A0A093HEA1_STRCA Loading...

Metalloreductase STEAP2

AlphaFold DB , UniProt , Accession A0A093HEA1, Species STRCA (Struthio camelus australis), Gene n/a, Length 489 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	30.2	Very low	27.5	Very low	244 Å²	244	150.9 Å²	150.9	100%	1.202	85%	0.846	S	S	*	*				0	120.8	0	-99.4	164.3	156.3	0	0	107.5
2	E	29.5	Very low	27.5	Very low	191 Å²	191	152.3 Å²	152.3	89%	0.893	85%	0.851	S	S	*	*			trans	68.9	88.9	162.6	-60.1	-172	167.4	0	0	120.5
3	S	24.4	Very low	27.6	Very low	108 Å²	108	152.7 Å²	152.7	76%	0.755	84%	0.841	S	S	*	*			trans	-52.4	143.6	143.8	48.6	0	0	0	0	115.1
4	I	28.1	Very low	27.7	Very low	165 Å²	165	152.4 Å²	152.4	85%	0.846	84%	0.838	S	S	*	*			trans	-138.7	115.3	137.8	-61.8	-175.1	0	0	0	109.5
5	S	26.5	Very low	27.6	Very low	94 Å²	94	154.9 Å²	154.9	66%	0.657	84%	0.841	S	S	*	*			trans	-89.6	141.2	168.9	134.5	0	0	0	0	108.8
6	M	26.4	Very low	27.7	Very low	186 Å²	186	152.7 Å²	152.7	92%	0.916	83%	0.834	S	S	*	*			trans	-121.6	106.9	163.7	-85.5	-81.6	-136.2	0	0	109.4
7	M	28.2	Very low	27.7	Very low	183 Å²	183	155.9 Å²	155.9	90%	0.901	84%	0.839	S	S	*	*			trans	-67.4	154.2	169.5	-102.8	162	136.9	0	0	112
8	G	25.5	Very low	27.7	Very low	78 Å²	78	156.1 Å²	156.1	80%	0.804	84%	0.838	S	S	*	*			trans	175.9	55.4	163.8	0	0	0	0	0	114.5
9	S	27.4	Very low	27.8	Very low	113 Å²	113	153.5 Å²	153.5	79%	0.79	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-81.2	136.2	168.4	-174.9	0	0	0	0	109.9
10	P	29.4	Very low	27.9	Very low	116 Å²	116	153.9 Å²	153.9	75%	0.753	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-70.9	138	177.9	27.9	-30.7	0	0	0	111	N12	P10-N12 PolarHBondContact O-N 3.18Å
11	K	27.3	Very low	28.1	Very low	182 Å²	182	152.4 Å²	152.4	79%	0.791	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-64.7	121.4	176.5	-70.9	175.7	174.5	178.6	0	110.3	H13	K11-H13 PolarHBondContact O-N 3.07Å
12	N	27	Very low	28.2	Very low	168 Å²	168	144.6 Å²	144.6	90%	0.898	80%	0.802	S	S	*	*			trans	-73.7	100.8	161.4	-93.7	-14.7	0	0	0	108.7	P10 N14	P10-N12 PolarHBondContact O-N 3.18Å; N12-N14 PolarHBondContact O-N 3Å
13	H	29.5	Very low	28.2	Very low	157 Å²	157	143.6 Å²	143.6	73%	0.727	80%	0.803	S	S	*	*			trans	-84.2	99	159.9	-81.5	-56.6	0	0	0	108.6	K11	K11-H13 PolarHBondContact O-N 3.07Å
14	N	27.9	Very low	28.4	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	80%	0.798	S	S	*	*			trans	-154.6	65.7	154.8	-97.3	-13.6	0	0	0	107.7	N12 T16	N12-N14 PolarHBondContact O-N 3Å; N14-T16 VanDerWaalsContact C-N 3.32Å; N14-T16 PolarHBondContact O-N 3.13Å
15	E	27.6	Very low	28.9	Very low	189 Å²	189	140.9 Å²	140.9	88%	0.883	80%	0.796	S	S	*	*			trans	-75.9	92.1	156.5	-76.7	-177.9	163.7	0	0	107
16	T	27.9	Very low	29.2	Very low	120 Å²	120	145.7 Å²	145.7	74%	0.736	80%	0.804	S	S	*	*			trans	-101.3	115.8	160.2	-7.3	0	0	0	0	106.5	N14 L18	N14-T16 VanDerWaalsContact C-N 3.32Å; N14-T16 PolarHBondContact O-N 3.13Å; T16-L18 PolarHBondContact O-N 3.29Å
17	F	28.5	Very low	29.7	Very low	207 Å²	207	145 Å²	145	91%	0.908	80%	0.804	S	S	*	*			trans	-44	108.2	177.1	-86.7	-103.2	0	0	0	111.8
18	L	27.5	Very low	30.4	Very low	159 Å²	159	140.3 Å²	140.3	83%	0.832	80%	0.795	S	S	*	*			trans	-101.4	120.4	158.2	-70.8	173.8	0	0	0	106.8	T16 N20	T16-L18 PolarHBondContact O-N 3.29Å; L18-N20 PolarHBondContact O-N 3.32Å
19	P	30.2	Very low	31.5	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	80%	0.795	S	S	*	*			trans	-64.7	137.7	170.5	26.9	-29.3	0	0	0	108.5	V21	P19-V21 WeakPolarHBondContact O-CG2 3.15Å; P19-V21 PolarHBondContact O-N 3.06Å
20	N	28.5	Very low	33.3	Very low	162 Å²	162	142.4 Å²	142.4	87%	0.866	78%	0.782	S	S	*	*			trans	-40.5	101.8	171.8	-84.9	-31.7	0	0	0	112.2	L18	L18-N20 PolarHBondContact O-N 3.32Å
21	V	33.4	Very low	35.8	Very low	122 Å²	122	141.6 Å²	141.6	74%	0.739	77%	0.771	S	S	*	*			trans	-106.2	54.4	163.2	-169.1	0	0	0	0	108.5	P19	P19-V21 WeakPolarHBondContact O-CG2 3.15Å; P19-V21 PolarHBondContact O-N 3.06Å
22	A	30.7	Very low	39	Very low	80 Å²	80	135.2 Å²	135.2	66%	0.661	75%	0.747	S	S	*	*	S	Bend	trans	-110.7	-2	174.4	0	0	0	0	0	113.2
23	N	29.5	Very low	42.3	Very low	171 Å²	171	127.2 Å²	127.2	91%	0.914	70%	0.704	S	S	*	*	S	Bend	trans	-131.7	61.5	179	-82.3	-16.7	0	0	0	111.9
24	G	29.7	Very low	45.5	Very low	63 Å²	63	119.8 Å²	119.8	65%	0.649	67%	0.67	S	S	*	*			trans	-156.3	16.4	176	0	0	0	0	0	115.7
25	I	37.8	Very low	48.9	Very low	153 Å²	153	112.8 Å²	112.8	79%	0.785	63%	0.633	S	S	*	*			trans	-110	57.3	-177.1	-46.5	178	0	0	0	110.2
26	K	34.3	Very low	52.2	Low	194 Å²	194	103.9 Å²	103.9	84%	0.843	59%	0.591	S	S	*	*	S	Bend	trans	-158	83.4	162.7	-72.5	-166.2	-178.7	174.2	0	107.5
27	D	35.6	Very low	55.5	Low	171 Å²	171	98.4 Å²	98.4	91%	0.914	56%	0.559	S	S	*	*			trans	148	54.6	158.3	-79.6	-15.4	0	0	0	113.7
28	A	43.8	Very low	58.6	Low	86 Å²	86	90.9 Å²	90.9	71%	0.711	53%	0.532	S	S	*	.			trans	-110.3	108.9	149.7	0	0	0	0	0	106.3	K30	A28-K30 PolarHBondContact O-N 2.97Å
29	S	48.4	Very low	61.9	Low	115 Å²	115	85.3 Å²	85.3	80%	0.804	51%	0.512	S	S	*	.			trans	-45.9	110.3	163.2	54.3	0	0	0	0	107.5	I31	S29-I31 PolarHBondContact O-N 3.12Å; S29-I31 VanDerWaalsContact O-N 3.16Å
30	K	64.4	Low	64.9	Low	119 Å²	119	86.3 Å²	86.3	52%	0.517	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-57.1	124.2	-172.9	-83.1	151.8	144	-159.6	0	109.1	A28 T32 G53	A28-K30 PolarHBondContact O-N 2.97Å; K30-T32 PolarHBondContact O-N 3.26Å; K30-G53 WeakPolarHBondContact CD-O 3.22Å; K30-G53 WeakPolarHBondContact CE-O 3.47Å; K30-G53 PolarHBondContact NZ-O 2.9Å
31	I	82.9	Confident	68.1	Low	99 Å²	99	80.8 Å²	80.8	51%	0.508	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-52.3	130.1	-176.7	-63	168.2	0	0	0	109.5	S29 I33	S29-I31 PolarHBondContact O-N 3.12Å; S29-I31 VanDerWaalsContact O-N 3.16Å; I31-I33 HydrophobicContact CG2-CD1 3.98Å
32	T	92.9	Very high	71.1	Confident	48 Å²	48	75 Å²	75	29%	0.294	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.8	174.5	-46.5	0	0	0	0	110	K30 H55 V57 T86	K30-T32 PolarHBondContact O-N 3.26Å; T32-H55 CarbonylContact C-O 3.54Å; T32-H55 WeakPolarHBondContact CA-O 3.25Å; T32-H55 HydrophobicContact CG2-CB 4.18Å; T32-V57 HydrophobicContact CG2-CG2 3.61Å; T32-T86 HydrophobicContact CG2-CG2 3.7Å
33	I	96.8	Very high	74.2	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.3	179.7	-58.5	-61.4	0	0	0	109.6	I31 L49 Y54 H55 V56 V57 I88 F90 L181	I31-I33 HydrophobicContact CG2-CD1 3.98Å; I33-L49 HydrophobicContact CB-CD1 4.33Å; I33-L49 HydrophobicContact CG1-CD2 4.24Å; I33-L49 HydrophobicContact CG2-CD1 3.83Å; I33-L49 HydrophobicContact CG2-CD2 4.44Å; I33-Y54 HydrophobicContact CG1-CD1 3.99Å; I33-Y54 HydrophobicContact CG1-CG 4.35Å; I33-H55 PolarHBondContact N-O 2.98Å; I33-V56 WeakPolarHBondContact O-CA 3.19Å; I33-V57 PolarHBondContact O-N 3.43Å; I33-I88 HydrophobicContact CD1-CB 3.9Å; I33-I88 HydrophobicContact CD1-CD1 4.17Å; I33-I88 HydrophobicContact CD1-CG2 4.23Å; I33-F90 HydrophobicContact CG2-CD2 3.6Å; I33-F90 HydrophobicContact CG2-CE2 3.61Å; I33-L181 HydrophobicContact CD1-CD2 4.31Å
34	G	97.4	Very high	77.4	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.01	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	145.2	175.5	0	0	0	0	0	111.3	V57 I88 I89 F90	G34-V57 CarbonylContact C-O 3.57Å; G34-V57 WeakPolarHBondContact CA-O 3.27Å; G34-I88 PolarHBondContact N-O 2.64Å; G34-I89 CarbonylContact O-C 3.6Å; G34-I89 VanDerWaalsContact O-CA 3.31Å; G34-I89 WeakPolarHBondContact O-CA 3.41Å; G34-F90 PolarHBondContact O-N 3.3Å
35	I	98.1	Very high	80.5	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.5	169.7	-57.2	174.8	0	0	0	108.3	A42 L45 T46 L49 V56 V57 V58 G59 F90 A92	I35-A42 HydrophobicContact CG2-CB 3.77Å; I35-L45 HydrophobicContact CD1-CB 4.36Å; I35-L45 HydrophobicContact CD1-CD2 4.08Å; I35-L45 HydrophobicContact CD1-CG 4.11Å; I35-L45 HydrophobicContact CG1-CD2 4.41Å; I35-T46 WeakPolarHBondContact CD1-OG1 3.5Å; I35-L49 HydrophobicContact CD1-CD1 3.94Å; I35-V56 HydrophobicContact CD1-CG1 3.63Å; I35-V56 HydrophobicContact CG1-CG1 4.09Å; I35-V57 PolarHBondContact N-O 3.46Å; I35-V58 HydrophobicContact CB-CG2 4.45Å; I35-V58 CarbonylContact O-C 3.58Å; I35-V58 WeakPolarHBondContact O-CA 3.17Å; I35-G59 PolarHBondContact O-N 3.31Å; I35-F90 WeakPolarHBondContact CA-O 3.12Å; I35-F90 HydrophobicContact CG1-CB 4.25Å; I35-A92 HydrophobicContact CG2-CB 4.01Å
36	I	97.9	Very high	83.3	Confident	2 Å²	2	56 Å²	56	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.1	171.3	-65	175	0	0	0	108.2	V83 I89 F90 A92 I93 L101	I36-V83 HydrophobicContact CD1-CG2 3.84Å; I36-V83 HydrophobicContact CG1-CG2 4.32Å; I36-I89 HydrophobicContact CD1-CG2 3.73Å; I36-I89 HydrophobicContact CG1-CG2 3.73Å; I36-F90 PolarHBondContact N-O 2.61Å; I36-A92 CarbonylContact O-C 3.59Å; I36-A92 WeakPolarHBondContact O-CA 3.35Å; I36-A92 WeakPolarHBondContact O-CB 3.4Å; I36-A92 PolarHBondContact O-N 3.32Å; I36-I93 HydrophobicContact CG2-CD1 4.49Å; I36-I93 HydrophobicContact CG2-CG2 4.35Å; I36-L101 HydrophobicContact CD1-CD1 4.02Å; I36-L101 HydrophobicContact CD1-CD2 4.32Å; I36-L101 HydrophobicContact CG2-CD1 4.1Å; I36-L101 HydrophobicContact CG2-CD2 3.76Å
37	G	96.1	Very high	86.1	Confident	6 Å²	6	48.2 Å²	48.2	6%	0.062	28%	0.284	C	S	.	.			trans	117.2	149.8	-178	0	0	0	0	0	112.5	A42 V58 G59	G37-A42 WeakPolarHBondContact O-CB 3.36Å; G37-V58 WeakPolarHBondContact O-CG1 3.09Å; G37-G59 PolarHBondContact N-O 2.69Å
38	S	95.4	Very high	88.9	Confident	49 Å²	49	41.1 Å²	41.1	34%	0.343	24%	0.244	S	C	.	.			trans	-123.9	17	-174.1	47.8	0	0	0	0	113.9	S60	S38-S60 PolarHBondContact OG-OG 3.13Å
39	G	94.9	Very high	91.3	Very high	41 Å²	41	37 Å²	37	42%	0.423	21%	0.21	S	C	.	.	S	Bend	trans	-84.8	-174.4	179	0	0	0	0	0	114.5	F41 A42 K43	G39-F41 VanDerWaalsContact C-N 3.35Å; G39-F41 PolarHBondContact O-N 3.03Å; G39-A42 WeakPolarHBondContact O-CB 3.42Å; G39-A42 PolarHBondContact O-N 3.04Å; G39-A42 VanDerWaalsContact O-N 3.14Å; G39-K43 PolarHBondContact O-N 3.01Å
40	D	94.8	Very high	93.4	Very high	129 Å²	129	33.9 Å²	33.9	69%	0.69	18%	0.184	S	C	*	.	H	α-helix	trans	-57.1	-43.1	-174.9	-67.8	-28.9	0	0	0	113.6	K43 S44	D40-K43 PolarHBondContact O-N 2.93Å; D40-S44 WeakPolarHBondContact O-CB 3.44Å; D40-S44 PolarHBondContact O-N 3.04Å; D40-S44 PolarHBondContact O-OG 3.18Å
41	F	95.6	Very high	94.7	Very high	45 Å²	45	36 Å²	36	20%	0.197	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-43.9	178.8	-168.6	-87.5	0	0	0	111.6	G39 S44 L45 A92 V116 F146 V149 A151 L154	G39-F41 VanDerWaalsContact C-N 3.35Å; G39-F41 PolarHBondContact O-N 3.03Å; F41-S44 PolarHBondContact O-N 2.65Å; F41-L45 HydrophobicContact CE1-CD2 4.27Å; F41-L45 VanDerWaalsContact O-CB 3.28Å; F41-L45 WeakPolarHBondContact O-CB 3.48Å; F41-L45 PolarHBondContact O-N 3.06Å; F41-A92 HydrophobicContact CD1-CB 4.31Å; F41-V116 HydrophobicContact CD1-CG2 3.93Å; F41-V116 HydrophobicContact CE1-CB 3.75Å; F41-V116 HydrophobicContact CE1-CG1 4.02Å; F41-V116 HydrophobicContact CE1-CG2 3.63Å; F41-V116 HydrophobicContact CZ-CB 4.08Å; F41-V116 HydrophobicContact CZ-CG1 4.44Å; F41-V116 HydrophobicContact CZ-CG2 4.38Å; F41-F146 HydrophobicContact CZ-CB 4.27Å; F41-V149 WeakPolarHBondContact CE2-O 3.46Å; F41-A151 HydrophobicContact CD2-CB 4.39Å; F41-L154 HydrophobicContact CD2-CD1 4.23Å; F41-L154 HydrophobicContact CE1-CD1 4.21Å; F41-L154 HydrophobicContact CE2-CD1 3.73Å; F41-L154 HydrophobicContact CZ-CD1 3.72Å
42	A	96.6	Very high	95.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-48.5	176.8	0	0	0	0	0	110.9	I35 G37 G39 S44 L45 T46 F70 A92	I35-A42 HydrophobicContact CG2-CB 3.77Å; G37-A42 WeakPolarHBondContact O-CB 3.36Å; G39-A42 WeakPolarHBondContact O-CB 3.42Å; G39-A42 PolarHBondContact O-N 3.04Å; G39-A42 VanDerWaalsContact O-N 3.14Å; A42-S44 PolarHBondContact O-N 3.37Å; A42-L45 PolarHBondContact O-N 3.34Å; A42-T46 WeakPolarHBondContact O-CB 3.49Å; A42-T46 PolarHBondContact O-N 3.21Å; A42-T46 PolarHBondContact O-OG1 3.21Å; A42-F70 HydrophobicContact CB-CZ 4.14Å; A42-A92 HydrophobicContact CB-CB 3.91Å
43	K	95.5	Very high	95.1	Very high	67 Å²	67	31.8 Å²	31.8	29%	0.291	17%	0.172	S	C	.	.	H	α-helix	trans	-55.9	-49.7	175.7	178.2	176.3	179.3	156.6	0	112.4	G39 D40 T46 I47 F69 F70	G39-K43 PolarHBondContact O-N 3.01Å; D40-K43 PolarHBondContact O-N 2.93Å; K43-T46 WeakPolarHBondContact O-CB 3.4Å; K43-T46 PolarHBondContact O-N 3.43Å; K43-I47 HydrophobicContact CG-CD1 4.07Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.9Å; K43-F69 WeakPolarHBondContact CD-O 3.47Å; K43-F69 WeakPolarHBondContact CE-O 3.41Å; K43-F69 PolarHBondContact NZ-O 3.06Å; K43-F70 VanDerWaalsContact CA-CE1 3.42Å; K43-F70 HydrophobicContact CB-CE1 4.08Å; K43-F70 HydrophobicContact CB-CZ 4.29Å
44	S	95.3	Very high	94.9	Very high	1 Å²	1	33 Å²	33	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-40.7	-179.4	-65	0	0	0	0	112.8	D40 F41 A42 I47 R48 A151 Q155	D40-S44 WeakPolarHBondContact O-CB 3.44Å; D40-S44 PolarHBondContact O-N 3.04Å; D40-S44 PolarHBondContact O-OG 3.18Å; F41-S44 PolarHBondContact O-N 2.65Å; A42-S44 PolarHBondContact O-N 3.37Å; S44-I47 PolarHBondContact O-N 3.02Å; S44-R48 PolarHBondContact O-N 3.11Å; S44-A151 WeakPolarHBondContact CB-O 3.44Å; S44-A151 PolarHBondContact OG-O 3.11Å; S44-Q155 VanDerWaalsContact OG-CG 3.24Å; S44-Q155 WeakPolarHBondContact OG-CG 3.47Å; S44-Q155 PolarHBondContact OG-NE2 3.27Å
45	L	95.6	Very high	94.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-43.9	175.6	-177	62	0	0	0	111.2	I35 F41 A42 I47 R48 L49 F90 L154	I35-L45 HydrophobicContact CD1-CB 4.36Å; I35-L45 HydrophobicContact CD1-CD2 4.08Å; I35-L45 HydrophobicContact CD1-CG 4.11Å; I35-L45 HydrophobicContact CG1-CD2 4.41Å; F41-L45 HydrophobicContact CE1-CD2 4.27Å; F41-L45 VanDerWaalsContact O-CB 3.28Å; F41-L45 WeakPolarHBondContact O-CB 3.48Å; F41-L45 PolarHBondContact O-N 3.06Å; A42-L45 PolarHBondContact O-N 3.34Å; L45-I47 PolarHBondContact O-N 3.42Å; L45-R48 WeakPolarHBondContact O-CB 3.41Å; L45-R48 PolarHBondContact O-N 3.49Å; L45-R48 VanDerWaalsContact O-N 3.16Å; L45-L49 HydrophobicContact CD1-CD1 4.26Å; L45-L49 HydrophobicContact CD1-CG 4.4Å; L45-L49 HydrophobicContact CG-CD1 3.87Å; L45-L49 HydrophobicContact CG-CG 4.47Å; L45-L49 WeakPolarHBondContact O-CB 3.48Å; L45-L49 WeakPolarHBondContact O-CG 3.46Å; L45-L49 PolarHBondContact O-N 3.35Å; L45-F90 HydrophobicContact CD2-CB 3.76Å; L45-F90 HydrophobicContact CD2-CD1 3.54Å; L45-F90 HydrophobicContact CD2-CD2 3.89Å; L45-F90 HydrophobicContact CD2-CE1 4Å; L45-F90 HydrophobicContact CD2-CE2 4.33Å; L45-F90 HydrophobicContact CD2-CG 3.45Å; L45-F90 VanDerWaalsContact CD2-CG 3.45Å; L45-F90 HydrophobicContact CD2-CZ 4.38Å; L45-L154 HydrophobicContact CB-CD1 4.15Å; L45-L154 HydrophobicContact CD1-CD1 4.33Å; L45-L154 HydrophobicContact CD1-CD2 4.07Å
46	T	95.9	Very high	94.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.3	-49.9	174.2	-63.8	0	0	0	0	111.6	I35 A42 K43 R48 L49 I50 V56 F70 V74	I35-T46 WeakPolarHBondContact CD1-OG1 3.5Å; A42-T46 WeakPolarHBondContact O-CB 3.49Å; A42-T46 PolarHBondContact O-N 3.21Å; A42-T46 PolarHBondContact O-OG1 3.21Å; K43-T46 WeakPolarHBondContact O-CB 3.4Å; K43-T46 PolarHBondContact O-N 3.43Å; T46-R48 VanDerWaalsContact C-N 3.27Å; T46-R48 PolarHBondContact O-N 2.93Å; T46-L49 PolarHBondContact O-N 3.28Å; T46-I50 HydrophobicContact CG2-CD1 3.61Å; T46-I50 HydrophobicContact CG2-CG1 4.39Å; T46-I50 WeakPolarHBondContact O-CD1 3.31Å; T46-I50 VanDerWaalsContact O-CG1 3.26Å; T46-I50 WeakPolarHBondContact O-CG1 3.37Å; T46-I50 PolarHBondContact O-N 3.42Å; T46-V56 HydrophobicContact CG2-CB 4.27Å; T46-V56 HydrophobicContact CG2-CG1 3.98Å; T46-F70 HydrophobicContact CG2-CD1 3.87Å; T46-F70 HydrophobicContact CG2-CE1 4.37Å; T46-F70 WeakPolarHBondContact OG1-CE1 3.48Å; T46-V74 HydrophobicContact CG2-CB 4.43Å; T46-V74 HydrophobicContact CG2-CG1 4.05Å; T46-V74 HydrophobicContact CG2-CG2 3.58Å
47	I	94.2	Very high	94.7	Very high	30 Å²	30	39.1 Å²	39.1	15%	0.154	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-41.9	177.8	-68.6	165.1	0	0	0	110.7	K43 S44 L45 R51 P71 Q155	K43-I47 HydrophobicContact CG-CD1 4.07Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.9Å; S44-I47 PolarHBondContact O-N 3.02Å; L45-I47 PolarHBondContact O-N 3.42Å; I47-R51 WeakPolarHBondContact O-CB 3.3Å; I47-R51 VanDerWaalsContact O-CG 3.3Å; I47-R51 WeakPolarHBondContact O-CG 3.39Å; I47-R51 PolarHBondContact O-N 3.23Å; I47-R51 VanDerWaalsContact O-N 3.09Å; I47-P71 HydrophobicContact CG1-CG 4.04Å; I47-Q155 HydrophobicContact CD1-CG 4.43Å
48	R	93.4	Very high	94.7	Very high	22 Å²	22	38.9 Å²	38.9	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-47.8	178.9	-175.4	57.9	-178.2	159.5	8	111.9	S44 L45 T46 R51 C52 L154 L185 N186	S44-R48 PolarHBondContact O-N 3.11Å; L45-R48 WeakPolarHBondContact O-CB 3.41Å; L45-R48 PolarHBondContact O-N 3.49Å; L45-R48 VanDerWaalsContact O-N 3.16Å; T46-R48 VanDerWaalsContact C-N 3.27Å; T46-R48 PolarHBondContact O-N 2.93Å; R48-R51 PolarHBondContact O-N 3.08Å; R48-C52 PolarHBondContact O-N 3.26Å; R48-L154 HydrophobicContact CB-CB 4.43Å; R48-L154 HydrophobicContact CB-CD2 4.23Å; R48-L154 WeakPolarHBondContact CB-O 3.26Å; R48-L154 WeakPolarHBondContact CD-O 3.48Å; R48-L154 HydrophobicContact CG-CD2 4.16Å; R48-L185 HydrophobicContact CG-CD2 3.93Å; R48-L185 VanDerWaalsContact CZ-O 3.3Å; R48-L185 PolarHBondContact NE-O 3.48Å; R48-L185 VanDerWaalsContact NE-O 3.09Å; R48-L185 VanDerWaalsContact NH2-C 3.32Å; R48-L185 PolarHBondContact NH2-O 2.95Å; R48-N186 VanDerWaalsContact NH2-CB 3.31Å; R48-N186 PolarHBondContact NH2-ND2 3.3Å
49	L	94.7	Very high	94.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-45.9	179.2	-76.6	164	0	0	0	111.5	I33 I35 L45 T46 R51 C52 G53 Y54 V56 L181 L185	I33-L49 HydrophobicContact CB-CD1 4.33Å; I33-L49 HydrophobicContact CG1-CD2 4.24Å; I33-L49 HydrophobicContact CG2-CD1 3.83Å; I33-L49 HydrophobicContact CG2-CD2 4.44Å; I35-L49 HydrophobicContact CD1-CD1 3.94Å; L45-L49 HydrophobicContact CD1-CD1 4.26Å; L45-L49 HydrophobicContact CD1-CG 4.4Å; L45-L49 HydrophobicContact CG-CD1 3.87Å; L45-L49 HydrophobicContact CG-CG 4.47Å; L45-L49 WeakPolarHBondContact O-CB 3.48Å; L45-L49 WeakPolarHBondContact O-CG 3.46Å; L45-L49 PolarHBondContact O-N 3.35Å; T46-L49 PolarHBondContact O-N 3.28Å; L49-R51 PolarHBondContact O-N 3.08Å; L49-C52 CarbonylContact O-C 3.53Å; L49-C52 PolarHBondContact O-N 3.46Å; L49-G53 PolarHBondContact O-N 3.22Å; L49-Y54 HydrophobicContact CD2-CD2 3.85Å; L49-Y54 HydrophobicContact CD2-CE2 4.39Å; L49-Y54 HydrophobicContact CD2-CG 4.09Å; L49-Y54 WeakPolarHBondContact O-CD2 3.25Å; L49-Y54 PolarHBondContact O-N 3.36Å; L49-V56 HydrophobicContact CB-CG2 3.5Å; L49-V56 HydrophobicContact CD1-CG2 4Å; L49-V56 HydrophobicContact CG-CG2 4.38Å; L49-L181 HydrophobicContact CD2-CD1 4.07Å; L49-L185 HydrophobicContact CD2-CD1 4.02Å; L49-L185 HydrophobicContact CD2-CD2 3.74Å; L49-L185 HydrophobicContact CD2-CG 4.37Å; L49-L185 HydrophobicContact CG-CD2 4.22Å
50	I	93.7	Very high	94.9	Very high	49 Å²	49	34.8 Å²	34.8	25%	0.251	17%	0.169	S	C	.	.	H	α-helix	trans	-62.8	-42.6	177.7	-65.6	162	0	0	0	111.3	T46 C52 G53 V56 P71 V73 V74	T46-I50 HydrophobicContact CG2-CD1 3.61Å; T46-I50 HydrophobicContact CG2-CG1 4.39Å; T46-I50 WeakPolarHBondContact O-CD1 3.31Å; T46-I50 VanDerWaalsContact O-CG1 3.26Å; T46-I50 WeakPolarHBondContact O-CG1 3.37Å; T46-I50 PolarHBondContact O-N 3.42Å; I50-C52 PolarHBondContact O-N 2.89Å; I50-G53 VanDerWaalsContact O-CA 3.3Å; I50-G53 WeakPolarHBondContact O-CA 3.43Å; I50-G53 PolarHBondContact O-N 3.31Å; I50-V56 HydrophobicContact CG1-CG2 4.12Å; I50-P71 HydrophobicContact CD1-CB 4.34Å; I50-P71 HydrophobicContact CD1-CG 4.1Å; I50-V73 HydrophobicContact CD1-CG1 4.11Å; I50-V73 HydrophobicContact CG2-CG1 4.33Å; I50-V74 HydrophobicContact CD1-CG2 3.24Å; I50-V74 HydrophobicContact CG1-CG2 4.31Å
51	R	91.6	Very high	94.8	Very high	165 Å²	165	37.6 Å²	37.6	62%	0.623	17%	0.17	S	C	*	.	H	α-helix	trans	-64.1	-30.5	177.4	-76.2	179.6	177.7	177.5	5.8	113	I47 R48 L49 Q155	I47-R51 WeakPolarHBondContact O-CB 3.3Å; I47-R51 VanDerWaalsContact O-CG 3.3Å; I47-R51 WeakPolarHBondContact O-CG 3.39Å; I47-R51 PolarHBondContact O-N 3.23Å; I47-R51 VanDerWaalsContact O-N 3.09Å; R48-R51 PolarHBondContact O-N 3.08Å; L49-R51 PolarHBondContact O-N 3.08Å; R51-Q155 PolarHBondContact NH1-O 3.42Å
52	C	90.9	Very high	94.8	Very high	39 Å²	39	39.1 Å²	39.1	26%	0.264	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.9	171	-69.9	0	0	0	0	112.7	R48 L49 I50 Y54 Q184 L185	R48-C52 PolarHBondContact O-N 3.26Å; L49-C52 CarbonylContact O-C 3.53Å; L49-C52 PolarHBondContact O-N 3.46Å; I50-C52 PolarHBondContact O-N 2.89Å; C52-Y54 HydrophobicContact CB-CD2 4.08Å; C52-Y54 HydrophobicContact CB-CE2 3.98Å; C52-Q184 PolarHBondContact SG-O 3.49Å; C52-Q184 VanDerWaalsContact SG-O 3.35Å; C52-L185 HydrophobicContact CB-CD2 3.82Å
53	G	92	Very high	94.6	Very high	19 Å²	19	39.7 Å²	39.7	20%	0.196	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	16.7	170.2	0	0	0	0	0	115.6	K30 L49 I50	K30-G53 WeakPolarHBondContact CD-O 3.22Å; K30-G53 WeakPolarHBondContact CE-O 3.47Å; K30-G53 PolarHBondContact NZ-O 2.9Å; L49-G53 PolarHBondContact O-N 3.22Å; I50-G53 VanDerWaalsContact O-CA 3.3Å; I50-G53 WeakPolarHBondContact O-CA 3.43Å; I50-G53 PolarHBondContact O-N 3.31Å
54	Y	94.1	Very high	94.5	Very high	26 Å²	26	45.1 Å²	45.1	10%	0.102	21%	0.207	C	C	.	.			trans	-81	151	173.7	-65.3	-90	0	0	0	112	I33 L49 C52 L181 Q184 L185	I33-Y54 HydrophobicContact CG1-CD1 3.99Å; I33-Y54 HydrophobicContact CG1-CG 4.35Å; L49-Y54 HydrophobicContact CD2-CD2 3.85Å; L49-Y54 HydrophobicContact CD2-CE2 4.39Å; L49-Y54 HydrophobicContact CD2-CG 4.09Å; L49-Y54 WeakPolarHBondContact O-CD2 3.25Å; L49-Y54 PolarHBondContact O-N 3.36Å; C52-Y54 HydrophobicContact CB-CD2 4.08Å; C52-Y54 HydrophobicContact CB-CE2 3.98Å; Y54-L181 HydrophobicContact CD1-CD1 4.46Å; Y54-L181 HydrophobicContact CE1-CD1 3.78Å; Y54-L181 HydrophobicContact CE2-CD1 3.9Å; Y54-L181 VanDerWaalsContact CZ-CD1 3.45Å; Y54-L181 WeakPolarHBondContact OH-CD1 3.33Å; Y54-Q184 HydrophobicContact CE2-CB 4.45Å; Y54-Q184 WeakPolarHBondContact OH-CB 3.4Å; Y54-Q184 PolarHBondContact OH-OE1 2.84Å; Y54-L185 HydrophobicContact CD2-CD2 4.43Å; Y54-L185 HydrophobicContact CE2-CD2 4.19Å
55	H	94.6	Very high	94.3	Very high	116 Å²	116	49.9 Å²	49.9	54%	0.537	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	134	162.6	-66	-75.9	0	0	0	108.7	T32 I33	T32-H55 CarbonylContact C-O 3.54Å; T32-H55 WeakPolarHBondContact CA-O 3.25Å; T32-H55 HydrophobicContact CG2-CB 4.18Å; I33-H55 PolarHBondContact N-O 2.98Å
56	V	96	Very high	94.2	Very high	11 Å²	11	50.2 Å²	50.2	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	133.7	-176.6	-174.8	0	0	0	0	108.9	I33 I35 T46 L49 I50 V58	I33-V56 WeakPolarHBondContact O-CA 3.19Å; I35-V56 HydrophobicContact CD1-CG1 3.63Å; I35-V56 HydrophobicContact CG1-CG1 4.09Å; T46-V56 HydrophobicContact CG2-CB 4.27Å; T46-V56 HydrophobicContact CG2-CG1 3.98Å; L49-V56 HydrophobicContact CB-CG2 3.5Å; L49-V56 HydrophobicContact CD1-CG2 4Å; L49-V56 HydrophobicContact CG-CG2 4.38Å; I50-V56 HydrophobicContact CG1-CG2 4.12Å; V56-V58 HydrophobicContact CG1-CG2 4.17Å
57	V	96.8	Very high	94	Very high	6 Å²	6	52.2 Å²	52.2	4%	0.036	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.9	171	-175	0	0	0	0	108.1	T32 I33 G34 I35 D75 A82 T86	T32-V57 HydrophobicContact CG2-CG2 3.61Å; I33-V57 PolarHBondContact O-N 3.43Å; G34-V57 CarbonylContact C-O 3.57Å; G34-V57 WeakPolarHBondContact CA-O 3.27Å; I35-V57 PolarHBondContact N-O 3.46Å; V57-D75 WeakPolarHBondContact CA-O 3.32Å; V57-D75 HydrophobicContact CG1-CB 4.24Å; V57-D75 HydrophobicContact CG2-CB 4.38Å; V57-A82 HydrophobicContact CG1-CB 3.83Å; V57-T86 HydrophobicContact CB-CG2 4.24Å; V57-T86 HydrophobicContact CG2-CG2 4.36Å
58	V	97.7	Very high	93.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.7	-176.9	178.8	0	0	0	0	109.6	I35 G37 V56 F70 V74 D75 V76 T77	I35-V58 HydrophobicContact CB-CG2 4.45Å; I35-V58 CarbonylContact O-C 3.58Å; I35-V58 WeakPolarHBondContact O-CA 3.17Å; G37-V58 WeakPolarHBondContact O-CG1 3.09Å; V56-V58 HydrophobicContact CG1-CG2 4.17Å; V58-F70 HydrophobicContact CG1-CE1 4.15Å; V58-F70 HydrophobicContact CG1-CE2 4.07Å; V58-F70 HydrophobicContact CG1-CZ 3.78Å; V58-F70 HydrophobicContact CG2-CD1 4Å; V58-F70 HydrophobicContact CG2-CE1 3.79Å; V58-F70 HydrophobicContact CG2-CZ 4.29Å; V58-V74 HydrophobicContact CB-CG1 4.45Å; V58-V74 HydrophobicContact CG2-CG1 3.69Å; V58-D75 PolarHBondContact N-O 3.41Å; V58-V76 HydrophobicContact CB-CG1 4.46Å; V58-V76 HydrophobicContact CB-CG2 4.24Å; V58-V76 HydrophobicContact CG1-CG1 4.44Å; V58-V76 CarbonylContact O-C 3.5Å; V58-V76 WeakPolarHBondContact O-CA 3.32Å; V58-T77 PolarHBondContact O-N 2.77Å
59	G	97	Very high	93.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125	169.9	0	0	0	0	0	111.1	I35 G37 T77 H79	I35-G59 PolarHBondContact O-N 3.31Å; G37-G59 PolarHBondContact N-O 2.69Å; G59-T77 WeakPolarHBondContact CA-O 3.36Å; G59-H79 PolarHBondContact O-CD2 2.95Å
60	S	96	Very high	93.7	Very high	5 Å²	5	62.9 Å²	62.9	4%	0.035	30%	0.3	C	S	.	.			trans	-131.5	152.2	173.9	179	0	0	0	0	111.5	S38 N62 A66 T77	S38-S60 PolarHBondContact OG-OG 3.13Å; S60-N62 VanDerWaalsContact C-N 3.28Å; S60-N62 PolarHBondContact O-N 3.4Å; S60-N62 PolarHBondContact OG-N 3.02Å; S60-N62 PolarHBondContact OG-O 3.36Å; S60-A66 WeakPolarHBondContact OG-CB 3.43Å; S60-T77 PolarHBondContact N-O 3.17Å
61	R	94.1	Very high	93.4	Very high	188 Å²	188	62.7 Å²	62.7	71%	0.709	30%	0.302	S	S	*	.	S	Bend	trans	-63.1	-34.7	170.6	-66.3	176.6	-69	179.2	-0.8	112.4
62	N	94.1	Very high	93.3	Very high	76 Å²	76	64 Å²	64	41%	0.406	31%	0.314	S	S	.	.	S	Bend	trans	-128.2	89.4	175.1	-169.9	-23.8	0	0	0	108.8	S60 K64 L65 A66	S60-N62 VanDerWaalsContact C-N 3.28Å; S60-N62 PolarHBondContact O-N 3.4Å; S60-N62 PolarHBondContact OG-N 3.02Å; S60-N62 PolarHBondContact OG-O 3.36Å; N62-K64 VanDerWaalsContact C-N 3.34Å; N62-K64 PolarHBondContact O-N 2.98Å; N62-L65 VanDerWaalsContact ND2-CD1 3.25Å; N62-L65 WeakPolarHBondContact ND2-CD1 3.28Å; N62-L65 PolarHBondContact OD1-N 3.39Å; N62-A66 VanDerWaalsContact O-CB 3.31Å; N62-A66 WeakPolarHBondContact O-CB 3.28Å; N62-A66 PolarHBondContact O-N 3.12Å; N62-A66 VanDerWaalsContact O-N 3.08Å
63	P	93.7	Very high	93.2	Very high	14 Å²	14	67.7 Å²	67.7	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-64.8	-36.5	-175.2	-22.9	34.3	0	0	0	113	L65 A66 A67 V76 T77 H78	P63-L65 PolarHBondContact O-N 3.34Å; P63-A66 PolarHBondContact O-N 3.49Å; P63-A67 WeakPolarHBondContact O-CB 3.2Å; P63-A67 PolarHBondContact O-N 3.36Å; P63-V76 HydrophobicContact CB-CG1 4.3Å; P63-T77 WeakPolarHBondContact CG-O 3.48Å; P63-H78 VanDerWaalsContact CD-CE1 3.46Å; P63-H78 WeakPolarHBondContact CD-CE1 3.41Å; P63-H78 HydrophobicContact CG-CB 4.46Å
64	K	92.9	Very high	93.2	Very high	181 Å²	181	67.4 Å²	67.4	79%	0.787	33%	0.329	S	S	*	.	H	α-helix	trans	-58.8	-49.6	-179.6	-67.9	-176.4	179	-180	0	111.8	N62	N62-K64 VanDerWaalsContact C-N 3.34Å; N62-K64 PolarHBondContact O-N 2.98Å
65	L	91.9	Very high	93	Very high	101 Å²	101	70.7 Å²	70.7	53%	0.529	35%	0.349	S	S	.	.	H	α-helix	trans	-71.2	-39.2	176.9	-67.9	-179.4	0	0	0	112.1	N62 P63 A67 E68 F69	N62-L65 VanDerWaalsContact ND2-CD1 3.25Å; N62-L65 WeakPolarHBondContact ND2-CD1 3.28Å; N62-L65 PolarHBondContact OD1-N 3.39Å; P63-L65 PolarHBondContact O-N 3.34Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.42Å; L65-E68 PolarHBondContact O-N 3.08Å; L65-F69 WeakPolarHBondContact O-CD2 3.39Å; L65-F69 WeakPolarHBondContact O-CE2 3.49Å
66	A	92.3	Very high	93.1	Very high	6 Å²	6	66.2 Å²	66.2	5%	0.05	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-35.1	-177.9	0	0	0	0	0	112.4	S60 N62 P63 E68 F69 F70 V76	S60-A66 WeakPolarHBondContact OG-CB 3.43Å; N62-A66 VanDerWaalsContact O-CB 3.31Å; N62-A66 WeakPolarHBondContact O-CB 3.28Å; N62-A66 PolarHBondContact O-N 3.12Å; N62-A66 VanDerWaalsContact O-N 3.08Å; P63-A66 PolarHBondContact O-N 3.49Å; A66-E68 PolarHBondContact O-N 3.39Å; A66-E68 VanDerWaalsContact O-N 3.12Å; A66-F69 PolarHBondContact O-N 2.81Å; A66-F70 WeakPolarHBondContact O-CD2 2.78Å; A66-V76 HydrophobicContact CB-CG1 3.8Å
67	A	92.9	Very high	93.1	Very high	43 Å²	43	66.7 Å²	66.7	36%	0.355	33%	0.333	S	S	.	.	H	α-helix	trans	-54.5	-31.9	-178.9	0	0	0	0	0	113.6	P63 L65 F69 F70 V76	P63-A67 WeakPolarHBondContact O-CB 3.2Å; P63-A67 PolarHBondContact O-N 3.36Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.42Å; A67-F69 PolarHBondContact O-N 2.92Å; A67-F70 PolarHBondContact O-N 3.21Å; A67-V76 HydrophobicContact CB-CB 4.19Å; A67-V76 HydrophobicContact CB-CG2 4.38Å
68	E	91.6	Very high	93.1	Very high	148 Å²	148	71.3 Å²	71.3	69%	0.692	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.6	177.4	-62	-177.5	-179.2	0	0	113.2	L65 A66	L65-E68 PolarHBondContact O-N 3.08Å; A66-E68 PolarHBondContact O-N 3.39Å; A66-E68 VanDerWaalsContact O-N 3.12Å
69	F	89.8	Confident	93	Very high	120 Å²	120	72.8 Å²	72.8	53%	0.526	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-12.9	-176.9	-64	-83.5	0	0	0	113.6	K43 L65 A66 A67	K43-F69 WeakPolarHBondContact CD-O 3.47Å; K43-F69 WeakPolarHBondContact CE-O 3.41Å; K43-F69 PolarHBondContact NZ-O 3.06Å; L65-F69 WeakPolarHBondContact O-CD2 3.39Å; L65-F69 WeakPolarHBondContact O-CE2 3.49Å; A66-F69 PolarHBondContact O-N 2.81Å; A67-F69 PolarHBondContact O-N 2.92Å
70	F	93.3	Very high	92.8	Very high	8 Å²	8	78.5 Å²	78.5	4%	0.035	39%	0.387	C	S	.	.	S	Bend	trans	-106.5	157.8	-178.4	-72.8	-91.7	0	0	0	111.6	A42 K43 T46 V58 A66 A67 H72 V76	A42-F70 HydrophobicContact CB-CZ 4.14Å; K43-F70 VanDerWaalsContact CA-CE1 3.42Å; K43-F70 HydrophobicContact CB-CE1 4.08Å; K43-F70 HydrophobicContact CB-CZ 4.29Å; T46-F70 HydrophobicContact CG2-CD1 3.87Å; T46-F70 HydrophobicContact CG2-CE1 4.37Å; T46-F70 WeakPolarHBondContact OG1-CE1 3.48Å; V58-F70 HydrophobicContact CG1-CE1 4.15Å; V58-F70 HydrophobicContact CG1-CE2 4.07Å; V58-F70 HydrophobicContact CG1-CZ 3.78Å; V58-F70 HydrophobicContact CG2-CD1 4Å; V58-F70 HydrophobicContact CG2-CE1 3.79Å; V58-F70 HydrophobicContact CG2-CZ 4.29Å; A66-F70 WeakPolarHBondContact O-CD2 2.78Å; A67-F70 PolarHBondContact O-N 3.21Å; F70-H72 PolarHBondContact O-N 2.5Å; F70-V76 HydrophobicContact CB-CG2 4.01Å; F70-V76 HydrophobicContact CD2-CG2 4.11Å; F70-V76 HydrophobicContact CG-CG2 4.16Å
71	P	89.2	Confident	92.7	Very high	45 Å²	45	82 Å²	82	29%	0.292	41%	0.406	S	S	.	.			trans	-57.4	138.7	172.6	-22.8	34	0	0	0	111.4	I47 I50 V73 V74	I47-P71 HydrophobicContact CG1-CG 4.04Å; I50-P71 HydrophobicContact CD1-CB 4.34Å; I50-P71 HydrophobicContact CD1-CG 4.1Å; P71-V73 HydrophobicContact CB-CG1 4.17Å; P71-V73 PolarHBondContact O-N 3.12Å; P71-V74 HydrophobicContact CB-CG2 4.24Å; P71-V74 HydrophobicContact CG-CG2 4.45Å; P71-V74 WeakPolarHBondContact O-CB 3.48Å; P71-V74 WeakPolarHBondContact O-CG2 3.47Å; P71-V74 PolarHBondContact O-N 3.4Å
72	H	87.6	Confident	92.8	Very high	193 Å²	193	73.1 Å²	73.1	89%	0.894	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-16.8	-176.5	-60.6	-57.7	0	0	0	115.4	F70 V74	F70-H72 PolarHBondContact O-N 2.5Å; H72-V74 PolarHBondContact O-N 2.7Å
73	V	89.2	Confident	92.8	Very high	115 Å²	115	69.5 Å²	69.5	70%	0.697	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.2	177.6	69.6	0	0	0	0	113.3	I50 P71	I50-V73 HydrophobicContact CD1-CG1 4.11Å; I50-V73 HydrophobicContact CG2-CG1 4.33Å; P71-V73 HydrophobicContact CB-CG1 4.17Å; P71-V73 PolarHBondContact O-N 3.12Å
74	V	91.7	Very high	92.8	Very high	13 Å²	13	71.9 Å²	71.9	8%	0.079	37%	0.374	C	S	.	.	S	Bend	trans	-101.9	129.2	-174.3	-177.9	0	0	0	0	110.5	T46 I50 V58 P71 H72 V76	T46-V74 HydrophobicContact CG2-CB 4.43Å; T46-V74 HydrophobicContact CG2-CG1 4.05Å; T46-V74 HydrophobicContact CG2-CG2 3.58Å; I50-V74 HydrophobicContact CD1-CG2 3.24Å; I50-V74 HydrophobicContact CG1-CG2 4.31Å; V58-V74 HydrophobicContact CB-CG1 4.45Å; V58-V74 HydrophobicContact CG2-CG1 3.69Å; P71-V74 HydrophobicContact CB-CG2 4.24Å; P71-V74 HydrophobicContact CG-CG2 4.45Å; P71-V74 WeakPolarHBondContact O-CB 3.48Å; P71-V74 WeakPolarHBondContact O-CG2 3.47Å; P71-V74 PolarHBondContact O-N 3.4Å; H72-V74 PolarHBondContact O-N 2.7Å; V74-V76 HydrophobicContact CG1-CG2 4.34Å; V74-V76 PolarHBondContact O-N 3.45Å
75	D	91.7	Very high	92.7	Very high	96 Å²	96	68.8 Å²	68.8	51%	0.513	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	107.9	170.8	-70.7	-20.1	0	0	0	109.5	V57 V58 T77	V57-D75 WeakPolarHBondContact CA-O 3.32Å; V57-D75 HydrophobicContact CG1-CB 4.24Å; V57-D75 HydrophobicContact CG2-CB 4.38Å; V58-D75 PolarHBondContact N-O 3.41Å; D75-T77 HydrophobicContact CB-CG2 4.4Å
76	V	95.4	Very high	92.8	Very high	22 Å²	22	64 Å²	64	13%	0.133	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.4	170.7	-173.2	0	0	0	0	108.6	V58 P63 A66 A67 F70 V74	V58-V76 HydrophobicContact CB-CG1 4.46Å; V58-V76 HydrophobicContact CB-CG2 4.24Å; V58-V76 HydrophobicContact CG1-CG1 4.44Å; V58-V76 CarbonylContact O-C 3.5Å; V58-V76 WeakPolarHBondContact O-CA 3.32Å; P63-V76 HydrophobicContact CB-CG1 4.3Å; A66-V76 HydrophobicContact CB-CG1 3.8Å; A67-V76 HydrophobicContact CB-CB 4.19Å; A67-V76 HydrophobicContact CB-CG2 4.38Å; F70-V76 HydrophobicContact CB-CG2 4.01Å; F70-V76 HydrophobicContact CD2-CG2 4.11Å; F70-V76 HydrophobicContact CG-CG2 4.16Å; V74-V76 HydrophobicContact CG1-CG2 4.34Å; V74-V76 PolarHBondContact O-N 3.45Å
77	T	96.4	Very high	93	Very high	21 Å²	21	69.1 Å²	69.1	13%	0.129	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	179.2	-172.7	65.9	0	0	0	0	111.5	V58 G59 S60 P63 D75 D81 A82	V58-T77 PolarHBondContact O-N 2.77Å; G59-T77 WeakPolarHBondContact CA-O 3.36Å; S60-T77 PolarHBondContact N-O 3.17Å; P63-T77 WeakPolarHBondContact CG-O 3.48Å; D75-T77 HydrophobicContact CB-CG2 4.4Å; T77-D81 HydrophobicContact CG2-CB 4.42Å; T77-A82 PolarHBondContact OG1-N 3.34Å
78	H	96.1	Very high	93.2	Very high	102 Å²	102	67.6 Å²	67.6	47%	0.472	35%	0.347	S	S	.	.			trans	-65.3	159.3	166.8	-72.6	-75.7	0	0	0	110.5	P63 E80 D81 A82	P63-H78 VanDerWaalsContact CD-CE1 3.46Å; P63-H78 WeakPolarHBondContact CD-CE1 3.41Å; P63-H78 HydrophobicContact CG-CB 4.46Å; H78-E80 VanDerWaalsContact C-N 3.27Å; H78-E80 PolarHBondContact O-N 3.06Å; H78-D81 PolarHBondContact O-N 3.39Å; H78-A82 PolarHBondContact O-N 3.4Å; H78-A82 VanDerWaalsContact O-N 3.17Å
79	H	95.4	Very high	93.5	Very high	32 Å²	32	60.6 Å²	60.6	15%	0.148	32%	0.315	C	S	.	.	H	α-helix	trans	-56.7	-41.4	-177.8	-60.4	151.6	0	0	0	112.3	G59 A82 V83 L104	G59-H79 PolarHBondContact O-CD2 2.95Å; H79-A82 PolarHBondContact O-N 3.38Å; H79-V83 WeakPolarHBondContact O-CB 3.38Å; H79-V83 VanDerWaalsContact O-CG2 3.22Å; H79-V83 WeakPolarHBondContact O-CG2 3.47Å; H79-V83 PolarHBondContact O-N 2.99Å; H79-L104 HydrophobicContact CB-CD1 3.45Å; H79-L104 VanDerWaalsContact CB-CD1 3.45Å
80	E	94.6	Very high	93.9	Very high	120 Å²	120	54.9 Å²	54.9	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-56.1	-53	179.7	-67.3	164.9	-165.3	0	0	111.8	H78 A82 V83 A84 L104 L107	H78-E80 VanDerWaalsContact C-N 3.27Å; H78-E80 PolarHBondContact O-N 3.06Å; E80-A82 VanDerWaalsContact C-N 3.34Å; E80-A82 PolarHBondContact O-N 3.02Å; E80-V83 PolarHBondContact O-N 3.15Å; E80-A84 WeakPolarHBondContact O-CB 3.46Å; E80-A84 PolarHBondContact O-N 3.01Å; E80-L104 HydrophobicContact CB-CD2 4.32Å; E80-L104 HydrophobicContact CG-CD2 3.31Å; E80-L107 HydrophobicContact CB-CD1 4.19Å; E80-L107 HydrophobicContact CG-CD1 4.36Å
81	D	94	Very high	94.2	Very high	78 Å²	78	54.5 Å²	54.5	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-38.8	180	-61.7	-43.5	0	0	0	112.6	T77 H78 K85	T77-D81 HydrophobicContact CG2-CB 4.42Å; H78-D81 PolarHBondContact O-N 3.39Å; D81-K85 WeakPolarHBondContact O-CG 3.17Å; D81-K85 PolarHBondContact O-N 2.86Å
82	A	94.3	Very high	94.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-42.8	-178.8	0	0	0	0	0	111.5	V57 T77 H78 H79 E80 T86	V57-A82 HydrophobicContact CG1-CB 3.83Å; T77-A82 PolarHBondContact OG1-N 3.34Å; H78-A82 PolarHBondContact O-N 3.4Å; H78-A82 VanDerWaalsContact O-N 3.17Å; H79-A82 PolarHBondContact O-N 3.38Å; E80-A82 VanDerWaalsContact C-N 3.34Å; E80-A82 PolarHBondContact O-N 3.02Å; A82-T86 WeakPolarHBondContact O-CG2 3.34Å; A82-T86 PolarHBondContact O-OG1 2.79Å
83	V	94.4	Very high	95	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-70.1	-37.4	179.1	173.4	0	0	0	0	111.1	I36 H79 E80 K85 T86 I89 L107 L108 K111	I36-V83 HydrophobicContact CD1-CG2 3.84Å; I36-V83 HydrophobicContact CG1-CG2 4.32Å; H79-V83 WeakPolarHBondContact O-CB 3.38Å; H79-V83 VanDerWaalsContact O-CG2 3.22Å; H79-V83 WeakPolarHBondContact O-CG2 3.47Å; H79-V83 PolarHBondContact O-N 2.99Å; E80-V83 PolarHBondContact O-N 3.15Å; V83-K85 VanDerWaalsContact C-N 3.28Å; V83-K85 PolarHBondContact O-N 2.94Å; V83-T86 PolarHBondContact O-N 3.23Å; V83-T86 VanDerWaalsContact O-O 3.14Å; V83-I89 HydrophobicContact CB-CD1 4.25Å; V83-I89 HydrophobicContact CG1-CD1 3.82Å; V83-I89 HydrophobicContact CG2-CD1 4.11Å; V83-L107 HydrophobicContact CG1-CB 3.73Å; V83-L108 HydrophobicContact CB-CD2 4.33Å; V83-L108 HydrophobicContact CG1-CD2 3.42Å; V83-L108 VanDerWaalsContact CG1-CD2 3.42Å; V83-L108 HydrophobicContact CG1-CG 3.93Å; V83-L108 HydrophobicContact CG2-CD2 3.88Å; V83-K111 HydrophobicContact CG1-CD 4.03Å; V83-K111 WeakPolarHBondContact O-CE 3.4Å; V83-K111 PolarHBondContact O-NZ 3.07Å; V83-K111 VanDerWaalsContact O-NZ 3.12Å
84	A	93.7	Very high	95.4	Very high	63 Å²	63	46 Å²	46	52%	0.521	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-36.1	178.5	0	0	0	0	0	112.6	E80	E80-A84 WeakPolarHBondContact O-CB 3.46Å; E80-A84 PolarHBondContact O-N 3.01Å
85	K	91.8	Very high	95.6	Very high	116 Å²	116	46.2 Å²	46.2	50%	0.504	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.9	-175.3	-67.7	173.8	-177.7	179.6	0	115.1	D81 V83	D81-K85 WeakPolarHBondContact O-CG 3.17Å; D81-K85 PolarHBondContact O-N 2.86Å; V83-K85 VanDerWaalsContact C-N 3.28Å; V83-K85 PolarHBondContact O-N 2.94Å
86	T	94.5	Very high	95.9	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.012	24%	0.239	C	C	.	.			trans	-136.9	148.1	-166.3	61.3	0	0	0	0	112.7	T32 V57 A82 V83 I89 K111	T32-T86 HydrophobicContact CG2-CG2 3.7Å; V57-T86 HydrophobicContact CB-CG2 4.24Å; V57-T86 HydrophobicContact CG2-CG2 4.36Å; A82-T86 WeakPolarHBondContact O-CG2 3.34Å; A82-T86 PolarHBondContact O-OG1 2.79Å; V83-T86 PolarHBondContact O-N 3.23Å; V83-T86 VanDerWaalsContact O-O 3.14Å; T86-I89 WeakPolarHBondContact OG1-CG1 3.39Å; T86-K111 WeakPolarHBondContact O-CD 3.47Å; T86-K111 WeakPolarHBondContact O-CE 3.4Å; T86-K111 PolarHBondContact O-NZ 2.84Å
87	N	95	Very high	95.9	Very high	113 Å²	113	49.7 Å²	49.7	60%	0.604	25%	0.252	S	S	*	.	S	Bend	trans	-108.2	-21.8	179.6	-70.4	-26	0	0	0	113.5	K111 I112	N87-K111 PolarHBondContact OD1-NZ 3.34Å; N87-I112 PolarHBondContact O-N 3.18Å
88	I	97.6	Very high	96	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.1	173.2	-57.6	174.7	0	0	0	107	I33 G34 I112 V114 L181	I33-I88 HydrophobicContact CD1-CB 3.9Å; I33-I88 HydrophobicContact CD1-CD1 4.17Å; I33-I88 HydrophobicContact CD1-CG2 4.23Å; G34-I88 PolarHBondContact N-O 2.64Å; I88-I112 HydrophobicContact CG1-CB 4.33Å; I88-I112 HydrophobicContact CG1-CD1 4.16Å; I88-I112 HydrophobicContact CG2-CG2 4.49Å; I88-V114 HydrophobicContact CG2-CG2 4.09Å; I88-L181 HydrophobicContact CG2-CD2 4.45Å
89	I	98.4	Very high	96	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.9	-172.8	-61.2	158.8	0	0	0	109.2	G34 I36 V83 T86 L108 K111 I112 L113 V114	G34-I89 CarbonylContact O-C 3.6Å; G34-I89 VanDerWaalsContact O-CA 3.31Å; G34-I89 WeakPolarHBondContact O-CA 3.41Å; I36-I89 HydrophobicContact CD1-CG2 3.73Å; I36-I89 HydrophobicContact CG1-CG2 3.73Å; V83-I89 HydrophobicContact CB-CD1 4.25Å; V83-I89 HydrophobicContact CG1-CD1 3.82Å; V83-I89 HydrophobicContact CG2-CD1 4.11Å; T86-I89 WeakPolarHBondContact OG1-CG1 3.39Å; I89-L108 HydrophobicContact CD1-CD2 3.71Å; I89-K111 HydrophobicContact CD1-CB 4.28Å; I89-K111 HydrophobicContact CD1-CD 3.65Å; I89-I112 PolarHBondContact N-O 2.85Å; I89-L113 HydrophobicContact CB-CD2 3.96Å; I89-L113 HydrophobicContact CD1-CD2 4.06Å; I89-L113 HydrophobicContact CG2-CD2 4.45Å; I89-L113 CarbonylContact O-C 3.44Å; I89-L113 WeakPolarHBondContact O-CA 3Å; I89-V114 PolarHBondContact O-N 3.27Å
90	F	98.5	Very high	96	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.9	169.7	-72	-94.1	0	0	0	110.4	I33 G34 I35 I36 L45 A92 V114 V116 F146 L181	I33-F90 HydrophobicContact CG2-CD2 3.6Å; I33-F90 HydrophobicContact CG2-CE2 3.61Å; G34-F90 PolarHBondContact O-N 3.3Å; I35-F90 WeakPolarHBondContact CA-O 3.12Å; I35-F90 HydrophobicContact CG1-CB 4.25Å; I36-F90 PolarHBondContact N-O 2.61Å; L45-F90 HydrophobicContact CD2-CB 3.76Å; L45-F90 HydrophobicContact CD2-CD1 3.54Å; L45-F90 HydrophobicContact CD2-CD2 3.89Å; L45-F90 HydrophobicContact CD2-CE1 4Å; L45-F90 HydrophobicContact CD2-CE2 4.33Å; L45-F90 HydrophobicContact CD2-CG 3.45Å; L45-F90 VanDerWaalsContact CD2-CG 3.45Å; L45-F90 HydrophobicContact CD2-CZ 4.38Å; F90-A92 PolarHBondContact O-N 3.12Å; F90-V114 HydrophobicContact CD1-CB 3.66Å; F90-V114 HydrophobicContact CD1-CG1 3.69Å; F90-V114 HydrophobicContact CD1-CG2 4.32Å; F90-V114 HydrophobicContact CE1-CB 3.92Å; F90-V114 HydrophobicContact CE1-CG1 3.61Å; F90-V114 HydrophobicContact CE1-CG2 4.25Å; F90-V114 HydrophobicContact CG-CB 4.17Å; F90-V114 HydrophobicContact CZ-CG1 4.49Å; F90-V114 HydrophobicContact CZ-CG2 4.45Å; F90-V116 HydrophobicContact CD1-CG1 3.67Å; F90-V116 HydrophobicContact CE1-CG1 4.31Å; F90-F146 AromaticContact CE1-CD2 3.66Å; F90-F146 HydrophobicContact CE1-CD2 3.66Å; F90-F146 AromaticContact CE1-CE2 3.8Å; F90-F146 HydrophobicContact CE1-CE2 3.8Å; F90-F146 HydrophobicContact CE1-CG 4.23Å; F90-F146 HydrophobicContact CE1-CZ 4.47Å; F90-F146 HydrophobicContact CZ-CD2 4.34Å; F90-F146 HydrophobicContact CZ-CE2 4.02Å; F90-F146 HydrophobicContact CZ-CZ 4.42Å; F90-L181 HydrophobicContact CE2-CD2 3.71Å; F90-L181 HydrophobicContact CZ-CD2 3.6Å
91	V	98.4	Very high	96	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	83.6	177.6	-175.7	0	0	0	0	108.4	I93 Y98 L101 L113 V114 V116 L133	V91-I93 VanDerWaalsContact C-N 3.27Å; V91-I93 HydrophobicContact CG1-CD1 4.26Å; V91-I93 HydrophobicContact CG1-CG1 3.72Å; V91-I93 PolarHBondContact O-N 3.44Å; V91-Y98 HydrophobicContact CG1-CD1 4.28Å; V91-Y98 HydrophobicContact CG1-CE1 3.85Å; V91-L101 HydrophobicContact CG1-CD1 4.17Å; V91-L113 HydrophobicContact CG2-CB 4.18Å; V91-V114 PolarHBondContact N-O 3.5Å; V91-V116 WeakPolarHBondContact O-CG2 3.31Å; V91-L133 HydrophobicContact CG2-CD2 4.21Å
92	A	97.9	Very high	96	Very high	19 Å²	19	44.5 Å²	44.5	16%	0.157	24%	0.235	C	C	.	.			trans	-92.6	46.8	-176.2	0	0	0	0	0	112.3	I35 I36 F41 A42 F90 V116	I35-A92 HydrophobicContact CG2-CB 4.01Å; I36-A92 CarbonylContact O-C 3.59Å; I36-A92 WeakPolarHBondContact O-CA 3.35Å; I36-A92 WeakPolarHBondContact O-CB 3.4Å; I36-A92 PolarHBondContact O-N 3.32Å; F41-A92 HydrophobicContact CD1-CB 4.31Å; A42-A92 HydrophobicContact CB-CB 3.91Å; F90-A92 PolarHBondContact O-N 3.12Å; A92-V116 HydrophobicContact CB-CG2 4.24Å
93	I	96.9	Very high	95.9	Very high	32 Å²	32	50.7 Å²	50.7	16%	0.164	27%	0.268	C	S	.	.	S	Bend	trans	-125.7	160.6	174.4	60.4	173.8	0	0	0	109.8	I36 V91 H97 Y98 L101	I36-I93 HydrophobicContact CG2-CD1 4.49Å; I36-I93 HydrophobicContact CG2-CG2 4.35Å; V91-I93 VanDerWaalsContact C-N 3.27Å; V91-I93 HydrophobicContact CG1-CD1 4.26Å; V91-I93 HydrophobicContact CG1-CG1 3.72Å; V91-I93 PolarHBondContact O-N 3.44Å; I93-H97 HydrophobicContact CD1-CB 4.05Å; I93-Y98 HydrophobicContact CD1-CD1 4.11Å; I93-Y98 HydrophobicContact CG1-CD1 3.97Å; I93-Y98 HydrophobicContact CG1-CE1 3.99Å; I93-L101 HydrophobicContact CD1-CD1 3.72Å; I93-L101 HydrophobicContact CD1-CD2 4.34Å; I93-L101 HydrophobicContact CD1-CG 3.97Å
94	H	96.6	Very high	96	Very high	122 Å²	122	51 Å²	51	57%	0.565	27%	0.27	S	S	*	.			trans	-73.8	153.4	175.8	-67.6	-82.2	0	0	0	111.9	E96 H97	H94-E96 VanDerWaalsContact CB-OE2 3.25Å; H94-E96 WeakPolarHBondContact CB-OE2 3.46Å; H94-E96 PolarHBondContact O-N 2.93Å; H94-E96 VanDerWaalsContact O-N 3.13Å; H94-H97 PolarHBondContact O-N 3.36Å
95	R	96.9	Very high	96	Very high	18 Å²	18	50.9 Å²	50.9	7%	0.068	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-50.9	-39.7	-176.2	-172.5	-156	173	98.2	-2.9	112.6	H97 Y98 D127 S128 N129 Y132	R95-H97 PolarHBondContact O-N 2.87Å; R95-Y98 HydrophobicContact CG-CD2 4.24Å; R95-Y98 HydrophobicContact CG-CE2 4.27Å; R95-Y98 WeakPolarHBondContact O-CB 3.46Å; R95-Y98 PolarHBondContact O-N 2.86Å; R95-D127 PolarHBondContact NH1-O 3.46Å; R95-D127 VanDerWaalsContact NH1-O 3.15Å; R95-S128 VanDerWaalsContact NH1-C 3.28Å; R95-S128 PolarHBondContact NH1-O 3.28Å; R95-N129 VanDerWaalsContact CD-OD1 3.27Å; R95-N129 WeakPolarHBondContact CD-OD1 3.49Å; R95-N129 HydrophobicContact CG-CB 4.42Å; R95-N129 VanDerWaalsContact NH1-CA 3.29Å; R95-N129 PolarHBondContact NH1-OD1 3.14Å; R95-Y132 HydrophobicContact CG-CD1 3.83Å; R95-Y132 HydrophobicContact CG-CE1 4.2Å; R95-Y132 VanDerWaalsContact CZ-CB 3.48Å
96	E	96.3	Very high	96.2	Very high	105 Å²	105	51.9 Å²	51.9	49%	0.491	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-59	-21.4	-178.7	-60.7	73.4	-157.8	0	0	112.5	H94 Y125	H94-E96 VanDerWaalsContact CB-OE2 3.25Å; H94-E96 WeakPolarHBondContact CB-OE2 3.46Å; H94-E96 PolarHBondContact O-N 2.93Å; H94-E96 VanDerWaalsContact O-N 3.13Å; E96-Y125 PolarHBondContact OE1-OH 3.49Å
97	H	97.1	Very high	96.3	Very high	86 Å²	86	54.1 Å²	54.1	40%	0.398	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-101.9	2.5	-178.6	-56.1	96	0	0	0	113.3	I93 H94 R95 A99 S100	I93-H97 HydrophobicContact CD1-CB 4.05Å; H94-H97 PolarHBondContact O-N 3.36Å; R95-H97 PolarHBondContact O-N 2.87Å; H97-A99 VanDerWaalsContact C-N 3.3Å; H97-A99 PolarHBondContact O-N 2.92Å; H97-S100 WeakPolarHBondContact O-CB 3.38Å; H97-S100 PolarHBondContact O-N 2.92Å; H97-S100 PolarHBondContact O-OG 2.87Å
98	Y	97.4	Very high	96.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-61.2	-39.2	-178.8	-72.7	1.9	0	0	0	112.5	V91 I93 R95 S100 L101 D115 S117 N129 Y132 L133	V91-Y98 HydrophobicContact CG1-CD1 4.28Å; V91-Y98 HydrophobicContact CG1-CE1 3.85Å; I93-Y98 HydrophobicContact CD1-CD1 4.11Å; I93-Y98 HydrophobicContact CG1-CD1 3.97Å; I93-Y98 HydrophobicContact CG1-CE1 3.99Å; R95-Y98 HydrophobicContact CG-CD2 4.24Å; R95-Y98 HydrophobicContact CG-CE2 4.27Å; R95-Y98 WeakPolarHBondContact O-CB 3.46Å; R95-Y98 PolarHBondContact O-N 2.86Å; Y98-S100 PolarHBondContact O-N 2.84Å; Y98-L101 WeakPolarHBondContact O-CB 3.36Å; Y98-L101 PolarHBondContact O-N 2.83Å; Y98-D115 WeakPolarHBondContact CE2-OD2 3.28Å; Y98-D115 VanDerWaalsContact CZ-OD2 3.3Å; Y98-D115 VanDerWaalsContact OH-CG 3.32Å; Y98-D115 PolarHBondContact OH-OD2 2.77Å; Y98-S117 WeakPolarHBondContact OH-CB 3.48Å; Y98-S117 PolarHBondContact OH-OG 2.85Å; Y98-S117 VanDerWaalsContact OH-OG 3.06Å; Y98-N129 HydrophobicContact CE2-CB 4.28Å; Y98-Y132 AromaticContact CD2-CD1 3.89Å; Y98-Y132 HydrophobicContact CD2-CD1 3.89Å; Y98-Y132 HydrophobicContact CD2-CE1 4.25Å; Y98-L133 HydrophobicContact CD2-CB 3.98Å; Y98-L133 HydrophobicContact CD2-CD1 3.71Å; Y98-L133 HydrophobicContact CD2-CG 4.39Å; Y98-L133 HydrophobicContact CE2-CB 3.84Å; Y98-L133 HydrophobicContact CE2-CD1 4.01Å; Y98-L133 HydrophobicContact CE2-CG 4.34Å; Y98-L133 HydrophobicContact CG-CD1 3.99Å
99	A	96	Very high	96.3	Very high	54 Å²	54	50.7 Å²	50.7	45%	0.446	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-61.6	-24	177.1	0	0	0	0	0	113	H97 L101 W102	H97-A99 VanDerWaalsContact C-N 3.3Å; H97-A99 PolarHBondContact O-N 2.92Å; A99-L101 PolarHBondContact O-N 3.26Å; A99-W102 WeakPolarHBondContact O-CB 3.42Å; A99-W102 PolarHBondContact O-N 3.28Å
100	S	95.1	Very high	96.2	Very high	66 Å²	66	53.3 Å²	53.3	46%	0.462	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-68	-12.6	175.8	74.4	0	0	0	0	113.7	H97 Y98	H97-S100 WeakPolarHBondContact O-CB 3.38Å; H97-S100 PolarHBondContact O-N 2.92Å; H97-S100 PolarHBondContact O-OG 2.87Å; Y98-S100 PolarHBondContact O-N 2.84Å
101	L	95.1	Very high	96.2	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-91.2	-0.6	174.8	-55.3	-179	0	0	0	112.5	I36 V91 I93 Y98 A99 D103 L104 F137	I36-L101 HydrophobicContact CD1-CD1 4.02Å; I36-L101 HydrophobicContact CD1-CD2 4.32Å; I36-L101 HydrophobicContact CG2-CD1 4.1Å; I36-L101 HydrophobicContact CG2-CD2 3.76Å; V91-L101 HydrophobicContact CG1-CD1 4.17Å; I93-L101 HydrophobicContact CD1-CD1 3.72Å; I93-L101 HydrophobicContact CD1-CD2 4.34Å; I93-L101 HydrophobicContact CD1-CG 3.97Å; Y98-L101 WeakPolarHBondContact O-CB 3.36Å; Y98-L101 PolarHBondContact O-N 2.83Å; A99-L101 PolarHBondContact O-N 3.26Å; L101-D103 VanDerWaalsContact C-N 3.28Å; L101-D103 PolarHBondContact O-N 2.9Å; L101-L104 HydrophobicContact CD2-CD1 4.1Å; L101-L104 WeakPolarHBondContact O-CB 3.3Å; L101-L104 PolarHBondContact O-N 2.69Å; L101-F137 HydrophobicContact CB-CE2 4.35Å; L101-F137 HydrophobicContact CB-CZ 3.69Å; L101-F137 WeakPolarHBondContact O-CE1 3.36Å
102	W	93.6	Very high	96.2	Very high	123 Å²	123	55 Å²	55	47%	0.466	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-58.2	-38.8	-174.8	-174.8	-92.9	0	0	0	112.9	A99 L104 K105 L136	A99-W102 WeakPolarHBondContact O-CB 3.42Å; A99-W102 PolarHBondContact O-N 3.28Å; W102-L104 PolarHBondContact O-N 2.85Å; W102-L104 VanDerWaalsContact O-N 3.13Å; W102-K105 HydrophobicContact CZ2-CD 4.45Å; W102-K105 WeakPolarHBondContact O-CB 3.21Å; W102-K105 PolarHBondContact O-N 2.7Å; W102-L136 HydrophobicContact CE3-CB 4.38Å; W102-L136 HydrophobicContact CE3-CD2 4.06Å; W102-L136 HydrophobicContact CZ3-CB 4.24Å; W102-L136 HydrophobicContact CZ3-CD2 3.9Å; W102-L136 WeakPolarHBondContact CZ3-O 3.12Å
103	D	93.9	Very high	96.2	Very high	130 Å²	130	54.1 Å²	54.1	70%	0.695	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-62	-24.2	178.7	-60	-32	0	0	0	112.3	L101 K105 H106	L101-D103 VanDerWaalsContact C-N 3.28Å; L101-D103 PolarHBondContact O-N 2.9Å; D103-K105 VanDerWaalsContact C-N 3.34Å; D103-H106 PolarHBondContact O-CE1 2.77Å; D103-H106 VanDerWaalsContact O-CE1 3.32Å; D103-H106 PolarHBondContact O-ND1 2.75Å
104	L	94.7	Very high	96.3	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.042	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-88.5	1.5	178.4	-49.5	176.6	0	0	0	113.3	H79 E80 L101 W102 H106 L107 L108	H79-L104 HydrophobicContact CB-CD1 3.45Å; H79-L104 VanDerWaalsContact CB-CD1 3.45Å; E80-L104 HydrophobicContact CB-CD2 4.32Å; E80-L104 HydrophobicContact CG-CD2 3.31Å; L101-L104 HydrophobicContact CD2-CD1 4.1Å; L101-L104 WeakPolarHBondContact O-CB 3.3Å; L101-L104 PolarHBondContact O-N 2.69Å; W102-L104 PolarHBondContact O-N 2.85Å; W102-L104 VanDerWaalsContact O-N 3.13Å; L104-H106 PolarHBondContact O-N 3.46Å; L104-H106 VanDerWaalsContact O-N 3.12Å; L104-L107 HydrophobicContact CD2-CD1 4.35Å; L104-L107 WeakPolarHBondContact O-CA 3.3Å; L104-L107 WeakPolarHBondContact O-CB 3.33Å; L104-L107 PolarHBondContact O-N 3.09Å; L104-L108 HydrophobicContact CB-CD1 3.98Å; L104-L108 HydrophobicContact CB-CG 4.33Å; L104-L108 WeakPolarHBondContact O-CG 3.1Å; L104-L108 PolarHBondContact O-N 2.81Å
105	K	94.7	Very high	96.4	Very high	60 Å²	60	46.8 Å²	46.8	26%	0.261	26%	0.257	S	S	.	.	H	α-helix	trans	-50.9	-41.6	-175.4	177.5	174.5	178.3	174.8	0	112.7	W102 D103 L107 L108 A109 F137	W102-K105 HydrophobicContact CZ2-CD 4.45Å; W102-K105 WeakPolarHBondContact O-CB 3.21Å; W102-K105 PolarHBondContact O-N 2.7Å; D103-K105 VanDerWaalsContact C-N 3.34Å; K105-L107 VanDerWaalsContact C-N 3.32Å; K105-L107 PolarHBondContact O-N 3.46Å; K105-L108 PolarHBondContact O-N 2.8Å; K105-A109 PolarHBondContact O-N 2.91Å; K105-F137 HydrophobicContact CB-CD1 4.08Å; K105-F137 HydrophobicContact CB-CE1 3.99Å; K105-F137 HydrophobicContact CG-CD1 4.1Å; K105-F137 HydrophobicContact CG-CE1 4.49Å
106	H	95.3	Very high	96.5	Very high	138 Å²	138	46.4 Å²	46.4	64%	0.639	26%	0.256	S	S	*	.	H	α-helix	trans	-63.8	-34.8	178.5	69.4	-78.6	0	0	0	113	D103 L104	D103-H106 PolarHBondContact O-CE1 2.77Å; D103-H106 VanDerWaalsContact O-CE1 3.32Å; D103-H106 PolarHBondContact O-ND1 2.75Å; L104-H106 PolarHBondContact O-N 3.46Å; L104-H106 VanDerWaalsContact O-N 3.12Å
107	L	96.3	Very high	96.5	Very high	49 Å²	49	41.8 Å²	41.8	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-78.3	-26.8	175.8	-59.5	177.6	0	0	0	112.2	E80 V83 L104 K105 K111	E80-L107 HydrophobicContact CB-CD1 4.19Å; E80-L107 HydrophobicContact CG-CD1 4.36Å; V83-L107 HydrophobicContact CG1-CB 3.73Å; L104-L107 HydrophobicContact CD2-CD1 4.35Å; L104-L107 WeakPolarHBondContact O-CA 3.3Å; L104-L107 WeakPolarHBondContact O-CB 3.33Å; L104-L107 PolarHBondContact O-N 3.09Å; K105-L107 VanDerWaalsContact C-N 3.32Å; K105-L107 PolarHBondContact O-N 3.46Å; L107-K111 VanDerWaalsContact O-CD 3.28Å; L107-K111 WeakPolarHBondContact O-CD 3.47Å; L107-K111 WeakPolarHBondContact O-CE 3.42Å
108	L	96.6	Very high	96.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-84.5	-10.8	-177.9	-65.8	166.2	0	0	0	113.3	V83 I89 L104 K105 G110 K111 L113 F137 S140	V83-L108 HydrophobicContact CB-CD2 4.33Å; V83-L108 HydrophobicContact CG1-CD2 3.42Å; V83-L108 VanDerWaalsContact CG1-CD2 3.42Å; V83-L108 HydrophobicContact CG1-CG 3.93Å; V83-L108 HydrophobicContact CG2-CD2 3.88Å; I89-L108 HydrophobicContact CD1-CD2 3.71Å; L104-L108 HydrophobicContact CB-CD1 3.98Å; L104-L108 HydrophobicContact CB-CG 4.33Å; L104-L108 WeakPolarHBondContact O-CG 3.1Å; L104-L108 PolarHBondContact O-N 2.81Å; K105-L108 PolarHBondContact O-N 2.8Å; L108-G110 PolarHBondContact O-N 2.86Å; L108-K111 WeakPolarHBondContact O-CB 3.25Å; L108-K111 PolarHBondContact O-N 2.93Å; L108-K111 VanDerWaalsContact O-N 3.12Å; L108-L113 HydrophobicContact CD2-CD1 4.49Å; L108-L113 HydrophobicContact CD2-CD2 3.64Å; L108-F137 HydrophobicContact CB-CD1 4.46Å; L108-F137 HydrophobicContact CD1-CD1 3.88Å; L108-F137 HydrophobicContact CD1-CE1 3.62Å; L108-F137 HydrophobicContact CD1-CZ 4.14Å; L108-S140 PolarHBondContact O-OG 2.84Å
109	A	97	Very high	96.2	Very high	49 Å²	49	41.1 Å²	41.1	41%	0.405	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	131.7	178.8	0	0	0	0	0	111.6	K105 K111 D139	K105-A109 PolarHBondContact O-N 2.91Å; A109-K111 PolarHBondContact O-N 3.27Å; A109-D139 HydrophobicContact CB-CB 4.14Å
110	G	96.6	Very high	96	Very high	56 Å²	56	42.9 Å²	42.9	58%	0.577	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	-4.9	-178.2	0	0	0	0	0	115.8	L108 D139	L108-G110 PolarHBondContact O-N 2.86Å; G110-D139 PolarHBondContact N-O 3.47Å
111	K	97.8	Very high	95.7	Very high	27 Å²	27	47.9 Å²	47.9	12%	0.117	26%	0.259	C	S	.	.			trans	-86.8	156.2	-179.3	-60.2	-175.8	-174.9	-81.4	0	112	V83 T86 N87 I89 L107 L108 A109 L141	V83-K111 HydrophobicContact CG1-CD 4.03Å; V83-K111 WeakPolarHBondContact O-CE 3.4Å; V83-K111 PolarHBondContact O-NZ 3.07Å; V83-K111 VanDerWaalsContact O-NZ 3.12Å; T86-K111 WeakPolarHBondContact O-CD 3.47Å; T86-K111 WeakPolarHBondContact O-CE 3.4Å; T86-K111 PolarHBondContact O-NZ 2.84Å; N87-K111 PolarHBondContact OD1-NZ 3.34Å; I89-K111 HydrophobicContact CD1-CB 4.28Å; I89-K111 HydrophobicContact CD1-CD 3.65Å; L107-K111 VanDerWaalsContact O-CD 3.28Å; L107-K111 WeakPolarHBondContact O-CD 3.47Å; L107-K111 WeakPolarHBondContact O-CE 3.42Å; L108-K111 WeakPolarHBondContact O-CB 3.25Å; L108-K111 PolarHBondContact O-N 2.93Å; L108-K111 VanDerWaalsContact O-N 3.12Å; A109-K111 PolarHBondContact O-N 3.27Å; K111-L141 PolarHBondContact O-N 3.48Å
112	I	98.5	Very high	95.4	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.046	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118.6	175.5	-60.8	171.4	0	0	0	108.9	N87 I88 I89 V114 L141 V143 A174 Q177 V178	N87-I112 PolarHBondContact O-N 3.18Å; I88-I112 HydrophobicContact CG1-CB 4.33Å; I88-I112 HydrophobicContact CG1-CD1 4.16Å; I88-I112 HydrophobicContact CG2-CG2 4.49Å; I89-I112 PolarHBondContact N-O 2.85Å; I112-V114 HydrophobicContact CG2-CG2 4.23Å; I112-L141 CarbonylContact C-O 3.48Å; I112-L141 WeakPolarHBondContact CA-O 3.48Å; I112-L141 HydrophobicContact CG1-CB 4.12Å; I112-L141 HydrophobicContact CG1-CD1 4.16Å; I112-V143 HydrophobicContact CG2-CG2 3.83Å; I112-A174 HydrophobicContact CD1-CB 3.71Å; I112-A174 HydrophobicContact CG1-CB 3.72Å; I112-A174 HydrophobicContact CG2-CB 4.26Å; I112-Q177 HydrophobicContact CD1-CB 4.34Å; I112-V178 HydrophobicContact CG2-CG2 3.99Å
113	L	98.6	Very high	95	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.5	175.4	-50.6	-174.4	0	0	0	109.3	I89 V91 L108 L133 F137 L141 I142 V143	I89-L113 HydrophobicContact CB-CD2 3.96Å; I89-L113 HydrophobicContact CD1-CD2 4.06Å; I89-L113 HydrophobicContact CG2-CD2 4.45Å; I89-L113 CarbonylContact O-C 3.44Å; I89-L113 WeakPolarHBondContact O-CA 3Å; V91-L113 HydrophobicContact CG2-CB 4.18Å; L108-L113 HydrophobicContact CD2-CD1 4.49Å; L108-L113 HydrophobicContact CD2-CD2 3.64Å; L113-L133 HydrophobicContact CB-CD2 4.36Å; L113-F137 HydrophobicContact CD1-CB 4.24Å; L113-F137 HydrophobicContact CD1-CD2 4.33Å; L113-F137 HydrophobicContact CD1-CG 4.26Å; L113-L141 PolarHBondContact N-O 2.64Å; L113-I142 HydrophobicContact CB-CD1 3.73Å; L113-I142 HydrophobicContact CD1-CD1 3.81Å; L113-I142 HydrophobicContact CG-CD1 4.06Å; L113-I142 WeakPolarHBondContact O-CA 3.18Å; L113-V143 PolarHBondContact O-N 2.62Å
114	V	98.7	Very high	94.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	106.8	178.6	-170.2	0	0	0	0	109.2	I88 I89 F90 V91 I112 V116 V143 F146 V178	I88-V114 HydrophobicContact CG2-CG2 4.09Å; I89-V114 PolarHBondContact O-N 3.27Å; F90-V114 HydrophobicContact CD1-CB 3.66Å; F90-V114 HydrophobicContact CD1-CG1 3.69Å; F90-V114 HydrophobicContact CD1-CG2 4.32Å; F90-V114 HydrophobicContact CE1-CB 3.92Å; F90-V114 HydrophobicContact CE1-CG1 3.61Å; F90-V114 HydrophobicContact CE1-CG2 4.25Å; F90-V114 HydrophobicContact CG-CB 4.17Å; F90-V114 HydrophobicContact CZ-CG1 4.49Å; F90-V114 HydrophobicContact CZ-CG2 4.45Å; V91-V114 PolarHBondContact N-O 3.5Å; I112-V114 HydrophobicContact CG2-CG2 4.23Å; V114-V116 HydrophobicContact CG1-CG1 4.17Å; V114-V116 PolarHBondContact O-N 2.63Å; V114-V143 CarbonylContact C-O 3.28Å; V114-V143 VanDerWaalsContact CA-O 3.28Å; V114-V143 WeakPolarHBondContact CA-O 3.46Å; V114-F146 HydrophobicContact CG1-CD2 4.33Å; V114-V178 HydrophobicContact CG1-CG1 4.38Å; V114-V178 HydrophobicContact CG2-CG1 4.4Å; V114-V178 HydrophobicContact CG2-CG2 3.81Å
115	D	98.6	Very high	94.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114.8	173.6	-174.6	-66.7	0	0	0	110	Y98 S117 A130 L133 V143 K144 G145	Y98-D115 WeakPolarHBondContact CE2-OD2 3.28Å; Y98-D115 VanDerWaalsContact CZ-OD2 3.3Å; Y98-D115 VanDerWaalsContact OH-CG 3.32Å; Y98-D115 PolarHBondContact OH-OD2 2.77Å; D115-S117 PolarHBondContact OD1-N 3.15Å; D115-S117 VanDerWaalsContact OD1-N 3.09Å; D115-S117 PolarHBondContact OD1-OG 3.16Å; D115-S117 PolarHBondContact OD2-OG 2.86Å; D115-A130 HydrophobicContact CB-CB 4.08Å; D115-L133 HydrophobicContact CB-CD2 4.06Å; D115-V143 PolarHBondContact N-O 3.34Å; D115-K144 HydrophobicContact CB-CD 4.26Å; D115-K144 IonicContact OD1-NZ 2.69Å; D115-K144 PolarHBondContact OD1-NZ 3.24Å; D115-G145 PolarHBondContact O-N 3.2Å; D115-G145 VanDerWaalsContact O-N 3.1Å; D115-G145 VanDerWaalsContact O-O 3.1Å
116	V	97.9	Very high	94.8	Very high	10 Å²	10	51.4 Å²	51.4	6%	0.061	29%	0.292	C	S	.	.			trans	-109	8.6	-180	-57	0	0	0	0	113.2	F41 F90 V91 A92 V114 G145 F146	F41-V116 HydrophobicContact CD1-CG2 3.93Å; F41-V116 HydrophobicContact CE1-CB 3.75Å; F41-V116 HydrophobicContact CE1-CG1 4.02Å; F41-V116 HydrophobicContact CE1-CG2 3.63Å; F41-V116 HydrophobicContact CZ-CB 4.08Å; F41-V116 HydrophobicContact CZ-CG1 4.44Å; F41-V116 HydrophobicContact CZ-CG2 4.38Å; F90-V116 HydrophobicContact CD1-CG1 3.67Å; F90-V116 HydrophobicContact CE1-CG1 4.31Å; V91-V116 WeakPolarHBondContact O-CG2 3.31Å; A92-V116 HydrophobicContact CB-CG2 4.24Å; V114-V116 HydrophobicContact CG1-CG1 4.17Å; V114-V116 PolarHBondContact O-N 2.63Å; V116-G145 WeakPolarHBondContact CA-O 3.28Å; V116-G145 WeakPolarHBondContact CG1-O 3.39Å; V116-F146 HydrophobicContact CG1-CB 4.02Å
117	S	96.9	Very high	94.7	Very high	9 Å²	9	48.8 Å²	48.8	6%	0.063	28%	0.282	C	S	.	.			trans	-75	155.6	-169	69.8	0	0	0	0	113.1	Y98 D115 N129 K144	Y98-S117 WeakPolarHBondContact OH-CB 3.48Å; Y98-S117 PolarHBondContact OH-OG 2.85Å; Y98-S117 VanDerWaalsContact OH-OG 3.06Å; D115-S117 PolarHBondContact OD1-N 3.15Å; D115-S117 VanDerWaalsContact OD1-N 3.09Å; D115-S117 PolarHBondContact OD1-OG 3.16Å; D115-S117 PolarHBondContact OD2-OG 2.86Å; S117-N129 WeakPolarHBondContact OG-CB 3.39Å; S117-N129 PolarHBondContact OG-ND2 2.98Å; S117-K144 PolarHBondContact O-NZ 2.93Å
118	N	94.3	Very high	94.7	Very high	60 Å²	60	46.4 Å²	46.4	32%	0.321	27%	0.27	S	S	.	.			trans	-129	146.3	168	-71	-52.1	0	0	0	109.4	N147	N118-N147 PolarHBondContact ND2-O 3.43Å; N118-N147 WeakPolarHBondContact OD1-CB 3.38Å; N118-N147 PolarHBondContact OD1-ND2 3.29Å
119	N	93.8	Very high	94.8	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.064	27%	0.27	C	S	.	.			trans	-81.7	160.7	170.4	-68.1	-35.3	0	0	0	110.7	Q124 N129 L206	N119-Q124 HydrophobicContact CB-CB 4.31Å; N119-N129 PolarHBondContact ND2-OD1 3.3Å; N119-N129 PolarHBondContact OD1-ND2 3.1Å; N119-N129 PolarHBondContact OD1-OD1 3.31Å; N119-N129 VanDerWaalsContact OD1-OD1 3.08Å; N119-L206 WeakPolarHBondContact O-CD2 3.44Å
120	A	91.3	Very high	94.8	Very high	91 Å²	91	44.1 Å²	44.1	75%	0.752	25%	0.251	S	S	*	.	S	Bend	trans	-78.2	-27.6	176.5	0	0	0	0	0	112.1
121	R	90.7	Very high	94.9	Very high	171 Å²	171	44.3 Å²	44.3	65%	0.645	24%	0.237	S	C	*	.	S	Bend	trans	-140.7	153.9	179.5	64.2	-174.7	-177.6	-168.6	0.2	111.3	Q124	R121-Q124 HydrophobicContact CG-CB 3.71Å; R121-Q124 HydrophobicContact CG-CG 4.11Å; R121-Q124 PolarHBondContact O-N 3.1Å
122	V	88.4	Confident	94.9	Very high	64 Å²	64	46.1 Å²	46.1	39%	0.388	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	140.1	171.8	-179.9	0	0	0	0	108.4	Q124 L206	V122-Q124 PolarHBondContact O-N 3.41Å; V122-L206 HydrophobicContact CG2-CB 3.92Å; V122-L206 HydrophobicContact CG2-CD1 4.1Å
123	D	85.5	Confident	94.9	Very high	118 Å²	118	45.7 Å²	45.7	63%	0.631	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	33.8	178.8	-53.1	-31.7	0	0	0	114.3	Y125	D123-Y125 VanDerWaalsContact C-N 3.26Å; D123-Y125 PolarHBondContact O-N 2.85Å
124	Q	90.9	Very high	94.8	Very high	48 Å²	48	47 Å²	47	22%	0.224	25%	0.251	C	S	.	.	S	Bend	trans	-62.4	-33.6	174	-173.6	172	-20.8	0	0	112.9	N119 R121 V122	N119-Q124 HydrophobicContact CB-CB 4.31Å; R121-Q124 HydrophobicContact CG-CB 3.71Å; R121-Q124 HydrophobicContact CG-CG 4.11Å; R121-Q124 PolarHBondContact O-N 3.1Å; V122-Q124 PolarHBondContact O-N 3.41Å
125	Y	93.9	Very high	94.8	Very high	62 Å²	62	50.8 Å²	50.8	24%	0.243	28%	0.278	C	S	.	.	S	Bend	trans	-132	151.7	-176	-63.9	-66.9	0	0	0	110.8	E96 D123 D127 R199	E96-Y125 PolarHBondContact OE1-OH 3.49Å; D123-Y125 VanDerWaalsContact C-N 3.26Å; D123-Y125 PolarHBondContact O-N 2.85Å; Y125-D127 VanDerWaalsContact C-N 3.3Å; Y125-D127 PolarHBondContact O-N 2.92Å; Y125-R199 PolarHBondContact O-NH1 3.04Å
126	P	92.6	Very high	94.7	Very high	105 Å²	105	51.7 Å²	51.7	68%	0.682	28%	0.283	S	S	*	.	S	Bend	trans	-68.7	-26.1	-177.3	27.8	-35.8	0	0	0	113.5	R199	P126-R199 VanDerWaalsContact C-NH2 3.25Å; P126-R199 PolarHBondContact O-NH2 3.18Å
127	D	94.3	Very high	94.7	Very high	82 Å²	82	51.3 Å²	51.3	44%	0.439	28%	0.28	S	S	.	.	S	Bend	trans	-118.8	155	178.5	-48.9	-47	0	0	0	110	R95 Y125 R199	R95-D127 PolarHBondContact NH1-O 3.46Å; R95-D127 VanDerWaalsContact NH1-O 3.15Å; Y125-D127 VanDerWaalsContact C-N 3.3Å; Y125-D127 PolarHBondContact O-N 2.92Å; D127-R199 PolarHBondContact O-NH1 3.4Å
128	S	96.8	Very high	94.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.			trans	-65	163.5	172.6	65.5	0	0	0	0	111.1	R95 A130 E131 Y132 S198 R199 E202	R95-S128 VanDerWaalsContact NH1-C 3.28Å; R95-S128 PolarHBondContact NH1-O 3.28Å; S128-A130 VanDerWaalsContact C-N 3.33Å; S128-E131 VanDerWaalsContact CB-OE2 3.3Å; S128-E131 WeakPolarHBondContact CB-OE2 3.47Å; S128-E131 PolarHBondContact N-OE2 2.97Å; S128-E131 WeakPolarHBondContact OG-CB 3.28Å; S128-E131 WeakPolarHBondContact OG-CG 3.19Å; S128-E131 PolarHBondContact OG-N 2.87Å; S128-E131 PolarHBondContact OG-OE2 2.93Å; S128-Y132 WeakPolarHBondContact O-CB 3.37Å; S128-Y132 PolarHBondContact O-N 2.88Å; S128-S198 WeakPolarHBondContact CB-OG 3.43Å; S128-S198 PolarHBondContact OG-OG 3Å; S128-R199 VanDerWaalsContact N-CZ 3.27Å; S128-E202 WeakPolarHBondContact CA-OE2 3.39Å
129	N	97.9	Very high	94.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-67.5	-38.6	178	-59.3	-11.9	0	0	0	111.3	R95 Y98 S117 N119 Y132 L133 E202	R95-N129 VanDerWaalsContact CD-OD1 3.27Å; R95-N129 WeakPolarHBondContact CD-OD1 3.49Å; R95-N129 HydrophobicContact CG-CB 4.42Å; R95-N129 VanDerWaalsContact NH1-CA 3.29Å; R95-N129 PolarHBondContact NH1-OD1 3.14Å; Y98-N129 HydrophobicContact CE2-CB 4.28Å; S117-N129 WeakPolarHBondContact OG-CB 3.39Å; S117-N129 PolarHBondContact OG-ND2 2.98Å; N119-N129 PolarHBondContact ND2-OD1 3.3Å; N119-N129 PolarHBondContact OD1-ND2 3.1Å; N119-N129 PolarHBondContact OD1-OD1 3.31Å; N119-N129 VanDerWaalsContact OD1-OD1 3.08Å; N129-Y132 PolarHBondContact O-N 2.97Å; N129-L133 WeakPolarHBondContact O-CB 3Å; N129-L133 PolarHBondContact O-N 3.42Å; N129-E202 WeakPolarHBondContact CA-OE1 3.34Å; N129-E202 VanDerWaalsContact CB-OE1 3.28Å; N129-E202 WeakPolarHBondContact CB-OE1 3.4Å; N129-E202 VanDerWaalsContact N-CD 3.34Å; N129-E202 PolarHBondContact N-OE1 2.95Å; N129-E202 PolarHBondContact N-OE2 3.43Å
130	A	97.9	Very high	95	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.4	-39.5	176.8	0	0	0	0	0	112.9	D115 S128 L133 A134 I142 K144 L195 E202	D115-A130 HydrophobicContact CB-CB 4.08Å; S128-A130 VanDerWaalsContact C-N 3.33Å; A130-L133 PolarHBondContact O-N 3.23Å; A130-A134 WeakPolarHBondContact O-CB 3.47Å; A130-A134 PolarHBondContact O-N 3.29Å; A130-I142 HydrophobicContact CB-CG2 4.21Å; A130-K144 HydrophobicContact CB-CB 4.12Å; A130-K144 HydrophobicContact CB-CD 3.94Å; A130-L195 HydrophobicContact CB-CD1 3.99Å; A130-E202 PolarHBondContact N-OE1 3.02Å
131	E	97.8	Very high	95.3	Very high	61 Å²	61	54.9 Å²	54.9	29%	0.285	29%	0.291	S	S	.	.	H	α-helix	trans	-65.9	-40	174.3	-72.3	163.6	144.2	0	0	111.6	S128 A134 S135 L195	S128-E131 VanDerWaalsContact CB-OE2 3.3Å; S128-E131 WeakPolarHBondContact CB-OE2 3.47Å; S128-E131 PolarHBondContact N-OE2 2.97Å; S128-E131 WeakPolarHBondContact OG-CB 3.28Å; S128-E131 WeakPolarHBondContact OG-CG 3.19Å; S128-E131 PolarHBondContact OG-N 2.87Å; S128-E131 PolarHBondContact OG-OE2 2.93Å; E131-A134 WeakPolarHBondContact O-CB 3.46Å; E131-A134 PolarHBondContact O-N 2.96Å; E131-S135 PolarHBondContact O-N 2.91Å; E131-L195 HydrophobicContact CG-CD2 4.37Å; E131-L195 HydrophobicContact CG-CG 4.46Å
132	Y	98	Very high	95.7	Very high	65 Å²	65	47.1 Å²	47.1	26%	0.255	26%	0.263	S	S	.	.	H	α-helix	trans	-64.1	-43.1	174.6	177.2	-122.6	0	0	0	112.1	R95 Y98 S128 N129 A134 S135 L136	R95-Y132 HydrophobicContact CG-CD1 3.83Å; R95-Y132 HydrophobicContact CG-CE1 4.2Å; R95-Y132 VanDerWaalsContact CZ-CB 3.48Å; Y98-Y132 AromaticContact CD2-CD1 3.89Å; Y98-Y132 HydrophobicContact CD2-CD1 3.89Å; Y98-Y132 HydrophobicContact CD2-CE1 4.25Å; S128-Y132 WeakPolarHBondContact O-CB 3.37Å; S128-Y132 PolarHBondContact O-N 2.88Å; N129-Y132 PolarHBondContact O-N 2.97Å; Y132-A134 VanDerWaalsContact C-N 3.26Å; Y132-A134 PolarHBondContact O-N 2.86Å; Y132-S135 WeakPolarHBondContact O-CB 3.48Å; Y132-S135 PolarHBondContact O-N 2.8Å; Y132-S135 VanDerWaalsContact O-N 3.11Å; Y132-S135 PolarHBondContact O-OG 2.86Å; Y132-L136 HydrophobicContact CD1-CD1 4.34Å; Y132-L136 HydrophobicContact CE1-CD1 3.81Å; Y132-L136 HydrophobicContact CE2-CD1 4.23Å; Y132-L136 HydrophobicContact CE2-CD2 4.23Å; Y132-L136 HydrophobicContact CE2-CG 4.15Å; Y132-L136 PolarHBondContact O-N 3.37Å; Y132-L136 VanDerWaalsContact O-N 3.11Å
133	L	98.1	Very high	96.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-39.9	173.6	-171.4	66.3	0	0	0	111.3	V91 Y98 L113 D115 N129 A130 S135 L136 F137 I142	V91-L133 HydrophobicContact CG2-CD2 4.21Å; Y98-L133 HydrophobicContact CD2-CB 3.98Å; Y98-L133 HydrophobicContact CD2-CD1 3.71Å; Y98-L133 HydrophobicContact CD2-CG 4.39Å; Y98-L133 HydrophobicContact CE2-CB 3.84Å; Y98-L133 HydrophobicContact CE2-CD1 4.01Å; Y98-L133 HydrophobicContact CE2-CG 4.34Å; Y98-L133 HydrophobicContact CG-CD1 3.99Å; L113-L133 HydrophobicContact CB-CD2 4.36Å; D115-L133 HydrophobicContact CB-CD2 4.06Å; N129-L133 WeakPolarHBondContact O-CB 3Å; N129-L133 PolarHBondContact O-N 3.42Å; A130-L133 PolarHBondContact O-N 3.23Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 2.98Å; L133-L136 PolarHBondContact O-N 3.1Å; L133-F137 HydrophobicContact CD1-CD2 3.7Å; L133-F137 HydrophobicContact CD1-CE2 3.78Å; L133-F137 HydrophobicContact CG-CD2 4.32Å; L133-F137 WeakPolarHBondContact O-CD2 3.49Å; L133-F137 PolarHBondContact O-N 3.17Å; L133-I142 HydrophobicContact CD2-CD1 4.13Å; L133-I142 HydrophobicContact CD2-CG2 4.31Å; L133-I142 HydrophobicContact CG-CD1 4.02Å
134	A	97.5	Very high	96.8	Very high	27 Å²	27	38.5 Å²	38.5	22%	0.223	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-37.6	174.7	0	0	0	0	0	112.7	A130 E131 Y132 L136 F137 P138 I142 L195	A130-A134 WeakPolarHBondContact O-CB 3.47Å; A130-A134 PolarHBondContact O-N 3.29Å; E131-A134 WeakPolarHBondContact O-CB 3.46Å; E131-A134 PolarHBondContact O-N 2.96Å; Y132-A134 VanDerWaalsContact C-N 3.26Å; Y132-A134 PolarHBondContact O-N 2.86Å; A134-L136 VanDerWaalsContact C-N 3.28Å; A134-L136 PolarHBondContact O-N 3.26Å; A134-F137 CarbonylContact O-C 3.33Å; A134-F137 PolarHBondContact O-N 3.41Å; A134-P138 WeakPolarHBondContact O-CA 3.43Å; A134-I142 HydrophobicContact CB-CB 4.27Å; A134-I142 HydrophobicContact CB-CG1 3.64Å; A134-L195 HydrophobicContact CB-CD2 3.95Å
135	S	97.2	Very high	97.1	Very high	80 Å²	80	36.2 Å²	36.2	56%	0.559	20%	0.204	S	C	*	.	H	α-helix	trans	-65.2	-32	175.6	78.2	0	0	0	0	112.8	E131 Y132 L133	E131-S135 PolarHBondContact O-N 2.91Å; Y132-S135 WeakPolarHBondContact O-CB 3.48Å; Y132-S135 PolarHBondContact O-N 2.8Å; Y132-S135 VanDerWaalsContact O-N 3.11Å; Y132-S135 PolarHBondContact O-OG 2.86Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 2.98Å
136	L	97.2	Very high	97.2	Very high	20 Å²	20	33.2 Å²	33.2	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-77.2	-38.3	177.6	-66.6	175.5	0	0	0	112.1	W102 Y132 L133 A134 P138	W102-L136 HydrophobicContact CE3-CB 4.38Å; W102-L136 HydrophobicContact CE3-CD2 4.06Å; W102-L136 HydrophobicContact CZ3-CB 4.24Å; W102-L136 HydrophobicContact CZ3-CD2 3.9Å; W102-L136 WeakPolarHBondContact CZ3-O 3.12Å; Y132-L136 HydrophobicContact CD1-CD1 4.34Å; Y132-L136 HydrophobicContact CE1-CD1 3.81Å; Y132-L136 HydrophobicContact CE2-CD1 4.23Å; Y132-L136 HydrophobicContact CE2-CD2 4.23Å; Y132-L136 HydrophobicContact CE2-CG 4.15Å; Y132-L136 PolarHBondContact O-N 3.37Å; Y132-L136 VanDerWaalsContact O-N 3.11Å; L133-L136 PolarHBondContact O-N 3.1Å; A134-L136 VanDerWaalsContact C-N 3.28Å; A134-L136 PolarHBondContact O-N 3.26Å; L136-P138 VanDerWaalsContact C-CD 3.46Å; L136-P138 VanDerWaalsContact O-CD 3.3Å; L136-P138 WeakPolarHBondContact O-CD 3.49Å
137	F	97.3	Very high	97.3	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	16%	0.161	C	C	.	.			trans	-122.4	70.1	-175.7	-56.3	-78.9	0	0	0	111.3	L101 K105 L108 L113 L133 A134 D139 S140	L101-F137 HydrophobicContact CB-CE2 4.35Å; L101-F137 HydrophobicContact CB-CZ 3.69Å; L101-F137 WeakPolarHBondContact O-CE1 3.36Å; K105-F137 HydrophobicContact CB-CD1 4.08Å; K105-F137 HydrophobicContact CB-CE1 3.99Å; K105-F137 HydrophobicContact CG-CD1 4.1Å; K105-F137 HydrophobicContact CG-CE1 4.49Å; L108-F137 HydrophobicContact CB-CD1 4.46Å; L108-F137 HydrophobicContact CD1-CD1 3.88Å; L108-F137 HydrophobicContact CD1-CE1 3.62Å; L108-F137 HydrophobicContact CD1-CZ 4.14Å; L113-F137 HydrophobicContact CD1-CB 4.24Å; L113-F137 HydrophobicContact CD1-CD2 4.33Å; L113-F137 HydrophobicContact CD1-CG 4.26Å; L133-F137 HydrophobicContact CD1-CD2 3.7Å; L133-F137 HydrophobicContact CD1-CE2 3.78Å; L133-F137 HydrophobicContact CG-CD2 4.32Å; L133-F137 WeakPolarHBondContact O-CD2 3.49Å; L133-F137 PolarHBondContact O-N 3.17Å; A134-F137 CarbonylContact O-C 3.33Å; A134-F137 PolarHBondContact O-N 3.41Å; F137-D139 PolarHBondContact O-N 3.2Å; F137-S140 WeakPolarHBondContact O-CB 3.32Å; F137-S140 PolarHBondContact O-N 3.17Å; F137-S140 VanDerWaalsContact O-N 3.08Å
138	P	96.4	Very high	97.2	Very high	82 Å²	82	26.1 Å²	26.1	53%	0.532	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.7	-175.2	26	-35.8	0	0	0	113.5	A134 L136 S140	A134-P138 WeakPolarHBondContact O-CA 3.43Å; L136-P138 VanDerWaalsContact C-CD 3.46Å; L136-P138 VanDerWaalsContact O-CD 3.3Å; L136-P138 WeakPolarHBondContact O-CD 3.49Å; P138-S140 VanDerWaalsContact C-N 3.27Å
139	D	97.1	Very high	96.9	Very high	102 Å²	102	26.3 Å²	26.3	55%	0.545	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.4	179	-52.8	-57.6	0	0	0	112.7	A109 G110 F137	A109-D139 HydrophobicContact CB-CB 4.14Å; G110-D139 PolarHBondContact N-O 3.47Å; F137-D139 PolarHBondContact O-N 3.2Å
140	S	97.7	Very high	96.5	Very high	12 Å²	12	28.8 Å²	28.8	8%	0.084	17%	0.168	C	C	.	.	S	Bend	trans	-101.9	156.8	178.2	-59.2	0	0	0	0	111.9	L108 F137 P138	L108-S140 PolarHBondContact O-OG 2.84Å; F137-S140 WeakPolarHBondContact O-CB 3.32Å; F137-S140 PolarHBondContact O-N 3.17Å; F137-S140 VanDerWaalsContact O-N 3.08Å; P138-S140 VanDerWaalsContact C-N 3.27Å
141	L	98.2	Very high	96.2	Very high	51 Å²	51	30 Å²	30	27%	0.267	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	96.1	-179	-52.8	-179.1	0	0	0	110.1	K111 I112 L113 N171 A174	K111-L141 PolarHBondContact O-N 3.48Å; I112-L141 CarbonylContact C-O 3.48Å; I112-L141 WeakPolarHBondContact CA-O 3.48Å; I112-L141 HydrophobicContact CG1-CB 4.12Å; I112-L141 HydrophobicContact CG1-CD1 4.16Å; L113-L141 PolarHBondContact N-O 2.64Å; L141-N171 HydrophobicContact CB-CB 4.49Å; L141-N171 HydrophobicContact CD2-CB 4.13Å; L141-N171 WeakPolarHBondContact CD2-ND2 3.43Å; L141-A174 HydrophobicContact CB-CB 3.97Å; L141-A174 HydrophobicContact CD1-CB 4.17Å
142	I	98.4	Very high	95.7	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.046	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.9	-176.3	-50.5	-51.1	0	0	0	111.9	L113 A130 L133 A134 S169 L195	L113-I142 HydrophobicContact CB-CD1 3.73Å; L113-I142 HydrophobicContact CD1-CD1 3.81Å; L113-I142 HydrophobicContact CG-CD1 4.06Å; L113-I142 WeakPolarHBondContact O-CA 3.18Å; A130-I142 HydrophobicContact CB-CG2 4.21Å; L133-I142 HydrophobicContact CD2-CD1 4.13Å; L133-I142 HydrophobicContact CD2-CG2 4.31Å; L133-I142 HydrophobicContact CG-CD1 4.02Å; A134-I142 HydrophobicContact CB-CB 4.27Å; A134-I142 HydrophobicContact CB-CG1 3.64Å; I142-S169 VanDerWaalsContact O-CB 3.3Å; I142-S169 WeakPolarHBondContact O-CB 3.46Å; I142-S169 PolarHBondContact O-OG 2.88Å; I142-L195 HydrophobicContact CB-CD2 4.42Å; I142-L195 HydrophobicContact CG2-CD1 4.18Å; I142-L195 HydrophobicContact CG2-CD2 4.49Å
143	V	98.7	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.1	173.5	-177.3	0	0	0	0	109.1	I112 L113 V114 D115 I167 A174 V178	I112-V143 HydrophobicContact CG2-CG2 3.83Å; L113-V143 PolarHBondContact O-N 2.62Å; V114-V143 CarbonylContact C-O 3.28Å; V114-V143 VanDerWaalsContact CA-O 3.28Å; V114-V143 WeakPolarHBondContact CA-O 3.46Å; D115-V143 PolarHBondContact N-O 3.34Å; V143-I167 HydrophobicContact CG1-CG2 3.64Å; V143-A174 HydrophobicContact CG2-CB 3.94Å; V143-V178 HydrophobicContact CB-CG2 4.14Å; V143-V178 HydrophobicContact CG1-CB 3.94Å; V143-V178 HydrophobicContact CG1-CG1 3.94Å; V143-V178 HydrophobicContact CG1-CG2 3.93Å; V143-V178 HydrophobicContact CG2-CG2 4.02Å
144	K	98.6	Very high	94.8	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133	168.2	-175.9	74.9	-167.9	-172.8	0	109	D115 S117 A130 I167 C168 I201 E202	D115-K144 HydrophobicContact CB-CD 4.26Å; D115-K144 IonicContact OD1-NZ 2.69Å; D115-K144 PolarHBondContact OD1-NZ 3.24Å; S117-K144 PolarHBondContact O-NZ 2.93Å; A130-K144 HydrophobicContact CB-CB 4.12Å; A130-K144 HydrophobicContact CB-CD 3.94Å; K144-I167 VanDerWaalsContact O-CA 3.3Å; K144-I167 WeakPolarHBondContact O-CA 3.3Å; K144-C168 PolarHBondContact N-O 3.24Å; K144-C168 PolarHBondContact O-N 2.99Å; K144-I201 HydrophobicContact CG-CB 4.25Å; K144-I201 HydrophobicContact CG-CD1 4.18Å; K144-I201 HydrophobicContact CG-CG2 3.89Å; K144-E202 HydrophobicContact CD-CG 4.31Å; K144-E202 VanDerWaalsContact CE-CG 3.46Å; K144-E202 IonicContact NZ-OE1 2.85Å; K144-E202 PolarHBondContact NZ-OE1 3.42Å
145	G	97.2	Very high	94.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.191	C	C	.	.			trans	-172.6	171.4	173.4	0	0	0	0	0	113.7	D115 V116 N147 Y166	D115-G145 PolarHBondContact O-N 3.2Å; D115-G145 VanDerWaalsContact O-N 3.1Å; D115-G145 VanDerWaalsContact O-O 3.1Å; V116-G145 WeakPolarHBondContact CA-O 3.28Å; V116-G145 WeakPolarHBondContact CG1-O 3.39Å; G145-N147 PolarHBondContact O-N 3.1Å; G145-Y166 WeakPolarHBondContact CA-O 3.45Å
146	F	96.1	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	61	-5.6	173.7	-63	-94.4	0	0	0	117.7	F41 F90 V114 V116 V148 V149 V165 V178 A182 L185 F187	F41-F146 HydrophobicContact CZ-CB 4.27Å; F90-F146 AromaticContact CE1-CD2 3.66Å; F90-F146 HydrophobicContact CE1-CD2 3.66Å; F90-F146 AromaticContact CE1-CE2 3.8Å; F90-F146 HydrophobicContact CE1-CE2 3.8Å; F90-F146 HydrophobicContact CE1-CG 4.23Å; F90-F146 HydrophobicContact CE1-CZ 4.47Å; F90-F146 HydrophobicContact CZ-CD2 4.34Å; F90-F146 HydrophobicContact CZ-CE2 4.02Å; F90-F146 HydrophobicContact CZ-CZ 4.42Å; V114-F146 HydrophobicContact CG1-CD2 4.33Å; V116-F146 HydrophobicContact CG1-CB 4.02Å; F146-V148 PolarHBondContact O-N 2.92Å; F146-V149 PolarHBondContact O-N 3.45Å; F146-V165 HydrophobicContact CD1-CG1 4.2Å; F146-V165 HydrophobicContact CD1-CG2 4.24Å; F146-V165 HydrophobicContact CD2-CG1 4.07Å; F146-V165 HydrophobicContact CE1-CG1 4.43Å; F146-V165 HydrophobicContact CE1-CG2 4.35Å; F146-V165 HydrophobicContact CE2-CG1 4.3Å; F146-V165 HydrophobicContact CG-CG1 4.03Å; F146-V165 HydrophobicContact CZ-CG1 4.48Å; F146-V178 HydrophobicContact CE2-CG1 4Å; F146-A182 HydrophobicContact CE1-CB 4.41Å; F146-A182 HydrophobicContact CE2-CB 4.43Å; F146-A182 HydrophobicContact CZ-CB 3.77Å; F146-L185 HydrophobicContact CE1-CD1 3.86Å; F146-L185 HydrophobicContact CZ-CD1 3.94Å; F146-F187 HydrophobicContact CE1-CD2 4.17Å; F146-F187 HydrophobicContact CE1-CE2 4.41Å
147	N	94.9	Very high	92.3	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.027	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.4	-180	76.6	-59.3	0	0	0	113.6	N118 G145 V149 I201	N118-N147 PolarHBondContact ND2-O 3.43Å; N118-N147 WeakPolarHBondContact OD1-CB 3.38Å; N118-N147 PolarHBondContact OD1-ND2 3.29Å; G145-N147 PolarHBondContact O-N 3.1Å; N147-V149 VanDerWaalsContact C-N 3.33Å; N147-I201 PolarHBondContact ND2-O 3.09Å; N147-I201 WeakPolarHBondContact OD1-CG2 3.41Å
148	V	92	Very high	90.9	Very high	32 Å²	32	35.1 Å²	35.1	19%	0.194	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.1	176.2	-60.6	0	0	0	0	113.9	F146 Q164 Y166 L204 P205	F146-V148 PolarHBondContact O-N 2.92Å; V148-Q164 WeakPolarHBondContact CG2-O 3.43Å; V148-Y166 HydrophobicContact CB-CD2 4.47Å; V148-Y166 HydrophobicContact CG1-CD2 3.91Å; V148-Y166 HydrophobicContact CG1-CE2 4.36Å; V148-Y166 HydrophobicContact CG2-CD2 3.9Å; V148-Y166 HydrophobicContact CG2-CE2 4.37Å; V148-L204 HydrophobicContact CG1-CB 4.13Å; V148-L204 HydrophobicContact CG1-CD1 4.3Å; V148-P205 HydrophobicContact CG1-CG 4.02Å
149	V	91.2	Very high	89.3	Confident	4 Å²	4	38 Å²	38	2%	0.024	20%	0.196	C	C	.	.	S	Bend	trans	-95.6	127.8	179.1	-174.6	0	0	0	0	108.5	F41 F146 N147 L154 V165 F187	F41-V149 WeakPolarHBondContact CE2-O 3.46Å; F146-V149 PolarHBondContact O-N 3.45Å; N147-V149 VanDerWaalsContact C-N 3.33Å; V149-L154 HydrophobicContact CG1-CD2 4.11Å; V149-L154 HydrophobicContact CG1-CG 3.81Å; V149-V165 HydrophobicContact CG2-CG2 3.6Å; V149-F187 HydrophobicContact CB-CE1 4.45Å; V149-F187 HydrophobicContact CG1-CE1 3.64Å; V149-F187 HydrophobicContact CG1-CZ 3.75Å; V149-F187 HydrophobicContact CG2-CD1 4.18Å; V149-F187 HydrophobicContact CG2-CE1 3.87Å; V149-F187 HydrophobicContact CG2-CZ 4.43Å
150	S	90.1	Very high	87.7	Confident	53 Å²	53	39.6 Å²	39.6	37%	0.371	21%	0.205	S	C	.	.			trans	-73.7	152.9	175.9	78.8	0	0	0	0	111.6	W152 S153 L154	S150-W152 PolarHBondContact O-N 2.97Å; S150-S153 WeakPolarHBondContact O-CB 3.29Å; S150-S153 PolarHBondContact O-N 3.07Å; S150-S153 VanDerWaalsContact O-N 3.08Å; S150-S153 WeakPolarHBondContact OG-CB 3.39Å; S150-S153 PolarHBondContact OG-N 2.92Å; S150-S153 PolarHBondContact OG-OG 2.98Å; S150-L154 PolarHBondContact O-N 3.41Å; S150-L154 VanDerWaalsContact O-N 3.13Å
151	A	90.6	Very high	85.9	Confident	27 Å²	27	44 Å²	44	22%	0.223	24%	0.242	C	C	.	.	H	α-helix	trans	-55.7	-36.2	172.8	0	0	0	0	0	111.7	F41 S44 L154 Q155	F41-A151 HydrophobicContact CD2-CB 4.39Å; S44-A151 WeakPolarHBondContact CB-O 3.44Å; S44-A151 PolarHBondContact OG-O 3.11Å; A151-L154 PolarHBondContact O-N 3Å; A151-Q155 PolarHBondContact O-N 3.3Å
152	W	87.6	Confident	84.4	Confident	168 Å²	168	43.5 Å²	43.5	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-64.2	-43.4	175.9	-176.6	-109.5	0	0	0	112.7	S150 L154 Q155 L156	S150-W152 PolarHBondContact O-N 2.97Å; W152-L154 VanDerWaalsContact C-N 3.31Å; W152-L154 PolarHBondContact O-N 3.47Å; W152-Q155 PolarHBondContact O-N 3.46Å; W152-Q155 VanDerWaalsContact O-N 3.14Å; W152-L156 HydrophobicContact CD2-CD1 4.26Å; W152-L156 VanDerWaalsContact CE2-CD1 3.4Å; W152-L156 HydrophobicContact CH2-CD1 4.42Å; W152-L156 HydrophobicContact CZ2-CD1 3.52Å; W152-L156 HydrophobicContact CZ2-CG 4.24Å; W152-L156 VanDerWaalsContact NE1-CD1 3.33Å; W152-L156 PolarHBondContact O-N 2.79Å; W152-L156 VanDerWaalsContact O-N 3.08Å
153	S	87.1	Confident	83.6	Confident	21 Å²	21	48.7 Å²	48.7	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-35.2	177.3	-56.2	0	0	0	0	112.4	S150 G157	S150-S153 WeakPolarHBondContact O-CB 3.29Å; S150-S153 PolarHBondContact O-N 3.07Å; S150-S153 VanDerWaalsContact O-N 3.08Å; S150-S153 WeakPolarHBondContact OG-CB 3.39Å; S150-S153 PolarHBondContact OG-N 2.92Å; S150-S153 PolarHBondContact OG-OG 2.98Å; S153-G157 CarbonylContact O-C 3.42Å; S153-G157 VanDerWaalsContact O-C 3.28Å; S153-G157 WeakPolarHBondContact O-CA 3.36Å; S153-G157 PolarHBondContact O-N 2.98Å
154	L	89.5	Confident	83.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-39.5	173.5	-74.4	166.8	0	0	0	111.7	F41 L45 R48 V149 S150 A151 W152 F187	F41-L154 HydrophobicContact CD2-CD1 4.23Å; F41-L154 HydrophobicContact CE1-CD1 4.21Å; F41-L154 HydrophobicContact CE2-CD1 3.73Å; F41-L154 HydrophobicContact CZ-CD1 3.72Å; L45-L154 HydrophobicContact CB-CD1 4.15Å; L45-L154 HydrophobicContact CD1-CD1 4.33Å; L45-L154 HydrophobicContact CD1-CD2 4.07Å; R48-L154 HydrophobicContact CB-CB 4.43Å; R48-L154 HydrophobicContact CB-CD2 4.23Å; R48-L154 WeakPolarHBondContact CB-O 3.26Å; R48-L154 WeakPolarHBondContact CD-O 3.48Å; R48-L154 HydrophobicContact CG-CD2 4.16Å; V149-L154 HydrophobicContact CG1-CD2 4.11Å; V149-L154 HydrophobicContact CG1-CG 3.81Å; S150-L154 PolarHBondContact O-N 3.41Å; S150-L154 VanDerWaalsContact O-N 3.13Å; A151-L154 PolarHBondContact O-N 3Å; W152-L154 VanDerWaalsContact C-N 3.31Å; W152-L154 PolarHBondContact O-N 3.47Å; L154-F187 HydrophobicContact CD2-CE2 3.9Å; L154-F187 HydrophobicContact CD2-CZ 3.77Å
155	Q	86.3	Confident	83.1	Confident	54 Å²	54	52.9 Å²	52.9	25%	0.252	28%	0.281	S	S	.	.	H	α-helix	trans	-71.5	-45.8	-179.9	-70.3	-178.6	2.2	0	0	113.5	S44 I47 R51 A151 W152	S44-Q155 VanDerWaalsContact OG-CG 3.24Å; S44-Q155 WeakPolarHBondContact OG-CG 3.47Å; S44-Q155 PolarHBondContact OG-NE2 3.27Å; I47-Q155 HydrophobicContact CD1-CG 4.43Å; R51-Q155 PolarHBondContact NH1-O 3.42Å; A151-Q155 PolarHBondContact O-N 3.3Å; W152-Q155 PolarHBondContact O-N 3.46Å; W152-Q155 VanDerWaalsContact O-N 3.14Å
156	L	81.8	Confident	83	Confident	89 Å²	89	55.5 Å²	55.5	47%	0.466	29%	0.292	S	S	.	.	H	α-helix	trans	-83.4	-16.1	-177.5	-68.1	-176.1	0	0	0	113.5	W152	W152-L156 HydrophobicContact CD2-CD1 4.26Å; W152-L156 VanDerWaalsContact CE2-CD1 3.4Å; W152-L156 HydrophobicContact CH2-CD1 4.42Å; W152-L156 HydrophobicContact CZ2-CD1 3.52Å; W152-L156 HydrophobicContact CZ2-CG 4.24Å; W152-L156 VanDerWaalsContact NE1-CD1 3.33Å; W152-L156 PolarHBondContact O-N 2.79Å; W152-L156 VanDerWaalsContact O-N 3.08Å
157	G	70.9	Confident	83.1	Confident	9 Å²	9	55.5 Å²	55.5	9%	0.093	29%	0.292	C	S	.	.			trans	88.6	162.6	-170.6	0	0	0	0	0	112.6	S153 K159	S153-G157 CarbonylContact O-C 3.42Å; S153-G157 VanDerWaalsContact O-C 3.28Å; S153-G157 WeakPolarHBondContact O-CA 3.36Å; S153-G157 PolarHBondContact O-N 2.98Å; G157-K159 VanDerWaalsContact C-N 3.34Å; G157-K159 PolarHBondContact O-N 3.38Å
158	P	68.9	Low	83.3	Confident	20 Å²	20	55.2 Å²	55.2	13%	0.13	29%	0.29	C	S	.	.	S	Bend	trans	-74.1	80.6	-174	28	-31.7	0	0	0	111.5	R163 N186 F187	P158-R163 HydrophobicContact CB-CG 4.14Å; P158-R163 PolarHBondContact O-NE 2.97Å; P158-R163 VanDerWaalsContact O-NE 3.08Å; P158-N186 HydrophobicContact CG-CB 4.01Å; P158-N186 WeakPolarHBondContact CG-O 3.42Å; P158-F187 HydrophobicContact CB-CD1 4Å; P158-F187 HydrophobicContact CB-CE1 3.82Å; P158-F187 HydrophobicContact CB-CZ 4.44Å; P158-F187 HydrophobicContact CG-CD1 4.46Å; P158-F187 HydrophobicContact CG-CE1 4.36Å
159	K	62.3	Low	83.6	Confident	142 Å²	142	53.8 Å²	53.8	62%	0.617	28%	0.282	S	S	*	.			trans	-88.2	-31.4	179.2	-65.6	-173.5	-178.5	-177.2	0	113.2	G157 R163	G157-K159 VanDerWaalsContact C-N 3.34Å; G157-K159 PolarHBondContact O-N 3.38Å; K159-R163 PolarHBondContact O-NH2 2.84Å
160	D	63.8	Low	83.9	Confident	135 Å²	135	59.1 Å²	59.1	72%	0.722	31%	0.31	S	S	*	.	S	Bend	trans	-131.1	-151.6	-170.2	-56.8	-45.6	0	0	0	114.4	S162 R163	D160-S162 PolarHBondContact O-N 3.46Å; D160-R163 WeakPolarHBondContact O-CG 3.41Å; D160-R163 PolarHBondContact O-N 2.94Å
161	A	59.5	Low	84.2	Confident	106 Å²	106	58.9 Å²	58.9	88%	0.876	30%	0.304	S	S	*	.	S	Bend	trans	-51	-15.1	-170.7	0	0	0	0	0	117.1	R163	A161-R163 PolarHBondContact O-N 2.98Å
162	S	66.9	Low	84.5	Confident	40 Å²	40	61 Å²	61	28%	0.28	32%	0.315	S	S	.	.			trans	-95.5	36	179.3	-53.6	0	0	0	0	113.7	D160	D160-S162 PolarHBondContact O-N 3.46Å
163	R	81.9	Confident	85	Confident	118 Å²	118	57 Å²	57	45%	0.445	31%	0.31	S	S	.	.			trans	-80.5	-27.2	175.3	-54.8	-154.5	179.6	167.3	0	113.3	P158 K159 D160 A161 F187 I188	P158-R163 HydrophobicContact CB-CG 4.14Å; P158-R163 PolarHBondContact O-NE 2.97Å; P158-R163 VanDerWaalsContact O-NE 3.08Å; K159-R163 PolarHBondContact O-NH2 2.84Å; D160-R163 WeakPolarHBondContact O-CG 3.41Å; D160-R163 PolarHBondContact O-N 2.94Å; A161-R163 PolarHBondContact O-N 2.98Å; R163-F187 WeakPolarHBondContact O-CB 3.47Å; R163-I188 HydrophobicContact CB-CD1 4.08Å; R163-I188 HydrophobicContact CB-CG1 4.3Å; R163-I188 PolarHBondContact O-N 3.48Å
164	Q	91.2	Very high	85.5	Confident	87 Å²	87	56 Å²	56	41%	0.407	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.6	-174.7	-68.7	-179.2	-11.7	0	0	110.8	V148 Y166 I188 I190	V148-Q164 WeakPolarHBondContact CG2-O 3.43Å; Q164-Y166 HydrophobicContact CB-CE2 4.43Å; Q164-Y166 PolarHBondContact OE1-OH 3.35Å; Q164-Y166 VanDerWaalsContact OE1-OH 3.07Å; Q164-I188 VanDerWaalsContact CA-O 3.28Å; Q164-I188 WeakPolarHBondContact CA-O 3.28Å; Q164-I188 HydrophobicContact CG-CB 4.46Å; Q164-I190 HydrophobicContact CB-CD1 3.93Å; Q164-I190 VanDerWaalsContact CD-CD1 3.41Å; Q164-I190 HydrophobicContact CG-CD1 3.8Å
165	V	94.7	Very high	85.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.1	174	179.6	0	0	0	0	107.8	F146 V149 I167 F187 I188 P189 I190	F146-V165 HydrophobicContact CD1-CG1 4.2Å; F146-V165 HydrophobicContact CD1-CG2 4.24Å; F146-V165 HydrophobicContact CD2-CG1 4.07Å; F146-V165 HydrophobicContact CE1-CG1 4.43Å; F146-V165 HydrophobicContact CE1-CG2 4.35Å; F146-V165 HydrophobicContact CE2-CG1 4.3Å; F146-V165 HydrophobicContact CG-CG1 4.03Å; F146-V165 HydrophobicContact CZ-CG1 4.48Å; V149-V165 HydrophobicContact CG2-CG2 3.6Å; V165-I167 HydrophobicContact CG1-CD1 4.17Å; V165-I167 HydrophobicContact CG1-CG1 3.89Å; V165-F187 HydrophobicContact CB-CB 4.47Å; V165-F187 HydrophobicContact CG2-CB 3.59Å; V165-F187 HydrophobicContact CG2-CD1 3.79Å; V165-F187 HydrophobicContact CG2-CD2 4.4Å; V165-F187 HydrophobicContact CG2-CG 3.67Å; V165-I188 PolarHBondContact N-O 3.03Å; V165-P189 CarbonylContact O-C 3.57Å; V165-P189 VanDerWaalsContact O-CA 3.31Å; V165-P189 WeakPolarHBondContact O-CA 3.49Å; V165-I190 PolarHBondContact O-N 3.43Å
166	Y	96.4	Very high	86.4	Confident	55 Å²	55	60.4 Å²	60.4	22%	0.216	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131	175.7	-57.4	-86.2	0	0	0	109.5	G145 V148 Q164 I190 L192 L204	G145-Y166 WeakPolarHBondContact CA-O 3.45Å; V148-Y166 HydrophobicContact CB-CD2 4.47Å; V148-Y166 HydrophobicContact CG1-CD2 3.91Å; V148-Y166 HydrophobicContact CG1-CE2 4.36Å; V148-Y166 HydrophobicContact CG2-CD2 3.9Å; V148-Y166 HydrophobicContact CG2-CE2 4.37Å; Q164-Y166 HydrophobicContact CB-CE2 4.43Å; Q164-Y166 PolarHBondContact OE1-OH 3.35Å; Q164-Y166 VanDerWaalsContact OE1-OH 3.07Å; Y166-I190 WeakPolarHBondContact CA-O 3.24Å; Y166-I190 HydrophobicContact CD1-CB 3.78Å; Y166-I190 HydrophobicContact CD1-CD1 4.13Å; Y166-I190 HydrophobicContact CD1-CG1 4.48Å; Y166-I190 HydrophobicContact CD1-CG2 3.83Å; Y166-I190 HydrophobicContact CE1-CB 4.11Å; Y166-I190 HydrophobicContact CE1-CD1 3.56Å; Y166-I190 HydrophobicContact CE1-CG1 4.38Å; Y166-I190 HydrophobicContact CE1-CG2 4.04Å; Y166-L192 HydrophobicContact CD1-CD1 3.84Å; Y166-L192 HydrophobicContact CD1-CD2 4.33Å; Y166-L192 HydrophobicContact CD1-CG 4.12Å; Y166-L192 HydrophobicContact CG-CD1 4.25Å; Y166-L204 HydrophobicContact CD1-CD1 4.38Å; Y166-L204 HydrophobicContact CD2-CD1 3.55Å; Y166-L204 HydrophobicContact CE1-CD1 4.44Å; Y166-L204 HydrophobicContact CE2-CD1 3.63Å; Y166-L204 HydrophobicContact CG-CD1 3.94Å
167	I	98.3	Very high	87.1	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.6	-174.3	-58.8	171.6	0	0	0	109.2	V143 K144 V165 R175 V178 I179 A182 P189 I190 L192	V143-I167 HydrophobicContact CG1-CG2 3.64Å; K144-I167 VanDerWaalsContact O-CA 3.3Å; K144-I167 WeakPolarHBondContact O-CA 3.3Å; V165-I167 HydrophobicContact CG1-CD1 4.17Å; V165-I167 HydrophobicContact CG1-CG1 3.89Å; I167-R175 HydrophobicContact CG2-CG 3.96Å; I167-V178 HydrophobicContact CD1-CG1 4.18Å; I167-V178 HydrophobicContact CG2-CG1 4.35Å; I167-I179 HydrophobicContact CB-CG1 4.25Å; I167-I179 HydrophobicContact CD1-CB 4.35Å; I167-I179 HydrophobicContact CD1-CG1 3.74Å; I167-I179 HydrophobicContact CG2-CG1 4.17Å; I167-A182 HydrophobicContact CD1-CB 4.03Å; I167-P189 HydrophobicContact CD1-CB 3.89Å; I167-I190 PolarHBondContact N-O 3.35Å; I167-L192 PolarHBondContact O-N 3.13Å
168	C	98.2	Very high	88.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-144.5	151.6	171.1	75.8	0	0	0	0	112.3	K144 L192 G193 A194 S198 I201	K144-C168 PolarHBondContact N-O 3.24Å; K144-C168 PolarHBondContact O-N 2.99Å; C168-L192 HydrophobicContact CB-CB 4.35Å; C168-G193 WeakPolarHBondContact CA-O 3.46Å; C168-G193 WeakPolarHBondContact CB-O 3.34Å; C168-A194 VanDerWaalsContact CB-O 3.29Å; C168-A194 WeakPolarHBondContact CB-O 3.33Å; C168-S198 PolarHBondContact SG-N 3.08Å; C168-S198 VanDerWaalsContact SG-N 3.45Å; C168-I201 HydrophobicContact CB-CD1 3.97Å
169	S	98	Very high	89.8	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.007	32%	0.315	C	S	.	.			trans	-169.8	153	177.5	-178.4	0	0	0	0	110.8	I142 N171 R175 G193	I142-S169 VanDerWaalsContact O-CB 3.3Å; I142-S169 WeakPolarHBondContact O-CB 3.46Å; I142-S169 PolarHBondContact O-OG 2.88Å; S169-N171 VanDerWaalsContact C-N 3.35Å; S169-N171 PolarHBondContact OG-N 3.43Å; S169-N171 VanDerWaalsContact OG-N 3.1Å; S169-R175 PolarHBondContact O-NH1 3.47Å; S169-G193 PolarHBondContact N-O 3.42Å
170	N	97.4	Very high	91.4	Very high	116 Å²	116	57.2 Å²	57.2	62%	0.62	30%	0.303	S	S	*	.	S	Bend	trans	-78	-19.5	170.6	-68.3	-16.4	0	0	0	112.7	L195	N170-L195 WeakPolarHBondContact OD1-CB 3.47Å; N170-L195 PolarHBondContact OD1-N 2.79Å
171	N	97.8	Very high	92.9	Very high	48 Å²	48	51 Å²	51	26%	0.257	27%	0.27	S	S	.	.			trans	-97.4	109	177.2	-174.3	-77	0	0	0	110.1	L141 S169 P173 A174 R175	L141-N171 HydrophobicContact CB-CB 4.49Å; L141-N171 HydrophobicContact CD2-CB 4.13Å; L141-N171 WeakPolarHBondContact CD2-ND2 3.43Å; S169-N171 VanDerWaalsContact C-N 3.35Å; S169-N171 PolarHBondContact OG-N 3.43Å; S169-N171 VanDerWaalsContact OG-N 3.1Å; N171-P173 VanDerWaalsContact OD1-CD 3.25Å; N171-P173 WeakPolarHBondContact OD1-CD 3.26Å; N171-A174 HydrophobicContact CB-CB 4.02Å; N171-A174 PolarHBondContact O-N 3.23Å; N171-A174 VanDerWaalsContact OD1-CB 3.28Å; N171-A174 WeakPolarHBondContact OD1-CB 3.09Å; N171-A174 PolarHBondContact OD1-N 3.39Å; N171-R175 WeakPolarHBondContact O-CB 3.49Å; N171-R175 PolarHBondContact O-N 3.33Å
172	V	96.8	Very high	94.6	Very high	72 Å²	72	46 Å²	46	44%	0.436	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-46.3	-176.1	177.4	0	0	0	0	112.6	A174 R175 H176	V172-A174 PolarHBondContact O-N 3.26Å; V172-R175 WeakPolarHBondContact O-CB 3.38Å; V172-R175 PolarHBondContact O-N 3.16Å; V172-H176 PolarHBondContact O-N 3.13Å
173	P	97.3	Very high	95.9	Very high	84 Å²	84	50.2 Å²	50.2	55%	0.545	24%	0.238	S	C	.	.	H	α-helix	trans	-57.3	-47.4	175.4	-26.9	34.2	0	0	0	113.9	N171 R175 H176 Q177	N171-P173 VanDerWaalsContact OD1-CD 3.25Å; N171-P173 WeakPolarHBondContact OD1-CD 3.26Å; P173-R175 VanDerWaalsContact C-N 3.34Å; P173-R175 PolarHBondContact O-N 2.97Å; P173-H176 PolarHBondContact O-N 3.08Å; P173-Q177 WeakPolarHBondContact O-CG 3.5Å; P173-Q177 PolarHBondContact O-N 3.04Å
174	A	97.3	Very high	96.4	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-42.5	178.4	0	0	0	0	0	111.6	I112 L141 V143 N171 V172 H176 Q177 V178	I112-A174 HydrophobicContact CD1-CB 3.71Å; I112-A174 HydrophobicContact CG1-CB 3.72Å; I112-A174 HydrophobicContact CG2-CB 4.26Å; L141-A174 HydrophobicContact CB-CB 3.97Å; L141-A174 HydrophobicContact CD1-CB 4.17Å; V143-A174 HydrophobicContact CG2-CB 3.94Å; N171-A174 HydrophobicContact CB-CB 4.02Å; N171-A174 PolarHBondContact O-N 3.23Å; N171-A174 VanDerWaalsContact OD1-CB 3.28Å; N171-A174 WeakPolarHBondContact OD1-CB 3.09Å; N171-A174 PolarHBondContact OD1-N 3.39Å; V172-A174 PolarHBondContact O-N 3.26Å; A174-H176 VanDerWaalsContact C-N 3.34Å; A174-H176 PolarHBondContact O-N 3.05Å; A174-Q177 PolarHBondContact O-N 3.29Å; A174-V178 WeakPolarHBondContact O-CG2 3.26Å; A174-V178 PolarHBondContact O-N 2.9Å; A174-V178 VanDerWaalsContact O-N 3.1Å
175	R	97.6	Very high	96.5	Very high	34 Å²	34	44.8 Å²	44.8	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-46.8	175.4	-159.7	167.9	71.6	-147.2	6.2	111.6	I167 S169 N171 V172 P173 V178 I179 D191 G193	I167-R175 HydrophobicContact CG2-CG 3.96Å; S169-R175 PolarHBondContact O-NH1 3.47Å; N171-R175 WeakPolarHBondContact O-CB 3.49Å; N171-R175 PolarHBondContact O-N 3.33Å; V172-R175 WeakPolarHBondContact O-CB 3.38Å; V172-R175 PolarHBondContact O-N 3.16Å; P173-R175 VanDerWaalsContact C-N 3.34Å; P173-R175 PolarHBondContact O-N 2.97Å; R175-V178 PolarHBondContact O-N 3.16Å; R175-I179 HydrophobicContact CG-CD1 4.07Å; R175-I179 WeakPolarHBondContact O-CB 3.21Å; R175-I179 VanDerWaalsContact O-CG1 3.24Å; R175-I179 WeakPolarHBondContact O-CG1 3.42Å; R175-I179 PolarHBondContact O-N 2.92Å; R175-D191 VanDerWaalsContact CD-OD1 3.26Å; R175-D191 WeakPolarHBondContact CD-OD1 3.47Å; R175-D191 IonicContact CZ-OD1 2.68Å; R175-D191 IonicContact CZ-OD2 2.8Å; R175-D191 VanDerWaalsContact CZ-OD2 3.31Å; R175-D191 VanDerWaalsContact NE-CG 3.29Å; R175-D191 IonicContact NE-OD1 2.67Å; R175-D191 PolarHBondContact NE-OD1 3.36Å; R175-D191 IonicContact NE-OD2 3.85Å; R175-D191 PolarHBondContact NE-OD2 3.17Å; R175-D191 IonicContact NH2-OD1 3.94Å; R175-D191 IonicContact NH2-OD2 3.7Å; R175-D191 PolarHBondContact NH2-OD2 2.97Å; R175-G193 WeakPolarHBondContact CD-O 3.49Å; R175-G193 VanDerWaalsContact NH1-C 3.29Å; R175-G193 PolarHBondContact NH1-O 3.15Å
176	H	97.5	Very high	96.3	Very high	112 Å²	112	49.8 Å²	49.8	52%	0.519	25%	0.245	S	C	.	.	H	α-helix	trans	-63.5	-40.3	178.9	-84.5	-152.4	0	0	0	112.7	V172 P173 A174 I179 E180	V172-H176 PolarHBondContact O-N 3.13Å; P173-H176 PolarHBondContact O-N 3.08Å; A174-H176 VanDerWaalsContact C-N 3.34Å; A174-H176 PolarHBondContact O-N 3.05Å; H176-I179 PolarHBondContact O-N 3.07Å; H176-E180 PolarHBondContact O-N 2.95Å
177	Q	96.9	Very high	96.1	Very high	102 Å²	102	47.5 Å²	47.5	48%	0.477	24%	0.236	S	C	.	.	H	α-helix	trans	-62.6	-42.8	176.4	-71.2	-176.2	9.2	0	0	112	I112 P173 A174 E180 L181	I112-Q177 HydrophobicContact CD1-CB 4.34Å; P173-Q177 WeakPolarHBondContact O-CG 3.5Å; P173-Q177 PolarHBondContact O-N 3.04Å; A174-Q177 PolarHBondContact O-N 3.29Å; Q177-E180 PolarHBondContact O-N 3.2Å; Q177-L181 WeakPolarHBondContact O-CB 3.24Å; Q177-L181 PolarHBondContact O-N 3.35Å
178	V	97.5	Very high	95.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-70.7	-33.9	177.8	-179.6	0	0	0	0	111.8	I112 V114 V143 F146 I167 A174 R175 L181 A182	I112-V178 HydrophobicContact CG2-CG2 3.99Å; V114-V178 HydrophobicContact CG1-CG1 4.38Å; V114-V178 HydrophobicContact CG2-CG1 4.4Å; V114-V178 HydrophobicContact CG2-CG2 3.81Å; V143-V178 HydrophobicContact CB-CG2 4.14Å; V143-V178 HydrophobicContact CG1-CB 3.94Å; V143-V178 HydrophobicContact CG1-CG1 3.94Å; V143-V178 HydrophobicContact CG1-CG2 3.93Å; V143-V178 HydrophobicContact CG2-CG2 4.02Å; F146-V178 HydrophobicContact CE2-CG1 4Å; I167-V178 HydrophobicContact CD1-CG1 4.18Å; I167-V178 HydrophobicContact CG2-CG1 4.35Å; A174-V178 WeakPolarHBondContact O-CG2 3.26Å; A174-V178 PolarHBondContact O-N 2.9Å; A174-V178 VanDerWaalsContact O-N 3.1Å; R175-V178 PolarHBondContact O-N 3.16Å; V178-L181 PolarHBondContact O-N 3.3Å; V178-A182 PolarHBondContact O-N 3.46Å
179	I	97.7	Very high	95.7	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-47.1	171.5	-75.6	166.8	0	0	0	110.6	I167 R175 H176 A182 R183 P189 D191	I167-I179 HydrophobicContact CB-CG1 4.25Å; I167-I179 HydrophobicContact CD1-CB 4.35Å; I167-I179 HydrophobicContact CD1-CG1 3.74Å; I167-I179 HydrophobicContact CG2-CG1 4.17Å; R175-I179 HydrophobicContact CG-CD1 4.07Å; R175-I179 WeakPolarHBondContact O-CB 3.21Å; R175-I179 VanDerWaalsContact O-CG1 3.24Å; R175-I179 WeakPolarHBondContact O-CG1 3.42Å; R175-I179 PolarHBondContact O-N 2.92Å; H176-I179 PolarHBondContact O-N 3.07Å; I179-A182 WeakPolarHBondContact O-CB 3.46Å; I179-A182 PolarHBondContact O-N 2.94Å; I179-R183 PolarHBondContact O-N 2.92Å; I179-R183 VanDerWaalsContact O-N 3.13Å; I179-P189 HydrophobicContact CB-CB 4.4Å; I179-P189 HydrophobicContact CG1-CB 4.35Å; I179-P189 HydrophobicContact CG2-CB 3.98Å; I179-P189 HydrophobicContact CG2-CG 3.8Å; I179-D191 HydrophobicContact CD1-CB 3.95Å
180	E	96.3	Very high	95.6	Very high	78 Å²	78	55 Å²	55	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-67.6	-40.4	179.6	-170.3	53.2	-148.3	0	0	111.8	H176 Q177 A182 R183 Q184	H176-E180 PolarHBondContact O-N 2.95Å; Q177-E180 PolarHBondContact O-N 3.2Å; E180-A182 VanDerWaalsContact C-N 3.29Å; E180-A182 PolarHBondContact O-N 3.4Å; E180-R183 WeakPolarHBondContact O-CB 3.48Å; E180-R183 PolarHBondContact O-N 3.34Å; E180-R183 VanDerWaalsContact O-N 3.07Å; E180-R183 IonicContact OE2-CZ 2.9Å; E180-R183 IonicContact OE2-NH1 3.31Å; E180-R183 PolarHBondContact OE2-NH1 3.36Å; E180-Q184 HydrophobicContact CG-CG 4.48Å; E180-Q184 WeakPolarHBondContact O-CG 3.41Å; E180-Q184 PolarHBondContact O-N 3.05Å
181	L	95.6	Very high	95.6	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-56.3	-43.8	171.9	-180	60.8	0	0	0	111.5	I33 L49 Y54 I88 F90 Q177 V178 R183 Q184 L185	I33-L181 HydrophobicContact CD1-CD2 4.31Å; L49-L181 HydrophobicContact CD2-CD1 4.07Å; Y54-L181 HydrophobicContact CD1-CD1 4.46Å; Y54-L181 HydrophobicContact CE1-CD1 3.78Å; Y54-L181 HydrophobicContact CE2-CD1 3.9Å; Y54-L181 VanDerWaalsContact CZ-CD1 3.45Å; Y54-L181 WeakPolarHBondContact OH-CD1 3.33Å; I88-L181 HydrophobicContact CG2-CD2 4.45Å; F90-L181 HydrophobicContact CE2-CD2 3.71Å; F90-L181 HydrophobicContact CZ-CD2 3.6Å; Q177-L181 WeakPolarHBondContact O-CB 3.24Å; Q177-L181 PolarHBondContact O-N 3.35Å; V178-L181 PolarHBondContact O-N 3.3Å; L181-R183 VanDerWaalsContact C-N 3.34Å; L181-R183 PolarHBondContact O-N 3.34Å; L181-Q184 PolarHBondContact O-N 2.96Å; L181-L185 HydrophobicContact CD1-CD1 4.19Å; L181-L185 HydrophobicContact CD1-CG 4.31Å; L181-L185 HydrophobicContact CG-CD1 4.06Å; L181-L185 WeakPolarHBondContact O-CB 3.49Å; L181-L185 VanDerWaalsContact O-CG 3.22Å; L181-L185 WeakPolarHBondContact O-CG 3.38Å; L181-L185 PolarHBondContact O-N 2.82Å
182	A	95.3	Very high	95.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-39.9	175.9	0	0	0	0	0	112.5	F146 I167 V178 I179 E180 L185 N186 F187 P189	F146-A182 HydrophobicContact CE1-CB 4.41Å; F146-A182 HydrophobicContact CE2-CB 4.43Å; F146-A182 HydrophobicContact CZ-CB 3.77Å; I167-A182 HydrophobicContact CD1-CB 4.03Å; V178-A182 PolarHBondContact O-N 3.46Å; I179-A182 WeakPolarHBondContact O-CB 3.46Å; I179-A182 PolarHBondContact O-N 2.94Å; E180-A182 VanDerWaalsContact C-N 3.29Å; E180-A182 PolarHBondContact O-N 3.4Å; A182-L185 CarbonylContact O-C 3.58Å; A182-L185 PolarHBondContact O-N 2.9Å; A182-N186 PolarHBondContact O-N 2.94Å; A182-F187 HydrophobicContact CB-CB 4.46Å; A182-F187 WeakPolarHBondContact O-CA 3.43Å; A182-F187 WeakPolarHBondContact O-CB 3.45Å; A182-F187 PolarHBondContact O-N 2.87Å; A182-P189 HydrophobicContact CB-CB 4.12Å
183	R	94.2	Very high	95.5	Very high	129 Å²	129	50.8 Å²	50.8	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-44.6	174.6	-63.6	-170.5	-173	112.3	1.3	112.2	I179 E180 L181 L185 N186 P189	I179-R183 PolarHBondContact O-N 2.92Å; I179-R183 VanDerWaalsContact O-N 3.13Å; E180-R183 WeakPolarHBondContact O-CB 3.48Å; E180-R183 PolarHBondContact O-N 3.34Å; E180-R183 VanDerWaalsContact O-N 3.07Å; E180-R183 IonicContact OE2-CZ 2.9Å; E180-R183 IonicContact OE2-NH1 3.31Å; E180-R183 PolarHBondContact OE2-NH1 3.36Å; L181-R183 VanDerWaalsContact C-N 3.34Å; L181-R183 PolarHBondContact O-N 3.34Å; R183-L185 PolarHBondContact O-N 3Å; R183-N186 VanDerWaalsContact O-CA 3.25Å; R183-N186 WeakPolarHBondContact O-CA 3.37Å; R183-N186 PolarHBondContact O-N 3.12Å; R183-P189 HydrophobicContact CG-CG 3.62Å
184	Q	93.3	Very high	95.5	Very high	91 Å²	91	48.7 Å²	48.7	43%	0.425	25%	0.246	S	C	.	.	H	α-helix	trans	-65.9	-25.8	178.2	-67.7	173.4	-33.6	0	0	111.8	C52 Y54 E180 L181 N186	C52-Q184 PolarHBondContact SG-O 3.49Å; C52-Q184 VanDerWaalsContact SG-O 3.35Å; Y54-Q184 HydrophobicContact CE2-CB 4.45Å; Y54-Q184 WeakPolarHBondContact OH-CB 3.4Å; Y54-Q184 PolarHBondContact OH-OE1 2.84Å; E180-Q184 HydrophobicContact CG-CG 4.48Å; E180-Q184 WeakPolarHBondContact O-CG 3.41Å; E180-Q184 PolarHBondContact O-N 3.05Å; L181-Q184 PolarHBondContact O-N 2.96Å; Q184-N186 PolarHBondContact O-N 2.87Å
185	L	91.8	Very high	95.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	14	168.1	-62.7	172	0	0	0	113.4	R48 L49 C52 Y54 F146 L181 A182 R183 F187	R48-L185 HydrophobicContact CG-CD2 3.93Å; R48-L185 VanDerWaalsContact CZ-O 3.3Å; R48-L185 PolarHBondContact NE-O 3.48Å; R48-L185 VanDerWaalsContact NE-O 3.09Å; R48-L185 VanDerWaalsContact NH2-C 3.32Å; R48-L185 PolarHBondContact NH2-O 2.95Å; L49-L185 HydrophobicContact CD2-CD1 4.02Å; L49-L185 HydrophobicContact CD2-CD2 3.74Å; L49-L185 HydrophobicContact CD2-CG 4.37Å; L49-L185 HydrophobicContact CG-CD2 4.22Å; C52-L185 HydrophobicContact CB-CD2 3.82Å; Y54-L185 HydrophobicContact CD2-CD2 4.43Å; Y54-L185 HydrophobicContact CE2-CD2 4.19Å; F146-L185 HydrophobicContact CE1-CD1 3.86Å; F146-L185 HydrophobicContact CZ-CD1 3.94Å; L181-L185 HydrophobicContact CD1-CD1 4.19Å; L181-L185 HydrophobicContact CD1-CG 4.31Å; L181-L185 HydrophobicContact CG-CD1 4.06Å; L181-L185 WeakPolarHBondContact O-CB 3.49Å; L181-L185 VanDerWaalsContact O-CG 3.22Å; L181-L185 WeakPolarHBondContact O-CG 3.38Å; L181-L185 PolarHBondContact O-N 2.82Å; A182-L185 CarbonylContact O-C 3.58Å; A182-L185 PolarHBondContact O-N 2.9Å; R183-L185 PolarHBondContact O-N 3Å; L185-F187 HydrophobicContact CB-CD2 3.7Å; L185-F187 HydrophobicContact CB-CE2 3.99Å; L185-F187 VanDerWaalsContact O-CD2 3.24Å; L185-F187 WeakPolarHBondContact O-CD2 3.37Å; L185-F187 WeakPolarHBondContact O-CE2 3.09Å; L185-F187 PolarHBondContact O-N 3.15Å
186	N	91	Very high	95.5	Very high	105 Å²	105	51.2 Å²	51.2	56%	0.561	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	25.6	-177.2	-49.2	-30.2	0	0	0	115.4	R48 P158 A182 R183 Q184	R48-N186 VanDerWaalsContact NH2-CB 3.31Å; R48-N186 PolarHBondContact NH2-ND2 3.3Å; P158-N186 HydrophobicContact CG-CB 4.01Å; P158-N186 WeakPolarHBondContact CG-O 3.42Å; A182-N186 PolarHBondContact O-N 2.94Å; R183-N186 VanDerWaalsContact O-CA 3.25Å; R183-N186 WeakPolarHBondContact O-CA 3.37Å; R183-N186 PolarHBondContact O-N 3.12Å; Q184-N186 PolarHBondContact O-N 2.87Å
187	F	93.1	Very high	95.5	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.031	25%	0.251	C	S	.	.			trans	-90.7	164.1	169.4	-66.5	-81.5	0	0	0	110.9	F146 V149 L154 P158 R163 V165 A182 L185 P189	F146-F187 HydrophobicContact CE1-CD2 4.17Å; F146-F187 HydrophobicContact CE1-CE2 4.41Å; V149-F187 HydrophobicContact CB-CE1 4.45Å; V149-F187 HydrophobicContact CG1-CE1 3.64Å; V149-F187 HydrophobicContact CG1-CZ 3.75Å; V149-F187 HydrophobicContact CG2-CD1 4.18Å; V149-F187 HydrophobicContact CG2-CE1 3.87Å; V149-F187 HydrophobicContact CG2-CZ 4.43Å; L154-F187 HydrophobicContact CD2-CE2 3.9Å; L154-F187 HydrophobicContact CD2-CZ 3.77Å; P158-F187 HydrophobicContact CB-CD1 4Å; P158-F187 HydrophobicContact CB-CE1 3.82Å; P158-F187 HydrophobicContact CB-CZ 4.44Å; P158-F187 HydrophobicContact CG-CD1 4.46Å; P158-F187 HydrophobicContact CG-CE1 4.36Å; R163-F187 WeakPolarHBondContact O-CB 3.47Å; V165-F187 HydrophobicContact CB-CB 4.47Å; V165-F187 HydrophobicContact CG2-CB 3.59Å; V165-F187 HydrophobicContact CG2-CD1 3.79Å; V165-F187 HydrophobicContact CG2-CD2 4.4Å; V165-F187 HydrophobicContact CG2-CG 3.67Å; A182-F187 HydrophobicContact CB-CB 4.46Å; A182-F187 WeakPolarHBondContact O-CA 3.43Å; A182-F187 WeakPolarHBondContact O-CB 3.45Å; A182-F187 PolarHBondContact O-N 2.87Å; L185-F187 HydrophobicContact CB-CD2 3.7Å; L185-F187 HydrophobicContact CB-CE2 3.99Å; L185-F187 VanDerWaalsContact O-CD2 3.24Å; L185-F187 WeakPolarHBondContact O-CD2 3.37Å; L185-F187 WeakPolarHBondContact O-CE2 3.09Å; L185-F187 PolarHBondContact O-N 3.15Å; F187-P189 VanDerWaalsContact O-CD 3.27Å; F187-P189 WeakPolarHBondContact O-CD 3.41Å
188	I	93	Very high	95.5	Very high	88 Å²	88	42.2 Å²	42.2	45%	0.451	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	97.8	174.6	-57.4	173.1	0	0	0	107.1	R163 Q164 V165	R163-I188 HydrophobicContact CB-CD1 4.08Å; R163-I188 HydrophobicContact CB-CG1 4.3Å; R163-I188 PolarHBondContact O-N 3.48Å; Q164-I188 VanDerWaalsContact CA-O 3.28Å; Q164-I188 WeakPolarHBondContact CA-O 3.28Å; Q164-I188 HydrophobicContact CG-CB 4.46Å; V165-I188 PolarHBondContact N-O 3.03Å
189	P	95.3	Very high	95.3	Very high	24 Å²	24	44.9 Å²	44.9	16%	0.156	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	142.1	178.7	29.2	-35.3	0	0	0	111.3	V165 I167 I179 A182 R183 F187	V165-P189 CarbonylContact O-C 3.57Å; V165-P189 VanDerWaalsContact O-CA 3.31Å; V165-P189 WeakPolarHBondContact O-CA 3.49Å; I167-P189 HydrophobicContact CD1-CB 3.89Å; I179-P189 HydrophobicContact CB-CB 4.4Å; I179-P189 HydrophobicContact CG1-CB 4.35Å; I179-P189 HydrophobicContact CG2-CB 3.98Å; I179-P189 HydrophobicContact CG2-CG 3.8Å; A182-P189 HydrophobicContact CB-CB 4.12Å; R183-P189 HydrophobicContact CG-CG 3.62Å; F187-P189 VanDerWaalsContact O-CD 3.27Å; F187-P189 WeakPolarHBondContact O-CD 3.41Å
190	I	96.1	Very high	95.1	Very high	47 Å²	47	50.2 Å²	50.2	24%	0.241	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.4	172.1	-60	-178.6	0	0	0	107.6	Q164 V165 Y166 I167 L192	Q164-I190 HydrophobicContact CB-CD1 3.93Å; Q164-I190 VanDerWaalsContact CD-CD1 3.41Å; Q164-I190 HydrophobicContact CG-CD1 3.8Å; V165-I190 PolarHBondContact O-N 3.43Å; Y166-I190 WeakPolarHBondContact CA-O 3.24Å; Y166-I190 HydrophobicContact CD1-CB 3.78Å; Y166-I190 HydrophobicContact CD1-CD1 4.13Å; Y166-I190 HydrophobicContact CD1-CG1 4.48Å; Y166-I190 HydrophobicContact CD1-CG2 3.83Å; Y166-I190 HydrophobicContact CE1-CB 4.11Å; Y166-I190 HydrophobicContact CE1-CD1 3.56Å; Y166-I190 HydrophobicContact CE1-CG1 4.38Å; Y166-I190 HydrophobicContact CE1-CG2 4.04Å; I167-I190 PolarHBondContact N-O 3.35Å; I190-L192 HydrophobicContact CG2-CD2 3.99Å; I190-L192 PolarHBondContact O-N 3.02Å
191	D	96.8	Very high	95	Very high	68 Å²	68	46.5 Å²	46.5	36%	0.364	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	118.7	176.9	-170.3	-3.4	0	0	0	110	R175 I179 G193	R175-D191 VanDerWaalsContact CD-OD1 3.26Å; R175-D191 WeakPolarHBondContact CD-OD1 3.47Å; R175-D191 IonicContact CZ-OD1 2.68Å; R175-D191 IonicContact CZ-OD2 2.8Å; R175-D191 VanDerWaalsContact CZ-OD2 3.31Å; R175-D191 VanDerWaalsContact NE-CG 3.29Å; R175-D191 IonicContact NE-OD1 2.67Å; R175-D191 PolarHBondContact NE-OD1 3.36Å; R175-D191 IonicContact NE-OD2 3.85Å; R175-D191 PolarHBondContact NE-OD2 3.17Å; R175-D191 IonicContact NH2-OD1 3.94Å; R175-D191 IonicContact NH2-OD2 3.7Å; R175-D191 PolarHBondContact NH2-OD2 2.97Å; I179-D191 HydrophobicContact CD1-CB 3.95Å; D191-G193 WeakPolarHBondContact OD1-CA 3.3Å; D191-G193 PolarHBondContact OD1-N 3.12Å
192	L	96.3	Very high	95	Very high	58 Å²	58	46.3 Å²	46.3	30%	0.304	25%	0.245	S	C	.	.			trans	-104.1	13	174.9	-63.2	-171	0	0	0	113	Y166 I167 C168 I190 S197 I201	Y166-L192 HydrophobicContact CD1-CD1 3.84Å; Y166-L192 HydrophobicContact CD1-CD2 4.33Å; Y166-L192 HydrophobicContact CD1-CG 4.12Å; Y166-L192 HydrophobicContact CG-CD1 4.25Å; I167-L192 PolarHBondContact O-N 3.13Å; C168-L192 HydrophobicContact CB-CB 4.35Å; I190-L192 HydrophobicContact CG2-CD2 3.99Å; I190-L192 PolarHBondContact O-N 3.02Å; L192-S197 WeakPolarHBondContact O-CB 3.48Å; L192-S197 PolarHBondContact O-OG 2.88Å; L192-I201 HydrophobicContact CB-CD1 4.4Å; L192-I201 HydrophobicContact CD1-CD1 3.88Å; L192-I201 HydrophobicContact CD1-CG1 3.55Å
193	G	96.5	Very high	94.8	Very high	21 Å²	21	46.8 Å²	46.8	22%	0.216	25%	0.247	C	C	.	.			trans	81.2	-126.1	171.2	0	0	0	0	0	113.6	C168 S169 R175 D191	C168-G193 WeakPolarHBondContact CA-O 3.46Å; C168-G193 WeakPolarHBondContact CB-O 3.34Å; S169-G193 PolarHBondContact N-O 3.42Å; R175-G193 WeakPolarHBondContact CD-O 3.49Å; R175-G193 VanDerWaalsContact NH1-C 3.29Å; R175-G193 PolarHBondContact NH1-O 3.15Å; D191-G193 WeakPolarHBondContact OD1-CA 3.3Å; D191-G193 PolarHBondContact OD1-N 3.12Å
194	A	97.4	Very high	94.6	Very high	41 Å²	41	43.6 Å²	43.6	34%	0.339	24%	0.24	S	C	.	.	S	Bend	trans	-70.2	161.2	-170.8	0	0	0	0	0	113.2	C168 S196 S197	C168-A194 VanDerWaalsContact CB-O 3.29Å; C168-A194 WeakPolarHBondContact CB-O 3.33Å; A194-S196 PolarHBondContact O-N 3.16Å; A194-S196 VanDerWaalsContact O-N 3.15Å; A194-S197 WeakPolarHBondContact O-CB 3.3Å; A194-S197 PolarHBondContact O-N 2.95Å; A194-S197 VanDerWaalsContact O-N 3.07Å; A194-S197 PolarHBondContact O-OG 3.36Å
195	L	97.5	Very high	94.3	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.052	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-62.2	-23.3	-179.1	-163.4	70.6	0	0	0	112.6	A130 E131 A134 I142 N170 S197 S198	A130-L195 HydrophobicContact CB-CD1 3.99Å; E131-L195 HydrophobicContact CG-CD2 4.37Å; E131-L195 HydrophobicContact CG-CG 4.46Å; A134-L195 HydrophobicContact CB-CD2 3.95Å; I142-L195 HydrophobicContact CB-CD2 4.42Å; I142-L195 HydrophobicContact CG2-CD1 4.18Å; I142-L195 HydrophobicContact CG2-CD2 4.49Å; N170-L195 WeakPolarHBondContact OD1-CB 3.47Å; N170-L195 PolarHBondContact OD1-N 2.79Å; L195-S197 PolarHBondContact O-N 3.46Å; L195-S197 VanDerWaalsContact O-N 3.16Å; L195-S198 WeakPolarHBondContact O-CB 3.42Å; L195-S198 PolarHBondContact O-N 3.12Å; L195-S198 PolarHBondContact O-OG 3.09Å
196	S	96.7	Very high	94.1	Very high	77 Å²	77	45 Å²	45	54%	0.538	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.1	174.1	53	0	0	0	0	113.6	A194 S198	A194-S196 PolarHBondContact O-N 3.16Å; A194-S196 VanDerWaalsContact O-N 3.15Å; S196-S198 PolarHBondContact O-N 3.25Å
197	S	96.9	Very high	93.8	Very high	26 Å²	26	46.2 Å²	46.2	18%	0.182	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-72.2	-11.4	174.1	-55	0	0	0	0	113.4	L192 A194 L195 R199 E200 I201	L192-S197 WeakPolarHBondContact O-CB 3.48Å; L192-S197 PolarHBondContact O-OG 2.88Å; A194-S197 WeakPolarHBondContact O-CB 3.3Å; A194-S197 PolarHBondContact O-N 2.95Å; A194-S197 VanDerWaalsContact O-N 3.07Å; A194-S197 PolarHBondContact O-OG 3.36Å; L195-S197 PolarHBondContact O-N 3.46Å; L195-S197 VanDerWaalsContact O-N 3.16Å; S197-R199 VanDerWaalsContact C-N 3.26Å; S197-R199 PolarHBondContact O-N 2.83Å; S197-E200 PolarHBondContact O-N 3Å; S197-E200 VanDerWaalsContact O-N 3.09Å; S197-I201 PolarHBondContact O-N 3.14Å
198	S	96.6	Very high	93.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-32.1	-175.8	58.6	0	0	0	0	113	S128 C168 L195 S196 E200 I201 E202	S128-S198 WeakPolarHBondContact CB-OG 3.43Å; S128-S198 PolarHBondContact OG-OG 3Å; C168-S198 PolarHBondContact SG-N 3.08Å; C168-S198 VanDerWaalsContact SG-N 3.45Å; L195-S198 WeakPolarHBondContact O-CB 3.42Å; L195-S198 PolarHBondContact O-N 3.12Å; L195-S198 PolarHBondContact O-OG 3.09Å; S196-S198 PolarHBondContact O-N 3.25Å; S198-E200 VanDerWaalsContact C-N 3.32Å; S198-E200 PolarHBondContact O-N 2.66Å; S198-I201 WeakPolarHBondContact O-CB 3Å; S198-I201 PolarHBondContact O-N 3.09Å; S198-E202 WeakPolarHBondContact O-CG 3.24Å; S198-E202 PolarHBondContact O-N 3.05Å
199	R	94.8	Very high	93.3	Very high	55 Å²	55	54.4 Å²	54.4	21%	0.208	29%	0.288	C	S	.	.	H	α-helix	trans	-56.8	-45.4	172.9	-175.7	67.7	62.1	143.6	29.1	112.3	Y125 P126 D127 S128 S197 I201 E202 N203	Y125-R199 PolarHBondContact O-NH1 3.04Å; P126-R199 VanDerWaalsContact C-NH2 3.25Å; P126-R199 PolarHBondContact O-NH2 3.18Å; D127-R199 PolarHBondContact O-NH1 3.4Å; S128-R199 VanDerWaalsContact N-CZ 3.27Å; S197-R199 VanDerWaalsContact C-N 3.26Å; S197-R199 PolarHBondContact O-N 2.83Å; R199-I201 VanDerWaalsContact C-N 3.34Å; R199-E202 PolarHBondContact O-N 3.3Å; R199-N203 WeakPolarHBondContact O-CB 3.22Å; R199-N203 PolarHBondContact O-N 3.35Å; R199-N203 PolarHBondContact O-ND2 2.96Å
200	E	92.5	Very high	92.9	Very high	124 Å²	124	57 Å²	57	58%	0.579	30%	0.304	S	S	*	.	H	α-helix	trans	-66.2	-43	-179.8	-62.6	-168.3	165.6	0	0	110.1	S197 S198 E202 N203 L204	S197-E200 PolarHBondContact O-N 3Å; S197-E200 VanDerWaalsContact O-N 3.09Å; S198-E200 VanDerWaalsContact C-N 3.32Å; S198-E200 PolarHBondContact O-N 2.66Å; E200-E202 PolarHBondContact O-N 2.85Å; E200-N203 PolarHBondContact O-N 3.17Å; E200-L204 WeakPolarHBondContact O-CG 3.02Å; E200-L204 PolarHBondContact O-N 2.69Å; E200-L204 VanDerWaalsContact O-N 3.17Å
201	I	94.6	Very high	92.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-44.7	176.6	-63.7	175.8	0	0	0	111.7	K144 N147 C168 L192 S197 S198 R199 N203 L204 P205	K144-I201 HydrophobicContact CG-CB 4.25Å; K144-I201 HydrophobicContact CG-CD1 4.18Å; K144-I201 HydrophobicContact CG-CG2 3.89Å; N147-I201 PolarHBondContact ND2-O 3.09Å; N147-I201 WeakPolarHBondContact OD1-CG2 3.41Å; C168-I201 HydrophobicContact CB-CD1 3.97Å; L192-I201 HydrophobicContact CB-CD1 4.4Å; L192-I201 HydrophobicContact CD1-CD1 3.88Å; L192-I201 HydrophobicContact CD1-CG1 3.55Å; S197-I201 PolarHBondContact O-N 3.14Å; S198-I201 WeakPolarHBondContact O-CB 3Å; S198-I201 PolarHBondContact O-N 3.09Å; R199-I201 VanDerWaalsContact C-N 3.34Å; I201-N203 VanDerWaalsContact C-N 3.27Å; I201-N203 PolarHBondContact O-N 3.44Å; I201-L204 WeakPolarHBondContact O-CB 3.46Å; I201-L204 PolarHBondContact O-N 3.3Å; I201-P205 WeakPolarHBondContact O-CD 2.99Å
202	E	95.1	Very high	92.5	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-32	178.2	-77.7	174.8	-167.9	0	0	113	S128 N129 A130 K144 S198 R199 E200 P205	S128-E202 WeakPolarHBondContact CA-OE2 3.39Å; N129-E202 WeakPolarHBondContact CA-OE1 3.34Å; N129-E202 VanDerWaalsContact CB-OE1 3.28Å; N129-E202 WeakPolarHBondContact CB-OE1 3.4Å; N129-E202 VanDerWaalsContact N-CD 3.34Å; N129-E202 PolarHBondContact N-OE1 2.95Å; N129-E202 PolarHBondContact N-OE2 3.43Å; A130-E202 PolarHBondContact N-OE1 3.02Å; K144-E202 HydrophobicContact CD-CG 4.31Å; K144-E202 VanDerWaalsContact CE-CG 3.46Å; K144-E202 IonicContact NZ-OE1 2.85Å; K144-E202 PolarHBondContact NZ-OE1 3.42Å; S198-E202 WeakPolarHBondContact O-CG 3.24Å; S198-E202 PolarHBondContact O-N 3.05Å; R199-E202 PolarHBondContact O-N 3.3Å; E200-E202 PolarHBondContact O-N 2.85Å; E202-P205 WeakPolarHBondContact O-CD 3.45Å
203	N	91.9	Very high	92.3	Very high	10 Å²	10	62.4 Å²	62.4	5%	0.053	32%	0.321	C	S	.	.	H	α-helix	trans	-82.1	-14.9	179.2	-75.5	-28.3	0	0	0	113	R199 E200 I201 L206 R207	R199-N203 WeakPolarHBondContact O-CB 3.22Å; R199-N203 PolarHBondContact O-N 3.35Å; R199-N203 PolarHBondContact O-ND2 2.96Å; E200-N203 PolarHBondContact O-N 3.17Å; I201-N203 VanDerWaalsContact C-N 3.27Å; I201-N203 PolarHBondContact O-N 3.44Å; N203-L206 PolarHBondContact O-N 3.32Å; N203-R207 VanDerWaalsContact O-CG 3.32Å; N203-R207 WeakPolarHBondContact O-CG 3.45Å; N203-R207 PolarHBondContact O-N 3.35Å
204	L	89.6	Confident	92.2	Very high	62 Å²	62	63.7 Å²	63.7	33%	0.325	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-50.9	-178.4	-74.8	172.7	0	0	0	112.9	V148 Y166 E200 I201 L206 R207	V148-L204 HydrophobicContact CG1-CB 4.13Å; V148-L204 HydrophobicContact CG1-CD1 4.3Å; Y166-L204 HydrophobicContact CD1-CD1 4.38Å; Y166-L204 HydrophobicContact CD2-CD1 3.55Å; Y166-L204 HydrophobicContact CE1-CD1 4.44Å; Y166-L204 HydrophobicContact CE2-CD1 3.63Å; Y166-L204 HydrophobicContact CG-CD1 3.94Å; E200-L204 WeakPolarHBondContact O-CG 3.02Å; E200-L204 PolarHBondContact O-N 2.69Å; E200-L204 VanDerWaalsContact O-N 3.17Å; I201-L204 WeakPolarHBondContact O-CB 3.46Å; I201-L204 PolarHBondContact O-N 3.3Å; L204-L206 PolarHBondContact O-N 3.29Å; L204-R207 PolarHBondContact O-N 3.39Å
205	P	87.5	Confident	92.1	Very high	63 Å²	63	61.9 Å²	61.9	41%	0.409	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-24	-179.5	-22.4	35.7	0	0	0	114	V148 I201 E202	V148-P205 HydrophobicContact CG1-CG 4.02Å; I201-P205 WeakPolarHBondContact O-CD 2.99Å; E202-P205 WeakPolarHBondContact O-CD 3.45Å
206	L	86.9	Confident	92.1	Very high	59 Å²	59	64 Å²	64	31%	0.309	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.7	-176.6	-58.3	178.8	0	0	0	113.1	N119 V122 N203 L204 L208	N119-L206 WeakPolarHBondContact O-CD2 3.44Å; V122-L206 HydrophobicContact CG2-CB 3.92Å; V122-L206 HydrophobicContact CG2-CD1 4.1Å; N203-L206 PolarHBondContact O-N 3.32Å; L204-L206 PolarHBondContact O-N 3.29Å; L206-L208 PolarHBondContact O-N 2.92Å
207	R	85.5	Confident	92.1	Very high	129 Å²	129	64.8 Å²	64.8	49%	0.487	33%	0.333	S	S	.	.			trans	-86.4	108.3	-177.9	-74.6	171.3	-178.3	-173.9	3.2	110.6	N203 L204 T210	N203-R207 VanDerWaalsContact O-CG 3.32Å; N203-R207 WeakPolarHBondContact O-CG 3.45Å; N203-R207 PolarHBondContact O-N 3.35Å; L204-R207 PolarHBondContact O-N 3.39Å; R207-T210 HydrophobicContact CB-CG2 3.96Å; R207-T210 HydrophobicContact CG-CG2 4Å
208	L	86.4	Confident	92.1	Very high	125 Å²	125	66.5 Å²	66.5	65%	0.654	34%	0.339	S	S	*	.			trans	-99	109.2	169.8	-171.6	67.4	0	0	0	111	L206 T210	L206-L208 PolarHBondContact O-N 2.92Å; L208-T210 VanDerWaalsContact C-N 3.28Å; L208-T210 PolarHBondContact O-N 2.53Å; L208-T210 VanDerWaalsContact O-N 3.07Å
209	F	87.6	Confident	92.1	Very high	142 Å²	142	66.6 Å²	66.6	62%	0.623	34%	0.34	S	S	*	.	S	Bend	trans	45.2	43.6	170.3	-64.7	-63.6	0	0	0	115.2	L211 W212 K213	F209-L211 VanDerWaalsContact C-N 3.34Å; F209-L211 PolarHBondContact O-N 2.93Å; F209-W212 HydrophobicContact CB-CB 4.04Å; F209-W212 HydrophobicContact CB-CG 4.34Å; F209-W212 AromaticContact CD1-CD1 3.79Å; F209-W212 HydrophobicContact CD1-CG 4.4Å; F209-W212 WeakPolarHBondContact O-CB 3.31Å; F209-W212 PolarHBondContact O-N 2.91Å; F209-K213 PolarHBondContact O-N 3.21Å
210	T	87.4	Confident	92.3	Very high	80 Å²	80	68.8 Å²	68.8	49%	0.491	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-54.4	-44.3	-171.3	52.4	0	0	0	0	113.8	R207 L208 W212	R207-T210 HydrophobicContact CB-CG2 3.96Å; R207-T210 HydrophobicContact CG-CG2 4Å; L208-T210 VanDerWaalsContact C-N 3.28Å; L208-T210 PolarHBondContact O-N 2.53Å; L208-T210 VanDerWaalsContact O-N 3.07Å; T210-W212 VanDerWaalsContact C-N 3.28Å; T210-W212 PolarHBondContact O-N 3.32Å
211	L	90.1	Very high	92.6	Very high	73 Å²	73	66.1 Å²	66.1	38%	0.382	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-73.8	-14.4	177.9	-64	177.9	0	0	0	114.2	F209 P215 Q304	F209-L211 VanDerWaalsContact C-N 3.34Å; F209-L211 PolarHBondContact O-N 2.93Å; L211-P215 VanDerWaalsContact O-CD 3.31Å; L211-P215 WeakPolarHBondContact O-CD 3.48Å; L211-P215 WeakPolarHBondContact O-CG 3.34Å; L211-Q304 HydrophobicContact CB-CG 4.41Å
212	W	94.5	Very high	92.7	Very high	78 Å²	78	67.9 Å²	67.9	30%	0.295	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-91.5	-21	179.2	-68.1	85	0	0	0	113.1	F209 T210 G214 P215 V216 Q304 L307 L308	F209-W212 HydrophobicContact CB-CB 4.04Å; F209-W212 HydrophobicContact CB-CG 4.34Å; F209-W212 AromaticContact CD1-CD1 3.79Å; F209-W212 HydrophobicContact CD1-CG 4.4Å; F209-W212 WeakPolarHBondContact O-CB 3.31Å; F209-W212 PolarHBondContact O-N 2.91Å; T210-W212 VanDerWaalsContact C-N 3.28Å; T210-W212 PolarHBondContact O-N 3.32Å; W212-G214 PolarHBondContact O-N 3.37Å; W212-P215 WeakPolarHBondContact O-CD 3.39Å; W212-V216 HydrophobicContact CB-CG2 4.24Å; W212-V216 HydrophobicContact CE3-CG2 4.34Å; W212-V216 VanDerWaalsContact O-CB 3.31Å; W212-V216 WeakPolarHBondContact O-CB 3.5Å; W212-V216 VanDerWaalsContact O-CG2 3.24Å; W212-V216 WeakPolarHBondContact O-CG2 3.45Å; W212-V216 PolarHBondContact O-N 2.79Å; W212-Q304 HydrophobicContact CD2-CB 4.07Å; W212-Q304 HydrophobicContact CD2-CG 3.57Å; W212-Q304 HydrophobicContact CE3-CB 4Å; W212-Q304 HydrophobicContact CE3-CG 4.03Å; W212-Q304 HydrophobicContact CG-CG 3.85Å; W212-Q304 HydrophobicContact CH2-CG 4.48Å; W212-Q304 HydrophobicContact CZ2-CG 4.07Å; W212-Q304 HydrophobicContact CZ3-CB 4.27Å; W212-Q304 HydrophobicContact CZ3-CG 4.47Å; W212-L307 HydrophobicContact CH2-CB 3.87Å; W212-L307 HydrophobicContact CH2-CD1 3.76Å; W212-L307 HydrophobicContact CH2-CG 4.49Å; W212-L307 HydrophobicContact CZ2-CD1 3.98Å; W212-L307 HydrophobicContact CZ3-CB 4.44Å; W212-L308 HydrophobicContact CE3-CG 4.42Å; W212-L308 HydrophobicContact CZ3-CD2 4.17Å; W212-L308 HydrophobicContact CZ3-CG 4Å
213	K	92.5	Very high	92.9	Very high	135 Å²	135	68.9 Å²	68.9	59%	0.587	37%	0.367	S	S	*	.	H	α-helix	trans	-52.3	-54	-176.8	-69.2	-174.9	178.1	-176.1	0	112.1	F209 V217	F209-K213 PolarHBondContact O-N 3.21Å; K213-V217 WeakPolarHBondContact O-CB 3.33Å; K213-V217 VanDerWaalsContact O-CG2 3.26Å; K213-V217 WeakPolarHBondContact O-CG2 3.33Å; K213-V217 PolarHBondContact O-N 3.07Å
214	G	93.3	Very high	93.2	Very high	47 Å²	47	71.9 Å²	71.9	49%	0.485	39%	0.386	S	S	.	.	H	α-helix	trans	-60.1	-56.4	178.5	0	0	0	0	0	113.1	W212 V216 V217 M218	W212-G214 PolarHBondContact O-N 3.37Å; G214-V216 VanDerWaalsContact C-N 3.34Å; G214-V216 PolarHBondContact O-N 2.97Å; G214-V217 PolarHBondContact O-N 3.13Å; G214-M218 WeakPolarHBondContact O-CB 3.43Å; G214-M218 PolarHBondContact O-N 2.9Å
215	P	96.7	Very high	93.6	Very high	4 Å²	4	74.7 Å²	74.7	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-53.2	-43.4	176.4	-33.3	39.4	0	0	0	115	L211 W212 M218 A219 C301 Q304 L305 L308	L211-P215 VanDerWaalsContact O-CD 3.31Å; L211-P215 WeakPolarHBondContact O-CD 3.48Å; L211-P215 WeakPolarHBondContact O-CG 3.34Å; W212-P215 WeakPolarHBondContact O-CD 3.39Å; P215-M218 PolarHBondContact O-N 3.35Å; P215-A219 WeakPolarHBondContact O-CB 3.46Å; P215-A219 PolarHBondContact O-N 3.26Å; P215-C301 HydrophobicContact CG-CB 3.78Å; P215-Q304 HydrophobicContact CB-CB 4.01Å; P215-Q304 HydrophobicContact CG-CB 3.77Å; P215-L305 HydrophobicContact CB-CD2 3.68Å; P215-L305 HydrophobicContact CB-CG 4.21Å; P215-L305 HydrophobicContact CG-CD2 4.05Å; P215-L305 HydrophobicContact CG-CG 4.17Å; P215-L308 HydrophobicContact CB-CD1 3.67Å; P215-L308 WeakPolarHBondContact O-CD1 3.28Å
216	V	97.2	Very high	94	Very high	54 Å²	54	72.4 Å²	72.4	33%	0.327	38%	0.38	S	S	.	.	H	α-helix	trans	-69	-46.8	-179.4	170.4	0	0	0	0	111.1	W212 G214 M218 A219 I220 L308	W212-V216 HydrophobicContact CB-CG2 4.24Å; W212-V216 HydrophobicContact CE3-CG2 4.34Å; W212-V216 VanDerWaalsContact O-CB 3.31Å; W212-V216 WeakPolarHBondContact O-CB 3.5Å; W212-V216 VanDerWaalsContact O-CG2 3.24Å; W212-V216 WeakPolarHBondContact O-CG2 3.45Å; W212-V216 PolarHBondContact O-N 2.79Å; G214-V216 VanDerWaalsContact C-N 3.34Å; G214-V216 PolarHBondContact O-N 2.97Å; V216-M218 VanDerWaalsContact C-N 3.27Å; V216-M218 PolarHBondContact O-N 3.3Å; V216-A219 PolarHBondContact O-N 2.92Å; V216-I220 HydrophobicContact CG1-CD1 3.71Å; V216-I220 HydrophobicContact CG1-CG1 4.39Å; V216-I220 WeakPolarHBondContact O-CG1 3.48Å; V216-I220 PolarHBondContact O-N 3.43Å; V216-L308 HydrophobicContact CG2-CD1 4.18Å
217	V	96.4	Very high	94.6	Very high	93 Å²	93	72.8 Å²	72.8	56%	0.564	38%	0.379	S	S	*	.	H	α-helix	trans	-58.9	-42.9	176.3	169.7	0	0	0	0	110.6	K213 G214 I220 S221	K213-V217 WeakPolarHBondContact O-CB 3.33Å; K213-V217 VanDerWaalsContact O-CG2 3.26Å; K213-V217 WeakPolarHBondContact O-CG2 3.33Å; K213-V217 PolarHBondContact O-N 3.07Å; G214-V217 PolarHBondContact O-N 3.13Å; V217-I220 PolarHBondContact O-N 2.71Å; V217-S221 WeakPolarHBondContact O-CB 3.4Å; V217-S221 PolarHBondContact O-N 2.97Å; V217-S221 PolarHBondContact O-OG 3.36Å
218	M	96.6	Very high	95.1	Very high	62 Å²	62	70.6 Å²	70.6	31%	0.305	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-44.5	176.9	-175.5	166.9	62.2	0	0	112.2	G214 P215 V216 S221 L222 L266 L269 L305	G214-M218 WeakPolarHBondContact O-CB 3.43Å; G214-M218 PolarHBondContact O-N 2.9Å; P215-M218 PolarHBondContact O-N 3.35Å; V216-M218 VanDerWaalsContact C-N 3.27Å; V216-M218 PolarHBondContact O-N 3.3Å; M218-S221 PolarHBondContact O-N 3.49Å; M218-L222 HydrophobicContact CG-CD1 4Å; M218-L222 HydrophobicContact CG-CG 4.43Å; M218-L222 WeakPolarHBondContact O-CB 3.49Å; M218-L222 VanDerWaalsContact O-CG 3.31Å; M218-L222 WeakPolarHBondContact O-CG 3.31Å; M218-L222 PolarHBondContact O-N 3.04Å; M218-L266 HydrophobicContact CE-CD2 4.06Å; M218-L269 HydrophobicContact CE-CD1 3.65Å; M218-L269 HydrophobicContact SD-CD1 3.6Å; M218-L305 HydrophobicContact CE-CD1 4.11Å; M218-L305 HydrophobicContact CE-CD2 3.1Å; M218-L305 HydrophobicContact CE-CG 4.24Å
219	A	97.9	Very high	95.6	Very high	3 Å²	3	66.3 Å²	66.3	3%	0.025	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-43.6	177.9	0	0	0	0	0	112.4	P215 V216 L222 A223 L266 L308 F312	P215-A219 WeakPolarHBondContact O-CB 3.46Å; P215-A219 PolarHBondContact O-N 3.26Å; V216-A219 PolarHBondContact O-N 2.92Å; A219-L222 PolarHBondContact O-N 2.94Å; A219-A223 VanDerWaalsContact O-CB 3.24Å; A219-A223 WeakPolarHBondContact O-CB 3.38Å; A219-A223 PolarHBondContact O-N 3.34Å; A219-L266 HydrophobicContact CB-CD1 3.91Å; A219-L266 HydrophobicContact CB-CD2 4.34Å; A219-L308 HydrophobicContact CB-CD1 4.12Å; A219-F312 HydrophobicContact CB-CE2 3.88Å; A219-F312 HydrophobicContact CB-CZ 4.36Å
220	I	98.1	Very high	96	Very high	100 Å²	100	59.5 Å²	59.5	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-42.6	176	-67.7	168.8	0	0	0	110.7	V216 V217 A223 T224	V216-I220 HydrophobicContact CG1-CD1 3.71Å; V216-I220 HydrophobicContact CG1-CG1 4.39Å; V216-I220 WeakPolarHBondContact O-CG1 3.48Å; V216-I220 PolarHBondContact O-N 3.43Å; V217-I220 PolarHBondContact O-N 2.71Å; I220-A223 PolarHBondContact O-N 2.87Å; I220-T224 WeakPolarHBondContact O-CB 3.4Å; I220-T224 PolarHBondContact O-N 3.29Å; I220-T224 PolarHBondContact O-OG1 3.07Å
221	S	98.2	Very high	96.4	Very high	68 Å²	68	58.1 Å²	58.1	48%	0.476	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-46.9	179	-57.4	0	0	0	0	111.3	V217 M218 T224 F225	V217-S221 WeakPolarHBondContact O-CB 3.4Å; V217-S221 PolarHBondContact O-N 2.97Å; V217-S221 PolarHBondContact O-OG 3.36Å; M218-S221 PolarHBondContact O-N 3.49Å; S221-T224 PolarHBondContact O-N 2.9Å; S221-F225 WeakPolarHBondContact O-CB 3.31Å; S221-F225 PolarHBondContact O-N 2.83Å
222	L	97.7	Very high	96.7	Very high	37 Å²	37	58.3 Å²	58.3	19%	0.194	31%	0.309	C	S	.	.	H	α-helix	trans	-62.4	-44.3	175.5	-72.4	171.7	0	0	0	111.7	M218 A219 F225 F226 V262 T265 L266 L269	M218-L222 HydrophobicContact CG-CD1 4Å; M218-L222 HydrophobicContact CG-CG 4.43Å; M218-L222 WeakPolarHBondContact O-CB 3.49Å; M218-L222 VanDerWaalsContact O-CG 3.31Å; M218-L222 WeakPolarHBondContact O-CG 3.31Å; M218-L222 PolarHBondContact O-N 3.04Å; A219-L222 PolarHBondContact O-N 2.94Å; L222-F225 PolarHBondContact O-N 2.8Å; L222-F226 HydrophobicContact CD2-CE2 4.24Å; L222-F226 VanDerWaalsContact O-CD2 3.26Å; L222-F226 WeakPolarHBondContact O-CD2 3.47Å; L222-F226 PolarHBondContact O-N 2.88Å; L222-V262 HydrophobicContact CB-CG2 4.34Å; L222-T265 HydrophobicContact CD1-CG2 3.89Å; L222-T265 HydrophobicContact CD2-CG2 4.34Å; L222-L266 HydrophobicContact CD1-CD2 4.1Å; L222-L269 HydrophobicContact CD1-CD1 4.38Å
223	A	98.1	Very high	96.6	Very high	22 Å²	22	55.2 Å²	55.2	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-45.6	177.8	0	0	0	0	0	111.6	A219 I220 F227 T258 V262	A219-A223 VanDerWaalsContact O-CB 3.24Å; A219-A223 WeakPolarHBondContact O-CB 3.38Å; A219-A223 PolarHBondContact O-N 3.34Å; I220-A223 PolarHBondContact O-N 2.87Å; A223-F227 WeakPolarHBondContact O-CB 3.37Å; A223-F227 PolarHBondContact O-N 3.36Å; A223-T258 HydrophobicContact CB-CG2 4.42Å; A223-T258 WeakPolarHBondContact O-CG2 3.25Å; A223-V262 HydrophobicContact CB-CG2 3.95Å
224	T	98.3	Very high	96.6	Very high	73 Å²	73	49.2 Å²	49.2	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-46.8	177.5	-55.9	0	0	0	0	110.9	I220 S221 F227 I228	I220-T224 WeakPolarHBondContact O-CB 3.4Å; I220-T224 PolarHBondContact O-N 3.29Å; I220-T224 PolarHBondContact O-OG1 3.07Å; S221-T224 PolarHBondContact O-N 2.9Å; T224-F227 PolarHBondContact O-N 3.22Å; T224-I228 HydrophobicContact CG2-CD1 3.83Å; T224-I228 WeakPolarHBondContact O-CB 3.39Å; T224-I228 VanDerWaalsContact O-CG1 3.28Å; T224-I228 WeakPolarHBondContact O-CG1 3.39Å; T224-I228 PolarHBondContact O-N 3.12Å
225	F	97.9	Very high	96.6	Very high	122 Å²	122	47 Å²	47	54%	0.535	25%	0.249	S	C	.	.	H	α-helix	trans	-58.9	-53.6	177.9	174	-97.5	0	0	0	112.2	S221 L222 F227 I228 Y229	S221-F225 WeakPolarHBondContact O-CB 3.31Å; S221-F225 PolarHBondContact O-N 2.83Å; L222-F225 PolarHBondContact O-N 2.8Å; F225-F227 VanDerWaalsContact C-N 3.32Å; F225-F227 PolarHBondContact O-N 3.18Å; F225-I228 PolarHBondContact O-N 3.34Å; F225-Y229 WeakPolarHBondContact O-CB 3.39Å; F225-Y229 PolarHBondContact O-N 3.34Å
226	F	97.7	Very high	96.5	Very high	15 Å²	15	49.1 Å²	49.1	7%	0.066	26%	0.26	C	S	.	.	H	α-helix	trans	-71	-27.8	-177.6	-77.4	-63.4	0	0	0	113.3	L222 S230 T258 I261 V262 L434	L222-F226 HydrophobicContact CD2-CE2 4.24Å; L222-F226 VanDerWaalsContact O-CD2 3.26Å; L222-F226 WeakPolarHBondContact O-CD2 3.47Å; L222-F226 PolarHBondContact O-N 2.88Å; F226-S230 VanDerWaalsContact O-CB 3.3Å; F226-S230 WeakPolarHBondContact O-CB 3.34Å; F226-S230 PolarHBondContact O-N 3.39Å; F226-S230 PolarHBondContact O-OG 3.44Å; F226-T258 HydrophobicContact CB-CG2 4.02Å; F226-I261 HydrophobicContact CD1-CD1 4.43Å; F226-I261 HydrophobicContact CD1-CG2 3.74Å; F226-I261 HydrophobicContact CD2-CG2 3.6Å; F226-I261 HydrophobicContact CE1-CG2 3.66Å; F226-I261 HydrophobicContact CE2-CG2 3.52Å; F226-I261 HydrophobicContact CG-CB 4.46Å; F226-I261 HydrophobicContact CG-CG2 3.72Å; F226-I261 HydrophobicContact CZ-CG2 3.54Å; F226-V262 HydrophobicContact CD2-CG2 4.48Å; F226-L434 HydrophobicContact CE1-CB 4.2Å; F226-L434 HydrophobicContact CE1-CD1 4.39Å
227	F	97.9	Very high	96.3	Very high	66 Å²	66	47.4 Å²	47.4	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-52.4	171.1	-179	-88.8	0	0	0	110.7	A223 T224 F225 Y229 S230 F231 I250 I254 V255 T258	A223-F227 WeakPolarHBondContact O-CB 3.37Å; A223-F227 PolarHBondContact O-N 3.36Å; T224-F227 PolarHBondContact O-N 3.22Å; F225-F227 VanDerWaalsContact C-N 3.32Å; F225-F227 PolarHBondContact O-N 3.18Å; F227-Y229 VanDerWaalsContact C-N 3.31Å; F227-Y229 PolarHBondContact O-N 3.18Å; F227-S230 PolarHBondContact O-N 3.49Å; F227-F231 WeakPolarHBondContact O-CB 3.49Å; F227-F231 PolarHBondContact O-N 3.27Å; F227-I250 HydrophobicContact CE2-CG2 4.45Å; F227-I250 HydrophobicContact CZ-CG2 3.94Å; F227-I254 HydrophobicContact CD2-CG2 3.69Å; F227-I254 HydrophobicContact CE2-CB 4.34Å; F227-I254 HydrophobicContact CE2-CG2 3.66Å; F227-I254 HydrophobicContact CG-CG2 4.31Å; F227-I254 HydrophobicContact CZ-CG2 4.27Å; F227-V255 HydrophobicContact CE2-CG2 4.27Å; F227-T258 WeakPolarHBondContact CA-OG1 3.48Å; F227-T258 HydrophobicContact CB-CG2 4.14Å
228	I	97.6	Very high	96.1	Very high	84 Å²	84	43.3 Å²	43.3	43%	0.431	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-45.1	177.6	-68.8	169.1	0	0	0	110.1	T224 F225 S230 F231 I232	T224-I228 HydrophobicContact CG2-CD1 3.83Å; T224-I228 WeakPolarHBondContact O-CB 3.39Å; T224-I228 VanDerWaalsContact O-CG1 3.28Å; T224-I228 WeakPolarHBondContact O-CG1 3.39Å; T224-I228 PolarHBondContact O-N 3.12Å; F225-I228 PolarHBondContact O-N 3.34Å; I228-S230 PolarHBondContact O-N 3.4Å; I228-F231 PolarHBondContact O-N 2.85Å; I228-I232 HydrophobicContact CG2-CD1 3.68Å; I228-I232 HydrophobicContact CG2-CG1 4.32Å; I228-I232 VanDerWaalsContact O-CG1 3.29Å; I228-I232 WeakPolarHBondContact O-CG1 3.28Å; I228-I232 PolarHBondContact O-N 3.49Å
229	Y	96.8	Very high	95.9	Very high	34 Å²	34	45.2 Å²	45.2	13%	0.133	23%	0.228	C	C	.	.	H	α-helix	trans	-57.5	-49.2	177.4	-176.8	-103.5	0	0	0	112.3	F225 F227 R233 T428 P429 L434	F225-Y229 WeakPolarHBondContact O-CB 3.39Å; F225-Y229 PolarHBondContact O-N 3.34Å; F227-Y229 VanDerWaalsContact C-N 3.31Å; F227-Y229 PolarHBondContact O-N 3.18Å; Y229-R233 WeakPolarHBondContact O-CB 3.12Å; Y229-R233 PolarHBondContact O-N 3.44Å; Y229-R233 VanDerWaalsContact O-N 3.13Å; Y229-T428 HydrophobicContact CE2-CG2 4.38Å; Y229-T428 WeakPolarHBondContact OH-CB 3.41Å; Y229-P429 VanDerWaalsContact OH-CD 3.29Å; Y229-P429 WeakPolarHBondContact OH-CD 3.43Å; Y229-P429 PolarHBondContact OH-O 3.24Å; Y229-L434 HydrophobicContact CD1-CD1 4.15Å; Y229-L434 HydrophobicContact CE1-CD1 3.48Å; Y229-L434 VanDerWaalsContact CE1-CD1 3.48Å; Y229-L434 HydrophobicContact CE2-CD1 4.01Å; Y229-L434 VanDerWaalsContact CZ-CD1 3.43Å
230	S	95.8	Very high	95.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.9	-35.7	179.9	-55.2	0	0	0	0	111.7	F226 F227 I228 R233 D234 S431	F226-S230 VanDerWaalsContact O-CB 3.3Å; F226-S230 WeakPolarHBondContact O-CB 3.34Å; F226-S230 PolarHBondContact O-N 3.39Å; F226-S230 PolarHBondContact O-OG 3.44Å; F227-S230 PolarHBondContact O-N 3.49Å; I228-S230 PolarHBondContact O-N 3.4Å; S230-R233 PolarHBondContact O-N 3.2Å; S230-D234 VanDerWaalsContact O-CB 3.24Å; S230-D234 WeakPolarHBondContact O-CB 3.13Å; S230-D234 PolarHBondContact O-N 3.1Å; S230-S431 PolarHBondContact OG-OG 3.07Å; S230-S431 VanDerWaalsContact OG-OG 3.06Å
231	F	95.8	Very high	95.3	Very high	50 Å²	50	53.2 Å²	53.2	22%	0.219	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-47.6	175.2	174.7	-107.7	0	0	0	112	F227 I228 R233 V235 I236 F247 I250 I254	F227-F231 WeakPolarHBondContact O-CB 3.49Å; F227-F231 PolarHBondContact O-N 3.27Å; I228-F231 PolarHBondContact O-N 2.85Å; F231-R233 VanDerWaalsContact C-N 3.3Å; F231-R233 PolarHBondContact O-N 3.43Å; F231-V235 HydrophobicContact CD2-CB 3.82Å; F231-V235 HydrophobicContact CD2-CG1 4.31Å; F231-V235 HydrophobicContact CD2-CG2 3.83Å; F231-V235 HydrophobicContact CE2-CB 3.81Å; F231-V235 HydrophobicContact CE2-CG1 3.79Å; F231-V235 HydrophobicContact CE2-CG2 4.14Å; F231-V235 HydrophobicContact CZ-CG1 4.5Å; F231-V235 WeakPolarHBondContact O-CA 3.29Å; F231-V235 WeakPolarHBondContact O-CB 3.49Å; F231-V235 PolarHBondContact O-N 3.03Å; F231-I236 HydrophobicContact CD1-CG1 4.05Å; F231-I236 HydrophobicContact CE1-CD1 3.64Å; F231-I236 HydrophobicContact CE1-CG1 3.65Å; F231-I236 HydrophobicContact CZ-CD1 3.65Å; F231-I236 HydrophobicContact CZ-CG1 4.05Å; F231-I236 PolarHBondContact O-N 2.87Å; F231-I236 VanDerWaalsContact O-N 3.11Å; F231-F247 HydrophobicContact CE2-CE1 4.45Å; F231-F247 HydrophobicContact CZ-CE1 4.34Å; F231-I250 HydrophobicContact CD2-CD1 4.26Å; F231-I250 HydrophobicContact CD2-CG1 4.1Å; F231-I250 HydrophobicContact CE2-CD1 3.72Å; F231-I250 HydrophobicContact CE2-CG1 4.04Å; F231-I254 HydrophobicContact CB-CG2 4.43Å
232	I	95.3	Very high	94.8	Very high	77 Å²	77	54.3 Å²	54.3	40%	0.395	26%	0.261	S	S	.	.	I	π-helix	trans	-59.1	-45.7	176.6	-69.3	168	0	0	0	110.2	I228 I236 H237	I228-I232 HydrophobicContact CG2-CD1 3.68Å; I228-I232 HydrophobicContact CG2-CG1 4.32Å; I228-I232 VanDerWaalsContact O-CG1 3.29Å; I228-I232 WeakPolarHBondContact O-CG1 3.28Å; I228-I232 PolarHBondContact O-N 3.49Å; I232-I236 WeakPolarHBondContact O-CB 3.35Å; I232-I236 PolarHBondContact O-N 3.48Å; I232-H237 PolarHBondContact O-N 3.36Å
233	R	93.8	Very high	94.4	Very high	13 Å²	13	59.4 Å²	59.4	5%	0.049	28%	0.284	C	S	.	.	I	π-helix	trans	-75.1	-38	-174.7	-158.3	-171.7	57	-114.4	-14	113.7	Y229 S230 F231 R425 P429 S431	Y229-R233 WeakPolarHBondContact O-CB 3.12Å; Y229-R233 PolarHBondContact O-N 3.44Å; Y229-R233 VanDerWaalsContact O-N 3.13Å; S230-R233 PolarHBondContact O-N 3.2Å; F231-R233 VanDerWaalsContact C-N 3.3Å; F231-R233 PolarHBondContact O-N 3.43Å; R233-R425 HydrophobicContact CG-CB 3.62Å; R233-R425 HydrophobicContact CG-CG 4.31Å; R233-R425 WeakPolarHBondContact O-CD 3.26Å; R233-R425 PolarHBondContact O-NH1 3.02Å; R233-P429 PolarHBondContact NH1-O 3.24Å; R233-P429 VanDerWaalsContact NH1-O 3.13Å; R233-S431 VanDerWaalsContact CZ-OG 3.24Å; R233-S431 PolarHBondContact NH1-OG 2.72Å; R233-S431 PolarHBondContact NH2-OG 2.97Å
234	D	91.4	Very high	93.7	Very high	9 Å²	9	63.3 Å²	63.3	5%	0.048	30%	0.298	C	S	.	.	I	π-helix	trans	-104.3	-16	-168.1	-59.6	-23.2	0	0	0	113.7	S230 I254 K257 R425	S230-D234 VanDerWaalsContact O-CB 3.24Å; S230-D234 WeakPolarHBondContact O-CB 3.13Å; S230-D234 PolarHBondContact O-N 3.1Å; D234-I254 HydrophobicContact CB-CD1 3.75Å; D234-K257 VanDerWaalsContact OD2-CD 3.27Å; D234-K257 WeakPolarHBondContact OD2-CD 3.47Å; D234-K257 WeakPolarHBondContact OD2-CE 3.25Å; D234-K257 IonicContact OD2-NZ 3.36Å; D234-K257 PolarHBondContact OD2-NZ 3.36Å; D234-R425 IonicContact OD1-NH1 3Å
235	V	93.6	Very high	93.2	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.006	30%	0.304	C	S	.	.	I	π-helix	trans	-116.8	-52.6	176	-174.6	0	0	0	0	111.4	F231 P238 Y239 F247 I250 I254	F231-V235 HydrophobicContact CD2-CB 3.82Å; F231-V235 HydrophobicContact CD2-CG1 4.31Å; F231-V235 HydrophobicContact CD2-CG2 3.83Å; F231-V235 HydrophobicContact CE2-CB 3.81Å; F231-V235 HydrophobicContact CE2-CG1 3.79Å; F231-V235 HydrophobicContact CE2-CG2 4.14Å; F231-V235 HydrophobicContact CZ-CG1 4.5Å; F231-V235 WeakPolarHBondContact O-CA 3.29Å; F231-V235 WeakPolarHBondContact O-CB 3.49Å; F231-V235 PolarHBondContact O-N 3.03Å; V235-P238 WeakPolarHBondContact O-CD 3.33Å; V235-Y239 VanDerWaalsContact O-CB 3.3Å; V235-Y239 WeakPolarHBondContact O-CB 3.33Å; V235-Y239 PolarHBondContact O-N 3.29Å; V235-F247 HydrophobicContact CG1-CD1 4.14Å; V235-F247 HydrophobicContact CG1-CD2 4.33Å; V235-F247 HydrophobicContact CG1-CE1 4.2Å; V235-F247 HydrophobicContact CG1-CE2 4.4Å; V235-F247 HydrophobicContact CG1-CG 4.19Å; V235-F247 HydrophobicContact CG1-CZ 4.33Å; V235-I250 HydrophobicContact CG2-CG1 4.33Å; V235-I254 HydrophobicContact CG2-CD1 4.08Å; V235-I254 HydrophobicContact CG2-CG1 4.16Å
236	I	94.7	Very high	92.8	Very high	48 Å²	48	59.1 Å²	59.1	25%	0.246	29%	0.285	C	S	.	.	I	π-helix	trans	-70.9	-45	-175	-57.8	-60.1	0	0	0	112.2	F231 I232 Y239 V240	F231-I236 HydrophobicContact CD1-CG1 4.05Å; F231-I236 HydrophobicContact CE1-CD1 3.64Å; F231-I236 HydrophobicContact CE1-CG1 3.65Å; F231-I236 HydrophobicContact CZ-CD1 3.65Å; F231-I236 HydrophobicContact CZ-CG1 4.05Å; F231-I236 PolarHBondContact O-N 2.87Å; F231-I236 VanDerWaalsContact O-N 3.11Å; I232-I236 WeakPolarHBondContact O-CB 3.35Å; I232-I236 PolarHBondContact O-N 3.48Å; I236-Y239 WeakPolarHBondContact O-CB 3.24Å; I236-Y239 PolarHBondContact O-N 2.85Å; I236-V240 HydrophobicContact CG2-CG2 4Å; I236-V240 WeakPolarHBondContact O-CG2 3.24Å; I236-V240 PolarHBondContact O-N 2.85Å
237	H	93.3	Very high	92.6	Very high	18 Å²	18	62.4 Å²	62.4	8%	0.083	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-51.4	179.8	172.6	-75.5	0	0	0	113	I232 Y239 V240 R241 R425 F426	I232-H237 PolarHBondContact O-N 3.36Å; H237-Y239 VanDerWaalsContact C-N 3.3Å; H237-Y239 PolarHBondContact O-N 2.99Å; H237-V240 PolarHBondContact O-N 3.37Å; H237-R241 WeakPolarHBondContact O-CB 3.27Å; H237-R241 PolarHBondContact O-N 3.08Å; H237-R425 HydrophobicContact CB-CB 4.41Å; H237-F426 HydrophobicContact CB-CD2 3.92Å; H237-F426 HydrophobicContact CB-CE2 3.44Å; H237-F426 VanDerWaalsContact CB-CE2 3.44Å; H237-F426 HydrophobicContact CB-CZ 3.87Å; H237-F426 AromaticContact CD2-CD1 3.58Å; H237-F426 AromaticContact CD2-CD2 3.74Å; H237-F426 AromaticContact CD2-CE1 3.48Å; H237-F426 VanDerWaalsContact CD2-CE1 3.48Å; H237-F426 WeakPolarHBondContact CD2-CE1 3.48Å; H237-F426 AromaticContact CD2-CE2 3.68Å; H237-F426 AromaticContact CD2-CG 3.69Å; H237-F426 AromaticContact CD2-CZ 3.53Å; H237-F426 AromaticContact CG-CE2 3.94Å; H237-F426 AromaticContact CG-CZ 3.99Å
238	P	91.1	Very high	92.3	Very high	8 Å²	8	65.2 Å²	65.2	5%	0.052	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-37.2	174.8	-25.1	35.5	0	0	0	113.6	V235 N242	V235-P238 WeakPolarHBondContact O-CD 3.33Å; P238-N242 WeakPolarHBondContact O-CA 3.26Å; P238-N242 WeakPolarHBondContact O-CB 3.31Å; P238-N242 PolarHBondContact O-N 3.06Å
239	Y	92.8	Very high	92.1	Very high	101 Å²	101	62.9 Å²	62.9	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-47.2	177.3	-178.6	-104.2	0	0	0	111.8	V235 I236 H237 Q243 Q244 F247	V235-Y239 VanDerWaalsContact O-CB 3.3Å; V235-Y239 WeakPolarHBondContact O-CB 3.33Å; V235-Y239 PolarHBondContact O-N 3.29Å; I236-Y239 WeakPolarHBondContact O-CB 3.24Å; I236-Y239 PolarHBondContact O-N 2.85Å; H237-Y239 VanDerWaalsContact C-N 3.3Å; H237-Y239 PolarHBondContact O-N 2.99Å; Y239-Q243 VanDerWaalsContact O-CA 3.23Å; Y239-Q243 WeakPolarHBondContact O-CA 3.37Å; Y239-Q243 PolarHBondContact O-N 2.84Å; Y239-Q244 WeakPolarHBondContact CA-O 3.42Å; Y239-F247 HydrophobicContact CD2-CE2 4.15Å; Y239-F247 HydrophobicContact CE2-CE2 4.39Å
240	V	93	Very high	92	Very high	86 Å²	86	63.5 Å²	63.5	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-68	-42.1	179.8	173.1	0	0	0	0	112	I236 H237	I236-V240 HydrophobicContact CG2-CG2 4Å; I236-V240 WeakPolarHBondContact O-CG2 3.24Å; I236-V240 PolarHBondContact O-N 2.85Å; H237-V240 PolarHBondContact O-N 3.37Å
241	R	90.5	Very high	92	Very high	186 Å²	186	67.4 Å²	67.4	70%	0.702	33%	0.326	S	S	*	.	H	α-helix	trans	-83.4	-40.7	-173	-167.2	172.5	-178.5	158	-2.1	113.5	H237	H237-R241 WeakPolarHBondContact O-CB 3.27Å; H237-R241 PolarHBondContact O-N 3.08Å
242	N	88.1	Confident	92	Very high	91 Å²	91	67.5 Å²	67.5	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-116.3	-0.7	-169.6	-60	-10.5	0	0	0	113.2	P238 Q244	P238-N242 WeakPolarHBondContact O-CA 3.26Å; P238-N242 WeakPolarHBondContact O-CB 3.31Å; P238-N242 PolarHBondContact O-N 3.06Å; N242-Q244 HydrophobicContact CB-CB 4.44Å; N242-Q244 HydrophobicContact CB-CG 4.01Å; N242-Q244 PolarHBondContact O-N 2.83Å; N242-Q244 VanDerWaalsContact O-N 3.13Å
243	Q	88.6	Confident	91.9	Very high	144 Å²	144	65.4 Å²	65.4	67%	0.673	32%	0.317	S	S	*	.			trans	55.3	26.5	-174.2	-61.7	-68.8	-19	0	0	113.4	Y239	Y239-Q243 VanDerWaalsContact O-CA 3.23Å; Y239-Q243 WeakPolarHBondContact O-CA 3.37Å; Y239-Q243 PolarHBondContact O-N 2.84Å
244	Q	83.9	Confident	92	Very high	104 Å²	104	64.8 Å²	64.8	49%	0.486	32%	0.315	S	S	.	.			trans	-92.6	125.4	179.2	-72.9	176.5	-13.9	0	0	110.6	Y239 N242 D246	Y239-Q244 WeakPolarHBondContact CA-O 3.42Å; N242-Q244 HydrophobicContact CB-CB 4.44Å; N242-Q244 HydrophobicContact CB-CG 4.01Å; N242-Q244 PolarHBondContact O-N 2.83Å; N242-Q244 VanDerWaalsContact O-N 3.13Å; Q244-D246 PolarHBondContact O-N 3.43Å
245	S	87.3	Confident	92.3	Very high	81 Å²	81	65.9 Å²	65.9	57%	0.566	32%	0.322	S	S	*	.			trans	-89.3	90.2	-179.8	170.7	0	0	0	0	111.9
246	D	88.9	Confident	92.5	Very high	26 Å²	26	66.7 Å²	66.7	14%	0.139	33%	0.326	C	S	.	.			trans	-96	24.4	-179.9	-79.9	-14.8	0	0	0	114.2	Q244 Y248 K249	Q244-D246 PolarHBondContact O-N 3.43Å; D246-Y248 HydrophobicContact CB-CE1 4.48Å; D246-Y248 PolarHBondContact O-N 3.45Å; D246-Y248 VanDerWaalsContact O-N 3.09Å; D246-K249 HydrophobicContact CB-CD 3.95Å; D246-K249 HydrophobicContact CB-CG 4.35Å; D246-K249 VanDerWaalsContact CG-NZ 3.33Å; D246-K249 WeakPolarHBondContact O-CB 3.45Å; D246-K249 WeakPolarHBondContact O-CG 3.37Å; D246-K249 PolarHBondContact O-N 3.35Å; D246-K249 IonicContact OD1-NZ 2.69Å; D246-K249 IonicContact OD2-NZ 3.48Å; D246-K249 PolarHBondContact OD2-NZ 2.9Å
247	F	93.4	Very high	92.6	Very high	84 Å²	84	67.5 Å²	67.5	37%	0.368	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.7	-22.5	-176.8	-75.9	-94.5	0	0	0	114.1	F231 V235 Y239 K249 I250	F231-F247 HydrophobicContact CE2-CE1 4.45Å; F231-F247 HydrophobicContact CZ-CE1 4.34Å; V235-F247 HydrophobicContact CG1-CD1 4.14Å; V235-F247 HydrophobicContact CG1-CD2 4.33Å; V235-F247 HydrophobicContact CG1-CE1 4.2Å; V235-F247 HydrophobicContact CG1-CE2 4.4Å; V235-F247 HydrophobicContact CG1-CG 4.19Å; V235-F247 HydrophobicContact CG1-CZ 4.33Å; Y239-F247 HydrophobicContact CD2-CE2 4.15Å; Y239-F247 HydrophobicContact CE2-CE2 4.39Å; F247-K249 PolarHBondContact O-N 2.97Å; F247-K249 VanDerWaalsContact O-N 3.11Å; F247-I250 HydrophobicContact CB-CD1 4.34Å; F247-I250 HydrophobicContact CD1-CD1 3.77Å; F247-I250 WeakPolarHBondContact O-CB 3.26Å; F247-I250 WeakPolarHBondContact O-CD1 3.41Å; F247-I250 VanDerWaalsContact O-CG1 3.27Å; F247-I250 WeakPolarHBondContact O-CG1 3.32Å; F247-I250 PolarHBondContact O-N 3.39Å; F247-I250 VanDerWaalsContact O-N 3.15Å
248	Y	92.9	Very high	92.8	Very high	124 Å²	124	67 Å²	67	49%	0.486	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62.4	-16.6	175.2	76.5	-90.7	0	0	0	113.2	D246 I250 P251	D246-Y248 HydrophobicContact CB-CE1 4.48Å; D246-Y248 PolarHBondContact O-N 3.45Å; D246-Y248 VanDerWaalsContact O-N 3.09Å; Y248-I250 VanDerWaalsContact C-N 3.27Å; Y248-I250 PolarHBondContact O-N 2.95Å; Y248-P251 VanDerWaalsContact O-CD 3.3Å; Y248-P251 WeakPolarHBondContact O-CD 3.47Å
249	K	93	Very high	93.1	Very high	35 Å²	35	67.5 Å²	67.5	15%	0.152	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-70.6	-21.5	176.9	-64.7	-175.6	178.8	163.3	0	112.8	D246 F247 E253 I254	D246-K249 HydrophobicContact CB-CD 3.95Å; D246-K249 HydrophobicContact CB-CG 4.35Å; D246-K249 VanDerWaalsContact CG-NZ 3.33Å; D246-K249 WeakPolarHBondContact O-CB 3.45Å; D246-K249 WeakPolarHBondContact O-CG 3.37Å; D246-K249 PolarHBondContact O-N 3.35Å; D246-K249 IonicContact OD1-NZ 2.69Å; D246-K249 IonicContact OD2-NZ 3.48Å; D246-K249 PolarHBondContact OD2-NZ 2.9Å; F247-K249 PolarHBondContact O-N 2.97Å; F247-K249 VanDerWaalsContact O-N 3.11Å; K249-E253 HydrophobicContact CB-CB 4.12Å; K249-E253 WeakPolarHBondContact CD-OE2 3.37Å; K249-E253 WeakPolarHBondContact CG-OE2 3.46Å; K249-E253 WeakPolarHBondContact O-CA 3.41Å; K249-E253 WeakPolarHBondContact O-CB 3.34Å; K249-E253 PolarHBondContact O-N 2.94Å; K249-I254 HydrophobicContact CB-CG1 4.4Å; K249-I254 PolarHBondContact O-N 3.43Å
250	I	94.7	Very high	93.3	Very high	48 Å²	48	64 Å²	64	25%	0.246	32%	0.317	C	S	.	.	I	π-helix	trans	-57.5	-52.6	-172.9	-62.8	167.3	0	0	0	112.9	F227 F231 V235 F247 Y248 I252	F227-I250 HydrophobicContact CE2-CG2 4.45Å; F227-I250 HydrophobicContact CZ-CG2 3.94Å; F231-I250 HydrophobicContact CD2-CD1 4.26Å; F231-I250 HydrophobicContact CD2-CG1 4.1Å; F231-I250 HydrophobicContact CE2-CD1 3.72Å; F231-I250 HydrophobicContact CE2-CG1 4.04Å; V235-I250 HydrophobicContact CG2-CG1 4.33Å; F247-I250 HydrophobicContact CB-CD1 4.34Å; F247-I250 HydrophobicContact CD1-CD1 3.77Å; F247-I250 WeakPolarHBondContact O-CB 3.26Å; F247-I250 WeakPolarHBondContact O-CD1 3.41Å; F247-I250 VanDerWaalsContact O-CG1 3.27Å; F247-I250 WeakPolarHBondContact O-CG1 3.32Å; F247-I250 PolarHBondContact O-N 3.39Å; F247-I250 VanDerWaalsContact O-N 3.15Å; Y248-I250 VanDerWaalsContact C-N 3.27Å; Y248-I250 PolarHBondContact O-N 2.95Å; I250-I252 VanDerWaalsContact C-N 3.35Å; I250-I252 PolarHBondContact O-N 3.45Å
251	P	95.5	Very high	93.6	Very high	81 Å²	81	60.3 Å²	60.3	53%	0.526	30%	0.295	S	S	.	.	I	π-helix	trans	-69	-29.6	-168.9	-22.8	36.5	0	0	0	114.3	Y248 V255	Y248-P251 VanDerWaalsContact O-CD 3.3Å; Y248-P251 WeakPolarHBondContact O-CD 3.47Å; P251-V255 WeakPolarHBondContact O-CG2 3.46Å
252	I	95.3	Very high	94	Very high	53 Å²	53	51.5 Å²	51.5	27%	0.272	26%	0.262	S	S	.	.	I	π-helix	trans	-119.6	-55.4	-174.5	-57.8	-64.5	0	0	0	112.2	I250 N256 Y319 L323	I250-I252 VanDerWaalsContact C-N 3.35Å; I250-I252 PolarHBondContact O-N 3.45Å; I252-N256 WeakPolarHBondContact O-CB 3.44Å; I252-N256 PolarHBondContact O-N 3.48Å; I252-Y319 HydrophobicContact CD1-CD1 4Å; I252-Y319 HydrophobicContact CD1-CE1 3.71Å; I252-Y319 HydrophobicContact CG2-CD1 4.09Å; I252-L323 HydrophobicContact CG2-CD2 4.25Å
253	E	94	Very high	94.5	Very high	32 Å²	32	47.4 Å²	47.4	15%	0.15	24%	0.241	C	C	.	.	I	π-helix	trans	-69.6	-46.4	-173.3	-69.1	178.4	-144.9	0	0	112.8	K249 V255 N256 K257 R326	K249-E253 HydrophobicContact CB-CB 4.12Å; K249-E253 WeakPolarHBondContact CD-OE2 3.37Å; K249-E253 WeakPolarHBondContact CG-OE2 3.46Å; K249-E253 WeakPolarHBondContact O-CA 3.41Å; K249-E253 WeakPolarHBondContact O-CB 3.34Å; K249-E253 PolarHBondContact O-N 2.94Å; E253-V255 VanDerWaalsContact C-N 3.35Å; E253-N256 PolarHBondContact O-N 2.87Å; E253-K257 WeakPolarHBondContact O-CG 3.39Å; E253-K257 PolarHBondContact O-N 2.76Å; E253-R326 IonicContact OE1-CZ 3.96Å; E253-R326 IonicContact OE1-NH1 3.63Å; E253-R326 PolarHBondContact OE1-NH1 3.43Å; E253-R326 IonicContact OE1-NH2 2.96Å; E253-R326 PolarHBondContact OE1-NH2 2.86Å
254	I	96.1	Very high	94.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	I	π-helix	trans	-67.4	-40.6	-179.4	-57.6	-56.5	0	0	0	110.4	F227 F231 D234 V235 K249 K257 T258	F227-I254 HydrophobicContact CD2-CG2 3.69Å; F227-I254 HydrophobicContact CE2-CB 4.34Å; F227-I254 HydrophobicContact CE2-CG2 3.66Å; F227-I254 HydrophobicContact CG-CG2 4.31Å; F227-I254 HydrophobicContact CZ-CG2 4.27Å; F231-I254 HydrophobicContact CB-CG2 4.43Å; D234-I254 HydrophobicContact CB-CD1 3.75Å; V235-I254 HydrophobicContact CG2-CD1 4.08Å; V235-I254 HydrophobicContact CG2-CG1 4.16Å; K249-I254 HydrophobicContact CB-CG1 4.4Å; K249-I254 PolarHBondContact O-N 3.43Å; I254-K257 PolarHBondContact O-N 3.39Å; I254-T258 WeakPolarHBondContact O-CB 3.49Å; I254-T258 PolarHBondContact O-N 2.87Å; I254-T258 VanDerWaalsContact O-N 3.08Å; I254-T258 PolarHBondContact O-OG1 3.48Å
255	V	97.5	Very high	95.6	Very high	33 Å²	33	36.8 Å²	36.8	20%	0.2	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-50	172.9	176.1	0	0	0	0	110.2	F227 P251 E253 K257 T258 L259 Y319	F227-V255 HydrophobicContact CE2-CG2 4.27Å; P251-V255 WeakPolarHBondContact O-CG2 3.46Å; E253-V255 VanDerWaalsContact C-N 3.35Å; V255-K257 PolarHBondContact O-N 2.9Å; V255-T258 WeakPolarHBondContact O-CA 3.47Å; V255-T258 WeakPolarHBondContact O-CB 3.21Å; V255-T258 PolarHBondContact O-N 2.92Å; V255-L259 HydrophobicContact CG1-CD1 3.71Å; V255-L259 HydrophobicContact CG1-CD2 4.38Å; V255-L259 HydrophobicContact CG1-CG 3.91Å; V255-L259 VanDerWaalsContact O-CG 3.31Å; V255-L259 WeakPolarHBondContact O-CG 3.49Å; V255-L259 PolarHBondContact O-N 3.04Å; V255-Y319 HydrophobicContact CB-CD1 4.45Å; V255-Y319 HydrophobicContact CB-CE1 3.94Å; V255-Y319 HydrophobicContact CG1-CD1 4.15Å; V255-Y319 HydrophobicContact CG1-CE1 3.57Å; V255-Y319 HydrophobicContact CG1-CE2 4.46Å
256	N	97.4	Very high	96.2	Very high	18 Å²	18	32.9 Å²	32.9	10%	0.096	17%	0.165	C	C	.	.	H	α-helix	trans	-69.3	-17.3	-178	-160.4	29.9	0	0	0	114	I252 E253 P260 H316 Y319 S320	I252-N256 WeakPolarHBondContact O-CB 3.44Å; I252-N256 PolarHBondContact O-N 3.48Å; E253-N256 PolarHBondContact O-N 2.87Å; N256-P260 WeakPolarHBondContact O-CD 3.35Å; N256-P260 VanDerWaalsContact O-CG 3.27Å; N256-P260 WeakPolarHBondContact O-CG 3.47Å; N256-H316 PolarHBondContact OD1-ND1 2.87Å; N256-H316 PolarHBondContact OD1-O 3.46Å; N256-Y319 HydrophobicContact CB-CD1 4.24Å; N256-Y319 HydrophobicContact CB-CG 4.48Å; N256-Y319 WeakPolarHBondContact OD1-CB 3.46Å; N256-S320 PolarHBondContact ND2-OG 2.89Å; N256-S320 PolarHBondContact OD1-OG 3.05Å
257	K	96.1	Very high	96.6	Very high	65 Å²	65	31.9 Å²	31.9	28%	0.283	16%	0.16	S	C	.	.	H	α-helix	trans	-79.2	-33	166.3	-76.6	173.2	175.6	172.8	0	112.5	D234 E253 I254 V255 I261	D234-K257 VanDerWaalsContact OD2-CD 3.27Å; D234-K257 WeakPolarHBondContact OD2-CD 3.47Å; D234-K257 WeakPolarHBondContact OD2-CE 3.25Å; D234-K257 IonicContact OD2-NZ 3.36Å; D234-K257 PolarHBondContact OD2-NZ 3.36Å; E253-K257 WeakPolarHBondContact O-CG 3.39Å; E253-K257 PolarHBondContact O-N 2.76Å; I254-K257 PolarHBondContact O-N 3.39Å; V255-K257 PolarHBondContact O-N 2.9Å; K257-I261 WeakPolarHBondContact O-CD1 3.34Å; K257-I261 VanDerWaalsContact O-CG1 3.22Å; K257-I261 WeakPolarHBondContact O-CG1 3.36Å
258	T	97.8	Very high	96.8	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.043	14%	0.142	C	C	.	.	H	α-helix	trans	-78.2	-47.8	-176.4	-57	0	0	0	0	112	A223 F226 F227 I254 V255 I261 V262	A223-T258 HydrophobicContact CB-CG2 4.42Å; A223-T258 WeakPolarHBondContact O-CG2 3.25Å; F226-T258 HydrophobicContact CB-CG2 4.02Å; F227-T258 WeakPolarHBondContact CA-OG1 3.48Å; F227-T258 HydrophobicContact CB-CG2 4.14Å; I254-T258 WeakPolarHBondContact O-CB 3.49Å; I254-T258 PolarHBondContact O-N 2.87Å; I254-T258 VanDerWaalsContact O-N 3.08Å; I254-T258 PolarHBondContact O-OG1 3.48Å; V255-T258 WeakPolarHBondContact O-CA 3.47Å; V255-T258 WeakPolarHBondContact O-CB 3.21Å; V255-T258 PolarHBondContact O-N 2.92Å; T258-I261 PolarHBondContact O-N 2.95Å; T258-V262 HydrophobicContact CG2-CG2 4.13Å; T258-V262 WeakPolarHBondContact O-CG2 3.48Å; T258-V262 PolarHBondContact O-N 3.39Å
259	L	98.2	Very high	97.1	Very high	18 Å²	18	23 Å²	23	9%	0.094	13%	0.125	C	C	.	.	H	α-helix	trans	-51.8	-53.1	-176.3	-64.4	170.6	0	0	0	114.1	V255 I261 V262 A263 F312 V315 H316 Y319	V255-L259 HydrophobicContact CG1-CD1 3.71Å; V255-L259 HydrophobicContact CG1-CD2 4.38Å; V255-L259 HydrophobicContact CG1-CG 3.91Å; V255-L259 VanDerWaalsContact O-CG 3.31Å; V255-L259 WeakPolarHBondContact O-CG 3.49Å; V255-L259 PolarHBondContact O-N 3.04Å; L259-I261 VanDerWaalsContact C-N 3.3Å; L259-I261 PolarHBondContact O-N 3.36Å; L259-V262 PolarHBondContact O-N 3.29Å; L259-A263 WeakPolarHBondContact O-CB 3.23Å; L259-A263 PolarHBondContact O-N 2.96Å; L259-F312 HydrophobicContact CD2-CD1 3.54Å; L259-F312 HydrophobicContact CD2-CE1 3.95Å; L259-V315 HydrophobicContact CD1-CB 4.2Å; L259-V315 HydrophobicContact CD1-CG1 3.62Å; L259-V315 HydrophobicContact CD2-CG1 4.32Å; L259-H316 HydrophobicContact CB-CB 3.94Å; L259-Y319 HydrophobicContact CD1-CD2 3.96Å; L259-Y319 HydrophobicContact CD1-CE2 4.22Å; L259-Y319 HydrophobicContact CD1-CG 4.2Å
260	P	98.1	Very high	97.3	Very high	27 Å²	27	22 Å²	22	18%	0.175	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-31.9	-177.6	25.5	-34.2	0	0	0	112.8	N256 A263 I264 H316	N256-P260 WeakPolarHBondContact O-CD 3.35Å; N256-P260 VanDerWaalsContact O-CG 3.27Å; N256-P260 WeakPolarHBondContact O-CG 3.47Å; P260-A263 PolarHBondContact O-N 3.04Å; P260-I264 WeakPolarHBondContact O-CG2 3.3Å; P260-I264 PolarHBondContact O-N 3.48Å; P260-H316 HydrophobicContact CB-CB 4.45Å
261	I	98.2	Very high	97.5	Very high	10 Å²	10	20.5 Å²	20.5	5%	0.051	11%	0.112	C	C	.	.	H	α-helix	trans	-67.3	-45.5	177.8	-60	177.6	0	0	0	110.1	F226 K257 T258 L259 A263 T265 A435	F226-I261 HydrophobicContact CD1-CD1 4.43Å; F226-I261 HydrophobicContact CD1-CG2 3.74Å; F226-I261 HydrophobicContact CD2-CG2 3.6Å; F226-I261 HydrophobicContact CE1-CG2 3.66Å; F226-I261 HydrophobicContact CE2-CG2 3.52Å; F226-I261 HydrophobicContact CG-CB 4.46Å; F226-I261 HydrophobicContact CG-CG2 3.72Å; F226-I261 HydrophobicContact CZ-CG2 3.54Å; K257-I261 WeakPolarHBondContact O-CD1 3.34Å; K257-I261 VanDerWaalsContact O-CG1 3.22Å; K257-I261 WeakPolarHBondContact O-CG1 3.36Å; T258-I261 PolarHBondContact O-N 2.95Å; L259-I261 VanDerWaalsContact C-N 3.3Å; L259-I261 PolarHBondContact O-N 3.36Å; I261-A263 VanDerWaalsContact C-N 3.32Å; I261-A263 PolarHBondContact O-N 3.14Å; I261-T265 VanDerWaalsContact O-CB 3.22Å; I261-T265 WeakPolarHBondContact O-CB 3.45Å; I261-T265 PolarHBondContact O-N 3.24Å; I261-T265 PolarHBondContact O-OG1 3.47Å; I261-A435 HydrophobicContact CB-CB 4.13Å; I261-A435 HydrophobicContact CD1-CB 4.38Å; I261-A435 HydrophobicContact CG1-CB 3.78Å; I261-A435 HydrophobicContact CG2-CB 3.7Å
262	V	98.4	Very high	97.6	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-44.1	174.3	177.9	0	0	0	0	110	L222 A223 F226 T258 L259 T265 L266 F312	L222-V262 HydrophobicContact CB-CG2 4.34Å; A223-V262 HydrophobicContact CB-CG2 3.95Å; F226-V262 HydrophobicContact CD2-CG2 4.48Å; T258-V262 HydrophobicContact CG2-CG2 4.13Å; T258-V262 WeakPolarHBondContact O-CG2 3.48Å; T258-V262 PolarHBondContact O-N 3.39Å; L259-V262 PolarHBondContact O-N 3.29Å; V262-T265 PolarHBondContact O-N 3.03Å; V262-L266 HydrophobicContact CG1-CD1 3.72Å; V262-L266 HydrophobicContact CG1-CG 4.15Å; V262-L266 WeakPolarHBondContact O-CB 3.27Å; V262-L266 VanDerWaalsContact O-CG 3.23Å; V262-L266 WeakPolarHBondContact O-CG 3.46Å; V262-L266 PolarHBondContact O-N 3.39Å; V262-F312 HydrophobicContact CB-CD1 4.28Å; V262-F312 HydrophobicContact CB-CG 4.42Å; V262-F312 HydrophobicContact CG1-CD1 4.1Å; V262-F312 HydrophobicContact CG1-CD2 3.89Å; V262-F312 HydrophobicContact CG1-CE1 4.12Å; V262-F312 HydrophobicContact CG1-CE2 3.94Å; V262-F312 HydrophobicContact CG1-CG 4.02Å; V262-F312 HydrophobicContact CG1-CZ 4.05Å
263	A	98.6	Very high	97.7	Very high	6 Å²	6	15.5 Å²	15.5	5%	0.05	8%	0.082	C	C	.	.	H	α-helix	trans	-57.7	-52.9	179.1	0	0	0	0	0	112.6	L259 P260 I261 T265 L266 L267 S309 F312 A313	L259-A263 WeakPolarHBondContact O-CB 3.23Å; L259-A263 PolarHBondContact O-N 2.96Å; P260-A263 PolarHBondContact O-N 3.04Å; I261-A263 VanDerWaalsContact C-N 3.32Å; I261-A263 PolarHBondContact O-N 3.14Å; A263-T265 PolarHBondContact O-N 2.97Å; A263-L266 PolarHBondContact O-N 2.85Å; A263-L267 WeakPolarHBondContact O-CB 3.21Å; A263-L267 PolarHBondContact O-N 3.37Å; A263-S309 WeakPolarHBondContact O-CB 3.06Å; A263-S309 PolarHBondContact O-OG 3.06Å; A263-F312 HydrophobicContact CB-CB 3.76Å; A263-A313 HydrophobicContact CB-CB 4.11Å
264	I	98.4	Very high	97.8	Very high	10 Å²	10	15 Å²	15	5%	0.051	9%	0.086	C	C	.	.	H	α-helix	trans	-70.9	-31.8	-177.4	-157.2	178.1	0	0	0	112.1	P260 S268 L403 V410 A435 P439	P260-I264 WeakPolarHBondContact O-CG2 3.3Å; P260-I264 PolarHBondContact O-N 3.48Å; I264-S268 WeakPolarHBondContact O-CB 3.47Å; I264-S268 PolarHBondContact O-N 3.26Å; I264-S268 PolarHBondContact O-OG 3.14Å; I264-L403 HydrophobicContact CG1-CD1 4.3Å; I264-V410 HydrophobicContact CD1-CG2 4.14Å; I264-A435 HydrophobicContact CG2-CB 4.29Å; I264-P439 HydrophobicContact CD1-CB 4.3Å; I264-P439 HydrophobicContact CD1-CG 3.77Å; I264-P439 HydrophobicContact CG1-CB 4.49Å; I264-P439 HydrophobicContact CG1-CG 3.79Å; I264-P439 HydrophobicContact CG2-CG 4.4Å
265	T	98.4	Very high	97.8	Very high	14 Å²	14	15.8 Å²	15.8	9%	0.086	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-48.7	174.2	-57.8	0	0	0	0	110.7	L222 I261 V262 A263 L267 S268 L269 L438	L222-T265 HydrophobicContact CD1-CG2 3.89Å; L222-T265 HydrophobicContact CD2-CG2 4.34Å; I261-T265 VanDerWaalsContact O-CB 3.22Å; I261-T265 WeakPolarHBondContact O-CB 3.45Å; I261-T265 PolarHBondContact O-N 3.24Å; I261-T265 PolarHBondContact O-OG1 3.47Å; V262-T265 PolarHBondContact O-N 3.03Å; A263-T265 PolarHBondContact O-N 2.97Å; T265-L267 VanDerWaalsContact C-N 3.33Å; T265-L267 PolarHBondContact O-N 3.02Å; T265-S268 WeakPolarHBondContact O-CB 3.35Å; T265-S268 PolarHBondContact O-N 3.5Å; T265-S268 VanDerWaalsContact O-N 3.17Å; T265-L269 HydrophobicContact CG2-CD1 4.35Å; T265-L269 WeakPolarHBondContact O-CG 3.21Å; T265-L269 PolarHBondContact O-N 3.46Å; T265-L438 HydrophobicContact CG2-CD2 3.88Å
266	L	98.5	Very high	97.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-41.6	176.5	-70	174.2	0	0	0	111.5	M218 A219 L222 V262 A263 S268 L269 V270 L305 L308 F312	M218-L266 HydrophobicContact CE-CD2 4.06Å; A219-L266 HydrophobicContact CB-CD1 3.91Å; A219-L266 HydrophobicContact CB-CD2 4.34Å; L222-L266 HydrophobicContact CD1-CD2 4.1Å; V262-L266 HydrophobicContact CG1-CD1 3.72Å; V262-L266 HydrophobicContact CG1-CG 4.15Å; V262-L266 WeakPolarHBondContact O-CB 3.27Å; V262-L266 VanDerWaalsContact O-CG 3.23Å; V262-L266 WeakPolarHBondContact O-CG 3.46Å; V262-L266 PolarHBondContact O-N 3.39Å; A263-L266 PolarHBondContact O-N 2.85Å; L266-S268 VanDerWaalsContact C-N 3.31Å; L266-S268 PolarHBondContact O-N 3.17Å; L266-L269 HydrophobicContact CD2-CD1 4.5Å; L266-L269 PolarHBondContact O-N 3.06Å; L266-V270 WeakPolarHBondContact O-CG2 3.39Å; L266-V270 PolarHBondContact O-N 3.14Å; L266-V270 VanDerWaalsContact O-N 3.16Å; L266-L305 HydrophobicContact CD2-CD2 3.98Å; L266-L308 HydrophobicContact CD1-CB 3.91Å; L266-F312 HydrophobicContact CD1-CD2 3.89Å; L266-F312 HydrophobicContact CD1-CE2 4.16Å
267	L	98.4	Very high	97.7	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.021	9%	0.092	C	C	.	.	H	α-helix	trans	-59.7	-43.8	174.9	-169.4	61.3	0	0	0	111.3	A263 T265 L269 V270 Y271 S309 L371 L403	A263-L267 WeakPolarHBondContact O-CB 3.21Å; A263-L267 PolarHBondContact O-N 3.37Å; T265-L267 VanDerWaalsContact C-N 3.33Å; T265-L267 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 2.96Å; L267-V270 WeakPolarHBondContact O-CB 3.08Å; L267-V270 PolarHBondContact O-N 3.47Å; L267-Y271 HydrophobicContact CD1-CE2 3.74Å; L267-Y271 HydrophobicContact CG-CD2 4.47Å; L267-Y271 HydrophobicContact CG-CE2 4.04Å; L267-Y271 WeakPolarHBondContact O-CD2 3.48Å; L267-S309 WeakPolarHBondContact CB-OG 3.5Å; L267-L371 HydrophobicContact CD1-CD2 3.83Å; L267-L371 HydrophobicContact CD2-CD2 3.92Å; L267-L403 HydrophobicContact CB-CD1 4.35Å; L267-L403 HydrophobicContact CD2-CB 4.07Å; L267-L403 HydrophobicContact CD2-CD1 3.89Å; L267-L403 HydrophobicContact CG-CB 4.42Å; L267-L403 HydrophobicContact CG-CD1 4.05Å
268	S	98.6	Very high	97.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.1	-40.5	177.8	-58.6	0	0	0	0	111.6	I264 T265 L266 V270 Y271 L272 L403 P439	I264-S268 WeakPolarHBondContact O-CB 3.47Å; I264-S268 PolarHBondContact O-N 3.26Å; I264-S268 PolarHBondContact O-OG 3.14Å; T265-S268 WeakPolarHBondContact O-CB 3.35Å; T265-S268 PolarHBondContact O-N 3.5Å; T265-S268 VanDerWaalsContact O-N 3.17Å; L266-S268 VanDerWaalsContact C-N 3.31Å; L266-S268 PolarHBondContact O-N 3.17Å; S268-V270 VanDerWaalsContact C-N 3.27Å; S268-V270 PolarHBondContact O-N 2.92Å; S268-Y271 PolarHBondContact O-N 3.36Å; S268-Y271 VanDerWaalsContact O-N 3.17Å; S268-L272 VanDerWaalsContact O-CB 3.31Å; S268-L272 WeakPolarHBondContact O-CB 3.48Å; S268-L272 PolarHBondContact O-N 3.36Å; S268-L403 WeakPolarHBondContact OG-CD1 3.3Å; S268-P439 WeakPolarHBondContact OG-CA 3.4Å; S268-P439 WeakPolarHBondContact OG-CD 3.42Å; S268-P439 VanDerWaalsContact OG-CG 3.27Å; S268-P439 WeakPolarHBondContact OG-CG 3.47Å
269	L	98.2	Very high	97.6	Very high	23 Å²	23	15.6 Å²	15.6	12%	0.12	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-28.7	177	-68.7	171.4	0	0	0	113.2	M218 L222 T265 L266 L267 L272 W298 L438	M218-L269 HydrophobicContact CE-CD1 3.65Å; M218-L269 HydrophobicContact SD-CD1 3.6Å; L222-L269 HydrophobicContact CD1-CD1 4.38Å; T265-L269 HydrophobicContact CG2-CD1 4.35Å; T265-L269 WeakPolarHBondContact O-CG 3.21Å; T265-L269 PolarHBondContact O-N 3.46Å; L266-L269 HydrophobicContact CD2-CD1 4.5Å; L266-L269 PolarHBondContact O-N 3.06Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 2.96Å; L269-L272 HydrophobicContact CD2-CD2 4.3Å; L269-W298 HydrophobicContact CB-CZ2 4.25Å; L269-W298 HydrophobicContact CD2-CH2 4.47Å; L269-W298 HydrophobicContact CD2-CZ2 3.89Å; L269-W298 VanDerWaalsContact O-CZ2 3.26Å; L269-W298 WeakPolarHBondContact O-CZ2 3.3Å; L269-W298 PolarHBondContact O-NE1 3.37Å; L269-L438 HydrophobicContact CD2-CD2 3.82Å; L269-L438 HydrophobicContact CG-CD2 3.89Å
270	V	98.1	Very high	97.4	Very high	13 Å²	13	17 Å²	17	8%	0.079	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-46.3	172.3	174.1	0	0	0	0	111.1	L266 L267 S268 S273 R302 L305	L266-V270 WeakPolarHBondContact O-CG2 3.39Å; L266-V270 PolarHBondContact O-N 3.14Å; L266-V270 VanDerWaalsContact O-N 3.16Å; L267-V270 WeakPolarHBondContact O-CB 3.08Å; L267-V270 PolarHBondContact O-N 3.47Å; S268-V270 VanDerWaalsContact C-N 3.27Å; S268-V270 PolarHBondContact O-N 2.92Å; V270-S273 PolarHBondContact O-OG 3.3Å; V270-R302 HydrophobicContact CG1-CB 4.18Å; V270-R302 HydrophobicContact CG1-CG 4.32Å; V270-R302 VanDerWaalsContact O-CD 3.32Å; V270-R302 WeakPolarHBondContact O-CD 3.46Å; V270-L305 HydrophobicContact CG2-CB 3.54Å
271	Y	98.1	Very high	97.3	Very high	16 Å²	16	17 Å²	17	6%	0.063	10%	0.1	C	C	.	.	H	α-helix	trans	-86.8	-29	-174	-64.5	-66.5	0	0	0	113	L267 S268 S273 G274 L275 Q395 G399 Y400 L403	L267-Y271 HydrophobicContact CD1-CE2 3.74Å; L267-Y271 HydrophobicContact CG-CD2 4.47Å; L267-Y271 HydrophobicContact CG-CE2 4.04Å; L267-Y271 WeakPolarHBondContact O-CD2 3.48Å; S268-Y271 PolarHBondContact O-N 3.36Å; S268-Y271 VanDerWaalsContact O-N 3.17Å; Y271-S273 VanDerWaalsContact C-N 3.32Å; Y271-S273 PolarHBondContact O-N 2.9Å; Y271-G274 PolarHBondContact O-N 2.92Å; Y271-G274 VanDerWaalsContact O-N 3.14Å; Y271-L275 PolarHBondContact O-N 3.06Å; Y271-Q395 PolarHBondContact OH-O 3.06Å; Y271-G399 VanDerWaalsContact CZ-C 3.48Å; Y271-G399 VanDerWaalsContact CZ-CA 3.5Å; Y271-G399 WeakPolarHBondContact OH-CA 3.24Å; Y271-Y400 AromaticContact CD1-CD2 3.99Å; Y271-Y400 HydrophobicContact CD1-CD2 3.99Å; Y271-Y400 HydrophobicContact CD1-CE1 4.3Å; Y271-Y400 AromaticContact CD1-CE2 3.65Å; Y271-Y400 HydrophobicContact CD1-CE2 3.65Å; Y271-Y400 HydrophobicContact CD1-CG 4.43Å; Y271-Y400 AromaticContact CD1-CZ 3.82Å; Y271-Y400 HydrophobicContact CE1-CD2 4.35Å; Y271-Y400 HydrophobicContact CE1-CE2 4.36Å; Y271-Y400 HydrophobicContact CG-CD1 4.47Å; Y271-Y400 HydrophobicContact CG-CE1 4.16Å; Y271-Y400 HydrophobicContact CG-CE2 4.32Å; Y271-Y400 PolarHBondContact O-OH 3.26Å; Y271-L403 HydrophobicContact CD2-CB 4.46Å; Y271-L403 HydrophobicContact CD2-CD2 4.06Å
272	L	98.1	Very high	97.1	Very high	30 Å²	30	18 Å²	18	16%	0.157	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-41.7	177.4	-177.9	58.3	0	0	0	112.2	S268 L269 G274 L275 I276 W298 L438 V442	S268-L272 VanDerWaalsContact O-CB 3.31Å; S268-L272 WeakPolarHBondContact O-CB 3.48Å; S268-L272 PolarHBondContact O-N 3.36Å; L269-L272 HydrophobicContact CD2-CD2 4.3Å; L272-G274 PolarHBondContact O-N 3.47Å; L272-L275 WeakPolarHBondContact O-CB 3.44Å; L272-L275 PolarHBondContact O-N 3.08Å; L272-I276 HydrophobicContact CD1-CD1 4.22Å; L272-I276 HydrophobicContact CD1-CG1 4.3Å; L272-I276 HydrophobicContact CG-CD1 3.92Å; L272-I276 HydrophobicContact CG-CG1 4.44Å; L272-I276 WeakPolarHBondContact O-CG1 3.23Å; L272-I276 PolarHBondContact O-N 3.36Å; L272-W298 HydrophobicContact CB-CH2 4.2Å; L272-W298 HydrophobicContact CB-CZ2 4.27Å; L272-W298 HydrophobicContact CD2-CH2 3.89Å; L272-W298 HydrophobicContact CD2-CZ2 4.44Å; L272-W298 HydrophobicContact CG-CH2 3.88Å; L272-W298 HydrophobicContact CG-CZ2 4.44Å; L272-L438 HydrophobicContact CD2-CD1 3.88Å; L272-V442 HydrophobicContact CB-CG2 3.82Å; L272-V442 HydrophobicContact CD1-CG2 4.07Å; L272-V442 HydrophobicContact CG-CG2 4.43Å
273	S	96.8	Very high	96.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.7	-35	178.9	79.7	0	0	0	0	112.1	V270 Y271 I276 A277 W298 L299 R302	V270-S273 PolarHBondContact O-OG 3.3Å; Y271-S273 VanDerWaalsContact C-N 3.32Å; Y271-S273 PolarHBondContact O-N 2.9Å; S273-I276 PolarHBondContact O-N 3.06Å; S273-A277 WeakPolarHBondContact O-CB 3.39Å; S273-A277 PolarHBondContact O-N 3Å; S273-W298 VanDerWaalsContact CB-CD2 3.49Å; S273-L299 WeakPolarHBondContact OG-CD2 3.49Å; S273-R302 WeakPolarHBondContact OG-CD 3.31Å
274	G	95.1	Very high	96.5	Very high	22 Å²	22	29.9 Å²	29.9	23%	0.227	15%	0.151	C	C	.	.	H	α-helix	trans	-68.7	-35.1	174.7	0	0	0	0	0	113.4	Y271 L272 A278	Y271-G274 PolarHBondContact O-N 2.92Å; Y271-G274 VanDerWaalsContact O-N 3.14Å; L272-G274 PolarHBondContact O-N 3.47Å; G274-A278 WeakPolarHBondContact O-CB 3.29Å; G274-A278 PolarHBondContact O-N 3.42Å
275	L	96.8	Very high	96.3	Very high	16 Å²	16	29.5 Å²	29.5	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-45.2	174.2	-62.4	178.6	0	0	0	111.2	Y271 L272 A277 A278 A279 Y400 V442 K446 L449	Y271-L275 PolarHBondContact O-N 3.06Å; L272-L275 WeakPolarHBondContact O-CB 3.44Å; L272-L275 PolarHBondContact O-N 3.08Å; L275-A277 VanDerWaalsContact C-N 3.33Å; L275-A277 PolarHBondContact O-N 2.8Å; L275-A278 PolarHBondContact O-N 3.38Å; L275-A278 VanDerWaalsContact O-N 3.17Å; L275-A279 WeakPolarHBondContact O-CB 3.22Å; L275-A279 PolarHBondContact O-N 3.11Å; L275-Y400 WeakPolarHBondContact CD2-OH 3.46Å; L275-V442 HydrophobicContact CD1-CB 4.19Å; L275-V442 HydrophobicContact CD1-CG1 3.87Å; L275-V442 HydrophobicContact CD1-CG2 4.41Å; L275-V442 VanDerWaalsContact CD1-O 3.31Å; L275-V442 WeakPolarHBondContact CD1-O 3.31Å; L275-K446 HydrophobicContact CD2-CB 4.28Å; L275-L449 HydrophobicContact CD2-CD1 3.45Å; L275-L449 VanDerWaalsContact CD2-CD1 3.45Å; L275-L449 HydrophobicContact CD2-CG 4.4Å
276	I	97.3	Very high	95.9	Very high	55 Å²	55	29.8 Å²	29.8	28%	0.282	15%	0.151	S	C	.	.	H	α-helix	trans	-61.7	-43.2	177.1	-66.9	169	0	0	0	110.4	L272 S273 A278 A279 Y280 W294 L295 W298	L272-I276 HydrophobicContact CD1-CD1 4.22Å; L272-I276 HydrophobicContact CD1-CG1 4.3Å; L272-I276 HydrophobicContact CG-CD1 3.92Å; L272-I276 HydrophobicContact CG-CG1 4.44Å; L272-I276 WeakPolarHBondContact O-CG1 3.23Å; L272-I276 PolarHBondContact O-N 3.36Å; S273-I276 PolarHBondContact O-N 3.06Å; I276-A278 VanDerWaalsContact C-N 3.33Å; I276-A278 PolarHBondContact O-N 2.89Å; I276-A279 PolarHBondContact O-N 2.94Å; I276-Y280 WeakPolarHBondContact O-CB 3.49Å; I276-Y280 PolarHBondContact O-N 3.41Å; I276-W294 HydrophobicContact CG2-CH2 4.01Å; I276-L295 HydrophobicContact CB-CD1 4.37Å; I276-L295 HydrophobicContact CG2-CD1 4.03Å; I276-L295 HydrophobicContact CG2-CD2 4.07Å; I276-W298 HydrophobicContact CD1-CH2 3.89Å; I276-W298 HydrophobicContact CD1-CZ3 3.57Å
277	A	96	Very high	95.5	Very high	9 Å²	9	33.8 Å²	33.8	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-39.6	175	0	0	0	0	0	112.6	S273 L275 Y280 Q281 F291 L295 L299	S273-A277 WeakPolarHBondContact O-CB 3.39Å; S273-A277 PolarHBondContact O-N 3Å; L275-A277 VanDerWaalsContact C-N 3.33Å; L275-A277 PolarHBondContact O-N 2.8Å; A277-Y280 PolarHBondContact O-N 3.3Å; A277-Q281 WeakPolarHBondContact O-CG 3.39Å; A277-Q281 PolarHBondContact O-N 3.28Å; A277-F291 HydrophobicContact CB-CE1 3.96Å; A277-F291 HydrophobicContact CB-CZ 3.84Å; A277-L295 HydrophobicContact CB-CD2 4.34Å; A277-L299 HydrophobicContact CB-CD1 4.24Å
278	A	95.5	Very high	95.1	Very high	2 Å²	2	40.3 Å²	40.3	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-40.6	175.2	0	0	0	0	0	112.3	G274 L275 I276 Q281 L282 L449 L458	G274-A278 WeakPolarHBondContact O-CB 3.29Å; G274-A278 PolarHBondContact O-N 3.42Å; L275-A278 PolarHBondContact O-N 3.38Å; L275-A278 VanDerWaalsContact O-N 3.17Å; I276-A278 VanDerWaalsContact C-N 3.33Å; I276-A278 PolarHBondContact O-N 2.89Å; A278-Q281 PolarHBondContact O-N 2.94Å; A278-L282 WeakPolarHBondContact O-CG 3.36Å; A278-L282 PolarHBondContact O-N 3.22Å; A278-L449 HydrophobicContact CB-CD1 3.64Å; A278-L449 HydrophobicContact CB-CD2 4.38Å; A278-L458 HydrophobicContact CB-CD1 4.4Å; A278-L458 HydrophobicContact CB-CD2 4.08Å
279	A	95.3	Very high	94.8	Very high	53 Å²	53	46.2 Å²	46.2	44%	0.438	22%	0.217	S	C	.	.	H	α-helix	trans	-62.2	-43.1	174.3	0	0	0	0	0	111.4	L275 I276 Q281 L282 Y283	L275-A279 WeakPolarHBondContact O-CB 3.22Å; L275-A279 PolarHBondContact O-N 3.11Å; I276-A279 PolarHBondContact O-N 2.94Å; A279-Q281 PolarHBondContact O-N 2.8Å; A279-L282 PolarHBondContact O-N 3.06Å; A279-Y283 WeakPolarHBondContact O-CB 3.41Å; A279-Y283 PolarHBondContact O-N 3.4Å
280	Y	95.1	Very high	94.5	Very high	46 Å²	46	55.7 Å²	55.7	18%	0.18	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-46.1	174.8	-173.6	-88.2	0	0	0	111.7	I276 A277 L282 Y283 Y284 R289 R290 F291 P292	I276-Y280 WeakPolarHBondContact O-CB 3.49Å; I276-Y280 PolarHBondContact O-N 3.41Å; A277-Y280 PolarHBondContact O-N 3.3Å; Y280-L282 VanDerWaalsContact C-N 3.34Å; Y280-L282 PolarHBondContact O-N 3.02Å; Y280-Y283 PolarHBondContact O-N 3.13Å; Y280-Y284 AromaticContact CD1-CD2 3.88Å; Y280-Y284 HydrophobicContact CD1-CD2 3.88Å; Y280-Y284 HydrophobicContact CD1-CE2 4.3Å; Y280-Y284 HydrophobicContact CD2-CD2 4.05Å; Y280-Y284 AromaticContact CD2-CE2 3.68Å; Y280-Y284 HydrophobicContact CD2-CE2 3.68Å; Y280-Y284 AromaticContact CE1-CD2 3.7Å; Y280-Y284 HydrophobicContact CE1-CD2 3.7Å; Y280-Y284 AromaticContact CE1-CE2 3.96Å; Y280-Y284 HydrophobicContact CE1-CE2 3.96Å; Y280-Y284 AromaticContact CE2-CD2 3.86Å; Y280-Y284 HydrophobicContact CE2-CD2 3.86Å; Y280-Y284 AromaticContact CE2-CE2 3.27Å; Y280-Y284 HydrophobicContact CE2-CE2 3.27Å; Y280-Y284 HydrophobicContact CG-CD2 4.06Å; Y280-Y284 HydrophobicContact CG-CE2 4.18Å; Y280-Y284 AromaticContact CZ-CD2 3.68Å; Y280-Y284 AromaticContact CZ-CE2 3.43Å; Y280-Y284 VanDerWaalsContact CZ-CE2 3.43Å; Y280-Y284 WeakPolarHBondContact O-CD2 3.48Å; Y280-Y284 PolarHBondContact O-N 3.06Å; Y280-Y284 VanDerWaalsContact O-N 3.1Å; Y280-R289 HydrophobicContact CE1-CG 4.3Å; Y280-R289 PolarHBondContact OH-NE 2.8Å; Y280-R289 VanDerWaalsContact OH-NE 3.12Å; Y280-R290 PolarHBondContact OH-O 2.68Å; Y280-F291 AromaticContact CD1-CD1 3.56Å; Y280-F291 HydrophobicContact CD1-CD1 3.56Å; Y280-F291 AromaticContact CD1-CE1 3.6Å; Y280-F291 HydrophobicContact CD1-CE1 3.6Å; Y280-F291 AromaticContact CE1-CD1 3.86Å; Y280-F291 HydrophobicContact CE1-CD1 3.86Å; Y280-F291 HydrophobicContact CE1-CE1 4.26Å; Y280-F291 HydrophobicContact CG-CD1 4.1Å; Y280-F291 HydrophobicContact CG-CE1 4.19Å; Y280-P292 HydrophobicContact CE2-CG 4.48Å
281	Q	94.8	Very high	94.4	Very high	27 Å²	27	57.7 Å²	57.7	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-40.7	175.1	-74.7	178	-13.4	0	0	112.3	A277 A278 A279 G285 F291 L458 I461	A277-Q281 WeakPolarHBondContact O-CG 3.39Å; A277-Q281 PolarHBondContact O-N 3.28Å; A278-Q281 PolarHBondContact O-N 2.94Å; A279-Q281 PolarHBondContact O-N 2.8Å; Q281-G285 WeakPolarHBondContact O-CA 3.44Å; Q281-G285 PolarHBondContact O-N 3.23Å; Q281-F291 HydrophobicContact CG-CE1 4.37Å; Q281-F291 HydrophobicContact CG-CZ 4.27Å; Q281-L458 HydrophobicContact CB-CD1 4.19Å; Q281-I461 HydrophobicContact CB-CG2 4.41Å
282	L	94.1	Very high	94.3	Very high	31 Å²	31	58.4 Å²	58.4	16%	0.162	27%	0.265	C	S	.	.	H	α-helix	trans	-69.2	-37.1	178.5	-75.9	165.5	0	0	0	112.9	A278 A279 Y280 L449 I454 K457 L458 I461	A278-L282 WeakPolarHBondContact O-CG 3.36Å; A278-L282 PolarHBondContact O-N 3.22Å; A279-L282 PolarHBondContact O-N 3.06Å; Y280-L282 VanDerWaalsContact C-N 3.34Å; Y280-L282 PolarHBondContact O-N 3.02Å; L282-L449 HydrophobicContact CD1-CD2 3.73Å; L282-I454 HydrophobicContact CD1-CG2 3.62Å; L282-I454 HydrophobicContact CD2-CG2 4.41Å; L282-K457 HydrophobicContact CD2-CB 4.29Å; L282-K457 HydrophobicContact CD2-CD 4.06Å; L282-K457 HydrophobicContact CD2-CG 4.05Å; L282-L458 HydrophobicContact CD2-CB 4.15Å; L282-L458 HydrophobicContact CD2-CD1 4.45Å; L282-L458 HydrophobicContact CG-CD1 4.14Å; L282-I461 HydrophobicContact CD2-CD1 4.05Å
283	Y	94.1	Very high	94.1	Very high	176 Å²	176	61.8 Å²	61.8	69%	0.69	29%	0.288	S	S	*	.	H	α-helix	trans	-65.4	-50.7	178.6	178.6	-97.7	0	0	0	111.3	A279 Y280	A279-Y283 WeakPolarHBondContact O-CB 3.41Å; A279-Y283 PolarHBondContact O-N 3.4Å; Y280-Y283 PolarHBondContact O-N 3.13Å
284	Y	92	Very high	94	Very high	80 Å²	80	69 Å²	69	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-81.2	-20	179.4	-70	-67	0	0	0	113.9	Y280 T286 R289	Y280-Y284 AromaticContact CD1-CD2 3.88Å; Y280-Y284 HydrophobicContact CD1-CD2 3.88Å; Y280-Y284 HydrophobicContact CD1-CE2 4.3Å; Y280-Y284 HydrophobicContact CD2-CD2 4.05Å; Y280-Y284 AromaticContact CD2-CE2 3.68Å; Y280-Y284 HydrophobicContact CD2-CE2 3.68Å; Y280-Y284 AromaticContact CE1-CD2 3.7Å; Y280-Y284 HydrophobicContact CE1-CD2 3.7Å; Y280-Y284 AromaticContact CE1-CE2 3.96Å; Y280-Y284 HydrophobicContact CE1-CE2 3.96Å; Y280-Y284 AromaticContact CE2-CD2 3.86Å; Y280-Y284 HydrophobicContact CE2-CD2 3.86Å; Y280-Y284 AromaticContact CE2-CE2 3.27Å; Y280-Y284 HydrophobicContact CE2-CE2 3.27Å; Y280-Y284 HydrophobicContact CG-CD2 4.06Å; Y280-Y284 HydrophobicContact CG-CE2 4.18Å; Y280-Y284 AromaticContact CZ-CD2 3.68Å; Y280-Y284 AromaticContact CZ-CE2 3.43Å; Y280-Y284 VanDerWaalsContact CZ-CE2 3.43Å; Y280-Y284 WeakPolarHBondContact O-CD2 3.48Å; Y280-Y284 PolarHBondContact O-N 3.06Å; Y280-Y284 VanDerWaalsContact O-N 3.1Å; Y284-T286 VanDerWaalsContact C-N 3.26Å; Y284-T286 PolarHBondContact O-N 2.96Å; Y284-R289 VanDerWaalsContact CD1-NH1 3.26Å; Y284-R289 VanDerWaalsContact CZ-CZ 3.47Å
285	G	92.2	Very high	94	Very high	2 Å²	2	68 Å²	68	2%	0.021	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	25.1	178.8	0	0	0	0	0	114.1	Q281 E466 K467	Q281-G285 WeakPolarHBondContact O-CA 3.44Å; Q281-G285 PolarHBondContact O-N 3.23Å; G285-E466 WeakPolarHBondContact O-CA 3.44Å; G285-K467 PolarHBondContact O-N 3.45Å
286	T	90.8	Very high	93.9	Very high	20 Å²	20	71.7 Å²	71.7	12%	0.123	32%	0.322	C	S	.	.			trans	-145.8	154.3	175.5	-179	0	0	0	0	110.2	Y284 Y288 R289 E466	Y284-T286 VanDerWaalsContact C-N 3.26Å; Y284-T286 PolarHBondContact O-N 2.96Å; T286-Y288 WeakPolarHBondContact OG1-CD2 3.41Å; T286-Y288 PolarHBondContact OG1-N 2.58Å; T286-Y288 VanDerWaalsContact OG1-N 3.15Å; T286-R289 HydrophobicContact CG2-CB 3.93Å; T286-E466 WeakPolarHBondContact OG1-CG 3.44Å; T286-E466 PolarHBondContact OG1-OE1 2.95Å
287	K	91	Very high	93.7	Very high	84 Å²	84	72.2 Å²	72.2	37%	0.365	33%	0.331	S	S	.	.	S	Bend	trans	-97.2	-12.1	171.2	70.9	174.5	-179.3	-178.3	0	113.4	I461 R462	K287-I461 HydrophobicContact CB-CG2 4.34Å; K287-R462 WeakPolarHBondContact CD-O 3.25Å; K287-R462 PolarHBondContact NZ-O 2.69Å
288	Y	89.7	Confident	93.7	Very high	141 Å²	141	74.2 Å²	74.2	55%	0.553	34%	0.336	S	S	*	.	S	Bend	trans	-85	-14.8	-171.4	-58.5	-67.8	0	0	0	113.1	T286 R290 E466	T286-Y288 WeakPolarHBondContact OG1-CD2 3.41Å; T286-Y288 PolarHBondContact OG1-N 2.58Å; T286-Y288 VanDerWaalsContact OG1-N 3.15Å; Y288-R290 PolarHBondContact O-N 3.33Å; Y288-E466 WeakPolarHBondContact CD2-OE1 3.4Å
289	R	91.1	Very high	93.7	Very high	125 Å²	125	75.4 Å²	75.4	47%	0.472	34%	0.342	S	S	.	.	S	Bend	trans	-71	124.9	172.7	-171.3	175.6	177.2	136.9	1.8	109.8	Y280 Y284 T286	Y280-R289 HydrophobicContact CE1-CG 4.3Å; Y280-R289 PolarHBondContact OH-NE 2.8Å; Y280-R289 VanDerWaalsContact OH-NE 3.12Å; Y284-R289 VanDerWaalsContact CD1-NH1 3.26Å; Y284-R289 VanDerWaalsContact CZ-CZ 3.47Å; T286-R289 HydrophobicContact CG2-CB 3.93Å
290	R	93	Very high	93.7	Very high	222 Å²	222	78 Å²	78	84%	0.838	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-59.5	144.2	174	-66	-173.3	-179.4	-178.2	0.4	110.6	Y280 Y288	Y280-R290 PolarHBondContact OH-O 2.68Å; Y288-R290 PolarHBondContact O-N 3.33Å
291	F	95.4	Very high	93.7	Very high	55 Å²	55	76.8 Å²	76.8	24%	0.241	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-70.4	152.5	171	-68.6	-57.8	0	0	0	110	A277 Y280 Q281 L295 L299	A277-F291 HydrophobicContact CB-CE1 3.96Å; A277-F291 HydrophobicContact CB-CZ 3.84Å; Y280-F291 AromaticContact CD1-CD1 3.56Å; Y280-F291 HydrophobicContact CD1-CD1 3.56Å; Y280-F291 AromaticContact CD1-CE1 3.6Å; Y280-F291 HydrophobicContact CD1-CE1 3.6Å; Y280-F291 AromaticContact CE1-CD1 3.86Å; Y280-F291 HydrophobicContact CE1-CD1 3.86Å; Y280-F291 HydrophobicContact CE1-CE1 4.26Å; Y280-F291 HydrophobicContact CG-CD1 4.1Å; Y280-F291 HydrophobicContact CG-CE1 4.19Å; Q281-F291 HydrophobicContact CG-CE1 4.37Å; Q281-F291 HydrophobicContact CG-CZ 4.27Å; F291-L295 HydrophobicContact CB-CD2 4.32Å; F291-L295 HydrophobicContact CD1-CD2 3.76Å; F291-L295 HydrophobicContact CE1-CD2 4.36Å; F291-L295 HydrophobicContact CG-CD2 4.17Å; F291-L299 HydrophobicContact CD2-CD1 4.11Å; F291-L299 HydrophobicContact CE2-CD1 4.24Å
292	P	95.9	Very high	93.8	Very high	30 Å²	30	80.9 Å²	80.9	20%	0.195	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.3	147.1	171.3	28.1	-34.9	0	0	0	110.1	Y280 W294 L295 E296	Y280-P292 HydrophobicContact CE2-CG 4.48Å; P292-W294 VanDerWaalsContact C-N 3.27Å; P292-W294 HydrophobicContact CG-CD2 4.45Å; P292-W294 HydrophobicContact CG-CZ2 3.92Å; P292-W294 PolarHBondContact O-N 3.34Å; P292-W294 VanDerWaalsContact O-N 3.13Å; P292-L295 HydrophobicContact CG-CB 3.94Å; P292-L295 PolarHBondContact O-N 2.9Å; P292-E296 PolarHBondContact O-N 3.41Å
293	P	94.8	Very high	93.9	Very high	101 Å²	101	83.7 Å²	83.7	66%	0.656	37%	0.369	S	S	*	.	H	α-helix	trans	-54.7	-38.3	-171.3	-29.1	35.1	0	0	0	114.4	L295 E296 S297	P293-L295 VanDerWaalsContact C-N 3.31Å; P293-L295 PolarHBondContact O-N 3Å; P293-E296 PolarHBondContact O-N 3.5Å; P293-S297 PolarHBondContact O-N 3.36Å; P293-S297 PolarHBondContact O-OG 3.38Å
294	W	94.7	Very high	94	Very high	152 Å²	152	76 Å²	76	58%	0.576	34%	0.339	S	S	*	.	H	α-helix	trans	-61.7	-37.2	178.6	65.5	-99.1	0	0	0	112.9	I276 P292 W298	I276-W294 HydrophobicContact CG2-CH2 4.01Å; P292-W294 VanDerWaalsContact C-N 3.27Å; P292-W294 HydrophobicContact CG-CD2 4.45Å; P292-W294 HydrophobicContact CG-CZ2 3.92Å; P292-W294 PolarHBondContact O-N 3.34Å; P292-W294 VanDerWaalsContact O-N 3.13Å; W294-W298 HydrophobicContact CE3-CE3 4.4Å; W294-W298 AromaticContact CZ3-CE3 3.99Å; W294-W298 HydrophobicContact CZ3-CE3 3.99Å; W294-W298 HydrophobicContact CZ3-CZ3 4.18Å; W294-W298 WeakPolarHBondContact O-CB 3.43Å; W294-W298 PolarHBondContact O-N 2.92Å; W294-W298 VanDerWaalsContact O-N 3.12Å
295	L	95.1	Very high	94.3	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-76.6	-37.2	179.9	-179.2	59.9	0	0	0	110.6	I276 A277 F291 P292 P293 W298 L299	I276-L295 HydrophobicContact CB-CD1 4.37Å; I276-L295 HydrophobicContact CG2-CD1 4.03Å; I276-L295 HydrophobicContact CG2-CD2 4.07Å; A277-L295 HydrophobicContact CB-CD2 4.34Å; F291-L295 HydrophobicContact CB-CD2 4.32Å; F291-L295 HydrophobicContact CD1-CD2 3.76Å; F291-L295 HydrophobicContact CE1-CD2 4.36Å; F291-L295 HydrophobicContact CG-CD2 4.17Å; P292-L295 HydrophobicContact CG-CB 3.94Å; P292-L295 PolarHBondContact O-N 2.9Å; P293-L295 VanDerWaalsContact C-N 3.31Å; P293-L295 PolarHBondContact O-N 3Å; L295-W298 HydrophobicContact CD1-CE3 4.15Å; L295-W298 PolarHBondContact O-N 3.42Å; L295-L299 HydrophobicContact CD1-CD1 4.47Å; L295-L299 HydrophobicContact CD1-CG 4.39Å; L295-L299 HydrophobicContact CG-CD1 4.1Å; L295-L299 HydrophobicContact CG-CG 4.49Å; L295-L299 WeakPolarHBondContact O-CB 3.45Å; L295-L299 VanDerWaalsContact O-CG 3.25Å; L295-L299 WeakPolarHBondContact O-CG 3.37Å; L295-L299 PolarHBondContact O-N 3.5Å
296	E	94.3	Very high	94.6	Very high	95 Å²	95	73.3 Å²	73.3	44%	0.444	34%	0.335	S	S	.	.	H	α-helix	trans	-62.3	-50.5	174.8	-177.7	171.1	-165	0	0	111.5	P292 P293 W298 L299 Q300	P292-E296 PolarHBondContact O-N 3.41Å; P293-E296 PolarHBondContact O-N 3.5Å; E296-W298 VanDerWaalsContact C-N 3.28Å; E296-W298 PolarHBondContact O-N 2.96Å; E296-L299 PolarHBondContact O-N 2.76Å; E296-Q300 WeakPolarHBondContact O-CG 3.27Å; E296-Q300 PolarHBondContact O-N 3.43Å
297	S	93.4	Very high	94.9	Very high	66 Å²	66	74.4 Å²	74.4	46%	0.462	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-40.2	175.6	-59.3	0	0	0	0	111.9	P293 Q300 C301	P293-S297 PolarHBondContact O-N 3.36Å; P293-S297 PolarHBondContact O-OG 3.38Å; S297-Q300 PolarHBondContact O-N 2.9Å; S297-C301 PolarHBondContact O-N 3.15Å; S297-C301 PolarHBondContact O-SG 3.43Å
298	W	96.1	Very high	95.3	Very high	50 Å²	50	71.4 Å²	71.4	19%	0.189	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-42.3	176.2	-174.9	14.3	0	0	0	112.5	L269 L272 S273 I276 W294 L295 E296 Q300 C301 R302	L269-W298 HydrophobicContact CB-CZ2 4.25Å; L269-W298 HydrophobicContact CD2-CH2 4.47Å; L269-W298 HydrophobicContact CD2-CZ2 3.89Å; L269-W298 VanDerWaalsContact O-CZ2 3.26Å; L269-W298 WeakPolarHBondContact O-CZ2 3.3Å; L269-W298 PolarHBondContact O-NE1 3.37Å; L272-W298 HydrophobicContact CB-CH2 4.2Å; L272-W298 HydrophobicContact CB-CZ2 4.27Å; L272-W298 HydrophobicContact CD2-CH2 3.89Å; L272-W298 HydrophobicContact CD2-CZ2 4.44Å; L272-W298 HydrophobicContact CG-CH2 3.88Å; L272-W298 HydrophobicContact CG-CZ2 4.44Å; S273-W298 VanDerWaalsContact CB-CD2 3.49Å; I276-W298 HydrophobicContact CD1-CH2 3.89Å; I276-W298 HydrophobicContact CD1-CZ3 3.57Å; W294-W298 HydrophobicContact CE3-CE3 4.4Å; W294-W298 AromaticContact CZ3-CE3 3.99Å; W294-W298 HydrophobicContact CZ3-CE3 3.99Å; W294-W298 HydrophobicContact CZ3-CZ3 4.18Å; W294-W298 WeakPolarHBondContact O-CB 3.43Å; W294-W298 PolarHBondContact O-N 2.92Å; W294-W298 VanDerWaalsContact O-N 3.12Å; L295-W298 HydrophobicContact CD1-CE3 4.15Å; L295-W298 PolarHBondContact O-N 3.42Å; E296-W298 VanDerWaalsContact C-N 3.28Å; E296-W298 PolarHBondContact O-N 2.96Å; W298-Q300 VanDerWaalsContact C-N 3.27Å; W298-Q300 PolarHBondContact O-N 3.41Å; W298-C301 PolarHBondContact O-N 2.93Å; W298-C301 VanDerWaalsContact O-N 3.12Å; W298-R302 PolarHBondContact O-N 3.32Å
299	L	95.4	Very high	95.7	Very high	28 Å²	28	64.8 Å²	64.8	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-34.1	176.8	-77.2	166.6	0	0	0	112.7	S273 A277 F291 L295 E296 R302	S273-L299 WeakPolarHBondContact OG-CD2 3.49Å; A277-L299 HydrophobicContact CB-CD1 4.24Å; F291-L299 HydrophobicContact CD2-CD1 4.11Å; F291-L299 HydrophobicContact CE2-CD1 4.24Å; L295-L299 HydrophobicContact CD1-CD1 4.47Å; L295-L299 HydrophobicContact CD1-CG 4.39Å; L295-L299 HydrophobicContact CG-CD1 4.1Å; L295-L299 HydrophobicContact CG-CG 4.49Å; L295-L299 WeakPolarHBondContact O-CB 3.45Å; L295-L299 VanDerWaalsContact O-CG 3.25Å; L295-L299 WeakPolarHBondContact O-CG 3.37Å; L295-L299 PolarHBondContact O-N 3.5Å; E296-L299 PolarHBondContact O-N 2.76Å; L299-R302 WeakPolarHBondContact O-CG 3.34Å; L299-R302 PolarHBondContact O-NE 2.94Å
300	Q	94.5	Very high	96.1	Very high	107 Å²	107	61.3 Å²	61.3	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-70	-31.6	175.5	-69	174.3	4.6	0	0	112.4	E296 S297 W298 R302 Q304	E296-Q300 WeakPolarHBondContact O-CG 3.27Å; E296-Q300 PolarHBondContact O-N 3.43Å; S297-Q300 PolarHBondContact O-N 2.9Å; W298-Q300 VanDerWaalsContact C-N 3.27Å; W298-Q300 PolarHBondContact O-N 3.41Å; Q300-R302 VanDerWaalsContact C-N 3.32Å; Q300-R302 PolarHBondContact O-N 2.97Å; Q300-Q304 PolarHBondContact O-OE1 3Å
301	C	95.4	Very high	96.3	Very high	20 Å²	20	56.3 Å²	56.3	14%	0.135	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.1	-178	-65	0	0	0	0	114.6	P215 S297 W298 K303 Q304 L305	P215-C301 HydrophobicContact CG-CB 3.78Å; S297-C301 PolarHBondContact O-N 3.15Å; S297-C301 PolarHBondContact O-SG 3.43Å; W298-C301 PolarHBondContact O-N 2.93Å; W298-C301 VanDerWaalsContact O-N 3.12Å; C301-K303 VanDerWaalsContact C-N 3.27Å; C301-K303 PolarHBondContact O-N 3.16Å; C301-Q304 PolarHBondContact O-N 3.24Å; C301-Q304 VanDerWaalsContact O-N 3.14Å; C301-Q304 PolarHBondContact O-OE1 3.45Å; C301-L305 WeakPolarHBondContact O-CG 3.22Å; C301-L305 PolarHBondContact O-N 3.34Å
302	R	96.5	Very high	96.5	Very high	113 Å²	113	55 Å²	55	43%	0.426	27%	0.269	S	S	.	.	H	α-helix	trans	-55.9	-38.7	-176.7	-78.2	-172.9	-67	166.7	3.6	113.5	V270 S273 W298 L299 Q300 L305 G306	V270-R302 HydrophobicContact CG1-CB 4.18Å; V270-R302 HydrophobicContact CG1-CG 4.32Å; V270-R302 VanDerWaalsContact O-CD 3.32Å; V270-R302 WeakPolarHBondContact O-CD 3.46Å; S273-R302 WeakPolarHBondContact OG-CD 3.31Å; W298-R302 PolarHBondContact O-N 3.32Å; L299-R302 WeakPolarHBondContact O-CG 3.34Å; L299-R302 PolarHBondContact O-NE 2.94Å; Q300-R302 VanDerWaalsContact C-N 3.32Å; Q300-R302 PolarHBondContact O-N 2.97Å; R302-L305 PolarHBondContact O-N 2.99Å; R302-G306 PolarHBondContact O-N 2.88Å
303	K	96.3	Very high	96.6	Very high	91 Å²	91	54.1 Å²	54.1	40%	0.396	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-48.5	177.9	179.5	-179.5	-179.8	172	0	110.9	C301 G306 L307 S378	C301-K303 VanDerWaalsContact C-N 3.27Å; C301-K303 PolarHBondContact O-N 3.16Å; K303-G306 PolarHBondContact O-N 2.82Å; K303-L307 HydrophobicContact CG-CD1 4.17Å; K303-L307 WeakPolarHBondContact O-CG 3.34Å; K303-L307 PolarHBondContact O-N 3.39Å; K303-S378 VanDerWaalsContact CE-O 3.25Å; K303-S378 WeakPolarHBondContact CE-O 2.98Å; K303-S378 PolarHBondContact NZ-O 3.16Å
304	Q	97.6	Very high	96.8	Very high	15 Å²	15	52.1 Å²	52.1	7%	0.07	25%	0.25	C	S	.	.	H	α-helix	trans	-65.7	-41.1	-178.2	-68.9	76.6	4.8	0	0	111.2	L211 W212 P215 Q300 C301 L307 L308	L211-Q304 HydrophobicContact CB-CG 4.41Å; W212-Q304 HydrophobicContact CD2-CB 4.07Å; W212-Q304 HydrophobicContact CD2-CG 3.57Å; W212-Q304 HydrophobicContact CE3-CB 4Å; W212-Q304 HydrophobicContact CE3-CG 4.03Å; W212-Q304 HydrophobicContact CG-CG 3.85Å; W212-Q304 HydrophobicContact CH2-CG 4.48Å; W212-Q304 HydrophobicContact CZ2-CG 4.07Å; W212-Q304 HydrophobicContact CZ3-CB 4.27Å; W212-Q304 HydrophobicContact CZ3-CG 4.47Å; P215-Q304 HydrophobicContact CB-CB 4.01Å; P215-Q304 HydrophobicContact CG-CB 3.77Å; Q300-Q304 PolarHBondContact O-OE1 3Å; C301-Q304 PolarHBondContact O-N 3.24Å; C301-Q304 VanDerWaalsContact O-N 3.14Å; C301-Q304 PolarHBondContact O-OE1 3.45Å; Q304-L307 PolarHBondContact O-N 2.96Å; Q304-L308 WeakPolarHBondContact O-CG 3.16Å; Q304-L308 PolarHBondContact O-N 3.17Å
305	L	97.8	Very high	96.9	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-44.1	174.5	-68.6	174.9	0	0	0	112.6	P215 M218 L266 V270 C301 R302 L308 S309	P215-L305 HydrophobicContact CB-CD2 3.68Å; P215-L305 HydrophobicContact CB-CG 4.21Å; P215-L305 HydrophobicContact CG-CD2 4.05Å; P215-L305 HydrophobicContact CG-CG 4.17Å; M218-L305 HydrophobicContact CE-CD1 4.11Å; M218-L305 HydrophobicContact CE-CD2 3.1Å; M218-L305 HydrophobicContact CE-CG 4.24Å; L266-L305 HydrophobicContact CD2-CD2 3.98Å; V270-L305 HydrophobicContact CG2-CB 3.54Å; C301-L305 WeakPolarHBondContact O-CG 3.22Å; C301-L305 PolarHBondContact O-N 3.34Å; R302-L305 PolarHBondContact O-N 2.99Å; L305-L308 PolarHBondContact O-N 2.91Å; L305-S309 WeakPolarHBondContact O-CB 3.37Å; L305-S309 PolarHBondContact O-N 3.11Å
306	G	97.7	Very high	97.1	Very high	23 Å²	23	48.3 Å²	48.3	24%	0.237	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-41.3	176.5	0	0	0	0	0	112.6	R302 K303 S309 F310	R302-G306 PolarHBondContact O-N 2.88Å; K303-G306 PolarHBondContact O-N 2.82Å; G306-S309 WeakPolarHBondContact O-CB 3.31Å; G306-S309 PolarHBondContact O-N 3.49Å; G306-F310 PolarHBondContact O-N 3.28Å
307	L	98.2	Very high	97.3	Very high	42 Å²	42	45.8 Å²	45.8	22%	0.22	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-40.4	176.6	-71.1	174	0	0	0	112.6	W212 K303 Q304 F310 F311 A375	W212-L307 HydrophobicContact CH2-CB 3.87Å; W212-L307 HydrophobicContact CH2-CD1 3.76Å; W212-L307 HydrophobicContact CH2-CG 4.49Å; W212-L307 HydrophobicContact CZ2-CD1 3.98Å; W212-L307 HydrophobicContact CZ3-CB 4.44Å; K303-L307 HydrophobicContact CG-CD1 4.17Å; K303-L307 WeakPolarHBondContact O-CG 3.34Å; K303-L307 PolarHBondContact O-N 3.39Å; Q304-L307 PolarHBondContact O-N 2.96Å; L307-F310 PolarHBondContact O-N 2.9Å; L307-F311 PolarHBondContact O-N 3.03Å; L307-A375 HydrophobicContact CD2-CB 4.35Å
308	L	98.4	Very high	97.5	Very high	22 Å²	22	45 Å²	45	12%	0.115	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-44.8	172.9	-73.1	172.5	0	0	0	111.1	W212 P215 V216 A219 L266 Q304 L305 F310 F311 F312	W212-L308 HydrophobicContact CE3-CG 4.42Å; W212-L308 HydrophobicContact CZ3-CD2 4.17Å; W212-L308 HydrophobicContact CZ3-CG 4Å; P215-L308 HydrophobicContact CB-CD1 3.67Å; P215-L308 WeakPolarHBondContact O-CD1 3.28Å; V216-L308 HydrophobicContact CG2-CD1 4.18Å; A219-L308 HydrophobicContact CB-CD1 4.12Å; L266-L308 HydrophobicContact CD1-CB 3.91Å; Q304-L308 WeakPolarHBondContact O-CG 3.16Å; Q304-L308 PolarHBondContact O-N 3.17Å; L305-L308 PolarHBondContact O-N 2.91Å; L308-F310 VanDerWaalsContact C-N 3.32Å; L308-F310 PolarHBondContact O-N 3.22Å; L308-F311 WeakPolarHBondContact O-CB 3.41Å; L308-F311 PolarHBondContact O-N 3.41Å; L308-F311 VanDerWaalsContact O-N 3.15Å; L308-F312 WeakPolarHBondContact O-CD2 3.32Å; L308-F312 PolarHBondContact O-N 3.22Å
309	S	98.4	Very high	97.5	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-54.2	-48.2	174.9	175.3	0	0	0	0	111.8	A263 L267 L305 G306 F311 F312 A313	A263-S309 WeakPolarHBondContact O-CB 3.06Å; A263-S309 PolarHBondContact O-OG 3.06Å; L267-S309 WeakPolarHBondContact CB-OG 3.5Å; L305-S309 WeakPolarHBondContact O-CB 3.37Å; L305-S309 PolarHBondContact O-N 3.11Å; G306-S309 WeakPolarHBondContact O-CB 3.31Å; G306-S309 PolarHBondContact O-N 3.49Å; S309-F311 PolarHBondContact O-N 3.39Å; S309-F312 PolarHBondContact O-N 3.45Å; S309-A313 WeakPolarHBondContact O-CB 3.46Å; S309-A313 PolarHBondContact O-N 3.42Å
310	F	98.5	Very high	97.6	Very high	52 Å²	52	46.5 Å²	46.5	23%	0.228	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-42	176.3	173.9	-112.5	0	0	0	112.8	G306 L307 L308 A313 T314 L368 L371 S372 A375	G306-F310 PolarHBondContact O-N 3.28Å; L307-F310 PolarHBondContact O-N 2.9Å; L308-F310 VanDerWaalsContact C-N 3.32Å; L308-F310 PolarHBondContact O-N 3.22Å; F310-A313 PolarHBondContact O-N 3.34Å; F310-T314 WeakPolarHBondContact O-CB 3.47Å; F310-T314 PolarHBondContact O-N 3.48Å; F310-T314 PolarHBondContact O-OG1 3.44Å; F310-L368 HydrophobicContact CE2-CD1 4.23Å; F310-L371 HydrophobicContact CD2-CB 3.82Å; F310-L371 HydrophobicContact CE2-CB 4.48Å; F310-S372 WeakPolarHBondContact CE2-OG 3.36Å; F310-A375 HydrophobicContact CB-CB 4.45Å; F310-A375 HydrophobicContact CD1-CB 3.47Å; F310-A375 VanDerWaalsContact CD1-CB 3.47Å; F310-A375 HydrophobicContact CD2-CB 4.27Å; F310-A375 HydrophobicContact CE1-CB 3.66Å; F310-A375 HydrophobicContact CE2-CB 4.42Å; F310-A375 HydrophobicContact CG-CB 3.79Å; F310-A375 HydrophobicContact CZ-CB 4.13Å
311	F	98.4	Very high	97.7	Very high	118 Å²	118	47.6 Å²	47.6	52%	0.518	25%	0.248	S	C	.	.	H	α-helix	trans	-58.9	-52.8	175	170.9	-100.2	0	0	0	111.6	L307 L308 S309 A313 T314 V315	L307-F311 PolarHBondContact O-N 3.03Å; L308-F311 WeakPolarHBondContact O-CB 3.41Å; L308-F311 PolarHBondContact O-N 3.41Å; L308-F311 VanDerWaalsContact O-N 3.15Å; S309-F311 PolarHBondContact O-N 3.39Å; F311-A313 VanDerWaalsContact C-N 3.3Å; F311-A313 PolarHBondContact O-N 3.17Å; F311-T314 PolarHBondContact O-N 3.34Å; F311-T314 VanDerWaalsContact O-N 3.16Å; F311-V315 HydrophobicContact CD2-CG2 4.31Å; F311-V315 HydrophobicContact CE1-CG2 4.22Å; F311-V315 HydrophobicContact CE2-CG2 3.91Å; F311-V315 HydrophobicContact CZ-CG2 3.85Å; F311-V315 WeakPolarHBondContact O-CG2 3.25Å; F311-V315 PolarHBondContact O-N 2.9Å
312	F	98.6	Very high	97.7	Very high	26 Å²	26	49.5 Å²	49.5	11%	0.114	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-39.2	177.8	-80.8	-78.5	0	0	0	112.2	A219 L259 V262 A263 L266 L308 S309 H316	A219-F312 HydrophobicContact CB-CE2 3.88Å; A219-F312 HydrophobicContact CB-CZ 4.36Å; L259-F312 HydrophobicContact CD2-CD1 3.54Å; L259-F312 HydrophobicContact CD2-CE1 3.95Å; V262-F312 HydrophobicContact CB-CD1 4.28Å; V262-F312 HydrophobicContact CB-CG 4.42Å; V262-F312 HydrophobicContact CG1-CD1 4.1Å; V262-F312 HydrophobicContact CG1-CD2 3.89Å; V262-F312 HydrophobicContact CG1-CE1 4.12Å; V262-F312 HydrophobicContact CG1-CE2 3.94Å; V262-F312 HydrophobicContact CG1-CG 4.02Å; V262-F312 HydrophobicContact CG1-CZ 4.05Å; A263-F312 HydrophobicContact CB-CB 3.76Å; L266-F312 HydrophobicContact CD1-CD2 3.89Å; L266-F312 HydrophobicContact CD1-CE2 4.16Å; L308-F312 WeakPolarHBondContact O-CD2 3.32Å; L308-F312 PolarHBondContact O-N 3.22Å; S309-F312 PolarHBondContact O-N 3.45Å; F312-H316 WeakPolarHBondContact O-CB 3.38Å; F312-H316 PolarHBondContact O-N 2.85Å
313	A	98.4	Very high	97.6	Very high	12 Å²	12	46.8 Å²	46.8	10%	0.099	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-42.4	175.5	0	0	0	0	0	112.2	A263 S309 F310 F311 H316 V317 L371	A263-A313 HydrophobicContact CB-CB 4.11Å; S309-A313 WeakPolarHBondContact O-CB 3.46Å; S309-A313 PolarHBondContact O-N 3.42Å; F310-A313 PolarHBondContact O-N 3.34Å; F311-A313 VanDerWaalsContact C-N 3.3Å; F311-A313 PolarHBondContact O-N 3.17Å; A313-H316 WeakPolarHBondContact O-CB 3.38Å; A313-H316 PolarHBondContact O-N 3.21Å; A313-V317 VanDerWaalsContact O-CG2 3.24Å; A313-V317 WeakPolarHBondContact O-CG2 3.22Å; A313-V317 PolarHBondContact O-N 3.2Å; A313-L371 HydrophobicContact CB-CD1 4.04Å
314	T	98.4	Very high	97.5	Very high	59 Å²	59	47.4 Å²	47.4	36%	0.362	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-42.2	179.1	-55.7	0	0	0	0	111.4	F310 F311 V317 A318	F310-T314 WeakPolarHBondContact O-CB 3.47Å; F310-T314 PolarHBondContact O-N 3.48Å; F310-T314 PolarHBondContact O-OG1 3.44Å; F311-T314 PolarHBondContact O-N 3.34Å; F311-T314 VanDerWaalsContact O-N 3.16Å; T314-V317 PolarHBondContact O-N 3.5Å; T314-A318 PolarHBondContact O-N 3.5Å; T314-A318 VanDerWaalsContact O-N 3.09Å
315	V	98.3	Very high	97.3	Very high	38 Å²	38	54.2 Å²	54.2	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-42.3	174.9	-177.5	0	0	0	0	110.3	L259 F311 V317 A318 Y319	L259-V315 HydrophobicContact CD1-CB 4.2Å; L259-V315 HydrophobicContact CD1-CG1 3.62Å; L259-V315 HydrophobicContact CD2-CG1 4.32Å; F311-V315 HydrophobicContact CD2-CG2 4.31Å; F311-V315 HydrophobicContact CE1-CG2 4.22Å; F311-V315 HydrophobicContact CE2-CG2 3.91Å; F311-V315 HydrophobicContact CZ-CG2 3.85Å; F311-V315 WeakPolarHBondContact O-CG2 3.25Å; F311-V315 PolarHBondContact O-N 2.9Å; V315-V317 VanDerWaalsContact C-N 3.28Å; V315-V317 PolarHBondContact O-N 3.45Å; V315-A318 WeakPolarHBondContact O-CB 3.42Å; V315-A318 PolarHBondContact O-N 3.33Å; V315-A318 VanDerWaalsContact O-N 3.16Å; V315-Y319 HydrophobicContact CG1-CD2 3.71Å; V315-Y319 HydrophobicContact CG1-CE2 3.55Å; V315-Y319 VanDerWaalsContact O-CD2 3.26Å; V315-Y319 WeakPolarHBondContact O-CD2 3.44Å; V315-Y319 PolarHBondContact O-N 3.2Å
316	H	98.1	Very high	97.2	Very high	34 Å²	34	55.5 Å²	55.5	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-56.4	-41.5	174	163.7	60.1	0	0	0	112.6	N256 L259 P260 F312 A313 Y319 S320	N256-H316 PolarHBondContact OD1-ND1 2.87Å; N256-H316 PolarHBondContact OD1-O 3.46Å; L259-H316 HydrophobicContact CB-CB 3.94Å; P260-H316 HydrophobicContact CB-CB 4.45Å; F312-H316 WeakPolarHBondContact O-CB 3.38Å; F312-H316 PolarHBondContact O-N 2.85Å; A313-H316 WeakPolarHBondContact O-CB 3.38Å; A313-H316 PolarHBondContact O-N 3.21Å; H316-Y319 PolarHBondContact O-N 3.04Å; H316-S320 PolarHBondContact CE1-OG 3.13Å; H316-S320 PolarHBondContact ND1-OG 3.39Å; H316-S320 WeakPolarHBondContact O-CB 3.46Å; H316-S320 PolarHBondContact O-N 3.41Å; H316-S320 PolarHBondContact O-OG 2.89Å
317	V	98.1	Very high	97.1	Very high	43 Å²	43	62.1 Å²	62.1	26%	0.261	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-46.6	176.3	171.1	0	0	0	0	110.6	A313 T314 V315 Y319 S320 L321 L368	A313-V317 VanDerWaalsContact O-CG2 3.24Å; A313-V317 WeakPolarHBondContact O-CG2 3.22Å; A313-V317 PolarHBondContact O-N 3.2Å; T314-V317 PolarHBondContact O-N 3.5Å; V315-V317 VanDerWaalsContact C-N 3.28Å; V315-V317 PolarHBondContact O-N 3.45Å; V317-Y319 PolarHBondContact O-N 3.45Å; V317-S320 PolarHBondContact O-N 3.28Å; V317-L321 HydrophobicContact CG1-CD1 3.86Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 WeakPolarHBondContact O-CG 3.5Å; V317-L321 PolarHBondContact O-N 2.99Å; V317-L368 HydrophobicContact CB-CD2 4.34Å; V317-L368 HydrophobicContact CG1-CD2 4.06Å; V317-L368 HydrophobicContact CG2-CD1 4.19Å; V317-L368 HydrophobicContact CG2-CD2 3.76Å; V317-L368 HydrophobicContact CG2-CG 4.43Å
318	A	97.7	Very high	96.9	Very high	50 Å²	50	61.6 Å²	61.6	41%	0.413	32%	0.324	S	S	.	.	H	α-helix	trans	-58.5	-46.5	177	0	0	0	0	0	111.9	T314 V315 S320 L321 C322	T314-A318 PolarHBondContact O-N 3.5Å; T314-A318 VanDerWaalsContact O-N 3.09Å; V315-A318 WeakPolarHBondContact O-CB 3.42Å; V315-A318 PolarHBondContact O-N 3.33Å; V315-A318 VanDerWaalsContact O-N 3.16Å; A318-S320 VanDerWaalsContact C-N 3.32Å; A318-S320 PolarHBondContact O-N 3.18Å; A318-L321 PolarHBondContact O-N 3.18Å; A318-C322 PolarHBondContact O-N 3.03Å; A318-C322 VanDerWaalsContact O-N 3.15Å; A318-C322 PolarHBondContact O-SG 2.89Å
319	Y	97.6	Very high	96.6	Very high	72 Å²	72	63.4 Å²	63.4	28%	0.282	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-39.9	176.6	-86.3	-110.7	0	0	0	112.3	I252 V255 N256 L259 V315 H316 V317 C322 L323	I252-Y319 HydrophobicContact CD1-CD1 4Å; I252-Y319 HydrophobicContact CD1-CE1 3.71Å; I252-Y319 HydrophobicContact CG2-CD1 4.09Å; V255-Y319 HydrophobicContact CB-CD1 4.45Å; V255-Y319 HydrophobicContact CB-CE1 3.94Å; V255-Y319 HydrophobicContact CG1-CD1 4.15Å; V255-Y319 HydrophobicContact CG1-CE1 3.57Å; V255-Y319 HydrophobicContact CG1-CE2 4.46Å; N256-Y319 HydrophobicContact CB-CD1 4.24Å; N256-Y319 HydrophobicContact CB-CG 4.48Å; N256-Y319 WeakPolarHBondContact OD1-CB 3.46Å; L259-Y319 HydrophobicContact CD1-CD2 3.96Å; L259-Y319 HydrophobicContact CD1-CE2 4.22Å; L259-Y319 HydrophobicContact CD1-CG 4.2Å; V315-Y319 HydrophobicContact CG1-CD2 3.71Å; V315-Y319 HydrophobicContact CG1-CE2 3.55Å; V315-Y319 VanDerWaalsContact O-CD2 3.26Å; V315-Y319 WeakPolarHBondContact O-CD2 3.44Å; V315-Y319 PolarHBondContact O-N 3.2Å; H316-Y319 PolarHBondContact O-N 3.04Å; V317-Y319 PolarHBondContact O-N 3.45Å; Y319-C322 PolarHBondContact O-N 3.38Å; Y319-L323 PolarHBondContact O-N 3.32Å
320	S	97.1	Very high	96.4	Very high	37 Å²	37	70.2 Å²	70.2	26%	0.259	36%	0.358	S	S	.	.	H	α-helix	trans	-69.2	-40.9	-179.2	-59.9	0	0	0	0	112.3	N256 H316 V317 A318 C322 L323	N256-S320 PolarHBondContact ND2-OG 2.89Å; N256-S320 PolarHBondContact OD1-OG 3.05Å; H316-S320 PolarHBondContact CE1-OG 3.13Å; H316-S320 PolarHBondContact ND1-OG 3.39Å; H316-S320 WeakPolarHBondContact O-CB 3.46Å; H316-S320 PolarHBondContact O-N 3.41Å; H316-S320 PolarHBondContact O-OG 2.89Å; V317-S320 PolarHBondContact O-N 3.28Å; A318-S320 VanDerWaalsContact C-N 3.32Å; A318-S320 PolarHBondContact O-N 3.18Å; S320-C322 VanDerWaalsContact C-N 3.26Å; S320-C322 PolarHBondContact O-N 3.09Å; S320-L323 WeakPolarHBondContact O-CB 3.36Å; S320-L323 WeakPolarHBondContact O-CG 3.3Å; S320-L323 PolarHBondContact O-N 3.4Å
321	L	96.3	Very high	96.3	Very high	129 Å²	129	74.5 Å²	74.5	68%	0.675	37%	0.374	S	S	*	.	H	α-helix	trans	-66.5	-28.5	175.4	-68.5	175.3	0	0	0	112.5	V317 A318 L323 P324	V317-L321 HydrophobicContact CG1-CD1 3.86Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 WeakPolarHBondContact O-CG 3.5Å; V317-L321 PolarHBondContact O-N 2.99Å; A318-L321 PolarHBondContact O-N 3.18Å; L321-L323 VanDerWaalsContact C-N 3.33Å; L321-P324 WeakPolarHBondContact O-CD 3.41Å
322	C	95.5	Very high	96	Very high	60 Å²	60	73.1 Å²	73.1	41%	0.405	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.4	176.7	-68	0	0	0	0	114.2	A318 Y319 S320 M325	A318-C322 PolarHBondContact O-N 3.03Å; A318-C322 VanDerWaalsContact O-N 3.15Å; A318-C322 PolarHBondContact O-SG 2.89Å; Y319-C322 PolarHBondContact O-N 3.38Å; S320-C322 VanDerWaalsContact C-N 3.26Å; S320-C322 PolarHBondContact O-N 3.09Å; C322-M325 WeakPolarHBondContact O-CB 3.33Å; C322-M325 PolarHBondContact O-N 3.13Å; C322-M325 VanDerWaalsContact O-N 3.15Å
323	L	93.4	Very high	95.8	Very high	56 Å²	56	79.1 Å²	79.1	29%	0.293	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-54.5	-48.9	-178.3	-69.6	172.2	0	0	0	112.9	I252 Y319 S320 L321 M325 R326 E329	I252-L323 HydrophobicContact CG2-CD2 4.25Å; Y319-L323 PolarHBondContact O-N 3.32Å; S320-L323 WeakPolarHBondContact O-CB 3.36Å; S320-L323 WeakPolarHBondContact O-CG 3.3Å; S320-L323 PolarHBondContact O-N 3.4Å; L321-L323 VanDerWaalsContact C-N 3.33Å; L323-M325 PolarHBondContact O-N 3.23Å; L323-M325 VanDerWaalsContact O-N 3.15Å; L323-R326 WeakPolarHBondContact O-CB 3.49Å; L323-R326 WeakPolarHBondContact O-CD 3.43Å; L323-R326 WeakPolarHBondContact O-CG 3.45Å; L323-R326 PolarHBondContact O-N 3.21Å; L323-E329 VanDerWaalsContact O-CG 3.26Å; L323-E329 WeakPolarHBondContact O-CG 3.49Å
324	P	94.4	Very high	95.7	Very high	105 Å²	105	82.9 Å²	82.9	68%	0.682	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-65.4	-20.5	-178.4	-20.6	34.3	0	0	0	114.2	L321 R326	L321-P324 WeakPolarHBondContact O-CD 3.41Å; P324-R326 VanDerWaalsContact C-N 3.27Å; P324-R326 PolarHBondContact O-N 3.15Å
325	M	94.3	Very high	95.6	Very high	157 Å²	157	84.8 Å²	84.8	77%	0.773	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-77.6	-13	-179.6	-62.4	175.9	64.9	0	0	113.1	C322 L323	C322-M325 WeakPolarHBondContact O-CB 3.33Å; C322-M325 PolarHBondContact O-N 3.13Å; C322-M325 VanDerWaalsContact O-N 3.15Å; L323-M325 PolarHBondContact O-N 3.23Å; L323-M325 VanDerWaalsContact O-N 3.15Å
326	R	95.3	Very high	95.5	Very high	30 Å²	30	88.1 Å²	88.1	11%	0.113	44%	0.438	C	S	.	.	S	Bend	trans	-73.1	140	-175.2	-63.9	165.6	62.2	-153	-9.1	111.2	E253 L323 P324 S328 E329 R330	E253-R326 IonicContact OE1-CZ 3.96Å; E253-R326 IonicContact OE1-NH1 3.63Å; E253-R326 PolarHBondContact OE1-NH1 3.43Å; E253-R326 IonicContact OE1-NH2 2.96Å; E253-R326 PolarHBondContact OE1-NH2 2.86Å; L323-R326 WeakPolarHBondContact O-CB 3.49Å; L323-R326 WeakPolarHBondContact O-CD 3.43Å; L323-R326 WeakPolarHBondContact O-CG 3.45Å; L323-R326 PolarHBondContact O-N 3.21Å; P324-R326 VanDerWaalsContact C-N 3.27Å; P324-R326 PolarHBondContact O-N 3.15Å; R326-S328 VanDerWaalsContact C-N 3.27Å; R326-S328 PolarHBondContact NE-OG 3.38Å; R326-S328 PolarHBondContact NH2-OG 3.32Å; R326-S328 PolarHBondContact O-N 2.84Å; R326-E329 HydrophobicContact CB-CB 4.43Å; R326-E329 HydrophobicContact CB-CG 4.11Å; R326-E329 IonicContact CZ-OE1 2.95Å; R326-E329 IonicContact NH1-OE1 3.79Å; R326-E329 PolarHBondContact NH1-OE1 3.04Å; R326-E329 IonicContact NH2-OE1 3.47Å; R326-E329 PolarHBondContact O-N 3.45Å; R326-R330 PolarHBondContact O-N 3.11Å; R326-R330 VanDerWaalsContact O-N 3.12Å
327	R	95.7	Very high	95.3	Very high	161 Å²	161	88.3 Å²	88.3	61%	0.608	45%	0.446	S	S	*	.	H	α-helix	trans	-60.2	-37	174.2	-67.8	-67.6	-177.6	167	-0.4	112.5	R330 Y331	R327-R330 PolarHBondContact O-N 2.96Å; R327-Y331 HydrophobicContact CB-CE2 4.18Å; R327-Y331 WeakPolarHBondContact O-CD2 3.17Å; R327-Y331 PolarHBondContact O-N 3.02Å
328	S	93.3	Very high	95.2	Very high	31 Å²	31	94 Å²	94	22%	0.217	46%	0.464	C	S	.	.	H	α-helix	trans	-61.5	-45.2	177.7	56.9	0	0	0	0	112.6	R326 Y331 L332	R326-S328 VanDerWaalsContact C-N 3.27Å; R326-S328 PolarHBondContact NE-OG 3.38Å; R326-S328 PolarHBondContact NH2-OG 3.32Å; R326-S328 PolarHBondContact O-N 2.84Å; S328-Y331 PolarHBondContact O-N 2.92Å; S328-L332 PolarHBondContact O-N 3.08Å
329	E	92.6	Very high	95.1	Very high	61 Å²	61	97.9 Å²	97.9	29%	0.285	47%	0.473	S	S	.	.	H	α-helix	trans	-66.4	-39.7	177.4	-63.2	-55	146.6	0	0	111.1	L323 R326 Y331 L332 F333	L323-E329 VanDerWaalsContact O-CG 3.26Å; L323-E329 WeakPolarHBondContact O-CG 3.49Å; R326-E329 HydrophobicContact CB-CB 4.43Å; R326-E329 HydrophobicContact CB-CG 4.11Å; R326-E329 IonicContact CZ-OE1 2.95Å; R326-E329 IonicContact NH1-OE1 3.79Å; R326-E329 PolarHBondContact NH1-OE1 3.04Å; R326-E329 IonicContact NH2-OE1 3.47Å; R326-E329 PolarHBondContact O-N 3.45Å; E329-Y331 PolarHBondContact O-N 3.33Å; E329-L332 PolarHBondContact O-N 2.67Å; E329-F333 WeakPolarHBondContact O-CB 3.24Å; E329-F333 PolarHBondContact O-N 2.95Å
330	R	95.1	Very high	95	Very high	143 Å²	143	97.4 Å²	97.4	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-59.6	-44.9	174.8	-177.9	176.5	174.8	172.5	0.1	112.2	R326 R327 L334	R326-R330 PolarHBondContact O-N 3.11Å; R326-R330 VanDerWaalsContact O-N 3.12Å; R327-R330 PolarHBondContact O-N 2.96Å; R330-L334 HydrophobicContact CG-CD1 4.2Å; R330-L334 VanDerWaalsContact O-CG 3.28Å; R330-L334 WeakPolarHBondContact O-CG 3.37Å; R330-L334 PolarHBondContact O-N 2.78Å; R330-L334 VanDerWaalsContact O-N 3.08Å
331	Y	95.2	Very high	95	Very high	142 Å²	142	100.8 Å²	100.8	56%	0.557	49%	0.492	S	S	*	.	H	α-helix	trans	-66.9	-38.9	177.2	-68.1	-49.9	0	0	0	112.1	R327 S328 E329 L334 N335	R327-Y331 HydrophobicContact CB-CE2 4.18Å; R327-Y331 WeakPolarHBondContact O-CD2 3.17Å; R327-Y331 PolarHBondContact O-N 3.02Å; S328-Y331 PolarHBondContact O-N 2.92Å; E329-Y331 PolarHBondContact O-N 3.33Å; Y331-L334 PolarHBondContact O-N 2.81Å; Y331-N335 WeakPolarHBondContact O-CB 3.37Å; Y331-N335 VanDerWaalsContact O-CG 3.24Å; Y331-N335 PolarHBondContact O-N 2.95Å; Y331-N335 PolarHBondContact O-ND2 3.37Å
332	L	93.6	Very high	95	Very high	89 Å²	89	101.6 Å²	101.6	47%	0.466	49%	0.492	S	S	.	.	H	α-helix	trans	-59.9	-48.9	174.8	-179	63.7	0	0	0	111.3	S328 E329 L334 N335 M336	S328-L332 PolarHBondContact O-N 3.08Å; E329-L332 PolarHBondContact O-N 2.67Å; L332-L334 PolarHBondContact O-N 2.81Å; L332-N335 PolarHBondContact O-N 2.92Å; L332-M336 HydrophobicContact CD1-CG 4.37Å; L332-M336 HydrophobicContact CD1-SD 4.23Å; L332-M336 HydrophobicContact CG-SD 3.99Å; L332-M336 VanDerWaalsContact O-CG 3.32Å; L332-M336 WeakPolarHBondContact O-CG 3.27Å; L332-M336 PolarHBondContact O-N 3.22Å
333	F	94.3	Very high	95	Very high	152 Å²	152	101.8 Å²	101.8	67%	0.667	50%	0.498	S	S	*	.	H	α-helix	trans	-60.8	-42.8	178.8	-171.6	-99	0	0	0	112.4	E329 M336 A337	E329-F333 WeakPolarHBondContact O-CB 3.24Å; E329-F333 PolarHBondContact O-N 2.95Å; F333-M336 PolarHBondContact O-N 3.16Å; F333-A337 WeakPolarHBondContact O-CB 3.47Å; F333-A337 PolarHBondContact O-N 3.01Å
334	L	96.3	Very high	95.1	Very high	92 Å²	92	106.1 Å²	106.1	48%	0.482	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176	-72.4	170	0	0	0	112.2	R330 Y331 L332 A337 Y338	R330-L334 HydrophobicContact CG-CD1 4.2Å; R330-L334 VanDerWaalsContact O-CG 3.28Å; R330-L334 WeakPolarHBondContact O-CG 3.37Å; R330-L334 PolarHBondContact O-N 2.78Å; R330-L334 VanDerWaalsContact O-N 3.08Å; Y331-L334 PolarHBondContact O-N 2.81Å; L332-L334 PolarHBondContact O-N 2.81Å; L334-A337 PolarHBondContact O-N 2.98Å; L334-Y338 WeakPolarHBondContact O-CB 3.22Å; L334-Y338 PolarHBondContact O-N 2.91Å
335	N	96.2	Very high	95.1	Very high	98 Å²	98	104.5 Å²	104.5	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-41.5	177.9	-71.6	-14.5	0	0	0	111.7	Y331 L332 Y338 Q339	Y331-N335 WeakPolarHBondContact O-CB 3.37Å; Y331-N335 VanDerWaalsContact O-CG 3.24Å; Y331-N335 PolarHBondContact O-N 2.95Å; Y331-N335 PolarHBondContact O-ND2 3.37Å; L332-N335 PolarHBondContact O-N 2.92Å; N335-Y338 PolarHBondContact O-N 2.94Å; N335-Q339 WeakPolarHBondContact O-CB 3.01Å; N335-Q339 VanDerWaalsContact O-CG 3.3Å; N335-Q339 WeakPolarHBondContact O-CG 3.33Å; N335-Q339 PolarHBondContact O-N 3.13Å
336	M	94.9	Very high	95	Very high	108 Å²	108	106.3 Å²	106.3	53%	0.532	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-44.5	176.1	-71.9	176	67.4	0	0	111.7	L332 F333 Y338 Q339 Q340	L332-M336 HydrophobicContact CD1-CG 4.37Å; L332-M336 HydrophobicContact CD1-SD 4.23Å; L332-M336 HydrophobicContact CG-SD 3.99Å; L332-M336 VanDerWaalsContact O-CG 3.32Å; L332-M336 WeakPolarHBondContact O-CG 3.27Å; L332-M336 PolarHBondContact O-N 3.22Å; F333-M336 PolarHBondContact O-N 3.16Å; M336-Y338 PolarHBondContact O-N 3.35Å; M336-Q339 PolarHBondContact O-N 3.06Å; M336-Q340 WeakPolarHBondContact O-CB 3.5Å; M336-Q340 PolarHBondContact O-N 3.29Å
337	A	94.9	Very high	94.8	Very high	39 Å²	39	110.7 Å²	110.7	32%	0.322	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-42.5	176.7	0	0	0	0	0	111.8	F333 L334 Q340 V341	F333-A337 WeakPolarHBondContact O-CB 3.47Å; F333-A337 PolarHBondContact O-N 3.01Å; L334-A337 PolarHBondContact O-N 2.98Å; A337-Q340 PolarHBondContact O-N 2.8Å; A337-V341 WeakPolarHBondContact O-CG2 3.14Å; A337-V341 PolarHBondContact O-N 3.37Å; A337-V341 VanDerWaalsContact O-N 3.08Å
338	Y	96.1	Very high	94.6	Very high	163 Å²	163	107 Å²	107	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-60.9	-46.4	175.1	177.1	-98.3	0	0	0	112	L334 N335 M336 Q340 V341 H342	L334-Y338 WeakPolarHBondContact O-CB 3.22Å; L334-Y338 PolarHBondContact O-N 2.91Å; N335-Y338 PolarHBondContact O-N 2.94Å; M336-Y338 PolarHBondContact O-N 3.35Å; Y338-Q340 PolarHBondContact O-N 3.36Å; Y338-V341 PolarHBondContact O-N 2.94Å; Y338-H342 WeakPolarHBondContact O-CB 3.46Å; Y338-H342 PolarHBondContact O-N 2.93Å
339	Q	95.8	Very high	94.6	Very high	130 Å²	130	112.7 Å²	112.7	61%	0.607	56%	0.557	S	S	*	*	H	α-helix	trans	-62.9	-40.3	177.6	-74.5	174.4	-10.1	0	0	112.4	N335 M336 H342 A343	N335-Q339 WeakPolarHBondContact O-CB 3.01Å; N335-Q339 VanDerWaalsContact O-CG 3.3Å; N335-Q339 WeakPolarHBondContact O-CG 3.33Å; N335-Q339 PolarHBondContact O-N 3.13Å; M336-Q339 PolarHBondContact O-N 3.06Å; Q339-H342 PolarHBondContact O-N 3.36Å; Q339-A343 WeakPolarHBondContact O-CB 3.31Å; Q339-A343 PolarHBondContact O-N 2.96Å
340	Q	95.1	Very high	94.7	Very high	63 Å²	63	113.4 Å²	113.4	29%	0.294	56%	0.563	S	S	.	*	H	α-helix	trans	-61.5	-48.4	177.3	-177.5	-172.3	-21.8	0	0	111.7	M336 A337 Y338 H342 A343 N344 V345	M336-Q340 WeakPolarHBondContact O-CB 3.5Å; M336-Q340 PolarHBondContact O-N 3.29Å; A337-Q340 PolarHBondContact O-N 2.8Å; Y338-Q340 PolarHBondContact O-N 3.36Å; Q340-H342 VanDerWaalsContact C-N 3.33Å; Q340-A343 PolarHBondContact O-N 3.02Å; Q340-N344 PolarHBondContact O-N 3.26Å; Q340-V345 HydrophobicContact CG-CB 3.95Å; Q340-V345 HydrophobicContact CG-CG1 4.33Å; Q340-V345 WeakPolarHBondContact CG-O 3.38Å; Q340-V345 PolarHBondContact NE2-O 3.08Å; Q340-V345 PolarHBondContact O-N 3.43Å; Q340-V345 VanDerWaalsContact O-N 3.16Å
341	V	96.1	Very high	94.7	Very high	108 Å²	108	111.2 Å²	111.2	66%	0.655	56%	0.559	S	S	*	*	H	α-helix	trans	-62.5	-43.9	177.5	172.8	0	0	0	0	110.3	A337 Y338 A343 N344	A337-V341 WeakPolarHBondContact O-CG2 3.14Å; A337-V341 PolarHBondContact O-N 3.37Å; A337-V341 VanDerWaalsContact O-N 3.08Å; Y338-V341 PolarHBondContact O-N 2.94Å; V341-A343 VanDerWaalsContact C-N 3.26Å; V341-A343 PolarHBondContact O-N 3.43Å; V341-N344 PolarHBondContact O-N 3.43Å
342	H	96	Very high	94.7	Very high	146 Å²	146	108.3 Å²	108.3	68%	0.676	55%	0.55	S	S	*	*	H	α-helix	trans	-62.6	-33.3	178.2	-170.2	65.6	0	0	0	112.9	Y338 Q339 Q340 N344	Y338-H342 WeakPolarHBondContact O-CB 3.46Å; Y338-H342 PolarHBondContact O-N 2.93Å; Q339-H342 PolarHBondContact O-N 3.36Å; Q340-H342 VanDerWaalsContact C-N 3.33Å; H342-N344 VanDerWaalsContact C-N 3.27Å; H342-N344 PolarHBondContact O-N 3.47Å
343	A	96.1	Very high	94.6	Very high	63 Å²	63	108.3 Å²	108.3	52%	0.521	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	2.1	176.2	0	0	0	0	0	114	Q339 Q340 V341 V345	Q339-A343 WeakPolarHBondContact O-CB 3.31Å; Q339-A343 PolarHBondContact O-N 2.96Å; Q340-A343 PolarHBondContact O-N 3.02Å; V341-A343 VanDerWaalsContact C-N 3.26Å; V341-A343 PolarHBondContact O-N 3.43Å; A343-V345 HydrophobicContact CB-CG2 4Å; A343-V345 PolarHBondContact O-N 2.75Å
344	N	95.8	Very high	94.7	Very high	147 Å²	147	103.1 Å²	103.1	79%	0.786	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	35.8	-175.1	-63.6	-42.4	0	0	0	113.8	Q340 V341 H342	Q340-N344 PolarHBondContact O-N 3.26Å; V341-N344 PolarHBondContact O-N 3.43Å; H342-N344 VanDerWaalsContact C-N 3.27Å; H342-N344 PolarHBondContact O-N 3.47Å
345	V	95.3	Very high	94.7	Very high	71 Å²	71	106 Å²	106	43%	0.43	53%	0.533	S	S	.	.			trans	-91.3	107.9	177.4	177.2	0	0	0	0	109.8	Q340 A343	Q340-V345 HydrophobicContact CG-CB 3.95Å; Q340-V345 HydrophobicContact CG-CG1 4.33Å; Q340-V345 WeakPolarHBondContact CG-O 3.38Å; Q340-V345 PolarHBondContact NE2-O 3.08Å; Q340-V345 PolarHBondContact O-N 3.43Å; Q340-V345 VanDerWaalsContact O-N 3.16Å; A343-V345 HydrophobicContact CB-CG2 4Å; A343-V345 PolarHBondContact O-N 2.75Å
346	E	90.8	Very high	94.7	Very high	196 Å²	196	102.4 Å²	102.4	92%	0.916	51%	0.512	S	S	*	.	S	Bend	trans	-68.5	-41	-177.3	-65.6	-176.3	171.9	0	0	113.2
347	N	91.4	Very high	94.7	Very high	121 Å²	121	100.2 Å²	100.2	65%	0.647	50%	0.502	S	S	*	.			trans	-135.3	120.5	-176.8	-173.2	11.3	0	0	0	111.4	W349	N347-W349 WeakPolarHBondContact OD1-CB 3.46Å; N347-W349 PolarHBondContact OD1-N 3.1Å
348	S	91.4	Very high	94.9	Very high	84 Å²	84	104.1 Å²	104.1	59%	0.587	51%	0.514	S	S	*	.			trans	-99.4	12.6	176.4	65.5	0	0	0	0	113.2	N350	S348-N350 PolarHBondContact O-N 2.98Å
349	W	93.9	Very high	94.9	Very high	151 Å²	151	99 Å²	99	57%	0.572	50%	0.496	S	S	*	.			trans	-60.8	124.1	-179.3	-178.7	-90.7	0	0	0	111.9	N347 E351 V354	N347-W349 WeakPolarHBondContact OD1-CB 3.46Å; N347-W349 PolarHBondContact OD1-N 3.1Å; W349-E351 PolarHBondContact NE1-OE2 3.26Å; W349-V354 HydrophobicContact CD2-CG2 4.32Å; W349-V354 HydrophobicContact CE3-CG2 4.25Å; W349-V354 HydrophobicContact CH2-CB 4.33Å; W349-V354 HydrophobicContact CH2-CG1 3.82Å; W349-V354 HydrophobicContact CH2-CG2 3.81Å; W349-V354 HydrophobicContact CZ2-CB 4.19Å; W349-V354 HydrophobicContact CZ2-CG1 3.97Å; W349-V354 HydrophobicContact CZ2-CG2 3.87Å; W349-V354 HydrophobicContact CZ3-CG2 4Å
350	N	94.4	Very high	95	Very high	75 Å²	75	95.2 Å²	95.2	40%	0.401	48%	0.477	S	S	.	.			trans	-122	104.6	173.1	-175.1	-29.7	0	0	0	109.5	S348 E352 E353 V354	S348-N350 PolarHBondContact O-N 2.98Å; N350-E352 VanDerWaalsContact C-N 3.3Å; N350-E352 PolarHBondContact O-N 2.68Å; N350-E352 PolarHBondContact OD1-N 2.93Å; N350-E352 VanDerWaalsContact OD1-N 3.11Å; N350-E353 HydrophobicContact CB-CB 4.21Å; N350-E353 HydrophobicContact CB-CG 4.27Å; N350-E353 PolarHBondContact O-N 3.22Å; N350-E353 PolarHBondContact OD1-N 3.5Å; N350-V354 WeakPolarHBondContact O-CG2 3.31Å; N350-V354 PolarHBondContact O-N 2.87Å
351	E	95.4	Very high	95.1	Very high	97 Å²	97	95.6 Å²	95.6	45%	0.453	48%	0.48	S	S	.	.	H	α-helix	trans	-55.1	-43.7	-177.3	-169.2	64.5	-154.9	0	0	112.2	W349 E353 V354 W355	W349-E351 PolarHBondContact NE1-OE2 3.26Å; E351-E353 PolarHBondContact O-N 2.86Å; E351-V354 PolarHBondContact O-N 2.91Å; E351-W355 VanDerWaalsContact O-CD1 3.24Å; E351-W355 PolarHBondContact O-N 3.04Å; E351-W355 PolarHBondContact OE1-NE1 3Å
352	E	94.1	Very high	95.2	Very high	81 Å²	81	93.4 Å²	93.4	38%	0.379	47%	0.469	S	S	.	.	H	α-helix	trans	-63.4	-42.8	-178.5	-171	-172.9	155.7	0	0	111.6	N350 R356 W415 K416	N350-E352 VanDerWaalsContact C-N 3.3Å; N350-E352 PolarHBondContact O-N 2.68Å; N350-E352 PolarHBondContact OD1-N 2.93Å; N350-E352 VanDerWaalsContact OD1-N 3.11Å; E352-R356 WeakPolarHBondContact O-CB 3.23Å; E352-R356 PolarHBondContact O-N 3.34Å; E352-W415 HydrophobicContact CG-CZ2 4.4Å; E352-W415 PolarHBondContact OE1-NE1 3.15Å; E352-K416 VanDerWaalsContact CD-NZ 3.3Å; E352-K416 WeakPolarHBondContact OE1-CE 3.41Å; E352-K416 IonicContact OE1-NZ 2.69Å; E352-K416 PolarHBondContact OE1-NZ 3.12Å; E352-K416 IonicContact OE2-NZ 3.06Å; E352-K416 PolarHBondContact OE2-NZ 3.18Å
353	E	92.3	Very high	95.3	Very high	90 Å²	90	89.2 Å²	89.2	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-69.3	-36.6	179.1	-68.9	-152.8	119.2	0	0	112.7	N350 E351 R356 I357	N350-E353 HydrophobicContact CB-CB 4.21Å; N350-E353 HydrophobicContact CB-CG 4.27Å; N350-E353 PolarHBondContact O-N 3.22Å; N350-E353 PolarHBondContact OD1-N 3.5Å; E351-E353 PolarHBondContact O-N 2.86Å; E353-R356 PolarHBondContact O-N 2.84Å; E353-R356 IonicContact OE1-CZ 3.67Å; E353-R356 IonicContact OE1-NH1 3.78Å; E353-R356 IonicContact OE1-NH2 2.81Å; E353-R356 PolarHBondContact OE1-NH2 3.09Å; E353-I357 VanDerWaalsContact O-CG1 3.3Å; E353-I357 WeakPolarHBondContact O-CG1 3.4Å; E353-I357 PolarHBondContact O-N 2.97Å
354	V	96.5	Very high	95.4	Very high	42 Å²	42	87.1 Å²	87.1	26%	0.255	43%	0.434	S	S	.	.	H	α-helix	trans	-61.4	-53.1	174.8	172.3	0	0	0	0	109.8	W349 N350 E351 R356 I357 E358	W349-V354 HydrophobicContact CD2-CG2 4.32Å; W349-V354 HydrophobicContact CE3-CG2 4.25Å; W349-V354 HydrophobicContact CH2-CB 4.33Å; W349-V354 HydrophobicContact CH2-CG1 3.82Å; W349-V354 HydrophobicContact CH2-CG2 3.81Å; W349-V354 HydrophobicContact CZ2-CB 4.19Å; W349-V354 HydrophobicContact CZ2-CG1 3.97Å; W349-V354 HydrophobicContact CZ2-CG2 3.87Å; W349-V354 HydrophobicContact CZ3-CG2 4Å; N350-V354 WeakPolarHBondContact O-CG2 3.31Å; N350-V354 PolarHBondContact O-N 2.87Å; E351-V354 PolarHBondContact O-N 2.91Å; V354-R356 VanDerWaalsContact C-N 3.3Å; V354-R356 PolarHBondContact O-N 3.16Å; V354-I357 PolarHBondContact O-N 3.03Å; V354-I357 VanDerWaalsContact O-N 3.11Å; V354-E358 HydrophobicContact CG1-CG 4.22Å; V354-E358 WeakPolarHBondContact O-CG 3.47Å; V354-E358 PolarHBondContact O-N 3.44Å
355	W	96.4	Very high	95.5	Very high	154 Å²	154	85.6 Å²	85.6	58%	0.583	42%	0.424	S	S	*	.	H	α-helix	trans	-55.9	-44	177	-85.7	101.3	0	0	0	112.7	E351 I357 M359	E351-W355 VanDerWaalsContact O-CD1 3.24Å; E351-W355 PolarHBondContact O-N 3.04Å; E351-W355 PolarHBondContact OE1-NE1 3Å; W355-I357 VanDerWaalsContact C-N 3.35Å; W355-I357 PolarHBondContact O-N 3.29Å; W355-M359 HydrophobicContact CE3-CG 4.42Å; W355-M359 WeakPolarHBondContact O-CB 3.38Å; W355-M359 VanDerWaalsContact O-CG 3.23Å; W355-M359 WeakPolarHBondContact O-CG 3.46Å; W355-M359 PolarHBondContact O-N 2.88Å
356	R	96	Very high	95.6	Very high	22 Å²	22	86.7 Å²	86.7	8%	0.083	43%	0.426	C	S	.	.	H	α-helix	trans	-56.1	-50.6	176.8	-178.2	-172.4	64.3	-163.4	-7	111	E352 E353 V354 Y360 I412 W415	E352-R356 WeakPolarHBondContact O-CB 3.23Å; E352-R356 PolarHBondContact O-N 3.34Å; E353-R356 PolarHBondContact O-N 2.84Å; E353-R356 IonicContact OE1-CZ 3.67Å; E353-R356 IonicContact OE1-NH1 3.78Å; E353-R356 IonicContact OE1-NH2 2.81Å; E353-R356 PolarHBondContact OE1-NH2 3.09Å; V354-R356 VanDerWaalsContact C-N 3.3Å; V354-R356 PolarHBondContact O-N 3.16Å; R356-Y360 HydrophobicContact CG-CD1 4.4Å; R356-Y360 WeakPolarHBondContact O-CD1 3.05Å; R356-Y360 PolarHBondContact O-N 3.45Å; R356-Y360 VanDerWaalsContact O-N 3.1Å; R356-I412 HydrophobicContact CG-CG2 4.25Å; R356-I412 VanDerWaalsContact CG-O 3.31Å; R356-I412 WeakPolarHBondContact CG-O 3.42Å; R356-W415 VanDerWaalsContact CD-CB 3.45Å; R356-W415 HydrophobicContact CG-CB 4.17Å; R356-W415 HydrophobicContact CG-CD2 4.16Å; R356-W415 HydrophobicContact CG-CE3 4.12Å; R356-W415 HydrophobicContact CG-CG 4.2Å
357	I	95.6	Very high	95.9	Very high	62 Å²	62	77.9 Å²	77.9	32%	0.318	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-50.9	-176.5	-68.7	168.1	0	0	0	111.4	E353 V354 W355 M359 Y360 I361	E353-I357 VanDerWaalsContact O-CG1 3.3Å; E353-I357 WeakPolarHBondContact O-CG1 3.4Å; E353-I357 PolarHBondContact O-N 2.97Å; V354-I357 PolarHBondContact O-N 3.03Å; V354-I357 VanDerWaalsContact O-N 3.11Å; W355-I357 VanDerWaalsContact C-N 3.35Å; W355-I357 PolarHBondContact O-N 3.29Å; I357-M359 VanDerWaalsContact C-N 3.3Å; I357-M359 PolarHBondContact O-N 3.46Å; I357-Y360 HydrophobicContact CB-CE1 4.17Å; I357-Y360 HydrophobicContact CG1-CE1 3.94Å; I357-Y360 HydrophobicContact CG2-CE1 4.46Å; I357-Y360 PolarHBondContact O-N 3.06Å; I357-I361 HydrophobicContact CG2-CD1 3.58Å; I357-I361 HydrophobicContact CG2-CG1 4.4Å; I357-I361 WeakPolarHBondContact O-CB 3.25Å; I357-I361 VanDerWaalsContact O-CG1 3.28Å; I357-I361 WeakPolarHBondContact O-CG1 3.31Å; I357-I361 PolarHBondContact O-N 3.34Å; I357-I361 VanDerWaalsContact O-N 3.09Å
358	E	97.6	Very high	96.2	Very high	120 Å²	120	74.1 Å²	74.1	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-58.6	-43	-179.8	-66.7	-57.1	148.2	0	0	111.7	V354 S362	V354-E358 HydrophobicContact CG1-CG 4.22Å; V354-E358 WeakPolarHBondContact O-CG 3.47Å; V354-E358 PolarHBondContact O-N 3.44Å; E358-S362 VanDerWaalsContact O-CB 3.31Å; E358-S362 WeakPolarHBondContact O-CB 3.33Å; E358-S362 PolarHBondContact O-N 3.42Å; E358-S362 VanDerWaalsContact O-N 3.07Å
359	M	97.4	Very high	96.5	Very high	57 Å²	57	72.2 Å²	72.2	28%	0.281	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-54.2	179.3	-73.5	-166.2	-41.5	0	0	112.6	W355 I357 I361 S362 F363 I412 W415	W355-M359 HydrophobicContact CE3-CG 4.42Å; W355-M359 WeakPolarHBondContact O-CB 3.38Å; W355-M359 VanDerWaalsContact O-CG 3.23Å; W355-M359 WeakPolarHBondContact O-CG 3.46Å; W355-M359 PolarHBondContact O-N 2.88Å; I357-M359 VanDerWaalsContact C-N 3.3Å; I357-M359 PolarHBondContact O-N 3.46Å; M359-I361 VanDerWaalsContact C-N 3.28Å; M359-I361 PolarHBondContact O-N 3.32Å; M359-S362 PolarHBondContact O-N 2.87Å; M359-F363 HydrophobicContact CB-CE2 4.5Å; M359-F363 WeakPolarHBondContact O-CD2 3.44Å; M359-F363 PolarHBondContact O-N 3.44Å; M359-I412 HydrophobicContact CB-CD1 4.39Å; M359-I412 HydrophobicContact CB-CG2 4.03Å; M359-I412 HydrophobicContact CE-CD1 4.23Å; M359-I412 HydrophobicContact CE-CG1 4.45Å; M359-I412 HydrophobicContact CE-CG2 3.69Å; M359-W415 HydrophobicContact CE-CH2 4.29Å; M359-W415 HydrophobicContact CE-CZ3 3.85Å
360	Y	96.9	Very high	96.7	Very high	49 Å²	49	66.7 Å²	66.7	19%	0.192	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-34.9	-174.8	80.8	-110.2	0	0	0	111.1	R356 I357 F363 G364 H409 Y413	R356-Y360 HydrophobicContact CG-CD1 4.4Å; R356-Y360 WeakPolarHBondContact O-CD1 3.05Å; R356-Y360 PolarHBondContact O-N 3.45Å; R356-Y360 VanDerWaalsContact O-N 3.1Å; I357-Y360 HydrophobicContact CB-CE1 4.17Å; I357-Y360 HydrophobicContact CG1-CE1 3.94Å; I357-Y360 HydrophobicContact CG2-CE1 4.46Å; I357-Y360 PolarHBondContact O-N 3.06Å; Y360-F363 PolarHBondContact O-N 3.31Å; Y360-G364 PolarHBondContact O-N 3.16Å; Y360-H409 WeakPolarHBondContact CB-O 3.44Å; Y360-H409 AromaticContact CD2-CE1 3.79Å; Y360-H409 AromaticContact CD2-ND1 3.91Å; Y360-H409 PolarHBondContact O-ND1 3.07Å; Y360-Y413 HydrophobicContact CE1-CD2 4.26Å; Y360-Y413 HydrophobicContact CE2-CD2 4.24Å
361	I	97.7	Very high	96.8	Very high	72 Å²	72	63.6 Å²	63.6	37%	0.369	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-47.8	175.1	-69	175.9	0	0	0	110.1	I357 M359 F363 G364 I365	I357-I361 HydrophobicContact CG2-CD1 3.58Å; I357-I361 HydrophobicContact CG2-CG1 4.4Å; I357-I361 WeakPolarHBondContact O-CB 3.25Å; I357-I361 VanDerWaalsContact O-CG1 3.28Å; I357-I361 WeakPolarHBondContact O-CG1 3.31Å; I357-I361 PolarHBondContact O-N 3.34Å; I357-I361 VanDerWaalsContact O-N 3.09Å; M359-I361 VanDerWaalsContact C-N 3.28Å; M359-I361 PolarHBondContact O-N 3.32Å; I361-F363 PolarHBondContact O-N 3.49Å; I361-G364 WeakPolarHBondContact O-CA 3.41Å; I361-G364 PolarHBondContact O-N 3.03Å; I361-G364 VanDerWaalsContact O-N 3.07Å; I361-I365 HydrophobicContact CG2-CD1 3.95Å; I361-I365 WeakPolarHBondContact O-CG1 3.49Å; I361-I365 PolarHBondContact O-N 2.94Å
362	S	98.1	Very high	96.9	Very high	61 Å²	61	60.9 Å²	60.9	43%	0.427	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-47.7	177.7	-176.1	0	0	0	0	112.4	E358 M359 G364 I365 M366	E358-S362 VanDerWaalsContact O-CB 3.31Å; E358-S362 WeakPolarHBondContact O-CB 3.33Å; E358-S362 PolarHBondContact O-N 3.42Å; E358-S362 VanDerWaalsContact O-N 3.07Å; M359-S362 PolarHBondContact O-N 2.87Å; S362-G364 VanDerWaalsContact C-N 3.28Å; S362-G364 PolarHBondContact O-N 2.91Å; S362-I365 PolarHBondContact O-N 3.01Å; S362-M366 WeakPolarHBondContact O-CG 3.27Å; S362-M366 PolarHBondContact O-N 3.45Å
363	F	98.1	Very high	97.1	Very high	58 Å²	58	60.4 Å²	60.4	25%	0.254	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-35.8	174.7	-77.2	-67.8	0	0	0	112.7	M359 Y360 I361 S367 I405 F408 H409 I412	M359-F363 HydrophobicContact CB-CE2 4.5Å; M359-F363 WeakPolarHBondContact O-CD2 3.44Å; M359-F363 PolarHBondContact O-N 3.44Å; Y360-F363 PolarHBondContact O-N 3.31Å; I361-F363 PolarHBondContact O-N 3.49Å; F363-S367 WeakPolarHBondContact O-CB 3.37Å; F363-S367 PolarHBondContact O-N 3.17Å; F363-I405 HydrophobicContact CB-CG2 4.24Å; F363-I405 HydrophobicContact CD1-CG2 3.93Å; F363-I405 WeakPolarHBondContact O-CG2 3.4Å; F363-F408 HydrophobicContact CD1-CB 4.37Å; F363-F408 HydrophobicContact CG-CB 4.44Å; F363-H409 HydrophobicContact CB-CB 3.97Å; F363-I412 HydrophobicContact CD2-CD1 3.46Å; F363-I412 VanDerWaalsContact CD2-CD1 3.46Å; F363-I412 HydrophobicContact CE2-CD1 3.36Å; F363-I412 HydrophobicContact CZ-CD1 4.39Å
364	G	97.7	Very high	97.2	Very high	19 Å²	19	56.8 Å²	56.8	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-44.5	174.5	0	0	0	0	0	112.3	Y360 I361 S362 S367 L368 H409	Y360-G364 PolarHBondContact O-N 3.16Å; I361-G364 WeakPolarHBondContact O-CA 3.41Å; I361-G364 PolarHBondContact O-N 3.03Å; I361-G364 VanDerWaalsContact O-N 3.07Å; S362-G364 VanDerWaalsContact C-N 3.28Å; S362-G364 PolarHBondContact O-N 2.91Å; G364-S367 WeakPolarHBondContact O-CB 3.48Å; G364-S367 PolarHBondContact O-N 2.98Å; G364-L368 PolarHBondContact O-N 3.27Å; G364-H409 WeakPolarHBondContact CA-ND1 3.32Å
365	I	98.1	Very high	97.2	Very high	115 Å²	115	55.5 Å²	55.5	59%	0.59	29%	0.293	S	S	*	.	H	α-helix	trans	-64.7	-46.5	177.3	-65.1	167	0	0	0	110.8	I361 S362 S367 L368 G369	I361-I365 HydrophobicContact CG2-CD1 3.95Å; I361-I365 WeakPolarHBondContact O-CG1 3.49Å; I361-I365 PolarHBondContact O-N 2.94Å; S362-I365 PolarHBondContact O-N 3.01Å; I365-S367 VanDerWaalsContact C-N 3.32Å; I365-S367 PolarHBondContact O-N 2.88Å; I365-L368 PolarHBondContact O-N 3.46Å; I365-G369 PolarHBondContact O-N 3.27Å
366	M	98.1	Very high	97.3	Very high	95 Å²	95	51.7 Å²	51.7	47%	0.468	29%	0.287	S	S	.	.	H	α-helix	trans	-60.1	-42.2	176.2	-69	176.7	68.2	0	0	111.9	S362 G369 L370 I405	S362-M366 WeakPolarHBondContact O-CG 3.27Å; S362-M366 PolarHBondContact O-N 3.45Å; M366-G369 PolarHBondContact O-N 2.99Å; M366-L370 PolarHBondContact O-N 3.19Å; M366-L370 VanDerWaalsContact O-N 3.13Å; M366-I405 HydrophobicContact CB-CG2 4.1Å; M366-I405 HydrophobicContact CE-CD1 4.31Å
367	S	97.4	Very high	97.2	Very high	10 Å²	10	50.9 Å²	50.9	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-49.6	175.5	178.8	0	0	0	0	111.3	F363 G364 I365 G369 L370 L371 S406	F363-S367 WeakPolarHBondContact O-CB 3.37Å; F363-S367 PolarHBondContact O-N 3.17Å; G364-S367 WeakPolarHBondContact O-CB 3.48Å; G364-S367 PolarHBondContact O-N 2.98Å; I365-S367 VanDerWaalsContact C-N 3.32Å; I365-S367 PolarHBondContact O-N 2.88Å; S367-G369 VanDerWaalsContact C-N 3.29Å; S367-G369 PolarHBondContact O-N 3.39Å; S367-L370 PolarHBondContact O-N 2.92Å; S367-L370 VanDerWaalsContact O-N 3.15Å; S367-L371 WeakPolarHBondContact O-CG 2.92Å; S367-L371 PolarHBondContact O-N 2.96Å; S367-S406 PolarHBondContact OG-OG 2.93Å
368	L	97.3	Very high	97.2	Very high	42 Å²	42	48.8 Å²	48.8	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-40	179.4	-176.3	68	0	0	0	111.9	F310 V317 G364 I365 L370 L371 S372	F310-L368 HydrophobicContact CE2-CD1 4.23Å; V317-L368 HydrophobicContact CB-CD2 4.34Å; V317-L368 HydrophobicContact CG1-CD2 4.06Å; V317-L368 HydrophobicContact CG2-CD1 4.19Å; V317-L368 HydrophobicContact CG2-CD2 3.76Å; V317-L368 HydrophobicContact CG2-CG 4.43Å; G364-L368 PolarHBondContact O-N 3.27Å; I365-L368 PolarHBondContact O-N 3.46Å; L368-L370 PolarHBondContact O-N 3.37Å; L368-L371 PolarHBondContact O-N 2.96Å; L368-S372 WeakPolarHBondContact O-CB 3.35Å; L368-S372 PolarHBondContact O-N 3.01Å; L368-S372 PolarHBondContact O-OG 2.97Å
369	G	97.8	Very high	97	Very high	45 Å²	45	46.9 Å²	46.9	46%	0.464	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-45.5	175.2	0	0	0	0	0	112.4	I365 M366 S367 S372 L373	I365-G369 PolarHBondContact O-N 3.27Å; M366-G369 PolarHBondContact O-N 2.99Å; S367-G369 VanDerWaalsContact C-N 3.29Å; S367-G369 PolarHBondContact O-N 3.39Å; G369-S372 PolarHBondContact O-N 2.95Å; G369-L373 PolarHBondContact O-N 2.92Å
370	L	97.6	Very high	96.7	Very high	34 Å²	34	48.6 Å²	48.6	18%	0.178	28%	0.284	C	S	.	.	H	α-helix	trans	-67.5	-43.8	176.4	-68.1	173	0	0	0	112.4	M366 S367 L368 S372 L373 L374 V401 A402 I405	M366-L370 PolarHBondContact O-N 3.19Å; M366-L370 VanDerWaalsContact O-N 3.13Å; S367-L370 PolarHBondContact O-N 2.92Å; S367-L370 VanDerWaalsContact O-N 3.15Å; L368-L370 PolarHBondContact O-N 3.37Å; L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.15Å; L370-L373 WeakPolarHBondContact O-CB 3.13Å; L370-L373 PolarHBondContact O-N 3.02Å; L370-L373 VanDerWaalsContact O-N 3.15Å; L370-L374 WeakPolarHBondContact O-CG 3.49Å; L370-L374 PolarHBondContact O-N 3.46Å; L370-L374 VanDerWaalsContact O-N 3.09Å; L370-V401 HydrophobicContact CD1-CB 4.49Å; L370-V401 HydrophobicContact CD1-CG1 3.82Å; L370-A402 HydrophobicContact CB-CB 3.77Å; L370-A402 HydrophobicContact CD1-CB 4.18Å; L370-I405 HydrophobicContact CD1-CD1 3.7Å
371	L	97.4	Very high	96.4	Very high	10 Å²	10	50.1 Å²	50.1	5%	0.052	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-36.5	176.9	-68.9	172	0	0	0	111.8	L267 F310 A313 S367 L368 L373 L374 A375 A402	L267-L371 HydrophobicContact CD1-CD2 3.83Å; L267-L371 HydrophobicContact CD2-CD2 3.92Å; F310-L371 HydrophobicContact CD2-CB 3.82Å; F310-L371 HydrophobicContact CE2-CB 4.48Å; A313-L371 HydrophobicContact CB-CD1 4.04Å; S367-L371 WeakPolarHBondContact O-CG 2.92Å; S367-L371 PolarHBondContact O-N 2.96Å; L368-L371 PolarHBondContact O-N 2.96Å; L371-L373 VanDerWaalsContact C-N 3.35Å; L371-L373 PolarHBondContact O-N 3.21Å; L371-L374 HydrophobicContact CD2-CD1 4.22Å; L371-L374 WeakPolarHBondContact O-CB 3.45Å; L371-L374 PolarHBondContact O-N 3.08Å; L371-A375 WeakPolarHBondContact O-CB 3.3Å; L371-A375 PolarHBondContact O-N 2.68Å; L371-A402 HydrophobicContact CD2-CB 4.26Å; L371-A402 HydrophobicContact CG-CB 4.5Å
372	S	97.9	Very high	96.2	Very high	40 Å²	40	49 Å²	49	28%	0.28	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-41.9	174.5	-58.6	0	0	0	0	111.4	F310 L368 G369 L370 L374 A375 V376	F310-S372 WeakPolarHBondContact CE2-OG 3.36Å; L368-S372 WeakPolarHBondContact O-CB 3.35Å; L368-S372 PolarHBondContact O-N 3.01Å; L368-S372 PolarHBondContact O-OG 2.97Å; G369-S372 PolarHBondContact O-N 2.95Å; L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.15Å; S372-L374 PolarHBondContact O-N 3.27Å; S372-A375 PolarHBondContact O-N 3.36Å; S372-V376 VanDerWaalsContact O-CG2 3.31Å; S372-V376 WeakPolarHBondContact O-CG2 3.27Å; S372-V376 PolarHBondContact O-N 3.18Å
373	L	96.5	Very high	95.8	Very high	71 Å²	71	49 Å²	49	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-40.8	175.2	-177	65.3	0	0	0	112.2	G369 L370 L371 A375 T377 I394 L398	G369-L373 PolarHBondContact O-N 2.92Å; L370-L373 WeakPolarHBondContact O-CB 3.13Å; L370-L373 PolarHBondContact O-N 3.02Å; L370-L373 VanDerWaalsContact O-N 3.15Å; L371-L373 VanDerWaalsContact C-N 3.35Å; L371-L373 PolarHBondContact O-N 3.21Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.69Å; L373-T377 WeakPolarHBondContact O-CG2 3.39Å; L373-T377 PolarHBondContact O-N 2.89Å; L373-T377 VanDerWaalsContact O-N 3.09Å; L373-T377 PolarHBondContact O-OG1 2.97Å; L373-I394 HydrophobicContact CD2-CG2 4.49Å; L373-I394 HydrophobicContact CG-CG2 4.23Å; L373-L398 HydrophobicContact CD2-CD1 3.52Å
374	L	96.1	Very high	95.5	Very high	14 Å²	14	51 Å²	51	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-38.4	174.5	-60.9	176.3	0	0	0	112	L370 L371 S372 T377 S378 I394 Q395 A402	L370-L374 WeakPolarHBondContact O-CG 3.49Å; L370-L374 PolarHBondContact O-N 3.46Å; L370-L374 VanDerWaalsContact O-N 3.09Å; L371-L374 HydrophobicContact CD2-CD1 4.22Å; L371-L374 WeakPolarHBondContact O-CB 3.45Å; L371-L374 PolarHBondContact O-N 3.08Å; S372-L374 PolarHBondContact O-N 3.27Å; L374-T377 PolarHBondContact O-OG1 3.11Å; L374-S378 PolarHBondContact O-N 3.25Å; L374-S378 PolarHBondContact O-OG 3.09Å; L374-I394 HydrophobicContact CD2-CG2 3.86Å; L374-I394 WeakPolarHBondContact CD2-O 3.08Å; L374-Q395 PolarHBondContact O-NE2 3.46Å; L374-A402 HydrophobicContact CD1-CB 4.34Å
375	A	96.6	Very high	95.4	Very high	16 Å²	16	54 Å²	54	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-69.9	-45.1	178.1	0	0	0	0	0	111.9	L307 F310 L371 S372 L373 T377 S378	L307-A375 HydrophobicContact CD2-CB 4.35Å; F310-A375 HydrophobicContact CB-CB 4.45Å; F310-A375 HydrophobicContact CD1-CB 3.47Å; F310-A375 VanDerWaalsContact CD1-CB 3.47Å; F310-A375 HydrophobicContact CD2-CB 4.27Å; F310-A375 HydrophobicContact CE1-CB 3.66Å; F310-A375 HydrophobicContact CE2-CB 4.42Å; F310-A375 HydrophobicContact CG-CB 3.79Å; F310-A375 HydrophobicContact CZ-CB 4.13Å; L371-A375 WeakPolarHBondContact O-CB 3.3Å; L371-A375 PolarHBondContact O-N 2.68Å; S372-A375 PolarHBondContact O-N 3.36Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.69Å; A375-T377 VanDerWaalsContact C-N 3.34Å; A375-T377 PolarHBondContact O-N 2.88Å; A375-S378 VanDerWaalsContact O-CB 3.23Å; A375-S378 WeakPolarHBondContact O-CB 3.3Å; A375-S378 PolarHBondContact O-N 3.42Å
376	V	96.9	Very high	95.2	Very high	73 Å²	73	50.9 Å²	50.9	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-42.6	177.9	170.4	0	0	0	0	111.2	S372 S378 I379 V382	S372-V376 VanDerWaalsContact O-CG2 3.31Å; S372-V376 WeakPolarHBondContact O-CG2 3.27Å; S372-V376 PolarHBondContact O-N 3.18Å; V376-S378 PolarHBondContact O-N 3.38Å; V376-I379 WeakPolarHBondContact O-CB 3.46Å; V376-I379 VanDerWaalsContact O-CG1 3.31Å; V376-I379 WeakPolarHBondContact O-CG1 3.47Å; V376-I379 PolarHBondContact O-N 3.34Å; V376-I379 VanDerWaalsContact O-N 3.12Å; V376-V382 HydrophobicContact CG1-CG2 4.44Å
377	T	95.6	Very high	95.1	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.037	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.6	176.3	52.8	0	0	0	0	114.1	L373 L374 A375 V382 L386 I394 Q395	L373-T377 WeakPolarHBondContact O-CG2 3.39Å; L373-T377 PolarHBondContact O-N 2.89Å; L373-T377 VanDerWaalsContact O-N 3.09Å; L373-T377 PolarHBondContact O-OG1 2.97Å; L374-T377 PolarHBondContact O-OG1 3.11Å; A375-T377 VanDerWaalsContact C-N 3.34Å; A375-T377 PolarHBondContact O-N 2.88Å; T377-V382 HydrophobicContact CG2-CG1 4.23Å; T377-L386 HydrophobicContact CG2-CD1 3.95Å; T377-I394 HydrophobicContact CG2-CD1 3.83Å; T377-I394 HydrophobicContact CG2-CG2 4.02Å; T377-Q395 PolarHBondContact OG1-NE2 3.42Å
378	S	94.4	Very high	94.8	Very high	17 Å²	17	58.9 Å²	58.9	12%	0.119	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.4	172.1	-64.3	0	0	0	0	113.3	K303 L374 A375 V376	K303-S378 VanDerWaalsContact CE-O 3.25Å; K303-S378 WeakPolarHBondContact CE-O 2.98Å; K303-S378 PolarHBondContact NZ-O 3.16Å; L374-S378 PolarHBondContact O-N 3.25Å; L374-S378 PolarHBondContact O-OG 3.09Å; A375-S378 VanDerWaalsContact O-CB 3.23Å; A375-S378 WeakPolarHBondContact O-CB 3.3Å; A375-S378 PolarHBondContact O-N 3.42Å; V376-S378 PolarHBondContact O-N 3.38Å
379	I	94.4	Very high	94.8	Very high	80 Å²	80	67 Å²	67	41%	0.41	38%	0.379	S	S	.	.	S	Bend	trans	-68.4	129.3	173.9	-59.5	172.6	0	0	0	108.6	V376 S381 V382 N383	V376-I379 WeakPolarHBondContact O-CB 3.46Å; V376-I379 VanDerWaalsContact O-CG1 3.31Å; V376-I379 WeakPolarHBondContact O-CG1 3.47Å; V376-I379 PolarHBondContact O-N 3.34Å; V376-I379 VanDerWaalsContact O-N 3.12Å; I379-S381 VanDerWaalsContact C-N 3.32Å; I379-S381 WeakPolarHBondContact CG2-OG 3.14Å; I379-S381 PolarHBondContact O-N 3.02Å; I379-V382 HydrophobicContact CB-CB 4.46Å; I379-V382 HydrophobicContact CB-CG2 4.19Å; I379-V382 PolarHBondContact O-N 2.8Å; I379-V382 VanDerWaalsContact O-N 3.16Å; I379-N383 WeakPolarHBondContact O-CB 3.36Å; I379-N383 PolarHBondContact O-N 2.98Å
380	P	89.8	Confident	94.7	Very high	94 Å²	94	69 Å²	69	61%	0.61	38%	0.376	S	S	*	.	H	α-helix	trans	-54	-41.4	-174.7	-28.9	35.7	0	0	0	114.9	N383 S384	P380-N383 PolarHBondContact O-N 3.12Å; P380-S384 WeakPolarHBondContact O-CB 3.43Å; P380-S384 PolarHBondContact O-N 3.37Å; P380-S384 PolarHBondContact O-OG 3.33Å
381	S	90.6	Very high	94.6	Very high	80 Å²	80	69.7 Å²	69.7	56%	0.559	38%	0.378	S	S	*	.	H	α-helix	trans	-64.6	-40	179.8	52.3	0	0	0	0	113.1	I379 S384	I379-S381 VanDerWaalsContact C-N 3.32Å; I379-S381 WeakPolarHBondContact CG2-OG 3.14Å; I379-S381 PolarHBondContact O-N 3.02Å; S381-S384 PolarHBondContact O-OG 2.89Å
382	V	93.4	Very high	94.4	Very high	48 Å²	48	71.5 Å²	71.5	29%	0.291	39%	0.391	S	S	.	.	H	α-helix	trans	-70.8	-46	175.7	-178.6	0	0	0	0	109.8	V376 T377 I379 S384 A385 L386	V376-V382 HydrophobicContact CG1-CG2 4.44Å; T377-V382 HydrophobicContact CG2-CG1 4.23Å; I379-V382 HydrophobicContact CB-CB 4.46Å; I379-V382 HydrophobicContact CB-CG2 4.19Å; I379-V382 PolarHBondContact O-N 2.8Å; I379-V382 VanDerWaalsContact O-N 3.16Å; V382-S384 VanDerWaalsContact C-N 3.3Å; V382-S384 PolarHBondContact O-N 2.83Å; V382-A385 WeakPolarHBondContact O-CB 3.5Å; V382-A385 PolarHBondContact O-N 2.79Å; V382-L386 PolarHBondContact O-N 3.23Å
383	N	91.1	Very high	94.4	Very high	61 Å²	61	74.9 Å²	74.9	33%	0.326	40%	0.401	S	S	.	.	H	α-helix	trans	-59.2	-40	179.4	-174.5	37.1	0	0	0	112.3	I379 P380 A385 L386 F391	I379-N383 WeakPolarHBondContact O-CB 3.36Å; I379-N383 PolarHBondContact O-N 2.98Å; P380-N383 PolarHBondContact O-N 3.12Å; N383-A385 PolarHBondContact O-N 3.29Å; N383-L386 PolarHBondContact O-N 3.31Å; N383-F391 WeakPolarHBondContact OD1-CD2 3.34Å; N383-F391 WeakPolarHBondContact OD1-CE2 3.5Å
384	S	91.3	Very high	94.4	Very high	100 Å²	100	72.7 Å²	72.7	70%	0.699	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17	177.1	54.5	0	0	0	0	114.2	P380 S381 V382	P380-S384 WeakPolarHBondContact O-CB 3.43Å; P380-S384 PolarHBondContact O-N 3.37Å; P380-S384 PolarHBondContact O-OG 3.33Å; S381-S384 PolarHBondContact O-OG 2.89Å; V382-S384 VanDerWaalsContact C-N 3.3Å; V382-S384 PolarHBondContact O-N 2.83Å
385	A	94.4	Very high	94.4	Very high	83 Å²	83	74.2 Å²	74.2	69%	0.686	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.7	178.3	0	0	0	0	0	113.2	V382 N383	V382-A385 WeakPolarHBondContact O-CB 3.5Å; V382-A385 PolarHBondContact O-N 2.79Å; N383-A385 PolarHBondContact O-N 3.29Å
386	L	93.8	Very high	94.3	Very high	50 Å²	50	75.5 Å²	75.5	26%	0.262	40%	0.404	S	S	.	.	S	Bend	trans	-96.7	141.5	-177.3	-62	175.8	0	0	0	111.3	T377 V382 N383 E390 I394	T377-L386 HydrophobicContact CG2-CD1 3.95Å; V382-L386 PolarHBondContact O-N 3.23Å; N383-L386 PolarHBondContact O-N 3.31Å; L386-E390 HydrophobicContact CB-CB 4.32Å; L386-E390 HydrophobicContact CD2-CB 4.24Å; L386-I394 HydrophobicContact CD1-CD1 4.27Å
387	N	96.2	Very high	94.2	Very high	78 Å²	78	75.4 Å²	75.4	42%	0.417	40%	0.403	S	S	.	.			trans	-76.9	166.1	167.1	69.3	54.6	0	0	0	111.2	R389 E390 F391	N387-R389 PolarHBondContact O-N 3.23Å; N387-R389 WeakPolarHBondContact OD1-CB 3.43Å; N387-R389 PolarHBondContact OD1-N 3.18Å; N387-E390 VanDerWaalsContact CG-CD 3.45Å; N387-E390 PolarHBondContact N-OE2 3.1Å; N387-E390 PolarHBondContact ND2-OE1 2.73Å; N387-E390 PolarHBondContact ND2-OE2 3.48Å; N387-E390 PolarHBondContact O-N 3.48Å; N387-E390 PolarHBondContact OD1-N 3.37Å; N387-F391 WeakPolarHBondContact O-CB 3.49Å; N387-F391 PolarHBondContact O-N 2.94Å
388	W	92.6	Very high	94.3	Very high	195 Å²	195	76.8 Å²	76.8	74%	0.739	41%	0.41	S	S	*	.	H	α-helix	trans	-60.3	-31	-176.7	-178.3	-107.8	0	0	0	114	F391 S392	W388-F391 HydrophobicContact CE3-CD1 4.04Å; W388-F391 HydrophobicContact CH2-CD1 4.48Å; W388-F391 HydrophobicContact CH2-CE1 4.49Å; W388-F391 AromaticContact CZ3-CD1 3.82Å; W388-F391 HydrophobicContact CZ3-CD1 3.82Å; W388-F391 HydrophobicContact CZ3-CE1 4Å; W388-S392 WeakPolarHBondContact O-CB 3.33Å; W388-S392 PolarHBondContact O-N 3.29Å
389	R	95.6	Very high	94.4	Very high	212 Å²	212	76 Å²	76	80%	0.8	41%	0.405	S	S	*	.	H	α-helix	trans	-71.7	-44.9	179.6	-69.4	-176.1	175.4	-177.8	0.7	111	N387 S392 F393	N387-R389 PolarHBondContact O-N 3.23Å; N387-R389 WeakPolarHBondContact OD1-CB 3.43Å; N387-R389 PolarHBondContact OD1-N 3.18Å; R389-S392 PolarHBondContact O-N 2.86Å; R389-F393 WeakPolarHBondContact O-CB 3.3Å; R389-F393 PolarHBondContact O-N 2.95Å
390	E	96.6	Very high	94.6	Very high	86 Å²	86	73.7 Å²	73.7	40%	0.402	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-50.4	175.1	-71.3	156.6	-173.3	0	0	111	L386 N387 S392 F393 I394	L386-E390 HydrophobicContact CB-CB 4.32Å; L386-E390 HydrophobicContact CD2-CB 4.24Å; N387-E390 VanDerWaalsContact CG-CD 3.45Å; N387-E390 PolarHBondContact N-OE2 3.1Å; N387-E390 PolarHBondContact ND2-OE1 2.73Å; N387-E390 PolarHBondContact ND2-OE2 3.48Å; N387-E390 PolarHBondContact O-N 3.48Å; N387-E390 PolarHBondContact OD1-N 3.37Å; E390-S392 VanDerWaalsContact C-N 3.33Å; E390-S392 PolarHBondContact O-N 3.4Å; E390-F393 PolarHBondContact O-N 3.22Å; E390-F393 VanDerWaalsContact O-N 3.17Å; E390-I394 WeakPolarHBondContact O-CG1 3.35Å; E390-I394 PolarHBondContact O-N 2.86Å
391	F	94.6	Very high	95	Very high	50 Å²	50	71.8 Å²	71.8	22%	0.219	38%	0.378	C	S	.	.	H	α-helix	trans	-56.8	-48.1	176.9	177	-96.2	0	0	0	111.3	N383 N387 W388 F393 I394 Q395	N383-F391 WeakPolarHBondContact OD1-CD2 3.34Å; N383-F391 WeakPolarHBondContact OD1-CE2 3.5Å; N387-F391 WeakPolarHBondContact O-CB 3.49Å; N387-F391 PolarHBondContact O-N 2.94Å; W388-F391 HydrophobicContact CE3-CD1 4.04Å; W388-F391 HydrophobicContact CH2-CD1 4.48Å; W388-F391 HydrophobicContact CH2-CE1 4.49Å; W388-F391 AromaticContact CZ3-CD1 3.82Å; W388-F391 HydrophobicContact CZ3-CD1 3.82Å; W388-F391 HydrophobicContact CZ3-CE1 4Å; F391-F393 VanDerWaalsContact C-N 3.34Å; F391-F393 PolarHBondContact O-N 3.25Å; F391-I394 PolarHBondContact O-N 3.02Å; F391-Q395 HydrophobicContact CD2-CG 4.01Å; F391-Q395 HydrophobicContact CE1-CB 4.36Å; F391-Q395 HydrophobicContact CE1-CG 4.17Å; F391-Q395 HydrophobicContact CE2-CG 3.62Å; F391-Q395 HydrophobicContact CG-CG 4.46Å; F391-Q395 HydrophobicContact CZ-CB 4.32Å; F391-Q395 HydrophobicContact CZ-CG 3.71Å; F391-Q395 WeakPolarHBondContact O-CB 3.1Å; F391-Q395 PolarHBondContact O-N 2.66Å
392	S	94.3	Very high	95.3	Very high	47 Å²	47	68 Å²	68	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-34.9	179.1	-177.2	0	0	0	0	112.4	W388 R389 E390 S396	W388-S392 WeakPolarHBondContact O-CB 3.33Å; W388-S392 PolarHBondContact O-N 3.29Å; R389-S392 PolarHBondContact O-N 2.86Å; E390-S392 VanDerWaalsContact C-N 3.33Å; E390-S392 PolarHBondContact O-N 3.4Å; S392-S396 WeakPolarHBondContact O-CA 3.37Å; S392-S396 WeakPolarHBondContact O-CB 3.26Å; S392-S396 PolarHBondContact O-N 2.88Å
393	F	97.4	Very high	95.6	Very high	112 Å²	112	65.7 Å²	65.7	49%	0.491	34%	0.337	S	S	.	.	I	π-helix	trans	-64.4	-46.9	176.5	174.7	-99.9	0	0	0	110.7	R389 E390 F391 T397 L398	R389-F393 WeakPolarHBondContact O-CB 3.3Å; R389-F393 PolarHBondContact O-N 2.95Å; E390-F393 PolarHBondContact O-N 3.22Å; E390-F393 VanDerWaalsContact O-N 3.17Å; F391-F393 VanDerWaalsContact C-N 3.34Å; F391-F393 PolarHBondContact O-N 3.25Å; F393-T397 HydrophobicContact CD2-CG2 4.31Å; F393-T397 HydrophobicContact CE2-CG2 4.04Å; F393-T397 WeakPolarHBondContact O-CA 3.49Å; F393-T397 WeakPolarHBondContact O-CB 3.27Å; F393-T397 PolarHBondContact O-N 3.15Å; F393-L398 HydrophobicContact CD1-CD1 4.42Å; F393-L398 HydrophobicContact CD1-CG 4.4Å; F393-L398 HydrophobicContact CE1-CD1 3.99Å; F393-L398 HydrophobicContact CE1-CD2 4.16Å; F393-L398 HydrophobicContact CE1-CG 3.95Å; F393-L398 HydrophobicContact CZ-CD2 4.17Å; F393-L398 HydrophobicContact CZ-CG 4.37Å; F393-L398 PolarHBondContact O-N 3.35Å; F393-L398 VanDerWaalsContact O-N 3.07Å
394	I	96	Very high	95.9	Very high	24 Å²	24	66 Å²	66	12%	0.123	34%	0.339	C	S	.	.	I	π-helix	trans	-66.6	-58.4	179.6	-63.3	172.4	0	0	0	110	L373 L374 T377 L386 E390 F391 S396 L398 G399	L373-I394 HydrophobicContact CD2-CG2 4.49Å; L373-I394 HydrophobicContact CG-CG2 4.23Å; L374-I394 HydrophobicContact CD2-CG2 3.86Å; L374-I394 WeakPolarHBondContact CD2-O 3.08Å; T377-I394 HydrophobicContact CG2-CD1 3.83Å; T377-I394 HydrophobicContact CG2-CG2 4.02Å; L386-I394 HydrophobicContact CD1-CD1 4.27Å; E390-I394 WeakPolarHBondContact O-CG1 3.35Å; E390-I394 PolarHBondContact O-N 2.86Å; F391-I394 PolarHBondContact O-N 3.02Å; I394-S396 VanDerWaalsContact C-N 3.33Å; I394-S396 PolarHBondContact O-N 3.34Å; I394-L398 HydrophobicContact CG1-CD1 4.29Å; I394-L398 WeakPolarHBondContact O-CB 3.45Å; I394-L398 PolarHBondContact O-N 3.43Å; I394-G399 PolarHBondContact O-N 2.65Å; I394-G399 VanDerWaalsContact O-N 3.16Å
395	Q	96.1	Very high	96.3	Very high	46 Å²	46	62.2 Å²	62.2	22%	0.215	31%	0.31	C	S	.	.	I	π-helix	trans	-72	-23.4	-171.6	-67.2	-68.5	-30.1	0	0	114.3	Y271 L374 T377 F391	Y271-Q395 PolarHBondContact OH-O 3.06Å; L374-Q395 PolarHBondContact O-NE2 3.46Å; T377-Q395 PolarHBondContact OG1-NE2 3.42Å; F391-Q395 HydrophobicContact CD2-CG 4.01Å; F391-Q395 HydrophobicContact CE1-CB 4.36Å; F391-Q395 HydrophobicContact CE1-CG 4.17Å; F391-Q395 HydrophobicContact CE2-CG 3.62Å; F391-Q395 HydrophobicContact CG-CG 4.46Å; F391-Q395 HydrophobicContact CZ-CB 4.32Å; F391-Q395 HydrophobicContact CZ-CG 3.71Å; F391-Q395 WeakPolarHBondContact O-CB 3.1Å; F391-Q395 PolarHBondContact O-N 2.66Å
396	S	94.7	Very high	96.4	Very high	43 Å²	43	58.9 Å²	58.9	30%	0.301	28%	0.282	S	S	.	.	I	π-helix	trans	-102	-63.6	177.5	-165	0	0	0	0	111.7	S392 I394 G399 Y400	S392-S396 WeakPolarHBondContact O-CA 3.37Å; S392-S396 WeakPolarHBondContact O-CB 3.26Å; S392-S396 PolarHBondContact O-N 2.88Å; I394-S396 VanDerWaalsContact C-N 3.33Å; I394-S396 PolarHBondContact O-N 3.34Å; S396-G399 PolarHBondContact O-N 3.26Å; S396-Y400 VanDerWaalsContact O-CD2 3.27Å; S396-Y400 WeakPolarHBondContact O-CD2 3.42Å; S396-Y400 PolarHBondContact O-N 3.37Å
397	T	96	Very high	96.6	Very high	71 Å²	71	56.7 Å²	56.7	44%	0.436	27%	0.27	S	S	.	.	I	π-helix	trans	-67.9	-56.9	-172	-51.7	0	0	0	0	111.2	F393 G399 Y400 V401	F393-T397 HydrophobicContact CD2-CG2 4.31Å; F393-T397 HydrophobicContact CE2-CG2 4.04Å; F393-T397 WeakPolarHBondContact O-CA 3.49Å; F393-T397 WeakPolarHBondContact O-CB 3.27Å; F393-T397 PolarHBondContact O-N 3.15Å; T397-G399 PolarHBondContact O-N 3.09Å; T397-Y400 PolarHBondContact O-N 3.43Å; T397-V401 WeakPolarHBondContact O-CG2 3.31Å; T397-V401 PolarHBondContact O-N 2.93Å; T397-V401 VanDerWaalsContact O-N 3.1Å
398	L	97.1	Very high	96.7	Very high	35 Å²	35	57.1 Å²	57.1	18%	0.183	27%	0.269	C	S	.	.	I	π-helix	trans	-65.1	-28.7	177.4	-59.4	-177.6	0	0	0	111.5	L373 F393 I394 V401 A402	L373-L398 HydrophobicContact CD2-CD1 3.52Å; F393-L398 HydrophobicContact CD1-CD1 4.42Å; F393-L398 HydrophobicContact CD1-CG 4.4Å; F393-L398 HydrophobicContact CE1-CD1 3.99Å; F393-L398 HydrophobicContact CE1-CD2 4.16Å; F393-L398 HydrophobicContact CE1-CG 3.95Å; F393-L398 HydrophobicContact CZ-CD2 4.17Å; F393-L398 HydrophobicContact CZ-CG 4.37Å; F393-L398 PolarHBondContact O-N 3.35Å; F393-L398 VanDerWaalsContact O-N 3.07Å; I394-L398 HydrophobicContact CG1-CD1 4.29Å; I394-L398 WeakPolarHBondContact O-CB 3.45Å; I394-L398 PolarHBondContact O-N 3.43Å; L398-V401 PolarHBondContact O-N 3.48Å; L398-A402 WeakPolarHBondContact O-CB 3.49Å; L398-A402 PolarHBondContact O-N 3.25Å
399	G	97.1	Very high	97	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-54.5	-54.9	169.3	0	0	0	0	0	115.3	Y271 I394 S396 T397 V401 A402 L403	Y271-G399 VanDerWaalsContact CZ-C 3.48Å; Y271-G399 VanDerWaalsContact CZ-CA 3.5Å; Y271-G399 WeakPolarHBondContact OH-CA 3.24Å; I394-G399 PolarHBondContact O-N 2.65Å; I394-G399 VanDerWaalsContact O-N 3.16Å; S396-G399 PolarHBondContact O-N 3.26Å; T397-G399 PolarHBondContact O-N 3.09Å; G399-V401 VanDerWaalsContact C-N 3.3Å; G399-V401 PolarHBondContact O-N 3.5Å; G399-A402 WeakPolarHBondContact O-CB 3.32Å; G399-A402 PolarHBondContact O-N 3.15Å; G399-L403 PolarHBondContact O-N 3.18Å
400	Y	97.9	Very high	97.1	Very high	32 Å²	32	40.3 Å²	40.3	13%	0.125	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-34	175.6	-84.5	-78.5	0	0	0	112.2	Y271 L275 S396 T397 L403 L404 V442 K446	Y271-Y400 AromaticContact CD1-CD2 3.99Å; Y271-Y400 HydrophobicContact CD1-CD2 3.99Å; Y271-Y400 HydrophobicContact CD1-CE1 4.3Å; Y271-Y400 AromaticContact CD1-CE2 3.65Å; Y271-Y400 HydrophobicContact CD1-CE2 3.65Å; Y271-Y400 HydrophobicContact CD1-CG 4.43Å; Y271-Y400 AromaticContact CD1-CZ 3.82Å; Y271-Y400 HydrophobicContact CE1-CD2 4.35Å; Y271-Y400 HydrophobicContact CE1-CE2 4.36Å; Y271-Y400 HydrophobicContact CG-CD1 4.47Å; Y271-Y400 HydrophobicContact CG-CE1 4.16Å; Y271-Y400 HydrophobicContact CG-CE2 4.32Å; Y271-Y400 PolarHBondContact O-OH 3.26Å; L275-Y400 WeakPolarHBondContact CD2-OH 3.46Å; S396-Y400 VanDerWaalsContact O-CD2 3.27Å; S396-Y400 WeakPolarHBondContact O-CD2 3.42Å; S396-Y400 PolarHBondContact O-N 3.37Å; T397-Y400 PolarHBondContact O-N 3.43Å; Y400-L403 PolarHBondContact O-N 2.71Å; Y400-L404 WeakPolarHBondContact O-CB 3.49Å; Y400-L404 PolarHBondContact O-N 3.39Å; Y400-V442 HydrophobicContact CE1-CG1 4.04Å; Y400-K446 HydrophobicContact CD1-CB 4.06Å; Y400-K446 HydrophobicContact CD1-CD 4.17Å; Y400-K446 HydrophobicContact CD1-CG 3.73Å; Y400-K446 HydrophobicContact CD2-CD 4.29Å; Y400-K446 HydrophobicContact CE1-CB 3.67Å; Y400-K446 HydrophobicContact CE1-CD 3.8Å; Y400-K446 HydrophobicContact CE1-CG 3.66Å; Y400-K446 HydrophobicContact CE2-CD 3.98Å; Y400-K446 HydrophobicContact CG-CD 4.4Å; Y400-K446 HydrophobicContact CG-CG 4.23Å
401	V	98.1	Very high	97.1	Very high	55 Å²	55	40 Å²	40	33%	0.333	21%	0.209	S	C	.	.	H	α-helix	trans	-65	-41.8	174.7	174.9	0	0	0	0	110.8	L370 T397 L398 G399 L403 L404 I405	L370-V401 HydrophobicContact CD1-CB 4.49Å; L370-V401 HydrophobicContact CD1-CG1 3.82Å; T397-V401 WeakPolarHBondContact O-CG2 3.31Å; T397-V401 PolarHBondContact O-N 2.93Å; T397-V401 VanDerWaalsContact O-N 3.1Å; L398-V401 PolarHBondContact O-N 3.48Å; G399-V401 VanDerWaalsContact C-N 3.3Å; G399-V401 PolarHBondContact O-N 3.5Å; V401-L403 PolarHBondContact O-N 3.12Å; V401-L404 PolarHBondContact O-N 2.93Å; V401-I405 HydrophobicContact CG1-CD1 3.68Å; V401-I405 HydrophobicContact CG1-CG1 4.41Å; V401-I405 WeakPolarHBondContact O-CB 3.35Å; V401-I405 WeakPolarHBondContact O-CG1 3.41Å; V401-I405 PolarHBondContact O-N 3.47Å
402	A	98.1	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-43.5	174.6	0	0	0	0	0	111.4	L370 L371 L374 L398 G399 S406	L370-A402 HydrophobicContact CB-CB 3.77Å; L370-A402 HydrophobicContact CD1-CB 4.18Å; L371-A402 HydrophobicContact CD2-CB 4.26Å; L371-A402 HydrophobicContact CG-CB 4.5Å; L374-A402 HydrophobicContact CD1-CB 4.34Å; L398-A402 WeakPolarHBondContact O-CB 3.49Å; L398-A402 PolarHBondContact O-N 3.25Å; G399-A402 WeakPolarHBondContact O-CB 3.32Å; G399-A402 PolarHBondContact O-N 3.15Å; A402-S406 VanDerWaalsContact O-CB 3.29Å; A402-S406 WeakPolarHBondContact O-CB 3.29Å; A402-S406 PolarHBondContact O-N 2.88Å; A402-S406 PolarHBondContact O-OG 3.49Å
403	L	98.4	Very high	97.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-42.5	175.7	-179.8	63.7	0	0	0	111.9	I264 L267 S268 Y271 G399 Y400 V401 S406 T407 P439 V442 I443	I264-L403 HydrophobicContact CG1-CD1 4.3Å; L267-L403 HydrophobicContact CB-CD1 4.35Å; L267-L403 HydrophobicContact CD2-CB 4.07Å; L267-L403 HydrophobicContact CD2-CD1 3.89Å; L267-L403 HydrophobicContact CG-CB 4.42Å; L267-L403 HydrophobicContact CG-CD1 4.05Å; S268-L403 WeakPolarHBondContact OG-CD1 3.3Å; Y271-L403 HydrophobicContact CD2-CB 4.46Å; Y271-L403 HydrophobicContact CD2-CD2 4.06Å; G399-L403 PolarHBondContact O-N 3.18Å; Y400-L403 PolarHBondContact O-N 2.71Å; V401-L403 PolarHBondContact O-N 3.12Å; L403-S406 PolarHBondContact O-N 2.9Å; L403-T407 WeakPolarHBondContact O-CB 3.39Å; L403-T407 PolarHBondContact O-N 3.38Å; L403-T407 PolarHBondContact O-OG1 3.4Å; L403-P439 HydrophobicContact CD1-CB 4.08Å; L403-V442 HydrophobicContact CD2-CB 4.11Å; L403-V442 HydrophobicContact CD2-CG1 3.53Å; L403-I443 HydrophobicContact CD2-CG1 4.38Å; L403-I443 HydrophobicContact CG-CG1 4.47Å
404	L	98.4	Very high	96.9	Very high	68 Å²	68	35 Å²	35	36%	0.356	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-49.7	178.1	-178.5	65.2	0	0	0	111.6	Y400 V401 S406 T407 F408 I443	Y400-L404 WeakPolarHBondContact O-CB 3.49Å; Y400-L404 PolarHBondContact O-N 3.39Å; V401-L404 PolarHBondContact O-N 2.93Å; L404-S406 PolarHBondContact O-N 3.49Å; L404-T407 WeakPolarHBondContact O-CB 3.42Å; L404-T407 PolarHBondContact O-N 2.81Å; L404-T407 VanDerWaalsContact O-N 3.12Å; L404-F408 HydrophobicContact CD1-CD2 4.16Å; L404-F408 HydrophobicContact CD1-CE2 3.63Å; L404-F408 HydrophobicContact CD1-CZ 4.28Å; L404-F408 HydrophobicContact CD2-CE2 4.18Å; L404-F408 HydrophobicContact CG-CD2 3.97Å; L404-F408 HydrophobicContact CG-CE2 3.65Å; L404-F408 WeakPolarHBondContact O-CD2 3.42Å; L404-F408 PolarHBondContact O-N 3.32Å; L404-I443 HydrophobicContact CD1-CD1 3.94Å; L404-I443 HydrophobicContact CD1-CG2 4.15Å
405	I	98.3	Very high	96.7	Very high	20 Å²	20	38.3 Å²	38.3	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-40.1	178.5	-70.8	168.8	0	0	0	111.1	F363 M366 L370 V401 T407 F408 H409	F363-I405 HydrophobicContact CB-CG2 4.24Å; F363-I405 HydrophobicContact CD1-CG2 3.93Å; F363-I405 WeakPolarHBondContact O-CG2 3.4Å; M366-I405 HydrophobicContact CB-CG2 4.1Å; M366-I405 HydrophobicContact CE-CD1 4.31Å; L370-I405 HydrophobicContact CD1-CD1 3.7Å; V401-I405 HydrophobicContact CG1-CD1 3.68Å; V401-I405 HydrophobicContact CG1-CG1 4.41Å; V401-I405 WeakPolarHBondContact O-CB 3.35Å; V401-I405 WeakPolarHBondContact O-CG1 3.41Å; V401-I405 PolarHBondContact O-N 3.47Å; I405-T407 VanDerWaalsContact C-N 3.28Å; I405-T407 PolarHBondContact O-N 3.3Å; I405-F408 PolarHBondContact O-N 3.2Å; I405-H409 PolarHBondContact O-N 3.1Å
406	S	98.1	Very high	96.4	Very high	12 Å²	12	41 Å²	41	8%	0.084	20%	0.203	C	C	.	.	H	α-helix	trans	-59.2	-39.8	171.9	-56.8	0	0	0	0	112.3	S367 A402 L403 L404 H409 V410	S367-S406 PolarHBondContact OG-OG 2.93Å; A402-S406 VanDerWaalsContact O-CB 3.29Å; A402-S406 WeakPolarHBondContact O-CB 3.29Å; A402-S406 PolarHBondContact O-N 2.88Å; A402-S406 PolarHBondContact O-OG 3.49Å; L403-S406 PolarHBondContact O-N 2.9Å; L404-S406 PolarHBondContact O-N 3.49Å; S406-H409 WeakPolarHBondContact O-CB 3.37Å; S406-H409 PolarHBondContact O-N 3.27Å; S406-V410 WeakPolarHBondContact O-CG2 3.4Å; S406-V410 PolarHBondContact O-N 3.23Å
407	T	98.1	Very high	96.2	Very high	4 Å²	4	41.6 Å²	41.6	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-68.3	-41	178.5	-54.2	0	0	0	0	110.4	L403 L404 I405 V410 L411 L436 P439 I443	L403-T407 WeakPolarHBondContact O-CB 3.39Å; L403-T407 PolarHBondContact O-N 3.38Å; L403-T407 PolarHBondContact O-OG1 3.4Å; L404-T407 WeakPolarHBondContact O-CB 3.42Å; L404-T407 PolarHBondContact O-N 2.81Å; L404-T407 VanDerWaalsContact O-N 3.12Å; I405-T407 VanDerWaalsContact C-N 3.28Å; I405-T407 PolarHBondContact O-N 3.3Å; T407-V410 PolarHBondContact O-N 2.85Å; T407-L411 HydrophobicContact CG2-CD1 3.98Å; T407-L411 HydrophobicContact CG2-CG 4.36Å; T407-L411 WeakPolarHBondContact O-CB 3.43Å; T407-L411 WeakPolarHBondContact O-CG 3.43Å; T407-L411 PolarHBondContact O-N 3.12Å; T407-L436 HydrophobicContact CG2-CD2 3.69Å; T407-P439 HydrophobicContact CG2-CB 4.24Å; T407-P439 WeakPolarHBondContact OG1-CB 3.17Å; T407-I443 HydrophobicContact CG2-CD1 4.04Å; T407-I443 WeakPolarHBondContact OG1-CD1 3.41Å
408	F	97.8	Very high	95.8	Very high	88 Å²	88	39.2 Å²	39.2	39%	0.386	19%	0.186	S	C	.	.	H	α-helix	trans	-63	-41.1	173.4	-79.1	-57.2	0	0	0	113	F363 L404 I405 V410 L411 I412	F363-F408 HydrophobicContact CD1-CB 4.37Å; F363-F408 HydrophobicContact CG-CB 4.44Å; L404-F408 HydrophobicContact CD1-CD2 4.16Å; L404-F408 HydrophobicContact CD1-CE2 3.63Å; L404-F408 HydrophobicContact CD1-CZ 4.28Å; L404-F408 HydrophobicContact CD2-CE2 4.18Å; L404-F408 HydrophobicContact CG-CD2 3.97Å; L404-F408 HydrophobicContact CG-CE2 3.65Å; L404-F408 WeakPolarHBondContact O-CD2 3.42Å; L404-F408 PolarHBondContact O-N 3.32Å; I405-F408 PolarHBondContact O-N 3.2Å; F408-V410 VanDerWaalsContact C-N 3.28Å; F408-V410 PolarHBondContact O-N 2.98Å; F408-L411 HydrophobicContact CD1-CD1 4.26Å; F408-L411 PolarHBondContact O-N 3.3Å; F408-I412 WeakPolarHBondContact O-CB 3.33Å; F408-I412 VanDerWaalsContact O-CG1 3.29Å; F408-I412 WeakPolarHBondContact O-CG1 3.47Å; F408-I412 PolarHBondContact O-N 2.99Å
409	H	97.8	Very high	95.6	Very high	35 Å²	35	46.2 Å²	46.2	16%	0.162	22%	0.216	C	C	.	.	H	α-helix	trans	-52	-47.8	172.1	165.1	76.1	0	0	0	111.4	Y360 F363 G364 I405 S406 Y413	Y360-H409 WeakPolarHBondContact CB-O 3.44Å; Y360-H409 AromaticContact CD2-CE1 3.79Å; Y360-H409 AromaticContact CD2-ND1 3.91Å; Y360-H409 PolarHBondContact O-ND1 3.07Å; F363-H409 HydrophobicContact CB-CB 3.97Å; G364-H409 WeakPolarHBondContact CA-ND1 3.32Å; I405-H409 PolarHBondContact O-N 3.1Å; S406-H409 WeakPolarHBondContact O-CB 3.37Å; S406-H409 PolarHBondContact O-N 3.27Å; H409-Y413 VanDerWaalsContact O-CB 3.28Å; H409-Y413 WeakPolarHBondContact O-CB 3.39Å; H409-Y413 PolarHBondContact O-N 3.44Å
410	V	97.3	Very high	95.3	Very high	19 Å²	19	49.7 Å²	49.7	12%	0.115	23%	0.232	C	C	.	.	H	α-helix	trans	-74.1	-38	-179.8	-178.4	0	0	0	0	112.6	I264 S406 T407 F408 Y413 G414 F432 L436	I264-V410 HydrophobicContact CD1-CG2 4.14Å; S406-V410 WeakPolarHBondContact O-CG2 3.4Å; S406-V410 PolarHBondContact O-N 3.23Å; T407-V410 PolarHBondContact O-N 2.85Å; F408-V410 VanDerWaalsContact C-N 3.28Å; F408-V410 PolarHBondContact O-N 2.98Å; V410-Y413 WeakPolarHBondContact O-CB 3.44Å; V410-Y413 PolarHBondContact O-N 3.33Å; V410-G414 PolarHBondContact O-N 3.34Å; V410-F432 HydrophobicContact CG1-CB 3.89Å; V410-L436 HydrophobicContact CB-CD2 3.84Å; V410-L436 HydrophobicContact CB-CG 4.36Å; V410-L436 HydrophobicContact CG1-CD1 4.07Å; V410-L436 HydrophobicContact CG1-CD2 3.79Å; V410-L436 HydrophobicContact CG1-CG 3.74Å
411	L	96.6	Very high	94.9	Very high	79 Å²	79	56.6 Å²	56.6	41%	0.414	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-46.8	177.2	-77.9	167.9	0	0	0	111.6	T407 F408 G414 W415 L436	T407-L411 HydrophobicContact CG2-CD1 3.98Å; T407-L411 HydrophobicContact CG2-CG 4.36Å; T407-L411 WeakPolarHBondContact O-CB 3.43Å; T407-L411 WeakPolarHBondContact O-CG 3.43Å; T407-L411 PolarHBondContact O-N 3.12Å; F408-L411 HydrophobicContact CD1-CD1 4.26Å; F408-L411 PolarHBondContact O-N 3.3Å; L411-G414 PolarHBondContact O-N 2.96Å; L411-W415 PolarHBondContact O-N 3.18Å; L411-L436 HydrophobicContact CD2-CD1 3.62Å; L411-L436 HydrophobicContact CD2-CD2 4.1Å; L411-L436 HydrophobicContact CD2-CG 4.46Å; L411-L436 HydrophobicContact CG-CD1 4.15Å; L411-L436 HydrophobicContact CG-CD2 3.83Å
412	I	96.5	Very high	94.4	Very high	20 Å²	20	62.1 Å²	62.1	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-70.6	-35.1	179.8	-62.5	165.9	0	0	0	110.5	R356 M359 F363 F408 G414 W415	R356-I412 HydrophobicContact CG-CG2 4.25Å; R356-I412 VanDerWaalsContact CG-O 3.31Å; R356-I412 WeakPolarHBondContact CG-O 3.42Å; M359-I412 HydrophobicContact CB-CD1 4.39Å; M359-I412 HydrophobicContact CB-CG2 4.03Å; M359-I412 HydrophobicContact CE-CD1 4.23Å; M359-I412 HydrophobicContact CE-CG1 4.45Å; M359-I412 HydrophobicContact CE-CG2 3.69Å; F363-I412 HydrophobicContact CD2-CD1 3.46Å; F363-I412 VanDerWaalsContact CD2-CD1 3.46Å; F363-I412 HydrophobicContact CE2-CD1 3.36Å; F363-I412 HydrophobicContact CZ-CD1 4.39Å; F408-I412 WeakPolarHBondContact O-CB 3.33Å; F408-I412 VanDerWaalsContact O-CG1 3.29Å; F408-I412 WeakPolarHBondContact O-CG1 3.47Å; F408-I412 PolarHBondContact O-N 2.99Å; I412-G414 VanDerWaalsContact C-N 3.32Å; I412-G414 PolarHBondContact O-N 3.15Å; I412-W415 HydrophobicContact CG2-CE3 4.16Å; I412-W415 HydrophobicContact CG2-CZ3 4.26Å; I412-W415 PolarHBondContact O-N 3.44Å
413	Y	95.3	Very high	93.9	Very high	81 Å²	81	65.8 Å²	65.8	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-59	-41.9	170.3	168.4	-95.8	0	0	0	112.5	Y360 H409 V410 F432	Y360-Y413 HydrophobicContact CE1-CD2 4.26Å; Y360-Y413 HydrophobicContact CE2-CD2 4.24Å; H409-Y413 VanDerWaalsContact O-CB 3.28Å; H409-Y413 WeakPolarHBondContact O-CB 3.39Å; H409-Y413 PolarHBondContact O-N 3.44Å; V410-Y413 WeakPolarHBondContact O-CB 3.44Å; V410-Y413 PolarHBondContact O-N 3.33Å; Y413-F432 HydrophobicContact CD1-CB 4.41Å; Y413-F432 HydrophobicContact CD1-CG 4.43Å; Y413-F432 HydrophobicContact CE1-CB 4.4Å; Y413-F432 HydrophobicContact CE1-CD1 4.14Å; Y413-F432 HydrophobicContact CE1-CG 4.42Å
414	G	91.7	Very high	93.7	Very high	2 Å²	2	70 Å²	70	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-69.4	-40.9	177.4	0	0	0	0	0	113.2	V410 L411 I412 K416 R417	V410-G414 PolarHBondContact O-N 3.34Å; L411-G414 PolarHBondContact O-N 2.96Å; I412-G414 VanDerWaalsContact C-N 3.32Å; I412-G414 PolarHBondContact O-N 3.15Å; G414-K416 PolarHBondContact O-N 3.15Å; G414-R417 WeakPolarHBondContact O-CB 3.43Å; G414-R417 WeakPolarHBondContact O-CG 3.41Å; G414-R417 PolarHBondContact O-N 3.27Å
415	W	91.4	Very high	93.3	Very high	94 Å²	94	70.6 Å²	70.6	36%	0.356	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	44.7	-122.9	-180	-159.3	-107.3	0	0	0	112.3	E352 R356 M359 L411 I412	E352-W415 HydrophobicContact CG-CZ2 4.4Å; E352-W415 PolarHBondContact OE1-NE1 3.15Å; R356-W415 VanDerWaalsContact CD-CB 3.45Å; R356-W415 HydrophobicContact CG-CB 4.17Å; R356-W415 HydrophobicContact CG-CD2 4.16Å; R356-W415 HydrophobicContact CG-CE3 4.12Å; R356-W415 HydrophobicContact CG-CG 4.2Å; M359-W415 HydrophobicContact CE-CH2 4.29Å; M359-W415 HydrophobicContact CE-CZ3 3.85Å; L411-W415 PolarHBondContact O-N 3.18Å; I412-W415 HydrophobicContact CG2-CE3 4.16Å; I412-W415 HydrophobicContact CG2-CZ3 4.26Å; I412-W415 PolarHBondContact O-N 3.44Å
416	K	90.6	Very high	93	Very high	102 Å²	102	74.4 Å²	74.4	44%	0.443	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-77.8	-16.8	177.9	-69.6	168	177.7	168.9	0	114.1	E352 G414 A418 F419 E420	E352-K416 VanDerWaalsContact CD-NZ 3.3Å; E352-K416 WeakPolarHBondContact OE1-CE 3.41Å; E352-K416 IonicContact OE1-NZ 2.69Å; E352-K416 PolarHBondContact OE1-NZ 3.12Å; E352-K416 IonicContact OE2-NZ 3.06Å; E352-K416 PolarHBondContact OE2-NZ 3.18Å; G414-K416 PolarHBondContact O-N 3.15Å; K416-A418 PolarHBondContact O-N 3.23Å; K416-F419 PolarHBondContact O-N 3.41Å; K416-E420 WeakPolarHBondContact CB-OE1 3.35Å
417	R	89.9	Confident	92.6	Very high	57 Å²	57	84.6 Å²	84.6	22%	0.215	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-62.3	-19.7	-173.3	-58.2	177.2	168.1	157.7	-0.8	114.3	G414 F419 Y423 F432	G414-R417 WeakPolarHBondContact O-CB 3.43Å; G414-R417 WeakPolarHBondContact O-CG 3.41Å; G414-R417 PolarHBondContact O-N 3.27Å; R417-F419 PolarHBondContact O-N 3.4Å; R417-Y423 HydrophobicContact CB-CD1 4.18Å; R417-Y423 HydrophobicContact CB-CD2 4.22Å; R417-Y423 HydrophobicContact CB-CE1 4.04Å; R417-Y423 HydrophobicContact CB-CE2 4.14Å; R417-Y423 HydrophobicContact CB-CG 4.25Å; R417-Y423 HydrophobicContact CG-CE1 3.9Å; R417-Y423 HydrophobicContact CG-CE2 4.09Å; R417-Y423 PolarHBondContact NE-OH 2.9Å; R417-F432 HydrophobicContact CB-CE1 4.36Å; R417-F432 HydrophobicContact CB-CZ 4.12Å
418	A	88.4	Confident	92.4	Very high	21 Å²	21	86.5 Å²	86.5	17%	0.174	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-71.1	-21.7	175.8	0	0	0	0	0	112.9	K416 Y424 F432 V433	K416-A418 PolarHBondContact O-N 3.23Å; A418-Y424 WeakPolarHBondContact O-CE2 3.09Å; A418-Y424 PolarHBondContact O-OH 2.98Å; A418-F432 HydrophobicContact CB-CE2 4.12Å; A418-F432 HydrophobicContact CB-CZ 4.2Å; A418-V433 HydrophobicContact CB-CG2 4.05Å
419	F	91.4	Very high	92.3	Very high	182 Å²	182	83.9 Å²	83.9	80%	0.798	37%	0.373	S	S	*	.	S	Bend	trans	-106.4	-2	-175.2	-54.4	-74	0	0	0	113.1	K416 R417	K416-F419 PolarHBondContact O-N 3.41Å; R417-F419 PolarHBondContact O-N 3.4Å
420	E	91.8	Very high	92.1	Very high	72 Å²	72	82.5 Å²	82.5	34%	0.336	37%	0.367	S	S	.	.			trans	-94.7	122.6	-179.4	-71.6	164.3	-159.1	0	0	109.8	K416 E422 Y423 Y424	K416-E420 WeakPolarHBondContact CB-OE1 3.35Å; E420-E422 PolarHBondContact O-N 3.38Å; E420-Y423 HydrophobicContact CB-CD2 3.71Å; E420-Y423 HydrophobicContact CB-CE2 4.05Å; E420-Y423 PolarHBondContact O-N 3.15Å; E420-Y423 WeakPolarHBondContact OE2-CE2 3.17Å; E420-Y424 WeakPolarHBondContact O-CD2 3.35Å
421	E	89.4	Confident	91.9	Very high	178 Å²	178	81.9 Å²	81.9	83%	0.832	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-60.5	-28.2	-176.2	-65.6	-174.9	174.9	0	0	112.9	Y423 Y424	E421-Y423 PolarHBondContact O-N 3.46Å; E421-Y423 VanDerWaalsContact O-N 3.1Å; E421-Y424 PolarHBondContact O-N 3.38Å
422	E	88.1	Confident	91.7	Very high	170 Å²	170	79.2 Å²	79.2	79%	0.794	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-59.9	-24	-179.5	-58.7	-175.8	178.9	0	0	113.6	E420	E420-E422 PolarHBondContact O-N 3.38Å
423	Y	87.6	Confident	91.6	Very high	78 Å²	78	80 Å²	80	31%	0.306	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-85.8	-8.4	179.6	-68.6	-96.4	0	0	0	113.2	R417 E420 E421 R425	R417-Y423 HydrophobicContact CB-CD1 4.18Å; R417-Y423 HydrophobicContact CB-CD2 4.22Å; R417-Y423 HydrophobicContact CB-CE1 4.04Å; R417-Y423 HydrophobicContact CB-CE2 4.14Å; R417-Y423 HydrophobicContact CB-CG 4.25Å; R417-Y423 HydrophobicContact CG-CE1 3.9Å; R417-Y423 HydrophobicContact CG-CE2 4.09Å; R417-Y423 PolarHBondContact NE-OH 2.9Å; E420-Y423 HydrophobicContact CB-CD2 3.71Å; E420-Y423 HydrophobicContact CB-CE2 4.05Å; E420-Y423 PolarHBondContact O-N 3.15Å; E420-Y423 WeakPolarHBondContact OE2-CE2 3.17Å; E421-Y423 PolarHBondContact O-N 3.46Å; E421-Y423 VanDerWaalsContact O-N 3.1Å; Y423-R425 PolarHBondContact O-N 3.18Å
424	Y	92.6	Very high	91.6	Very high	89 Å²	89	79 Å²	79	35%	0.349	36%	0.355	S	S	.	.			trans	-94	71.5	-179.2	-71.6	-100.6	0	0	0	112.1	A418 E420 E421 Y427 T428 P429	A418-Y424 WeakPolarHBondContact O-CE2 3.09Å; A418-Y424 PolarHBondContact O-OH 2.98Å; E420-Y424 WeakPolarHBondContact O-CD2 3.35Å; E421-Y424 PolarHBondContact O-N 3.38Å; Y424-Y427 PolarHBondContact O-N 2.91Å; Y424-T428 WeakPolarHBondContact CA-O 3.38Å; Y424-P429 HydrophobicContact CD1-CB 4.23Å; Y424-P429 HydrophobicContact CE1-CB 3.75Å
425	R	90.9	Very high	91.7	Very high	79 Å²	79	79 Å²	79	30%	0.298	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-73.3	131.9	178.5	-66	178.2	-176.2	-178.2	1.7	110.9	R233 D234 H237 Y423 Y427 T428	R233-R425 HydrophobicContact CG-CB 3.62Å; R233-R425 HydrophobicContact CG-CG 4.31Å; R233-R425 WeakPolarHBondContact O-CD 3.26Å; R233-R425 PolarHBondContact O-NH1 3.02Å; D234-R425 IonicContact OD1-NH1 3Å; H237-R425 HydrophobicContact CB-CB 4.41Å; Y423-R425 PolarHBondContact O-N 3.18Å; R425-Y427 PolarHBondContact O-N 3.26Å; R425-T428 PolarHBondContact O-N 2.93Å; R425-T428 PolarHBondContact O-OG1 3.37Å
426	F	91.3	Very high	92	Very high	100 Å²	100	75.4 Å²	75.4	44%	0.439	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	49.2	36.9	-171.6	-61.8	-44.3	0	0	0	113.8	H237 T428	H237-F426 HydrophobicContact CB-CD2 3.92Å; H237-F426 HydrophobicContact CB-CE2 3.44Å; H237-F426 VanDerWaalsContact CB-CE2 3.44Å; H237-F426 HydrophobicContact CB-CZ 3.87Å; H237-F426 AromaticContact CD2-CD1 3.58Å; H237-F426 AromaticContact CD2-CD2 3.74Å; H237-F426 AromaticContact CD2-CE1 3.48Å; H237-F426 VanDerWaalsContact CD2-CE1 3.48Å; H237-F426 WeakPolarHBondContact CD2-CE1 3.48Å; H237-F426 AromaticContact CD2-CE2 3.68Å; H237-F426 AromaticContact CD2-CG 3.69Å; H237-F426 AromaticContact CD2-CZ 3.53Å; H237-F426 AromaticContact CG-CE2 3.94Å; H237-F426 AromaticContact CG-CZ 3.99Å; F426-T428 PolarHBondContact O-N 3.41Å
427	Y	91	Very high	92.3	Very high	227 Å²	227	74.4 Å²	74.4	89%	0.89	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	61	8.7	-175.4	-52	-82.7	0	0	0	114.8	Y424 R425	Y424-Y427 PolarHBondContact O-N 2.91Å; R425-Y427 PolarHBondContact O-N 3.26Å
428	T	93.8	Very high	92.6	Very high	44 Å²	44	73.6 Å²	73.6	27%	0.27	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-92.9	136	177.6	68.2	0	0	0	0	110.3	Y229 Y424 R425 F426	Y229-T428 HydrophobicContact CE2-CG2 4.38Å; Y229-T428 WeakPolarHBondContact OH-CB 3.41Å; Y424-T428 WeakPolarHBondContact CA-O 3.38Å; R425-T428 PolarHBondContact O-N 2.93Å; R425-T428 PolarHBondContact O-OG1 3.37Å; F426-T428 PolarHBondContact O-N 3.41Å
429	P	94.7	Very high	93.1	Very high	32 Å²	32	72.6 Å²	72.6	21%	0.208	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-68.8	160.2	-179.1	27.7	-35.2	0	0	0	112.5	Y229 R233 Y424 V433 L434	Y229-P429 VanDerWaalsContact OH-CD 3.29Å; Y229-P429 WeakPolarHBondContact OH-CD 3.43Å; Y229-P429 PolarHBondContact OH-O 3.24Å; R233-P429 PolarHBondContact NH1-O 3.24Å; R233-P429 VanDerWaalsContact NH1-O 3.13Å; Y424-P429 HydrophobicContact CD1-CB 4.23Å; Y424-P429 HydrophobicContact CE1-CB 3.75Å; P429-V433 HydrophobicContact CB-CB 4.25Å; P429-V433 HydrophobicContact CB-CG1 4.26Å; P429-L434 HydrophobicContact CG-CD2 3.81Å; P429-L434 HydrophobicContact CG-CG 4.03Å
430	P	93.6	Very high	93.4	Very high	6 Å²	6	66.5 Å²	66.5	4%	0.039	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-62.5	146.5	171.7	26.5	-33	0	0	0	111	F432 V433	P430-F432 HydrophobicContact CB-CD1 3.77Å; P430-F432 HydrophobicContact CB-CE1 3.46Å; P430-F432 VanDerWaalsContact CB-CE1 3.46Å; P430-F432 HydrophobicContact CB-CZ 4.24Å; P430-F432 HydrophobicContact CG-CD1 4.13Å; P430-F432 HydrophobicContact CG-CE1 3.47Å; P430-F432 VanDerWaalsContact CG-CE1 3.47Å; P430-F432 HydrophobicContact CG-CZ 3.73Å; P430-F432 PolarHBondContact O-N 2.9Å; P430-V433 HydrophobicContact CG-CG2 3.77Å; P430-V433 WeakPolarHBondContact O-CB 3.49Å; P430-V433 PolarHBondContact O-N 3.47Å
431	S	92.7	Very high	93.7	Very high	6 Å²	6	67.5 Å²	67.5	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-60.8	-29.1	-166.6	-55.2	0	0	0	0	113.1	S230 R233 V433 L434 A435	S230-S431 PolarHBondContact OG-OG 3.07Å; S230-S431 VanDerWaalsContact OG-OG 3.06Å; R233-S431 VanDerWaalsContact CZ-OG 3.24Å; R233-S431 PolarHBondContact NH1-OG 2.72Å; R233-S431 PolarHBondContact NH2-OG 2.97Å; S431-V433 VanDerWaalsContact C-N 3.31Å; S431-V433 PolarHBondContact O-N 3.46Å; S431-L434 PolarHBondContact O-N 3.06Å; S431-A435 PolarHBondContact O-N 2.91Å; S431-A435 VanDerWaalsContact O-N 3.08Å
432	F	93.1	Very high	94.1	Very high	23 Å²	23	59 Å²	59	10%	0.101	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-29.5	178.6	72.9	-97.7	0	0	0	112.8	V410 Y413 R417 A418 P430 A435 L436	V410-F432 HydrophobicContact CG1-CB 3.89Å; Y413-F432 HydrophobicContact CD1-CB 4.41Å; Y413-F432 HydrophobicContact CD1-CG 4.43Å; Y413-F432 HydrophobicContact CE1-CB 4.4Å; Y413-F432 HydrophobicContact CE1-CD1 4.14Å; Y413-F432 HydrophobicContact CE1-CG 4.42Å; R417-F432 HydrophobicContact CB-CE1 4.36Å; R417-F432 HydrophobicContact CB-CZ 4.12Å; A418-F432 HydrophobicContact CB-CE2 4.12Å; A418-F432 HydrophobicContact CB-CZ 4.2Å; P430-F432 HydrophobicContact CB-CD1 3.77Å; P430-F432 HydrophobicContact CB-CE1 3.46Å; P430-F432 VanDerWaalsContact CB-CE1 3.46Å; P430-F432 HydrophobicContact CB-CZ 4.24Å; P430-F432 HydrophobicContact CG-CD1 4.13Å; P430-F432 HydrophobicContact CG-CE1 3.47Å; P430-F432 VanDerWaalsContact CG-CE1 3.47Å; P430-F432 HydrophobicContact CG-CZ 3.73Å; P430-F432 PolarHBondContact O-N 2.9Å; F432-A435 WeakPolarHBondContact O-CB 3.35Å; F432-A435 PolarHBondContact O-N 3.34Å; F432-L436 HydrophobicContact CD2-CD1 4.21Å; F432-L436 VanDerWaalsContact O-CG 3.31Å; F432-L436 WeakPolarHBondContact O-CG 3.41Å; F432-L436 PolarHBondContact O-N 3.13Å; F432-L436 VanDerWaalsContact O-N 3.1Å
433	V	95	Very high	94.6	Very high	38 Å²	38	52.3 Å²	52.3	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-44.8	176.4	171.3	0	0	0	0	109.9	A418 P429 P430 S431 A435 L436	A418-V433 HydrophobicContact CB-CG2 4.05Å; P429-V433 HydrophobicContact CB-CB 4.25Å; P429-V433 HydrophobicContact CB-CG1 4.26Å; P430-V433 HydrophobicContact CG-CG2 3.77Å; P430-V433 WeakPolarHBondContact O-CB 3.49Å; P430-V433 PolarHBondContact O-N 3.47Å; S431-V433 VanDerWaalsContact C-N 3.31Å; S431-V433 PolarHBondContact O-N 3.46Å; V433-A435 VanDerWaalsContact C-N 3.29Å; V433-A435 PolarHBondContact O-N 2.95Å; V433-L436 PolarHBondContact O-N 2.89Å
434	L	94.2	Very high	95.1	Very high	59 Å²	59	53.6 Å²	53.6	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-39.6	174.2	-62.9	-178.7	0	0	0	111.7	F226 Y229 P429 S431 L436 V437	F226-L434 HydrophobicContact CE1-CB 4.2Å; F226-L434 HydrophobicContact CE1-CD1 4.39Å; Y229-L434 HydrophobicContact CD1-CD1 4.15Å; Y229-L434 HydrophobicContact CE1-CD1 3.48Å; Y229-L434 VanDerWaalsContact CE1-CD1 3.48Å; Y229-L434 HydrophobicContact CE2-CD1 4.01Å; Y229-L434 VanDerWaalsContact CZ-CD1 3.43Å; P429-L434 HydrophobicContact CG-CD2 3.81Å; P429-L434 HydrophobicContact CG-CG 4.03Å; S431-L434 PolarHBondContact O-N 3.06Å; L434-L436 PolarHBondContact O-N 3.43Å; L434-V437 PolarHBondContact O-N 2.96Å
435	A	94.8	Very high	95.3	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-63.1	-29.3	179.2	0	0	0	0	0	113.3	I261 I264 S431 F432 V433 P439	I261-A435 HydrophobicContact CB-CB 4.13Å; I261-A435 HydrophobicContact CD1-CB 4.38Å; I261-A435 HydrophobicContact CG1-CB 3.78Å; I261-A435 HydrophobicContact CG2-CB 3.7Å; I264-A435 HydrophobicContact CG2-CB 4.29Å; S431-A435 PolarHBondContact O-N 2.91Å; S431-A435 VanDerWaalsContact O-N 3.08Å; F432-A435 WeakPolarHBondContact O-CB 3.35Å; F432-A435 PolarHBondContact O-N 3.34Å; V433-A435 VanDerWaalsContact C-N 3.29Å; V433-A435 PolarHBondContact O-N 2.95Å; A435-P439 WeakPolarHBondContact O-CD 3.32Å; A435-P439 VanDerWaalsContact O-CG 3.25Å; A435-P439 WeakPolarHBondContact O-CG 3.41Å
436	L	96.8	Very high	95.6	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-80.5	-22.2	-178.3	-75	168.2	0	0	0	113.9	T407 V410 L411 F432 V433 L434 L438 P439 S440	T407-L436 HydrophobicContact CG2-CD2 3.69Å; V410-L436 HydrophobicContact CB-CD2 3.84Å; V410-L436 HydrophobicContact CB-CG 4.36Å; V410-L436 HydrophobicContact CG1-CD1 4.07Å; V410-L436 HydrophobicContact CG1-CD2 3.79Å; V410-L436 HydrophobicContact CG1-CG 3.74Å; L411-L436 HydrophobicContact CD2-CD1 3.62Å; L411-L436 HydrophobicContact CD2-CD2 4.1Å; L411-L436 HydrophobicContact CD2-CG 4.46Å; L411-L436 HydrophobicContact CG-CD1 4.15Å; L411-L436 HydrophobicContact CG-CD2 3.83Å; F432-L436 HydrophobicContact CD2-CD1 4.21Å; F432-L436 VanDerWaalsContact O-CG 3.31Å; F432-L436 WeakPolarHBondContact O-CG 3.41Å; F432-L436 PolarHBondContact O-N 3.13Å; F432-L436 VanDerWaalsContact O-N 3.1Å; V433-L436 PolarHBondContact O-N 2.89Å; L434-L436 PolarHBondContact O-N 3.43Å; L436-L438 PolarHBondContact O-N 3.23Å; L436-P439 WeakPolarHBondContact O-CD 3.01Å; L436-S440 VanDerWaalsContact O-CB 3.27Å; L436-S440 WeakPolarHBondContact O-CB 3.38Å; L436-S440 PolarHBondContact O-N 3.34Å; L436-S440 PolarHBondContact O-OG 3Å
437	V	96.6	Very high	95.8	Very high	82 Å²	82	48.8 Å²	48.8	50%	0.497	26%	0.256	S	S	.	.	H	α-helix	trans	-55.7	-54.7	-175	176.9	0	0	0	0	111.9	L434 S440 I441	L434-V437 PolarHBondContact O-N 2.96Å; V437-S440 PolarHBondContact O-N 3.26Å; V437-I441 HydrophobicContact CG1-CD1 3.92Å; V437-I441 VanDerWaalsContact O-CG1 3.3Å; V437-I441 WeakPolarHBondContact O-CG1 3.49Å; V437-I441 PolarHBondContact O-N 3.43Å; V437-I441 VanDerWaalsContact O-N 3.11Å
438	L	97.7	Very high	96.1	Very high	39 Å²	39	41.5 Å²	41.5	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-69.1	-46.9	-175.2	-168.9	68.4	0	0	0	113.3	T265 L269 L272 L436 S440 I441 V442	T265-L438 HydrophobicContact CG2-CD2 3.88Å; L269-L438 HydrophobicContact CD2-CD2 3.82Å; L269-L438 HydrophobicContact CG-CD2 3.89Å; L272-L438 HydrophobicContact CD2-CD1 3.88Å; L436-L438 PolarHBondContact O-N 3.23Å; L438-S440 VanDerWaalsContact C-N 3.31Å; L438-S440 PolarHBondContact O-N 3.45Å; L438-I441 PolarHBondContact O-N 2.98Å; L438-V442 WeakPolarHBondContact O-CG2 3.38Å; L438-V442 PolarHBondContact O-N 3.42Å
439	P	98.1	Very high	96.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.8	-44	172.9	-22.2	27.9	0	0	0	113.1	I264 S268 L403 T407 A435 L436 I441 V442 I443	I264-P439 HydrophobicContact CD1-CB 4.3Å; I264-P439 HydrophobicContact CD1-CG 3.77Å; I264-P439 HydrophobicContact CG1-CB 4.49Å; I264-P439 HydrophobicContact CG1-CG 3.79Å; I264-P439 HydrophobicContact CG2-CG 4.4Å; S268-P439 WeakPolarHBondContact OG-CA 3.4Å; S268-P439 WeakPolarHBondContact OG-CD 3.42Å; S268-P439 VanDerWaalsContact OG-CG 3.27Å; S268-P439 WeakPolarHBondContact OG-CG 3.47Å; L403-P439 HydrophobicContact CD1-CB 4.08Å; T407-P439 HydrophobicContact CG2-CB 4.24Å; T407-P439 WeakPolarHBondContact OG1-CB 3.17Å; A435-P439 WeakPolarHBondContact O-CD 3.32Å; A435-P439 VanDerWaalsContact O-CG 3.25Å; A435-P439 WeakPolarHBondContact O-CG 3.41Å; L436-P439 WeakPolarHBondContact O-CD 3.01Å; P439-I441 PolarHBondContact O-N 3.36Å; P439-V442 PolarHBondContact O-N 2.91Å; P439-I443 VanDerWaalsContact O-CG1 3.3Å; P439-I443 WeakPolarHBondContact O-CG1 3.19Å; P439-I443 PolarHBondContact O-N 3.26Å
440	S	97.9	Very high	96.1	Very high	54 Å²	54	44.5 Å²	44.5	38%	0.378	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-42.4	179.3	-67.2	0	0	0	0	112.3	L436 V437 L438 V442 I443 L444	L436-S440 VanDerWaalsContact O-CB 3.27Å; L436-S440 WeakPolarHBondContact O-CB 3.38Å; L436-S440 PolarHBondContact O-N 3.34Å; L436-S440 PolarHBondContact O-OG 3Å; V437-S440 PolarHBondContact O-N 3.26Å; L438-S440 VanDerWaalsContact C-N 3.31Å; L438-S440 PolarHBondContact O-N 3.45Å; S440-V442 VanDerWaalsContact C-N 3.32Å; S440-V442 PolarHBondContact O-N 3.24Å; S440-I443 PolarHBondContact O-N 2.81Å; S440-L444 VanDerWaalsContact O-CB 3.3Å; S440-L444 WeakPolarHBondContact O-CB 3.28Å; S440-L444 PolarHBondContact O-N 3.45Å
441	I	97.9	Very high	96.2	Very high	94 Å²	94	48 Å²	48	48%	0.482	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-44	174.5	-69.5	165.8	0	0	0	110.8	V437 L438 P439 G445	V437-I441 HydrophobicContact CG1-CD1 3.92Å; V437-I441 VanDerWaalsContact O-CG1 3.3Å; V437-I441 WeakPolarHBondContact O-CG1 3.49Å; V437-I441 PolarHBondContact O-N 3.43Å; V437-I441 VanDerWaalsContact O-N 3.11Å; L438-I441 PolarHBondContact O-N 2.98Å; P439-I441 PolarHBondContact O-N 3.36Å; I441-G445 PolarHBondContact O-N 3.08Å
442	V	98.4	Very high	96.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.4	-44.6	-179.6	171.9	0	0	0	0	111.4	L272 L275 Y400 L403 L438 P439 S440 G445 K446	L272-V442 HydrophobicContact CB-CG2 3.82Å; L272-V442 HydrophobicContact CD1-CG2 4.07Å; L272-V442 HydrophobicContact CG-CG2 4.43Å; L275-V442 HydrophobicContact CD1-CB 4.19Å; L275-V442 HydrophobicContact CD1-CG1 3.87Å; L275-V442 HydrophobicContact CD1-CG2 4.41Å; L275-V442 VanDerWaalsContact CD1-O 3.31Å; L275-V442 WeakPolarHBondContact CD1-O 3.31Å; Y400-V442 HydrophobicContact CE1-CG1 4.04Å; L403-V442 HydrophobicContact CD2-CB 4.11Å; L403-V442 HydrophobicContact CD2-CG1 3.53Å; L438-V442 WeakPolarHBondContact O-CG2 3.38Å; L438-V442 PolarHBondContact O-N 3.42Å; P439-V442 PolarHBondContact O-N 2.91Å; S440-V442 VanDerWaalsContact C-N 3.32Å; S440-V442 PolarHBondContact O-N 3.24Å; V442-G445 PolarHBondContact O-N 3.43Å; V442-K446 WeakPolarHBondContact O-CB 3.42Å; V442-K446 PolarHBondContact O-N 2.89Å
443	I	98.1	Very high	96.3	Very high	29 Å²	29	54.8 Å²	54.8	15%	0.149	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-46.4	177.7	-69.1	163.3	0	0	0	110.3	L403 L404 T407 P439 S440 G445 K446 I447	L403-I443 HydrophobicContact CD2-CG1 4.38Å; L403-I443 HydrophobicContact CG-CG1 4.47Å; L404-I443 HydrophobicContact CD1-CD1 3.94Å; L404-I443 HydrophobicContact CD1-CG2 4.15Å; T407-I443 HydrophobicContact CG2-CD1 4.04Å; T407-I443 WeakPolarHBondContact OG1-CD1 3.41Å; P439-I443 VanDerWaalsContact O-CG1 3.3Å; P439-I443 WeakPolarHBondContact O-CG1 3.19Å; P439-I443 PolarHBondContact O-N 3.26Å; S440-I443 PolarHBondContact O-N 2.81Å; I443-G445 PolarHBondContact O-N 3.09Å; I443-K446 WeakPolarHBondContact O-CB 3.47Å; I443-K446 PolarHBondContact O-N 3.35Å; I443-I447 HydrophobicContact CG2-CD1 3.97Å; I443-I447 WeakPolarHBondContact O-CG1 3.47Å; I443-I447 PolarHBondContact O-N 3.11Å
444	L	97.6	Very high	96.2	Very high	105 Å²	105	55.1 Å²	55.1	55%	0.55	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-47	177.2	-178.3	64.1	0	0	0	111.6	S440 K446 I447 I448	S440-L444 VanDerWaalsContact O-CB 3.3Å; S440-L444 WeakPolarHBondContact O-CB 3.28Å; S440-L444 PolarHBondContact O-N 3.45Å; L444-K446 VanDerWaalsContact C-N 3.26Å; L444-K446 PolarHBondContact O-N 3.45Å; L444-I447 WeakPolarHBondContact O-CB 3.32Å; L444-I447 PolarHBondContact O-N 3.44Å; L444-I447 VanDerWaalsContact O-N 3.15Å; L444-I448 HydrophobicContact CG-CD1 4.17Å; L444-I448 WeakPolarHBondContact O-CG1 3.29Å; L444-I448 PolarHBondContact O-N 3.04Å
445	G	97.1	Very high	96.2	Very high	20 Å²	20	54 Å²	54	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-38.3	176.2	0	0	0	0	0	112.2	I441 V442 I443 I448 L449	I441-G445 PolarHBondContact O-N 3.08Å; V442-G445 PolarHBondContact O-N 3.43Å; I443-G445 PolarHBondContact O-N 3.09Å; G445-I448 PolarHBondContact O-N 3.35Å; G445-L449 WeakPolarHBondContact O-CG 3.45Å; G445-L449 PolarHBondContact O-N 3.45Å
446	K	96.7	Very high	96.1	Very high	53 Å²	53	61 Å²	61	23%	0.23	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-44.5	174.3	179.8	60.5	172.4	-168.6	0	112.2	L275 Y400 V442 I443 L444 I448 L449 L450	L275-K446 HydrophobicContact CD2-CB 4.28Å; Y400-K446 HydrophobicContact CD1-CB 4.06Å; Y400-K446 HydrophobicContact CD1-CD 4.17Å; Y400-K446 HydrophobicContact CD1-CG 3.73Å; Y400-K446 HydrophobicContact CD2-CD 4.29Å; Y400-K446 HydrophobicContact CE1-CB 3.67Å; Y400-K446 HydrophobicContact CE1-CD 3.8Å; Y400-K446 HydrophobicContact CE1-CG 3.66Å; Y400-K446 HydrophobicContact CE2-CD 3.98Å; Y400-K446 HydrophobicContact CG-CD 4.4Å; Y400-K446 HydrophobicContact CG-CG 4.23Å; V442-K446 WeakPolarHBondContact O-CB 3.42Å; V442-K446 PolarHBondContact O-N 2.89Å; I443-K446 WeakPolarHBondContact O-CB 3.47Å; I443-K446 PolarHBondContact O-N 3.35Å; L444-K446 VanDerWaalsContact C-N 3.26Å; L444-K446 PolarHBondContact O-N 3.45Å; K446-I448 VanDerWaalsContact C-N 3.31Å; K446-I448 PolarHBondContact O-N 3.07Å; K446-L449 PolarHBondContact O-N 2.69Å; K446-L450 HydrophobicContact CD-CD1 4.45Å; K446-L450 HydrophobicContact CD-CG 4.39Å; K446-L450 HydrophobicContact CG-CD1 4.2Å; K446-L450 WeakPolarHBondContact O-CG 3.28Å; K446-L450 PolarHBondContact O-N 2.74Å
447	I	96.8	Very high	95.9	Very high	94 Å²	94	64.8 Å²	64.8	48%	0.482	35%	0.348	S	S	.	.	H	α-helix	trans	-57.9	-46.2	176.1	-69.4	166	0	0	0	110	I443 L444 L449 L450 L451	I443-I447 HydrophobicContact CG2-CD1 3.97Å; I443-I447 WeakPolarHBondContact O-CG1 3.47Å; I443-I447 PolarHBondContact O-N 3.11Å; L444-I447 WeakPolarHBondContact O-CB 3.32Å; L444-I447 PolarHBondContact O-N 3.44Å; L444-I447 VanDerWaalsContact O-N 3.15Å; I447-L449 PolarHBondContact O-N 2.97Å; I447-L450 WeakPolarHBondContact O-CB 3.3Å; I447-L450 PolarHBondContact O-N 3.03Å; I447-L450 VanDerWaalsContact O-N 3.08Å; I447-L451 PolarHBondContact O-N 3.1Å
448	I	96.5	Very high	95.7	Very high	73 Å²	73	61.5 Å²	61.5	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-57.8	-47	176.4	-67.5	166.8	0	0	0	111	L444 G445 K446 L450 L451 I454	L444-I448 HydrophobicContact CG-CD1 4.17Å; L444-I448 WeakPolarHBondContact O-CG1 3.29Å; L444-I448 PolarHBondContact O-N 3.04Å; G445-I448 PolarHBondContact O-N 3.35Å; K446-I448 VanDerWaalsContact C-N 3.31Å; K446-I448 PolarHBondContact O-N 3.07Å; I448-L450 PolarHBondContact O-N 3.21Å; I448-L451 VanDerWaalsContact O-CB 3.32Å; I448-L451 WeakPolarHBondContact O-CB 3.47Å; I448-L451 PolarHBondContact O-N 3.07Å; I448-I454 HydrophobicContact CG2-CD1 3.54Å; I448-I454 WeakPolarHBondContact O-CD1 3.42Å
449	L	93.9	Very high	95.4	Very high	30 Å²	30	66 Å²	66	16%	0.157	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-21.9	178.5	-69.7	-175.9	0	0	0	114.1	L275 A278 L282 G445 K446 I447 I454 S455	L275-L449 HydrophobicContact CD2-CD1 3.45Å; L275-L449 VanDerWaalsContact CD2-CD1 3.45Å; L275-L449 HydrophobicContact CD2-CG 4.4Å; A278-L449 HydrophobicContact CB-CD1 3.64Å; A278-L449 HydrophobicContact CB-CD2 4.38Å; L282-L449 HydrophobicContact CD1-CD2 3.73Å; G445-L449 WeakPolarHBondContact O-CG 3.45Å; G445-L449 PolarHBondContact O-N 3.45Å; K446-L449 PolarHBondContact O-N 2.69Å; I447-L449 PolarHBondContact O-N 2.97Å; L449-I454 HydrophobicContact CD2-CG2 3.79Å; L449-S455 WeakPolarHBondContact O-CB 3.12Å
450	L	94	Very high	95.1	Very high	109 Å²	109	73.6 Å²	73.6	57%	0.571	37%	0.37	S	S	*	.	H	α-helix	trans	-80.2	-20	176.2	-72.3	172.6	0	0	0	112.7	K446 I447 I448	K446-L450 HydrophobicContact CD-CD1 4.45Å; K446-L450 HydrophobicContact CD-CG 4.39Å; K446-L450 HydrophobicContact CG-CD1 4.2Å; K446-L450 WeakPolarHBondContact O-CG 3.28Å; K446-L450 PolarHBondContact O-N 2.74Å; I447-L450 WeakPolarHBondContact O-CB 3.3Å; I447-L450 PolarHBondContact O-N 3.03Å; I447-L450 VanDerWaalsContact O-N 3.08Å; I448-L450 PolarHBondContact O-N 3.21Å
451	L	95.9	Very high	94.9	Very high	81 Å²	81	71 Å²	71	42%	0.424	35%	0.352	S	S	.	.	S	Bend	trans	-52.5	134.5	177.2	-69.1	170.3	0	0	0	110.8	I447 I448 C453 I454 S455	I447-L451 PolarHBondContact O-N 3.1Å; I448-L451 VanDerWaalsContact O-CB 3.32Å; I448-L451 WeakPolarHBondContact O-CB 3.47Å; I448-L451 PolarHBondContact O-N 3.07Å; L451-C453 PolarHBondContact O-N 3.44Å; L451-C453 VanDerWaalsContact O-N 3.11Å; L451-I454 PolarHBondContact O-N 3.46Å; L451-S455 WeakPolarHBondContact O-CB 3.28Å; L451-S455 PolarHBondContact O-N 2.95Å; L451-S455 PolarHBondContact O-OG 2.97Å
452	P	94.3	Very high	94.5	Very high	79 Å²	79	73 Å²	73	51%	0.513	35%	0.354	S	S	.	.	H	α-helix	trans	-54.6	-36.3	-172	-29.1	34.8	0	0	0	114.6	S455 R456	P452-S455 PolarHBondContact O-OG 3.49Å; P452-R456 WeakPolarHBondContact O-CB 3.19Å; P452-R456 VanDerWaalsContact O-CD 3.3Å; P452-R456 WeakPolarHBondContact O-CD 3.44Å; P452-R456 WeakPolarHBondContact O-CG 3.43Å; P452-R456 PolarHBondContact O-N 2.91Å; P452-R456 VanDerWaalsContact O-N 3.13Å
453	C	93.6	Very high	94.2	Very high	92 Å²	92	82.8 Å²	82.8	62%	0.622	39%	0.39	S	S	*	.	H	α-helix	trans	-63.2	-44.6	178.7	52.2	0	0	0	0	112.1	L451	L451-C453 PolarHBondContact O-N 3.44Å; L451-C453 VanDerWaalsContact O-N 3.11Å
454	I	93.5	Very high	93.7	Very high	45 Å²	45	82.6 Å²	82.6	23%	0.231	40%	0.395	C	S	.	.	H	α-helix	trans	-79.7	-45	-177.8	-63.2	175	0	0	0	110.6	L282 I448 L449 L451 R456 K457 L458	L282-I454 HydrophobicContact CD1-CG2 3.62Å; L282-I454 HydrophobicContact CD2-CG2 4.41Å; I448-I454 HydrophobicContact CG2-CD1 3.54Å; I448-I454 WeakPolarHBondContact O-CD1 3.42Å; L449-I454 HydrophobicContact CD2-CG2 3.79Å; L451-I454 PolarHBondContact O-N 3.46Å; I454-R456 VanDerWaalsContact C-N 3.35Å; I454-R456 PolarHBondContact O-N 3.42Å; I454-K457 PolarHBondContact O-N 3.33Å; I454-L458 WeakPolarHBondContact O-CB 3.33Å; I454-L458 PolarHBondContact O-N 3.06Å
455	S	93.4	Very high	93	Very high	34 Å²	34	81.3 Å²	81.3	24%	0.238	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-37.7	-177.7	71.2	0	0	0	0	112.6	L449 L451 P452 R459	L449-S455 WeakPolarHBondContact O-CB 3.12Å; L451-S455 WeakPolarHBondContact O-CB 3.28Å; L451-S455 PolarHBondContact O-N 2.95Å; L451-S455 PolarHBondContact O-OG 2.97Å; P452-S455 PolarHBondContact O-OG 3.49Å; S455-R459 VanDerWaalsContact O-CB 3.25Å; S455-R459 WeakPolarHBondContact O-CB 3.46Å; S455-R459 PolarHBondContact O-N 2.95Å
456	R	93	Very high	92.2	Very high	151 Å²	151	83.1 Å²	83.1	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-63.3	-45.9	173.4	-72.8	172.1	-172.3	-175.5	2.5	111.2	P452 I454 R459 R460	P452-R456 WeakPolarHBondContact O-CB 3.19Å; P452-R456 VanDerWaalsContact O-CD 3.3Å; P452-R456 WeakPolarHBondContact O-CD 3.44Å; P452-R456 WeakPolarHBondContact O-CG 3.43Å; P452-R456 PolarHBondContact O-N 2.91Å; P452-R456 VanDerWaalsContact O-N 3.13Å; I454-R456 VanDerWaalsContact C-N 3.35Å; I454-R456 PolarHBondContact O-N 3.42Å; R456-R459 PolarHBondContact O-N 3.34Å; R456-R460 WeakPolarHBondContact O-CG 3.47Å; R456-R460 PolarHBondContact O-N 3.43Å
457	K	92.5	Very high	91	Very high	97 Å²	97	86.6 Å²	86.6	42%	0.422	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-48.2	178.1	-173.1	177.3	178.7	-175.6	0	111.7	L282 I454 R459 R460 I461	L282-K457 HydrophobicContact CD2-CB 4.29Å; L282-K457 HydrophobicContact CD2-CD 4.06Å; L282-K457 HydrophobicContact CD2-CG 4.05Å; I454-K457 PolarHBondContact O-N 3.33Å; K457-R459 VanDerWaalsContact C-N 3.3Å; K457-R459 PolarHBondContact O-N 3.4Å; K457-R460 WeakPolarHBondContact O-CB 3.15Å; K457-R460 PolarHBondContact O-N 3.33Å; K457-R460 VanDerWaalsContact O-N 3.14Å; K457-I461 HydrophobicContact CG-CD1 4.19Å; K457-I461 WeakPolarHBondContact O-CG1 3.47Å; K457-I461 PolarHBondContact O-N 3.11Å
458	L	92.5	Very high	89.3	Confident	13 Å²	13	85 Å²	85	7%	0.068	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-40.4	177.9	-175.3	62.5	0	0	0	112	A278 Q281 L282 I454 I461 R462	A278-L458 HydrophobicContact CB-CD1 4.4Å; A278-L458 HydrophobicContact CB-CD2 4.08Å; Q281-L458 HydrophobicContact CB-CD1 4.19Å; L282-L458 HydrophobicContact CD2-CB 4.15Å; L282-L458 HydrophobicContact CD2-CD1 4.45Å; L282-L458 HydrophobicContact CG-CD1 4.14Å; I454-L458 WeakPolarHBondContact O-CB 3.33Å; I454-L458 PolarHBondContact O-N 3.06Å; L458-I461 PolarHBondContact O-N 3.45Å; L458-R462 WeakPolarHBondContact O-CG 3.42Å; L458-R462 PolarHBondContact O-N 3.34Å
459	R	92.2	Very high	87.4	Confident	132 Å²	132	87.2 Å²	87.2	50%	0.498	41%	0.407	S	S	.	.	H	α-helix	trans	-64.6	-38.5	175.6	176.2	167.9	37.8	169	-7.5	112.5	S455 R456 K457 R462 R463	S455-R459 VanDerWaalsContact O-CB 3.25Å; S455-R459 WeakPolarHBondContact O-CB 3.46Å; S455-R459 PolarHBondContact O-N 2.95Å; R456-R459 PolarHBondContact O-N 3.34Å; K457-R459 VanDerWaalsContact C-N 3.3Å; K457-R459 PolarHBondContact O-N 3.4Å; R459-R462 PolarHBondContact O-N 3.25Å; R459-R463 WeakPolarHBondContact O-CG 3.31Å; R459-R463 PolarHBondContact O-N 3.45Å; R459-R463 VanDerWaalsContact O-N 3.08Å
460	R	92.4	Very high	85.5	Confident	161 Å²	161	89.9 Å²	89.9	61%	0.608	42%	0.421	S	S	*	.	H	α-helix	trans	-62.1	-48.2	173	-71.3	-179.6	-172.4	175.6	1.1	111	R456 K457 R462 R463 G464 W465	R456-R460 WeakPolarHBondContact O-CG 3.47Å; R456-R460 PolarHBondContact O-N 3.43Å; K457-R460 WeakPolarHBondContact O-CB 3.15Å; K457-R460 PolarHBondContact O-N 3.33Å; K457-R460 VanDerWaalsContact O-N 3.14Å; R460-R462 VanDerWaalsContact C-N 3.32Å; R460-R462 PolarHBondContact O-N 2.92Å; R460-R463 CarbonylContact O-C 3.54Å; R460-R463 WeakPolarHBondContact O-CA 3.39Å; R460-R463 WeakPolarHBondContact O-CB 3.43Å; R460-R463 PolarHBondContact O-N 2.96Å; R460-G464 PolarHBondContact O-N 3.29Å; R460-W465 VanDerWaalsContact C-CB 3.43Å; R460-W465 HydrophobicContact CB-CB 3.91Å; R460-W465 HydrophobicContact CB-CG 4.18Å; R460-W465 WeakPolarHBondContact O-CB 3.3Å; R460-W465 PolarHBondContact O-N 3.06Å
461	I	91.9	Very high	83.5	Confident	0 Å²	0	91.3 Å²	91.3	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-57.2	-45.9	177.6	-66.9	161.2	0	0	0	110.9	Q281 L282 K287 K457 L458 R463 G464 W465	Q281-I461 HydrophobicContact CB-CG2 4.41Å; L282-I461 HydrophobicContact CD2-CD1 4.05Å; K287-I461 HydrophobicContact CB-CG2 4.34Å; K457-I461 HydrophobicContact CG-CD1 4.19Å; K457-I461 WeakPolarHBondContact O-CG1 3.47Å; K457-I461 PolarHBondContact O-N 3.11Å; L458-I461 PolarHBondContact O-N 3.45Å; I461-R463 VanDerWaalsContact C-N 3.26Å; I461-R463 PolarHBondContact O-N 3.05Å; I461-G464 WeakPolarHBondContact O-CA 3.41Å; I461-G464 PolarHBondContact O-N 3Å; I461-W465 HydrophobicContact CG1-CE3 3.7Å; I461-W465 HydrophobicContact CG1-CZ3 4.23Å
462	R	90.8	Very high	81.1	Confident	136 Å²	136	93.1 Å²	93.1	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-27.9	178.5	-71.5	175.4	178.7	-178.3	-1.3	113.4	K287 L458 R459 R460 G464	K287-R462 WeakPolarHBondContact CD-O 3.25Å; K287-R462 PolarHBondContact NZ-O 2.69Å; L458-R462 WeakPolarHBondContact O-CG 3.42Å; L458-R462 PolarHBondContact O-N 3.34Å; R459-R462 PolarHBondContact O-N 3.25Å; R460-R462 VanDerWaalsContact C-N 3.32Å; R460-R462 PolarHBondContact O-N 2.92Å; R462-G464 PolarHBondContact O-N 3.37Å
463	R	91.4	Very high	78.9	Confident	205 Å²	205	96.1 Å²	96.1	77%	0.774	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.3	170.9	-72.6	180	178.2	-172.4	-2.5	113.9	R459 R460 I461	R459-R463 WeakPolarHBondContact O-CG 3.31Å; R459-R463 PolarHBondContact O-N 3.45Å; R459-R463 VanDerWaalsContact O-N 3.08Å; R460-R463 CarbonylContact O-C 3.54Å; R460-R463 WeakPolarHBondContact O-CA 3.39Å; R460-R463 WeakPolarHBondContact O-CB 3.43Å; R460-R463 PolarHBondContact O-N 2.96Å; I461-R463 VanDerWaalsContact C-N 3.26Å; I461-R463 PolarHBondContact O-N 3.05Å
464	G	87.3	Confident	76.8	Confident	24 Å²	24	95.2 Å²	95.2	25%	0.247	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.3	13.5	176.5	0	0	0	0	0	115	R460 I461 R462	R460-G464 PolarHBondContact O-N 3.29Å; I461-G464 WeakPolarHBondContact O-CA 3.41Å; I461-G464 PolarHBondContact O-N 3Å; R462-G464 PolarHBondContact O-N 3.37Å
465	W	84.1	Confident	74.5	Confident	79 Å²	79	96.7 Å²	96.7	30%	0.299	46%	0.456	S	S	.	.			trans	-68.9	137.6	174.7	-176.1	86.9	0	0	0	111.9	R460 I461 K467 I470	R460-W465 VanDerWaalsContact C-CB 3.43Å; R460-W465 HydrophobicContact CB-CB 3.91Å; R460-W465 HydrophobicContact CB-CG 4.18Å; R460-W465 WeakPolarHBondContact O-CB 3.3Å; R460-W465 PolarHBondContact O-N 3.06Å; I461-W465 HydrophobicContact CG1-CE3 3.7Å; I461-W465 HydrophobicContact CG1-CZ3 4.23Å; W465-K467 HydrophobicContact CH2-CB 4.05Å; W465-K467 HydrophobicContact CH2-CG 4.26Å; W465-K467 HydrophobicContact CZ3-CB 4.03Å; W465-I470 HydrophobicContact CZ2-CD1 3.55Å
466	E	80.3	Confident	72	Confident	57 Å²	57	97.9 Å²	97.9	27%	0.266	47%	0.474	S	S	.	.			trans	-126	135.8	179.3	-114.7	176.5	-166.6	0	0	112.1	G285 T286 Y288 S468	G285-E466 WeakPolarHBondContact O-CA 3.44Å; T286-E466 WeakPolarHBondContact OG1-CG 3.44Å; T286-E466 PolarHBondContact OG1-OE1 2.95Å; Y288-E466 WeakPolarHBondContact CD2-OE1 3.4Å; E466-S468 VanDerWaalsContact C-N 3.32Å; E466-S468 PolarHBondContact O-N 3.42Å
467	K	71.2	Confident	69.5	Low	127 Å²	127	95.8 Å²	95.8	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-68.7	-29.2	179.9	-167.7	-178.4	176.6	-169.3	0	112.8	G285 W465	G285-K467 PolarHBondContact O-N 3.45Å; W465-K467 HydrophobicContact CH2-CB 4.05Å; W465-K467 HydrophobicContact CH2-CG 4.26Å; W465-K467 HydrophobicContact CZ3-CB 4.03Å
468	S	61.4	Low	67	Low	61 Å²	61	96.5 Å²	96.5	43%	0.427	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-33.8	179.4	43	0	0	0	0	113.5	E466 I470 M471 N472	E466-S468 VanDerWaalsContact C-N 3.32Å; E466-S468 PolarHBondContact O-N 3.42Å; S468-I470 PolarHBondContact O-N 3.49Å; S468-M471 PolarHBondContact O-N 3.39Å; S468-M471 VanDerWaalsContact O-N 3.16Å; S468-N472 PolarHBondContact O-N 3.16Å; S468-N472 VanDerWaalsContact O-N 3.12Å
469	H	56.2	Low	64.7	Low	118 Å²	118	100.7 Å²	100.7	55%	0.546	53%	0.526	S	S	.	.	H	α-helix	trans	-58	-35.5	178.6	-109.5	-83.1	0	0	0	112.3	E473	H469-E473 WeakPolarHBondContact O-CB 3.23Å; H469-E473 WeakPolarHBondContact O-CG 3.35Å; H469-E473 PolarHBondContact O-N 3.08Å
470	I	53.7	Low	62	Low	87 Å²	87	103.2 Å²	103.2	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-76.5	-34.8	179.3	-61.9	177	0	0	0	111.9	W465 S468 N472 A474	W465-I470 HydrophobicContact CZ2-CD1 3.55Å; S468-I470 PolarHBondContact O-N 3.49Å; I470-N472 VanDerWaalsContact C-N 3.35Å; I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.94Å
471	M	50.8	Low	59.3	Low	138 Å²	138	102.7 Å²	102.7	68%	0.68	55%	0.551	S	S	*	*	H	α-helix	trans	-66.7	-39.1	175.2	-88	173.5	74.4	0	0	111.2	S468 S475	S468-M471 PolarHBondContact O-N 3.39Å; S468-M471 VanDerWaalsContact O-N 3.16Å; M471-S475 VanDerWaalsContact O-CB 3.28Å; M471-S475 WeakPolarHBondContact O-CB 3.34Å; M471-S475 PolarHBondContact O-N 3.33Å; M471-S475 PolarHBondContact O-OG 3.21Å
472	N	45.6	Very low	56.7	Low	119 Å²	119	108.2 Å²	108.2	64%	0.636	59%	0.59	S	S	*	*	H	α-helix	trans	-74.6	-34.9	176.7	-78.4	-1.6	0	0	0	113.5	S468 I470 S475 G476	S468-N472 PolarHBondContact O-N 3.16Å; S468-N472 VanDerWaalsContact O-N 3.12Å; I470-N472 VanDerWaalsContact C-N 3.35Å; N472-S475 WeakPolarHBondContact CA-OG 3.34Å; N472-S475 PolarHBondContact O-OG 3.31Å; N472-G476 WeakPolarHBondContact O-CA 3.32Å; N472-G476 PolarHBondContact O-N 3.01Å
473	E	49.3	Very low	54.2	Low	143 Å²	143	107 Å²	107	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-35.6	171.9	-80.5	175.9	176	0	0	112.1	H469	H469-E473 WeakPolarHBondContact O-CB 3.23Å; H469-E473 WeakPolarHBondContact O-CG 3.35Å; H469-E473 PolarHBondContact O-N 3.08Å
474	A	49.6	Very low	51.3	Low	73 Å²	73	105.4 Å²	105.4	60%	0.603	60%	0.601	S	S	*	*	H	α-helix	trans	-76.2	-25.5	176.3	0	0	0	0	0	113.3	I470	I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.94Å
475	S	44.5	Very low	49	Very low	75 Å²	75	115.9 Å²	115.9	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-91.9	-8.1	173.4	69.6	0	0	0	0	113.8	M471 N472 S477	M471-S475 VanDerWaalsContact O-CB 3.28Å; M471-S475 WeakPolarHBondContact O-CB 3.34Å; M471-S475 PolarHBondContact O-N 3.33Å; M471-S475 PolarHBondContact O-OG 3.21Å; N472-S475 WeakPolarHBondContact CA-OG 3.34Å; N472-S475 PolarHBondContact O-OG 3.31Å; S475-S477 VanDerWaalsContact C-N 3.32Å; S475-S477 PolarHBondContact O-N 2.78Å
476	G	42	Very low	46.4	Very low	59 Å²	59	119.1 Å²	119.1	61%	0.608	66%	0.655	S	S	*	*			trans	-84.7	8	-177.3	0	0	0	0	0	115.4	N472 V478	N472-G476 WeakPolarHBondContact O-CA 3.32Å; N472-G476 PolarHBondContact O-N 3.01Å; G476-V478 VanDerWaalsContact C-N 3.27Å; G476-V478 PolarHBondContact O-N 2.73Å
477	S	38.9	Very low	43.9	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	68%	0.679	S	S	*	*			trans	-89	19.7	173.7	62.9	0	0	0	0	113.8	S475	S475-S477 VanDerWaalsContact C-N 3.32Å; S475-S477 PolarHBondContact O-N 2.78Å
478	V	41.4	Very low	41.8	Very low	112 Å²	112	122.3 Å²	122.3	68%	0.679	69%	0.689	S	S	*	*	S	Bend	trans	-99.9	109.3	166.2	-175.3	0	0	0	0	108.1	G476 H480	G476-V478 VanDerWaalsContact C-N 3.27Å; G476-V478 PolarHBondContact O-N 2.73Å; V478-H480 PolarHBondContact O-N 3.06Å; V478-H480 VanDerWaalsContact O-N 3.1Å
479	S	43.9	Very low	40.4	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	73%	0.73	S	S	*	*			trans	-47.7	107.3	177.2	51.3	0	0	0	0	112.4
480	H	34.5	Very low	39.6	Very low	184 Å²	184	132.6 Å²	132.6	85%	0.852	74%	0.739	S	S	*	*			trans	-98.5	106.8	154.9	-103.7	-79.3	0	0	0	108.3	V478 S482	V478-H480 PolarHBondContact O-N 3.06Å; V478-H480 VanDerWaalsContact O-N 3.1Å; H480-S482 PolarHBondContact O-N 3.28Å
481	L	37.2	Very low	38.9	Very low	151 Å²	151	135 Å²	135	79%	0.791	75%	0.754	S	S	*	*			trans	-51.3	131.1	165	-84.1	101.6	0	0	0	109.3	P483	L481-P483 WeakPolarHBondContact O-CD 3.12Å
482	S	37.3	Very low	38.2	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	76%	0.758	S	S	*	*			trans	-61.7	138.2	167.6	-162.9	0	0	0	0	110.2	H480	H480-S482 PolarHBondContact O-N 3.28Å
483	P	37.3	Very low	37.8	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	77%	0.766	S	S	*	*			trans	-114.7	117.7	144.2	21.1	-3.6	0	0	0	109.6	L481	L481-P483 WeakPolarHBondContact O-CD 3.12Å
484	E	31.8	Very low	37.1	Very low	171 Å²	171	135.3 Å²	135.3	80%	0.799	77%	0.772	S	S	*	*			trans	42.4	117.9	139.9	-69.9	178.6	147.7	0	0	119.6	I486	E484-I486 PolarHBondContact O-N 3.29Å
485	R	38.8	Very low	36.2	Very low	243 Å²	243	139.5 Å²	139.5	92%	0.917	78%	0.783	S	S	*	*			trans	-50.4	124	152.1	-74.3	-179.1	-168	-171.2	2.8	109.7
486	I	27.9	Very low	35.7	Very low	148 Å²	148	144.1 Å²	144.1	76%	0.759	80%	0.801	S	S	*	*			trans	-121.8	103.6	150.9	-58.9	179	0	0	0	107.1	E484 V488	E484-I486 PolarHBondContact O-N 3.29Å; I486-V488 HydrophobicContact CG2-CG2 4.33Å
487	T	29.5	Very low	35.2	Very low	127 Å²	127	150.6 Å²	150.6	78%	0.779	82%	0.816	S	S	*	*			trans	-79.6	121.1	157.3	33.4	0	0	0	0	108.7
488	V	26.7	Very low	34.9	Very low	124 Å²	124	154.3 Å²	154.3	75%	0.752	82%	0.822	S	S	*	*			trans	-152.6	124.1	148.5	-173.7	0	0	0	0	109.6	I486	I486-V488 HydrophobicContact CG2-CG2 4.33Å
489	M	32.1	Very low	34.3	Very low	262 Å²	262	158.1 Å²	158.1	100%	1.291	84%	0.835	S	S	*	*			trans	46.3	0	161.1	-68	-175.1	172.2	0	0	121.2

Retrieved 489 of 489 residues in 3339 ms (Link to these results)

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