	S	92.4	Very high	97.1	Very high	59 Å²	59	64.6 Å²	64.6	41%	0.413	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-73.8	14.9	175.9	80.7	0	0	0	0	115	V243 K244 N270	V243-S272 WeakPolarHBondContact O-CB 3.44Å; K244-S272 WeakPolarHBondContact CD-OG 3.29Å; N270-S272 PolarHBondContact O-N 2.94Å
273	K	95.4	Very high	97.2	Very high	190 Å²	190	64.2 Å²	64.2	83%	0.826	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-132.9	14.2	172.8	-63.9	-163.4	175.2	-163.8	0	112.3	N270 V271	N270-K273 PolarHBondContact O-N 3.12Å; V271-K273 PolarHBondContact O-N 3.32Å
274	M	97.2	Very high	97.2	Very high	59 Å²	59	65.1 Å²	65.1	29%	0.291	32%	0.321	S	S	.	.	S	Bend	trans	-131.4	149.4	-173.9	-62.5	175.9	66.8	0	0	110.3	L269 V271 D278 I279	L269-M274 HydrophobicContact CB-SD 4.23Å; L269-M274 HydrophobicContact CD2-CE 4.32Å; L269-M274 HydrophobicContact CD2-SD 4.37Å; V271-M274 PolarHBondContact O-N 3.1Å; V271-M274 VanDerWaalsContact O-N 3.16Å; M274-D278 HydrophobicContact CE-CB 4.04Å; M274-I279 HydrophobicContact CB-CD1 4Å; M274-I279 HydrophobicContact CB-CG1 3.6Å; M274-I279 HydrophobicContact CE-CG1 4.14Å; M274-I279 HydrophobicContact SD-CG1 4.25Å
275	L	96.6	Very high	97.2	Very high	127 Å²	127	69.1 Å²	69.1	67%	0.665	34%	0.339	S	S	*	.			trans	-76	151.8	170.8	-57.9	176	0	0	0	110	A277 D278 I279	L275-A277 PolarHBondContact O-N 3.36Å; L275-A277 VanDerWaalsContact O-N 3.11Å; L275-D278 WeakPolarHBondContact CB-OD2 3.37Å; L275-D278 PolarHBondContact O-N 3.46Å; L275-I279 WeakPolarHBondContact O-CG1 3.46Å; L275-I279 PolarHBondContact O-N 2.96Å
276	R	95.3	Very high	97.3	Very high	108 Å²	108	64.1 Å²	64.1	41%	0.408	32%	0.317	S	S	.	.	H	α-helix	trans	-60.3	-25.3	-178.5	-161.4	157.5	161.4	143.5	-23.3	112.5	F230 E233 D234 R280	F230-R276 HydrophobicContact CD1-CG 4.01Å; F230-R276 HydrophobicContact CD2-CG 4.49Å; F230-R276 HydrophobicContact CE1-CG 3.5Å; F230-R276 VanDerWaalsContact CE1-CG 3.5Å; F230-R276 HydrophobicContact CE2-CG 4.02Å; F230-R276 HydrophobicContact CZ-CG 3.5Å; F230-R276 WeakPolarHBondContact CZ-O 3.29Å; E233-R276 IonicContact OE2-CZ 3.97Å; E233-R276 IonicContact OE2-NH1 2.68Å; E233-R276 PolarHBondContact OE2-NH1 3.31Å; D234-R276 IonicContact OD1-CZ 2.66Å; D234-R276 IonicContact OD1-NH1 2.72Å; D234-R276 PolarHBondContact OD1-NH1 2.92Å; D234-R276 IonicContact OD1-NH2 2.72Å; D234-R276 IonicContact OD2-CZ 3.92Å; D234-R276 IonicContact OD2-NH1 2.68Å; D234-R276 PolarHBondContact OD2-NH1 2.83Å; D234-R276 IonicContact OD2-NH2 2.63Å; D234-R276 PolarHBondContact OD2-NH2 3.08Å; R276-R280 WeakPolarHBondContact O-CB 3.49Å; R276-R280 PolarHBondContact O-N 2.9Å
277	A	97.8	Very high	97.3	Very high	73 Å²	73	62.3 Å²	62.3	60%	0.603	31%	0.309	S	S	*	.	H	α-helix	trans	-68.2	-45.5	170.8	0	0	0	0	0	113.3	L275 R280 K281	L275-A277 PolarHBondContact O-N 3.36Å; L275-A277 VanDerWaalsContact O-N 3.11Å; A277-R280 PolarHBondContact O-N 2.94Å; A277-K281 WeakPolarHBondContact O-CB 3.45Å; A277-K281 PolarHBondContact O-N 3.4Å
278	D	98.1	Very high	97.3	Very high	70 Å²	70	67.8 Å²	67.8	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-67.5	-38.8	177.9	-58.3	-53.2	0	0	0	111.6	M274 L275 R280 K281 E282	M274-D278 HydrophobicContact CE-CB 4.04Å; L275-D278 WeakPolarHBondContact CB-OD2 3.37Å; L275-D278 PolarHBondContact O-N 3.46Å; D278-R280 VanDerWaalsContact C-N 3.34Å; D278-K281 PolarHBondContact O-N 3.07Å; D278-E282 PolarHBondContact O-N 3.44Å
279	I	98.3	Very high	97.1	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-46.8	173.3	-61.5	165.7	0	0	0	109.5	F230 L269 V271 M274 L275 K281 L283	F230-I279 HydrophobicContact CE1-CB 4.1Å; F230-I279 HydrophobicContact CE1-CG2 3.62Å; F230-I279 HydrophobicContact CZ-CB 4.15Å; F230-I279 HydrophobicContact CZ-CG2 3.91Å; L269-I279 HydrophobicContact CD1-CG2 4.19Å; V271-I279 HydrophobicContact CB-CD1 3.79Å; V271-I279 HydrophobicContact CB-CG1 4.46Å; V271-I279 HydrophobicContact CG1-CD1 3.98Å; V271-I279 HydrophobicContact CG1-CG1 4.21Å; V271-I279 HydrophobicContact CG1-CG2 4.21Å; M274-I279 HydrophobicContact CB-CD1 4Å; M274-I279 HydrophobicContact CB-CG1 3.6Å; M274-I279 HydrophobicContact CE-CG1 4.14Å; M274-I279 HydrophobicContact SD-CG1 4.25Å; L275-I279 WeakPolarHBondContact O-CG1 3.46Å; L275-I279 PolarHBondContact O-N 2.96Å; I279-K281 PolarHBondContact O-N 3.42Å; I279-L283 HydrophobicContact CG2-CD1 3.64Å; I279-L283 HydrophobicContact CG2-CG 4.25Å; I279-L283 VanDerWaalsContact O-CB 3.29Å; I279-L283 WeakPolarHBondContact O-CB 3.15Å; I279-L283 WeakPolarHBondContact O-CG 3.47Å; I279-L283 PolarHBondContact O-N 3.05Å
280	R	98.6	Very high	97	Very high	95 Å²	95	66.2 Å²	66.2	36%	0.358	32%	0.317	S	S	.	.	H	α-helix	trans	-59.3	-45.3	175.5	-178	173.7	-67.4	-87.8	17.3	111.7	T224 S226 D227 F230 R276 A277 D278 L283 E284	T224-R280 PolarHBondContact OG1-NH1 3.38Å; S226-R280 PolarHBondContact OG-NH1 3.44Å; D227-R280 IonicContact OD1-CZ 3.94Å; D227-R280 VanDerWaalsContact OD1-CZ 3.24Å; D227-R280 IonicContact OD1-NH1 2.75Å; D227-R280 PolarHBondContact OD1-NH1 3.01Å; D227-R280 IonicContact OD1-NH2 3.24Å; D227-R280 PolarHBondContact OD1-NH2 3.11Å; D227-R280 IonicContact OD2-NH1 3.28Å; F230-R280 HydrophobicContact CE2-CB 4.05Å; F230-R280 HydrophobicContact CZ-CB 4.09Å; R276-R280 WeakPolarHBondContact O-CB 3.49Å; R276-R280 PolarHBondContact O-N 2.9Å; A277-R280 PolarHBondContact O-N 2.94Å; D278-R280 VanDerWaalsContact C-N 3.34Å; R280-L283 PolarHBondContact O-N 3.5Å; R280-E284 HydrophobicContact CG-CG 4.36Å; R280-E284 WeakPolarHBondContact O-CG 3.4Å; R280-E284 PolarHBondContact O-N 3.39Å
281	K	98.4	Very high	96.8	Very high	140 Å²	140	67 Å²	67	61%	0.609	32%	0.315	S	S	*	.	H	α-helix	trans	-58.5	-51.2	-179.8	179.6	-176.8	174.6	-175.7	0	112.4	A277 D278 I279 K285	A277-K281 WeakPolarHBondContact O-CB 3.45Å; A277-K281 PolarHBondContact O-N 3.4Å; D278-K281 PolarHBondContact O-N 3.07Å; I279-K281 PolarHBondContact O-N 3.42Å; K281-K285 WeakPolarHBondContact O-CB 3.23Å; K281-K285 PolarHBondContact O-N 3.29Å
282	E	98.4	Very high	96.7	Very high	60 Å²	60	72.7 Å²	72.7	28%	0.28	34%	0.343	S	S	.	.	H	α-helix	trans	-71.5	-35.5	-179.8	-69.1	-55.5	118.9	0	0	112.4	L269 D278 K285 Y286	L269-E282 HydrophobicContact CD1-CB 4.45Å; L269-E282 HydrophobicContact CD2-CB 4.06Å; D278-E282 PolarHBondContact O-N 3.44Å; E282-K285 IonicContact OE2-NZ 2.7Å; E282-Y286 VanDerWaalsContact O-CB 3.25Å; E282-Y286 WeakPolarHBondContact O-CB 3.03Å; E282-Y286 PolarHBondContact O-N 3.16Å
283	L	98.5	Very high	96.5	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-45.2	174.3	-73.2	175.7	0	0	0	112.4	L225 I229 I248 L267 L269 I279 R280 Y286 A287	L225-L283 HydrophobicContact CD2-CD2 4.45Å; I229-L283 HydrophobicContact CB-CD1 3.87Å; I229-L283 HydrophobicContact CG1-CD1 4.05Å; I229-L283 HydrophobicContact CG1-CD2 4.31Å; I229-L283 HydrophobicContact CG2-CD1 3.89Å; I248-L283 HydrophobicContact CD1-CD2 3.41Å; I248-L283 VanDerWaalsContact CD1-CD2 3.41Å; L267-L283 HydrophobicContact CD2-CD2 3.88Å; L269-L283 HydrophobicContact CD1-CD2 3.84Å; L269-L283 HydrophobicContact CD1-CG 3.83Å; I279-L283 HydrophobicContact CG2-CD1 3.64Å; I279-L283 HydrophobicContact CG2-CG 4.25Å; I279-L283 VanDerWaalsContact O-CB 3.29Å; I279-L283 WeakPolarHBondContact O-CB 3.15Å; I279-L283 WeakPolarHBondContact O-CG 3.47Å; I279-L283 PolarHBondContact O-N 3.05Å; R280-L283 PolarHBondContact O-N 3.5Å; L283-Y286 PolarHBondContact O-N 3.13Å; L283-A287 VanDerWaalsContact O-CB 3.23Å; L283-A287 WeakPolarHBondContact O-CB 3.49Å; L283-A287 PolarHBondContact O-N 3.22Å
284	E	98.1	Very high	95.9	Very high	35 Å²	35	73.1 Å²	73.1	16%	0.164	34%	0.341	C	S	.	.	H	α-helix	trans	-76.2	-28.8	-179.2	-66.8	-43.4	127.7	0	0	113.9	T224 L225 S226 R280 R288	T224-E284 VanDerWaalsContact CB-OE1 3.31Å; T224-E284 WeakPolarHBondContact CB-OE1 3.44Å; L225-E284 PolarHBondContact N-OE1 3.33Å; S226-E284 VanDerWaalsContact CB-OE1 3.26Å; S226-E284 WeakPolarHBondContact CB-OE1 3.3Å; S226-E284 PolarHBondContact N-OE1 3.4Å; S226-E284 PolarHBondContact OG-OE1 2.93Å; R280-E284 HydrophobicContact CG-CG 4.36Å; R280-E284 WeakPolarHBondContact O-CG 3.4Å; R280-E284 PolarHBondContact O-N 3.39Å; E284-R288 WeakPolarHBondContact O-CB 3.34Å; E284-R288 PolarHBondContact O-N 3.47Å
285	K	97.9	Very high	95.2	Very high	100 Å²	100	72.6 Å²	72.6	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-56	166.2	178.8	-169.6	174.5	-162.5	0	110	K281 E282 A287 R288 D289	K281-K285 WeakPolarHBondContact O-CB 3.23Å; K281-K285 PolarHBondContact O-N 3.29Å; E282-K285 IonicContact OE2-NZ 2.7Å; K285-A287 VanDerWaalsContact C-N 3.31Å; K285-A287 PolarHBondContact O-N 3.33Å; K285-R288 WeakPolarHBondContact O-CB 2.9Å; K285-R288 PolarHBondContact O-N 2.79Å; K285-D289 PolarHBondContact O-N 2.9Å
286	Y	97.9	Very high	94.6	Very high	12 Å²	12	73.9 Å²	73.9	5%	0.047	34%	0.34	C	S	.	.	H	α-helix	trans	-58.9	-40.9	179.3	-179	-102.5	0	0	0	112.9	L225 I248 G249 Q266 L267 E282 L283 R288 D289 M290 L295	L225-Y286 HydrophobicContact CD2-CD1 4.32Å; I248-Y286 HydrophobicContact CB-CE1 3.95Å; I248-Y286 HydrophobicContact CG2-CD1 4.44Å; I248-Y286 HydrophobicContact CG2-CE1 3.73Å; G249-Y286 PolarHBondContact O-OH 3.44Å; Q266-Y286 HydrophobicContact CB-CE2 4.17Å; Q266-Y286 WeakPolarHBondContact CB-OH 3.47Å; Q266-Y286 HydrophobicContact CG-CE2 3.61Å; Q266-Y286 WeakPolarHBondContact CG-OH 3.37Å; L267-Y286 HydrophobicContact CB-CD1 4.14Å; L267-Y286 HydrophobicContact CB-CD2 3.9Å; L267-Y286 HydrophobicContact CB-CE1 4.18Å; L267-Y286 HydrophobicContact CB-CE2 3.94Å; L267-Y286 HydrophobicContact CB-CG 4.01Å; L267-Y286 HydrophobicContact CD1-CD2 4.31Å; L267-Y286 HydrophobicContact CD1-CG 4.38Å; L267-Y286 HydrophobicContact CD2-CD1 3.91Å; L267-Y286 HydrophobicContact CD2-CD2 4.43Å; L267-Y286 HydrophobicContact CD2-CG 3.79Å; L267-Y286 HydrophobicContact CG-CD2 4.43Å; L267-Y286 HydrophobicContact CG-CG 4.27Å; E282-Y286 VanDerWaalsContact O-CB 3.25Å; E282-Y286 WeakPolarHBondContact O-CB 3.03Å; E282-Y286 PolarHBondContact O-N 3.16Å; L283-Y286 PolarHBondContact O-N 3.13Å; Y286-R288 VanDerWaalsContact C-N 3.34Å; Y286-R288 PolarHBondContact O-N 2.93Å; Y286-D289 PolarHBondContact O-N 3.49Å; Y286-M290 HydrophobicContact CD1-CE 4.22Å; Y286-M290 HydrophobicContact CD1-CG 4.26Å; Y286-M290 HydrophobicContact CD1-SD 4.33Å; Y286-M290 HydrophobicContact CE1-CE 3.86Å; Y286-M290 HydrophobicContact CE1-CG 3.7Å; Y286-M290 HydrophobicContact CE1-SD 3.49Å; Y286-M290 WeakPolarHBondContact CE1-SD 3.45Å; Y286-M290 HydrophobicContact CE2-CG 4.39Å; Y286-M290 PolarHBondContact O-N 2.79Å; Y286-L295 HydrophobicContact CD2-CD1 3.95Å; Y286-L295 HydrophobicContact CE2-CD1 3.4Å
287	A	97.6	Very high	93.8	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-35.9	176.1	0	0	0	0	0	112.7	L225 L283 K285 R291	L225-A287 HydrophobicContact CB-CB 3.81Å; L225-A287 HydrophobicContact CD2-CB 3.83Å; L283-A287 VanDerWaalsContact O-CB 3.23Å; L283-A287 WeakPolarHBondContact O-CB 3.49Å; L283-A287 PolarHBondContact O-N 3.22Å; K285-A287 VanDerWaalsContact C-N 3.31Å; K285-A287 PolarHBondContact O-N 3.33Å; A287-R291 VanDerWaalsContact O-CG 3.29Å; A287-R291 WeakPolarHBondContact O-CG 3.2Å; A287-R291 PolarHBondContact O-N 3.17Å; A287-R291 VanDerWaalsContact O-N 3.15Å; A287-R291 PolarHBondContact O-NE 2.71Å
288	R	97.1	Very high	92.6	Very high	139 Å²	139	69.8 Å²	69.8	53%	0.525	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-48.4	170.6	-172.9	-171	-64.1	108.2	-2.6	110.6	E284 K285 Y286 M290 R291 M292	E284-R288 WeakPolarHBondContact O-CB 3.34Å; E284-R288 PolarHBondContact O-N 3.47Å; K285-R288 WeakPolarHBondContact O-CB 2.9Å; K285-R288 PolarHBondContact O-N 2.79Å; Y286-R288 VanDerWaalsContact C-N 3.34Å; Y286-R288 PolarHBondContact O-N 2.93Å; R288-M290 VanDerWaalsContact C-N 3.3Å; R288-M290 PolarHBondContact O-N 3.46Å; R288-R291 PolarHBondContact O-N 3.16Å; R288-R291 VanDerWaalsContact O-N 3.12Å; R288-M292 HydrophobicContact CG-CG 4.33Å; R288-M292 WeakPolarHBondContact O-CG 3.49Å; R288-M292 PolarHBondContact O-N 3.46Å
289	D	96	Very high	91	Very high	40 Å²	40	69.4 Å²	69.4	21%	0.214	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-33.1	-176.1	-57.2	-18.3	0	0	0	112.1	K285 Y286 K293 I294 L295	K285-D289 PolarHBondContact O-N 2.9Å; Y286-D289 PolarHBondContact O-N 3.49Å; D289-K293 PolarHBondContact O-N 3.47Å; D289-I294 PolarHBondContact O-N 3.1Å; D289-I294 VanDerWaalsContact O-N 3.15Å; D289-L295 HydrophobicContact CB-CD1 4.07Å; D289-L295 HydrophobicContact CB-CD2 3.88Å; D289-L295 HydrophobicContact CB-CG 3.88Å
290	M	94.7	Very high	89.2	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.02	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-52	167.8	-75.9	-158.4	-58.6	0	0	112.4	F178 L225 Y251 Y286 R288 M292 K293 L295	F178-M290 HydrophobicContact CD2-CE 4.41Å; F178-M290 HydrophobicContact CE2-CE 4.41Å; F178-M290 HydrophobicContact CG-CE 4.48Å; L225-M290 HydrophobicContact CD2-CE 4.19Å; Y251-M290 HydrophobicContact CD1-SD 4.17Å; Y251-M290 HydrophobicContact CE1-CB 4.4Å; Y251-M290 HydrophobicContact CE1-CE 4.06Å; Y251-M290 HydrophobicContact CE1-SD 3.98Å; Y251-M290 HydrophobicContact CE2-CB 4.19Å; Y286-M290 HydrophobicContact CD1-CE 4.22Å; Y286-M290 HydrophobicContact CD1-CG 4.26Å; Y286-M290 HydrophobicContact CD1-SD 4.33Å; Y286-M290 HydrophobicContact CE1-CE 3.86Å; Y286-M290 HydrophobicContact CE1-CG 3.7Å; Y286-M290 HydrophobicContact CE1-SD 3.49Å; Y286-M290 WeakPolarHBondContact CE1-SD 3.45Å; Y286-M290 HydrophobicContact CE2-CG 4.39Å; Y286-M290 PolarHBondContact O-N 2.79Å; R288-M290 VanDerWaalsContact C-N 3.3Å; R288-M290 PolarHBondContact O-N 3.46Å; M290-M292 VanDerWaalsContact C-N 3.26Å; M290-M292 PolarHBondContact O-N 3.41Å; M290-K293 WeakPolarHBondContact O-CA 3.32Å; M290-K293 PolarHBondContact O-N 2.91Å; M290-L295 HydrophobicContact CB-CD1 4.38Å; M290-L295 HydrophobicContact CG-CD1 3.65Å
291	R	93.9	Very high	87.1	Confident	84 Å²	84	74.3 Å²	74.3	32%	0.317	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-33.2	-178	-71.2	-177.9	-53.2	-109	5	112.5	Y199 Y204 A287 R288 K293	Y199-R291 HydrophobicContact CE1-CG 4Å; Y199-R291 VanDerWaalsContact CZ-CD 3.47Å; Y199-R291 WeakPolarHBondContact OH-CD 3.36Å; Y204-R291 PolarHBondContact OH-NH1 3.16Å; A287-R291 VanDerWaalsContact O-CG 3.29Å; A287-R291 WeakPolarHBondContact O-CG 3.2Å; A287-R291 PolarHBondContact O-N 3.17Å; A287-R291 VanDerWaalsContact O-N 3.15Å; A287-R291 PolarHBondContact O-NE 2.71Å; R288-R291 PolarHBondContact O-N 3.16Å; R288-R291 VanDerWaalsContact O-N 3.12Å; R291-K293 VanDerWaalsContact C-N 3.26Å; R291-K293 PolarHBondContact O-N 2.95Å
292	M	91.8	Very high	84.2	Confident	127 Å²	127	72.4 Å²	72.4	63%	0.626	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3	173.5	-61.5	-57.8	-62.9	0	0	113.6	R288 M290 I294	R288-M292 HydrophobicContact CG-CG 4.33Å; R288-M292 WeakPolarHBondContact O-CG 3.49Å; R288-M292 PolarHBondContact O-N 3.46Å; M290-M292 VanDerWaalsContact C-N 3.26Å; M290-M292 PolarHBondContact O-N 3.41Å; M292-I294 HydrophobicContact CB-CD1 3.59Å; M292-I294 HydrophobicContact CB-CG1 3.74Å; M292-I294 HydrophobicContact CG-CD1 4.35Å; M292-I294 PolarHBondContact O-N 2.97Å
293	K	88.4	Confident	81.6	Confident	146 Å²	146	75.3 Å²	75.3	64%	0.635	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	32.5	-179.9	-51.7	-165.5	179.9	-161.5	0	114.4	E176 D289 M290 R291	E176-K293 WeakPolarHBondContact OE1-CE 3.48Å; E176-K293 IonicContact OE1-NZ 2.77Å; E176-K293 PolarHBondContact OE1-NZ 3.37Å; D289-K293 PolarHBondContact O-N 3.47Å; M290-K293 WeakPolarHBondContact O-CA 3.32Å; M290-K293 PolarHBondContact O-N 2.91Å; R291-K293 VanDerWaalsContact C-N 3.26Å; R291-K293 PolarHBondContact O-N 2.95Å
294	I	82.6	Confident	78.7	Confident	113 Å²	113	81.4 Å²	81.4	58%	0.579	43%	0.432	S	S	*	.			trans	-79.4	-26.8	-177.5	-64.4	170.7	0	0	0	112.1	D289 M292	D289-I294 PolarHBondContact O-N 3.1Å; D289-I294 VanDerWaalsContact O-N 3.15Å; M292-I294 HydrophobicContact CB-CD1 3.59Å; M292-I294 HydrophobicContact CB-CG1 3.74Å; M292-I294 HydrophobicContact CG-CD1 4.35Å; M292-I294 PolarHBondContact O-N 2.97Å
295	L	83.6	Confident	76	Confident	48 Å²	48	88.1 Å²	88.1	25%	0.251	46%	0.463	S	S	.	.			trans	-75.9	137.4	-168.5	-61	167.7	0	0	0	113.2	L250 Y286 D289 M290	L250-L295 HydrophobicContact CD2-CB 3.6Å; L250-L295 HydrophobicContact CD2-CD1 3.83Å; L250-L295 HydrophobicContact CD2-CG 4.39Å; Y286-L295 HydrophobicContact CD2-CD1 3.95Å; Y286-L295 HydrophobicContact CE2-CD1 3.4Å; D289-L295 HydrophobicContact CB-CD1 4.07Å; D289-L295 HydrophobicContact CB-CD2 3.88Å; D289-L295 HydrophobicContact CB-CG 3.88Å; M290-L295 HydrophobicContact CB-CD1 4.38Å; M290-L295 HydrophobicContact CG-CD1 3.65Å
296	K	82.7	Confident	73.2	Confident	154 Å²	154	89.6 Å²	89.6	67%	0.67	48%	0.481	S	S	*	.			trans	-106.3	148.6	170.3	-65.6	179.7	179.4	178.3	0	110.3	Q266 A298	Q266-K296 PolarHBondContact NE2-O 3.43Å; Q266-K296 PolarHBondContact OE1-O 3.03Å; K296-A298 PolarHBondContact O-N 2.7Å
297	P	79.2	Confident	70.4	Confident	55 Å²	55	100.1 Å²	100.1	36%	0.357	52%	0.52	S	S	.	.			trans	-57.2	120.1	-176.2	-26	34.6	0	0	0	113.7	L250 S299 A300	L250-P297 HydrophobicContact CD1-CB 4.2Å; L250-P297 HydrophobicContact CD1-CG 3.91Å; P297-S299 PolarHBondContact O-N 3.02Å; P297-A300 HydrophobicContact CB-CB 4.22Å; P297-A300 WeakPolarHBondContact O-CB 3.39Å; P297-A300 PolarHBondContact O-N 2.89Å
298	A	73.4	Confident	67.7	Low	40 Å²	40	105 Å²	105	33%	0.331	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-61.3	-33.9	-179.4	0	0	0	0	0	112.4	E263 K296 A300 H301	E263-A298 PolarHBondContact OE2-N 2.69Å; K296-A298 PolarHBondContact O-N 2.7Å; A298-A300 PolarHBondContact O-N 2.84Å; A298-H301 PolarHBondContact O-N 3.16Å
299	S	64	Low	65.3	Low	62 Å²	62	110 Å²	110	43%	0.434	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-66	-16.7	173.4	51.3	0	0	0	0	115	E263 P297	E263-S299 WeakPolarHBondContact OE2-CB 3.32Å; E263-S299 PolarHBondContact OE2-N 2.68Å; E263-S299 PolarHBondContact OE2-OG 3.24Å; P297-S299 PolarHBondContact O-N 3.02Å
300	A	60.1	Low	62.5	Low	73 Å²	73	111.3 Å²	111.3	60%	0.603	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-90.3	-6.1	176.1	0	0	0	0	0	113.4	P297 A298 S302	P297-A300 HydrophobicContact CB-CB 4.22Å; P297-A300 WeakPolarHBondContact O-CB 3.39Å; P297-A300 PolarHBondContact O-N 2.89Å; A298-A300 PolarHBondContact O-N 2.84Å; A300-S302 PolarHBondContact O-N 2.79Å; A300-S302 VanDerWaalsContact O-N 3.08Å
301	H	55.4	Low	59.9	Low	128 Å²	128	120 Å²	120	59%	0.593	63%	0.633	S	S	*	*			trans	-81.1	87.1	175.1	-69.3	-47.1	0	0	0	111	A298	A298-H301 PolarHBondContact O-N 3.16Å
302	S	37.2	Very low	57.2	Low	100 Å²	100	121.3 Å²	121.3	70%	0.699	66%	0.655	S	S	*	*			trans	-47.4	135.3	159.2	-61.2	0	0	0	0	109.7	A300 T304	A300-S302 PolarHBondContact O-N 2.79Å; A300-S302 VanDerWaalsContact O-N 3.08Å; S302-T304 PolarHBondContact O-N 2.88Å; S302-T304 VanDerWaalsContact O-N 3.15Å
303	P	43.7	Very low	54.7	Low	121 Å²	121	122.9 Å²	122.9	79%	0.786	67%	0.665	S	S	*	*			trans	-55.4	125.4	171.2	-22.6	32.8	0	0	0	108.9	Q305	P303-Q305 VanDerWaalsContact C-N 3.33Å; P303-Q305 PolarHBondContact O-N 2.99Å
304	T	38	Very low	52.4	Low	129 Å²	129	120.7 Å²	120.7	79%	0.791	67%	0.669	S	S	*	*			trans	-61.3	100.4	172.1	-49.8	0	0	0	0	107.3	S302 V306	S302-T304 PolarHBondContact O-N 2.88Å; S302-T304 VanDerWaalsContact O-N 3.15Å; T304-V306 VanDerWaalsContact C-N 3.3Å; T304-V306 PolarHBondContact O-N 2.87Å
305	Q	40.6	Very low	50.4	Low	175 Å²	175	121.8 Å²	121.8	82%	0.818	68%	0.683	S	S	*	*			trans	-60.5	103.7	166.2	-76.5	-165.7	3.1	0	0	106.1	P303 R307	P303-Q305 VanDerWaalsContact C-N 3.33Å; P303-Q305 PolarHBondContact O-N 2.99Å; Q305-R307 PolarHBondContact O-N 2.75Å
306	V	38.7	Very low	48	Very low	132 Å²	132	130.6 Å²	130.6	80%	0.8	71%	0.713	S	S	*	*			trans	-61.8	93.8	166.3	177	0	0	0	0	104.8	T304 S308	T304-V306 VanDerWaalsContact C-N 3.3Å; T304-V306 PolarHBondContact O-N 2.87Å; V306-S308 PolarHBondContact O-N 2.83Å
307	R	40	Very low	45.7	Very low	233 Å²	233	134.7 Å²	134.7	88%	0.879	72%	0.724	S	S	*	*			trans	-71.7	80.9	-174.9	-161	179.4	-166.8	-175	4.6	106.9	Q305 R309	Q305-R307 PolarHBondContact O-N 2.75Å; R307-R309 PolarHBondContact O-N 2.91Å
308	S	41.3	Very low	43.5	Very low	101 Å²	101	143.5 Å²	143.5	71%	0.706	75%	0.75	S	S	*	*			trans	-47	132.1	173.7	51.5	0	0	0	0	107.6	V306 G310	V306-S308 PolarHBondContact O-N 2.83Å; S308-G310 PolarHBondContact O-N 2.75Å
309	R	46.5	Very low	41.7	Very low	246 Å²	246	151.3 Å²	151.3	93%	0.928	78%	0.78	S	S	*	*			trans	-72.2	68.9	-177.8	-90.6	179.1	159.3	179.3	-6	109.8	R307 K311	R307-R309 PolarHBondContact O-N 2.91Å; R309-K311 PolarHBondContact O-N 3.01Å
310	G	37.3	Very low	40.2	Very low	66 Å²	66	153 Å²	153	68%	0.68	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-55.8	117.5	166.2	0	0	0	0	0	108.1	S308 S312	S308-G310 PolarHBondContact O-N 2.75Å; G310-S312 PolarHBondContact O-N 3.5Å
311	K	39.5	Very low	38.9	Very low	187 Å²	187	154.7 Å²	154.7	81%	0.813	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.5	122.8	-179.4	-66.4	177	179.1	177.7	0	108.1	R309 L313	R309-K311 PolarHBondContact O-N 3.01Å; K311-L313 PolarHBondContact O-N 2.9Å
312	S	38.1	Very low	38.8	Very low	112 Å²	112	154.3 Å²	154.3	78%	0.783	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-60.9	120.3	173.4	-175	0	0	0	0	109.1	G310	G310-S312 PolarHBondContact O-N 3.5Å
313	L	37.8	Very low	39.5	Very low	160 Å²	160	154.6 Å²	154.6	84%	0.838	81%	0.813	S	S	*	*			trans	-120.1	89.3	174	-70.7	178.2	0	0	0	108.5	K311	K311-L313 PolarHBondContact O-N 2.9Å
314	S	39.9	Very low	39.1	Very low	100 Å²	100	161 Å²	161	70%	0.699	82%	0.822	S	S	*	*			trans	-68.9	138.6	168.4	39.7	0	0	0	0	110.2	R316	S314-R316 PolarHBondContact O-N 3.06Å
315	P	40.6	Very low	39	Very low	135 Å²	135	165.8 Å²	165.8	88%	0.877	83%	0.825	S	S	*	*			trans	-77.6	121	-171.3	29.5	-34.5	0	0	0	111.7
316	R	34.8	Very low	38.6	Very low	233 Å²	233	165.2 Å²	165.2	88%	0.879	83%	0.827	S	S	*	*			trans	-141.2	102.9	175.7	-151.8	178.2	-163.6	-148.6	4.9	115	S314	S314-R316 PolarHBondContact O-N 3.06Å
317	R	32.8	Very low	38.4	Very low	241 Å²	241	162.5 Å²	162.5	91%	0.909	83%	0.826	S	S	*	*			trans	61	133.9	146.4	-146.3	171.8	-167.8	173.3	3.5	119.4
318	R	34.3	Very low	38.2	Very low	240 Å²	240	162.5 Å²	162.5	91%	0.906	83%	0.826	S	S	*	*			trans	-67	154	-180	-55.8	173.9	177.2	-179.6	-2.5	114
319	Q	34.4	Very low	38	Very low	203 Å²	203	167.5 Å²	167.5	95%	0.949	83%	0.829	S	S	*	*			trans	-149.3	-176	135.8	-111.9	173.4	10.6	0	0	110.5
320	A	32.9	Very low	37.3	Very low	98 Å²	98	161.7 Å²	161.7	81%	0.81	82%	0.817	S	S	*	*			trans	-116.9	176.5	-144.4	0	0	0	0	0	118.2
321	S	33.5	Very low	37.2	Very low	109 Å²	109	168.2 Å²	168.2	76%	0.762	83%	0.826	S	S	*	*			trans	-61.8	-177	-176.4	-36.8	0	0	0	0	117
322	P	53.4	Low	37	Very low	119 Å²	119	164.6 Å²	164.6	77%	0.773	82%	0.824	S	S	*	*			cis	-127.7	-107.3	-46.8	33.3	-15.4	0	0	0	113.1
323	P	51.6	Low	37.3	Very low	107 Å²	107	165.7 Å²	165.7	70%	0.695	83%	0.829	S	S	*	*				-116.7	164.7	-75.6	37.5	-23.8	0	0	0	115.6
324	R	34.2	Very low	37	Very low	254 Å²	254	162 Å²	162	96%	0.958	82%	0.822	S	S	*	*			trans	-163	155.2	138.2	-110.2	164.3	-171.2	-174.6	2	113.5
325	R	36.1	Very low	36.8	Very low	231 Å²	231	165.2 Å²	165.2	87%	0.872	83%	0.83	S	S	*	*			trans	-90.5	167.9	177.9	-73.2	178.8	168.2	179.2	-3.5	110
326	L	33.7	Very low	36.9	Very low	162 Å²	162	163.9 Å²	163.9	85%	0.848	82%	0.821	S	S	*	*				-168.3	144.2	59.2	-89.2	166.3	0	0	0	114.8
327	G	33	Very low	36.6	Very low	75 Å²	75	160.9 Å²	160.9	77%	0.773	82%	0.817	S	S	*	*			trans	84	154.5	149.4	0	0	0	0	0	118.7
328	R	35.9	Very low	36.5	Very low	234 Å²	234	158.4 Å²	158.4	88%	0.883	81%	0.813	S	S	*	*			cis	-166	127.3	-16.8	-172.5	-174.8	-172.9	-146	6.4	110.3
329	R	37	Very low	36.4	Very low	206 Å²	206	156.4 Å²	156.4	78%	0.777	81%	0.811	S	S	*	*			trans	43.3	118.8	159.6	-73.7	-151.2	137.1	148.2	1.9	120.2
330	D	32.5	Very low	36.2	Very low	124 Å²	124	153 Å²	153	66%	0.663	80%	0.804	S	S	*	*				72	109.5	80.2	-60.1	-28.7	0	0	0	115.2
331	K	35	Very low	36.1	Very low	202 Å²	202	152.3 Å²	152.3	88%	0.878	80%	0.798	S	S	*	*				168.2	134.4	102.6	-88.8	-167.3	179.9	-173.8	0	112.7
332	S	35.4	Very low	36.1	Very low	111 Å²	111	154.6 Å²	154.6	78%	0.776	80%	0.802	S	S	*	*			trans	-95.1	168.7	159.4	-47.6	0	0	0	0	110.5
333	P	45.3	Very low	34.9	Very low	136 Å²	136	156.1 Å²	156.1	88%	0.883	80%	0.803	S	S	*	*				-134	-165.5	104.6	32.2	-16.8	0	0	0	113
334	A	31.4	Very low	33.9	Very low	83 Å²	83	157 Å²	157	69%	0.686	81%	0.811	S	S	*	*			trans	-117.5	159.9	-157	0	0	0	0	0	115.2
335	L	35.2	Very low	33.7	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	80%	0.798	S	S	*	*			trans	34.2	157.3	130.4	-59.4	178.2	0	0	0	120.7
336	P	42.5	Very low	33.4	Very low	107 Å²	107	146.5 Å²	146.5	70%	0.695	80%	0.795	S	S	*	*			cis	-143.3	-170.5	21.9	42.5	-22	0	0	0	117.1
337	E	28	Very low	33.2	Very low	169 Å²	169	146.3 Å²	146.3	79%	0.79	80%	0.795	S	S	*	*			trans	69.5	149	162.6	-63.6	-159.3	174.9	0	0	118
338	K	32.3	Very low	33.2	Very low	190 Å²	190	151.5 Å²	151.5	83%	0.826	80%	0.799	S	S	*	*			cis	-144.4	166.8	32.6	-139.3	166.7	-160.3	174.9	0	114.1
339	K	30.5	Very low	32.9	Very low	197 Å²	197	145 Å²	145	86%	0.857	79%	0.785	S	S	*	*			trans	-105.7	140.1	177.4	-160.9	-177.4	-170.3	-176.9	0	109.5
340	V	31.8	Very low	32.5	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	79%	0.785	S	S	*	*			trans	-124.3	142.8	168	-177.6	0	0	0	0	108.1
341	A	30.5	Very low	32.3	Very low	84 Å²	84	142.8 Å²	142.8	69%	0.694	79%	0.792	S	S	*	*			trans	-140.3	129.4	176.1	0	0	0	0	0	108.4
342	D	32.2	Very low	31.9	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	79%	0.791	S	S	*	*			trans	-96.2	128.7	175.3	-74.7	-48.8	0	0	0	110.7
343	L	29.8	Very low	31.5	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	78%	0.784	S	S	*	*			trans	-91.1	134.2	158.6	-83.5	74.8	0	0	0	108.3
344	S	29.6	Very low	30.9	Very low	124 Å²	124	145.7 Å²	145.7	87%	0.867	78%	0.779	S	S	*	*			trans	-134	97.6	150.7	41.8	0	0	0	0	108.7
345	T	30.5	Very low	30.9	Very low	110 Å²	110	150 Å²	150	68%	0.675	79%	0.789	S	S	*	*			trans	-84.8	173.7	169.3	44.8	0	0	0	0	110.3
346	L	29.6	Very low	30.7	Very low	155 Å²	155	149.2 Å²	149.2	81%	0.812	79%	0.785	S	S	*	*			trans	64.8	100	169	-60.1	168.7	0	0	0	116.4
347	N	30.5	Very low	30.1	Very low	159 Å²	159	151.4 Å²	151.4	85%	0.85	79%	0.789	S	S	*	*				-148.1	74.9	124.5	-134.9	-8.1	0	0	0	110.8	V349	N347-V349 PolarHBondContact O-N 2.91Å
348	E	32.9	Very low	30.2	Very low	183 Å²	183	150.4 Å²	150.4	86%	0.855	79%	0.789	S	S	*	*			trans	-93.6	89.8	176.4	-176.2	171.5	-141.5	0	0	109.8
349	V	29.9	Very low	30.1	Very low	98 Å²	98	148.1 Å²	148.1	59%	0.594	79%	0.787	S	S	*	*			trans	-132.5	94.6	169.6	-173.6	0	0	0	0	108.9	N347 Y351	N347-V349 PolarHBondContact O-N 2.91Å; V349-Y351 HydrophobicContact CG1-CD2 3.99Å; V349-Y351 HydrophobicContact CG1-CE2 3.72Å; V349-Y351 PolarHBondContact O-N 3.03Å
350	G	28.2	Very low	30.1	Very low	76 Å²	76	145.1 Å²	145.1	78%	0.784	78%	0.783	S	S	*	*			trans	-74.1	82.9	-172	0	0	0	0	0	114.5	Q352	G350-Q352 VanDerWaalsContact C-N 3.26Å; G350-Q352 PolarHBondContact O-N 2.98Å
351	Y	26.8	Very low	30	Very low	207 Å²	207	145.9 Å²	145.9	81%	0.812	78%	0.782	S	S	*	*			trans	-73.7	79.3	165	-82.3	-83.9	0	0	0	111	V349 I353	V349-Y351 HydrophobicContact CG1-CD2 3.99Å; V349-Y351 HydrophobicContact CG1-CE2 3.72Å; V349-Y351 PolarHBondContact O-N 3.03Å; Y351-I353 PolarHBondContact O-N 3.32Å
352	Q	27.6	Very low	29.9	Very low	183 Å²	183	150.4 Å²	150.4	86%	0.855	79%	0.788	S	S	*	*			trans	-81.2	82.1	-175.7	-152.9	172	25.8	0	0	111.5	G350 R354	G350-Q352 VanDerWaalsContact C-N 3.26Å; G350-Q352 PolarHBondContact O-N 2.98Å; Q352-R354 PolarHBondContact O-N 3.45Å
353	I	26.6	Very low	29.8	Very low	124 Å²	124	149.9 Å²	149.9	64%	0.636	78%	0.784	S	S	*	*			trans	-65.7	123	180	-60.8	174.9	0	0	0	110.4	Y351 I355	Y351-I353 PolarHBondContact O-N 3.32Å; I353-I355 HydrophobicContact CG2-CG1 4.37Å
354	R	33.5	Very low	29.8	Very low	203 Å²	203	149.8 Å²	149.8	77%	0.766	78%	0.784	S	S	*	*			trans	-89.6	102.6	175.7	-64	176.5	178.7	171	-1.1	111.4	Q352	Q352-R354 PolarHBondContact O-N 3.45Å
355	I	31.6	Very low	29.8	Very low	175 Å²	175	152.1 Å²	152.1	90%	0.897	78%	0.776	S	S	*	*			trans	-146.2	0	159.7	-52	-177.9	0	0	0	110.5	I353	I353-I355 HydrophobicContact CG2-CG1 4.37Å

Retrieved 355 of 355 residues in 167.7 ms (Link to these results)

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