A0A087YIY3_POEFO Loading...

aromatase

Catalyzes the formation of aromatic C18 estrogens from C19 androgens.

AlphaFold DB , UniProt , Accession A0A087YIY3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 517 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	29.8	Very low	230 Å²	230	137.2 Å²	137.2	100%	1.133	86%	0.857	S	S	*	*				0	94.6	0	-72.6	175.6	165.9	0	0	107.7
2	D	30.1	Very low	29.7	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	85%	0.845	S	S	*	*			cis	-154.2	135.8	-5.1	-87.1	-37.8	0	0	0	108.9
3	S	29.3	Very low	30	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	85%	0.85	S	S	*	*			trans	38.9	118.9	149.2	52.4	0	0	0	0	123.2
4	I	33.6	Very low	30.1	Very low	159 Å²	159	136.6 Å²	136.6	82%	0.815	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-82.4	144.9	156.6	-61.3	162.1	0	0	0	109.3
5	P	31.8	Very low	30	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-95.8	117.8	160.3	27.6	-15.2	0	0	0	111.4
6	S	29.7	Very low	30.2	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-85.5	119.8	167.9	54.1	0	0	0	0	110.6	G8	S6-G8 PolarHBondContact O-N 3.28Å
7	C	28.1	Very low	30.3	Very low	143 Å²	143	138.8 Å²	138.8	97%	0.966	83%	0.834	S	S	*	*			trans	-91	91.7	165.1	-96.6	0	0	0	0	109.7
8	G	27.9	Very low	30.4	Very low	69 Å²	69	137 Å²	137	71%	0.711	83%	0.828	S	S	*	*			trans	-88	112.4	163.7	0	0	0	0	0	109.8	S6 T10	S6-G8 PolarHBondContact O-N 3.28Å; G8-T10 PolarHBondContact O-N 3.12Å
9	G	27.3	Very low	30.5	Very low	82 Å²	82	134.6 Å²	134.6	85%	0.845	83%	0.825	S	S	*	*			trans	-90	92.5	169.2	0	0	0	0	0	110.2
10	T	27.1	Very low	30.6	Very low	136 Å²	136	133.7 Å²	133.7	83%	0.834	82%	0.818	S	S	*	*			trans	-73.2	118.9	164.8	37.3	0	0	0	0	109.5	G8 S12	G8-T10 PolarHBondContact O-N 3.12Å; T10-S12 PolarHBondContact O-N 3.37Å
11	M	29.8	Very low	30.6	Very low	192 Å²	192	132.9 Å²	132.9	95%	0.946	81%	0.814	S	S	*	*			trans	-65.5	112.7	166.3	-73.9	178.2	67.7	0	0	109.1
12	S	28.4	Very low	30.4	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	80%	0.802	S	S	*	*			trans	-78.2	127.6	169.1	52.5	0	0	0	0	110.2	T10 V14	T10-S12 PolarHBondContact O-N 3.37Å; S12-V14 PolarHBondContact O-N 2.69Å
13	N	33.3	Very low	30.3	Very low	169 Å²	169	130.6 Å²	130.6	90%	0.904	81%	0.805	S	S	*	*			trans	-56.9	122.2	165.4	-79.7	-24.7	0	0	0	109.3
14	V	32.2	Very low	30.5	Very low	133 Å²	133	131.5 Å²	131.5	81%	0.806	81%	0.806	S	S	*	*			trans	-90.5	113.3	170.7	177.7	0	0	0	0	107.7	S12	S12-V14 PolarHBondContact O-N 2.69Å
15	D	28.2	Very low	30.8	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	80%	0.8	S	S	*	*			trans	-62.2	125.4	176.1	-133.8	-13.2	0	0	0	110.2	D17	D15-D17 VanDerWaalsContact C-N 3.28Å; D15-D17 PolarHBondContact O-N 3.37Å
16	M	33	Very low	30.7	Very low	173 Å²	173	130.6 Å²	130.6	85%	0.852	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	37.1	-169.9	-150	-178.6	76.7	0	0	112.2
17	D	32.7	Very low	30.8	Very low	139 Å²	139	130.2 Å²	130.2	74%	0.743	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	5.1	-173.2	-88.2	-12.1	0	0	0	114.9	D15	D15-D17 VanDerWaalsContact C-N 3.28Å; D15-D17 PolarHBondContact O-N 3.37Å
18	S	31.6	Very low	31.3	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	79%	0.794	S	S	*	*	S	Bend	trans	-103	1.7	-179.5	62.6	0	0	0	0	115.9
19	A	31.3	Very low	31.6	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	80%	0.802	S	S	*	*	S	Bend	trans	-104	15.2	-177.7	0	0	0	0	0	114.6
20	V	32.7	Very low	31.9	Very low	115 Å²	115	136.5 Å²	136.5	70%	0.697	80%	0.8	S	S	*	*	S	Bend	trans	-107	-9.3	-174.7	179.3	0	0	0	0	113.4
21	T	30.4	Very low	32.2	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	80%	0.802	S	S	*	*	S	Bend	trans	-97.6	-4.2	-171.3	12.5	0	0	0	0	116.7
22	D	29.5	Very low	32.9	Very low	165 Å²	165	131.7 Å²	131.7	88%	0.882	79%	0.79	S	S	*	*	S	Bend	trans	-102.2	13.7	-177.9	-83.2	-16.2	0	0	0	115.2
23	L	29	Very low	33.1	Very low	162 Å²	162	135.9 Å²	135.9	85%	0.848	80%	0.799	S	S	*	*	S	Bend	trans	-110	5.9	178.3	-91.9	157	0	0	0	114.8
24	V	32.7	Very low	33.4	Very low	134 Å²	134	135.8 Å²	135.8	81%	0.812	80%	0.797	S	S	*	*	S	Bend	trans	-114.8	56.1	-179.5	-165	0	0	0	0	111.4
25	S	39.4	Very low	34	Very low	99 Å²	99	134.4 Å²	134.4	69%	0.692	79%	0.793	S	S	*	*			trans	-168.5	97.4	156.2	54.4	0	0	0	0	109.6
26	I	31.3	Very low	35	Very low	167 Å²	167	133.8 Å²	133.8	86%	0.856	80%	0.796	S	S	*	*	S	Bend	trans	-166.9	119.9	145.6	-91.9	142	0	0	0	108.9
27	S	29.8	Very low	36.4	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	78%	0.783	S	S	*	*			trans	56.1	105.2	157.9	67.6	0	0	0	0	120.8
28	L	38.7	Very low	38.2	Very low	165 Å²	165	126.1 Å²	126.1	86%	0.864	77%	0.771	S	S	*	*			trans	-60.6	145.3	140.2	-83.4	106.6	0	0	0	110.4
29	N	35.9	Very low	40.6	Very low	162 Å²	162	125 Å²	125	87%	0.866	76%	0.761	S	S	*	*			trans	98.6	80.3	173.3	-64.3	-13	0	0	0	116.5
30	A	32.6	Very low	42.8	Very low	99 Å²	99	127.4 Å²	127.4	82%	0.818	76%	0.76	S	S	*	*			trans	-144.9	127	144.3	0	0	0	0	0	108.9
31	T	34.1	Very low	44.9	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	76%	0.755	S	S	*	*			trans	-45.2	140.3	178.2	34	0	0	0	0	114.4	H33	T31-H33 PolarHBondContact O-N 3.05Å
32	A	43.3	Very low	47.3	Very low	86 Å²	86	122.3 Å²	122.3	71%	0.711	74%	0.736	S	S	*	*			trans	-53.1	120.4	177.1	0	0	0	0	0	113.3
33	H	33.6	Very low	49.7	Very low	191 Å²	191	121.7 Å²	121.7	88%	0.884	72%	0.722	S	S	*	*			trans	-137.9	101.1	143.2	-94.6	-72.2	0	0	0	107.3	T31 S35	T31-H33 PolarHBondContact O-N 3.05Å; H33-S35 PolarHBondContact O-N 3.49Å
34	L	39.1	Very low	52.2	Low	167 Å²	167	117.8 Å²	117.8	87%	0.874	71%	0.705	S	S	*	*			trans	-63	105.6	170.6	-99.7	81.3	0	0	0	108.5
35	S	45.8	Very low	54.7	Low	104 Å²	104	116.6 Å²	116.6	73%	0.727	69%	0.693	S	S	*	*			trans	-67.8	131.2	153.3	-174.8	0	0	0	0	107.3	H33 G37	H33-S35 PolarHBondContact O-N 3.49Å; S35-G37 PolarHBondContact O-N 3.45Å
36	P	48.9	Very low	56.8	Low	121 Å²	121	116.2 Å²	116.2	79%	0.786	68%	0.682	S	S	*	*			trans	-64.5	106.1	-179.8	25.4	-30.5	0	0	0	108.4	I38	P36-I38 PolarHBondContact O-N 2.98Å
37	G	62.2	Low	59.4	Low	55 Å²	55	113.5 Å²	113.5	57%	0.567	67%	0.669	S	S	*	*			trans	-54.7	138.7	173.4	0	0	0	0	0	109.9	S35 P39	S35-G37 PolarHBondContact O-N 3.45Å; G37-P39 VanDerWaalsContact O-N 3.15Å
38	I	69.9	Low	62.1	Low	96 Å²	96	113.5 Å²	113.5	49%	0.492	66%	0.66	S	S	.	*			trans	-43.5	122	176.9	-63.6	171.9	0	0	0	109.3	P36 T42 R43	P36-I38 PolarHBondContact O-N 2.98Å; I38-T42 HydrophobicContact CG2-CG2 3.73Å; I38-R43 HydrophobicContact CB-CG 4.45Å; I38-R43 HydrophobicContact CG2-CG 4Å; I38-R43 PolarHBondContact O-NE 3.36Å
39	P	82.4	Confident	64.3	Low	83 Å²	83	109.2 Å²	109.2	54%	0.539	64%	0.641	S	S	.	*			trans	-52.7	146.7	-176.2	-26.5	32.4	0	0	0	112.2	G37 A41 T42 R43	G37-P39 VanDerWaalsContact O-N 3.15Å; P39-A41 PolarHBondContact O-N 2.9Å; P39-A41 VanDerWaalsContact O-N 3.15Å; P39-T42 WeakPolarHBondContact O-CA 3.46Å; P39-T42 WeakPolarHBondContact O-CB 3.27Å; P39-T42 PolarHBondContact O-N 2.72Å; P39-R43 PolarHBondContact O-N 3.3Å; P39-R43 VanDerWaalsContact O-N 3.08Å
40	I	77.4	Confident	66.4	Low	142 Å²	142	104.7 Å²	104.7	73%	0.728	62%	0.621	S	S	*	*	H	α-helix	trans	-53.4	-39	179.1	-65	168	0	0	0	110.7	T42 R43 T44	I40-T42 VanDerWaalsContact C-N 3.31Å; I40-T42 PolarHBondContact O-N 2.87Å; I40-R43 PolarHBondContact O-N 3.17Å; I40-T44 HydrophobicContact CG2-CG2 4.47Å; I40-T44 PolarHBondContact O-N 3.03Å; I40-T44 PolarHBondContact O-OG1 3.33Å; I40-T44 VanDerWaalsContact O-OG1 3.04Å
41	A	76.8	Confident	68.6	Low	71 Å²	71	105.1 Å²	105.1	59%	0.587	61%	0.609	S	S	*	*	H	α-helix	trans	-60.2	-35.9	175.4	0	0	0	0	0	113.6	P39 T44 L45	P39-A41 PolarHBondContact O-N 2.9Å; P39-A41 VanDerWaalsContact O-N 3.15Å; A41-T44 WeakPolarHBondContact CA-OG1 2.84Å; A41-T44 PolarHBondContact O-OG1 3.45Å; A41-L45 VanDerWaalsContact O-CB 3.28Å; A41-L45 WeakPolarHBondContact O-CB 3.41Å; A41-L45 PolarHBondContact O-N 3.42Å
42	T	80.1	Confident	70.7	Confident	56 Å²	56	103.5 Å²	103.5	34%	0.344	60%	0.595	S	S	.	*	H	α-helix	trans	-75.7	-37	177.8	-43.1	0	0	0	0	110.7	I38 P39 I40 L45 I46	I38-T42 HydrophobicContact CG2-CG2 3.73Å; P39-T42 WeakPolarHBondContact O-CA 3.46Å; P39-T42 WeakPolarHBondContact O-CB 3.27Å; P39-T42 PolarHBondContact O-N 2.72Å; I40-T42 VanDerWaalsContact C-N 3.31Å; I40-T42 PolarHBondContact O-N 2.87Å; T42-L45 PolarHBondContact O-N 3.3Å; T42-I46 HydrophobicContact CG2-CD1 4.23Å; T42-I46 WeakPolarHBondContact O-CD1 3.16Å; T42-I46 VanDerWaalsContact O-CG1 3.22Å; T42-I46 WeakPolarHBondContact O-CG1 3.4Å; T42-I46 PolarHBondContact O-N 2.99Å
43	R	80.8	Confident	71.9	Confident	151 Å²	151	103.3 Å²	103.3	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-65.5	-43.6	174.3	-67.2	-176.4	-178.2	-170.5	-3.4	111.8	I38 P39 I40 L45 I46 L47	I38-R43 HydrophobicContact CB-CG 4.45Å; I38-R43 HydrophobicContact CG2-CG 4Å; I38-R43 PolarHBondContact O-NE 3.36Å; P39-R43 PolarHBondContact O-N 3.3Å; P39-R43 VanDerWaalsContact O-N 3.08Å; I40-R43 PolarHBondContact O-N 3.17Å; R43-L45 VanDerWaalsContact C-N 3.34Å; R43-I46 PolarHBondContact O-N 2.82Å; R43-L47 WeakPolarHBondContact O-CB 3.47Å; R43-L47 PolarHBondContact O-N 3.29Å
44	T	81.4	Confident	73.6	Confident	80 Å²	80	97.8 Å²	97.8	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-38.1	175.6	49.3	0	0	0	0	111.5	I40 A41 L47 L48	I40-T44 HydrophobicContact CG2-CG2 4.47Å; I40-T44 PolarHBondContact O-N 3.03Å; I40-T44 PolarHBondContact O-OG1 3.33Å; I40-T44 VanDerWaalsContact O-OG1 3.04Å; A41-T44 WeakPolarHBondContact CA-OG1 2.84Å; A41-T44 PolarHBondContact O-OG1 3.45Å; T44-L47 PolarHBondContact O-N 3.05Å; T44-L48 VanDerWaalsContact O-CB 3.22Å; T44-L48 WeakPolarHBondContact O-CB 3.11Å; T44-L48 PolarHBondContact O-N 3.3Å
45	L	84.9	Confident	74.8	Confident	110 Å²	110	92.5 Å²	92.5	58%	0.576	54%	0.544	S	S	*	.	H	α-helix	trans	-63.6	-44.4	174.3	-170.8	71.7	0	0	0	111.7	A41 T42 R43 L48 V49	A41-L45 VanDerWaalsContact O-CB 3.28Å; A41-L45 WeakPolarHBondContact O-CB 3.41Å; A41-L45 PolarHBondContact O-N 3.42Å; T42-L45 PolarHBondContact O-N 3.3Å; R43-L45 VanDerWaalsContact C-N 3.34Å; L45-L48 PolarHBondContact O-N 3.49Å; L45-V49 WeakPolarHBondContact O-CB 3.45Å; L45-V49 VanDerWaalsContact O-CG2 3.24Å; L45-V49 WeakPolarHBondContact O-CG2 3.3Å; L45-V49 PolarHBondContact O-N 3.29Å
46	I	84.1	Confident	75.5	Confident	90 Å²	90	94.9 Å²	94.9	46%	0.462	54%	0.538	S	S	.	.	H	α-helix	trans	-61.6	-46.2	176.2	-69.5	163.8	0	0	0	110.4	T42 R43 L48 V49 C50	T42-I46 HydrophobicContact CG2-CD1 4.23Å; T42-I46 WeakPolarHBondContact O-CD1 3.16Å; T42-I46 VanDerWaalsContact O-CG1 3.22Å; T42-I46 WeakPolarHBondContact O-CG1 3.4Å; T42-I46 PolarHBondContact O-N 2.99Å; R43-I46 PolarHBondContact O-N 2.82Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 2.96Å; I46-V49 PolarHBondContact O-N 2.94Å; I46-C50 WeakPolarHBondContact O-CB 3.39Å; I46-C50 PolarHBondContact O-N 3.37Å; I46-C50 PolarHBondContact O-SG 3.09Å
47	L	85.2	Confident	75.8	Confident	111 Å²	111	92.8 Å²	92.8	58%	0.581	53%	0.526	S	S	*	.	H	α-helix	trans	-61.9	-40.6	177.6	-119.1	150.5	0	0	0	112	R43 T44 C50 L51	R43-L47 WeakPolarHBondContact O-CB 3.47Å; R43-L47 PolarHBondContact O-N 3.29Å; T44-L47 PolarHBondContact O-N 3.05Å; L47-C50 PolarHBondContact O-N 2.89Å; L47-L51 HydrophobicContact CD2-CD1 4.13Å; L47-L51 HydrophobicContact CD2-CG 4.42Å; L47-L51 WeakPolarHBondContact O-CB 3.17Å; L47-L51 VanDerWaalsContact O-CG 3.24Å; L47-L51 WeakPolarHBondContact O-CG 3.28Å; L47-L51 PolarHBondContact O-N 2.97Å
48	L	86.6	Confident	75.3	Confident	104 Å²	104	96.7 Å²	96.7	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-70.7	-37.9	179.1	-158.5	132.3	0	0	0	111.5	T44 L45 I46 L51 L52	T44-L48 VanDerWaalsContact O-CB 3.22Å; T44-L48 WeakPolarHBondContact O-CB 3.11Å; T44-L48 PolarHBondContact O-N 3.3Å; L45-L48 PolarHBondContact O-N 3.49Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 2.96Å; L48-L51 PolarHBondContact O-N 3.34Å; L48-L52 HydrophobicContact CD2-CD1 3.77Å; L48-L52 HydrophobicContact CD2-CG 4.42Å; L48-L52 WeakPolarHBondContact O-CB 3.43Å; L48-L52 VanDerWaalsContact O-CG 3.24Å; L48-L52 WeakPolarHBondContact O-CG 3.14Å; L48-L52 PolarHBondContact O-N 3.01Å
49	V	84.6	Confident	74.3	Confident	74 Å²	74	97.5 Å²	97.5	45%	0.448	54%	0.538	S	S	.	.	H	α-helix	trans	-64.5	-44.7	170.6	170.7	0	0	0	0	110.7	L45 I46 L51 L52 V53	L45-V49 WeakPolarHBondContact O-CB 3.45Å; L45-V49 VanDerWaalsContact O-CG2 3.24Å; L45-V49 WeakPolarHBondContact O-CG2 3.3Å; L45-V49 PolarHBondContact O-N 3.29Å; I46-V49 PolarHBondContact O-N 2.94Å; V49-L51 PolarHBondContact O-N 3.03Å; V49-L52 PolarHBondContact O-N 2.8Å; V49-V53 HydrophobicContact CG1-CG2 4.33Å; V49-V53 WeakPolarHBondContact O-CB 3.22Å; V49-V53 WeakPolarHBondContact O-CG2 3.14Å; V49-V53 PolarHBondContact O-N 3.36Å
50	C	79.9	Confident	72.9	Confident	68 Å²	68	97.5 Å²	97.5	46%	0.459	53%	0.531	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.4	-72	0	0	0	0	111.7	I46 L47 V53 V54	I46-C50 WeakPolarHBondContact O-CB 3.39Å; I46-C50 PolarHBondContact O-N 3.37Å; I46-C50 PolarHBondContact O-SG 3.09Å; L47-C50 PolarHBondContact O-N 2.89Å; C50-V53 PolarHBondContact O-N 3.48Å; C50-V54 WeakPolarHBondContact O-CB 3.41Å; C50-V54 VanDerWaalsContact O-CG2 3.23Å; C50-V54 WeakPolarHBondContact O-CG2 3.32Å; C50-V54 PolarHBondContact O-N 3.39Å
51	L	80.3	Confident	71.6	Confident	107 Å²	107	99.7 Å²	99.7	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-66.8	-38.1	176.7	-74.5	169.1	0	0	0	112.2	L47 L48 V49 V54 A55	L47-L51 HydrophobicContact CD2-CD1 4.13Å; L47-L51 HydrophobicContact CD2-CG 4.42Å; L47-L51 WeakPolarHBondContact O-CB 3.17Å; L47-L51 VanDerWaalsContact O-CG 3.24Å; L47-L51 WeakPolarHBondContact O-CG 3.28Å; L47-L51 PolarHBondContact O-N 2.97Å; L48-L51 PolarHBondContact O-N 3.34Å; V49-L51 PolarHBondContact O-N 3.03Å; L51-V54 PolarHBondContact O-N 3.14Å; L51-A55 VanDerWaalsContact O-CB 3.23Å; L51-A55 WeakPolarHBondContact O-CB 3.45Å; L51-A55 PolarHBondContact O-N 2.73Å
52	L	76.7	Confident	70.8	Confident	107 Å²	107	103.5 Å²	103.5	56%	0.56	55%	0.546	S	S	*	.	H	α-helix	trans	-66.7	-38.8	172.8	-75.8	170.8	0	0	0	111.7	L48 V49 A55 W56	L48-L52 HydrophobicContact CD2-CD1 3.77Å; L48-L52 HydrophobicContact CD2-CG 4.42Å; L48-L52 WeakPolarHBondContact O-CB 3.43Å; L48-L52 VanDerWaalsContact O-CG 3.24Å; L48-L52 WeakPolarHBondContact O-CG 3.14Å; L48-L52 PolarHBondContact O-N 3.01Å; V49-L52 PolarHBondContact O-N 2.8Å; L52-A55 PolarHBondContact O-N 3.17Å; L52-W56 WeakPolarHBondContact O-CB 2.97Å; L52-W56 PolarHBondContact O-N 3.15Å
53	V	69.9	Low	70.8	Confident	82 Å²	82	103.7 Å²	103.7	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-39.5	174.8	169.4	0	0	0	0	111.1	V49 C50 S57	V49-V53 HydrophobicContact CG1-CG2 4.33Å; V49-V53 WeakPolarHBondContact O-CB 3.22Å; V49-V53 WeakPolarHBondContact O-CG2 3.14Å; V49-V53 PolarHBondContact O-N 3.36Å; C50-V53 PolarHBondContact O-N 3.48Å; V53-S57 WeakPolarHBondContact O-CB 3.45Å; V53-S57 PolarHBondContact O-N 3Å; V53-S57 PolarHBondContact O-OG 3Å
54	V	68.5	Low	71.2	Confident	74 Å²	74	97.4 Å²	97.4	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-71.8	-39.6	176.3	171.3	0	0	0	0	111.7	C50 L51 W56 S57 H58	C50-V54 WeakPolarHBondContact O-CB 3.41Å; C50-V54 VanDerWaalsContact O-CG2 3.23Å; C50-V54 WeakPolarHBondContact O-CG2 3.32Å; C50-V54 PolarHBondContact O-N 3.39Å; L51-V54 PolarHBondContact O-N 3.14Å; V54-W56 VanDerWaalsContact C-N 3.34Å; V54-S57 WeakPolarHBondContact CA-OG 3.36Å; V54-S57 PolarHBondContact O-N 3.04Å; V54-S57 PolarHBondContact O-OG 2.76Å; V54-H58 PolarHBondContact O-CD2 2.93Å; V54-H58 PolarHBondContact O-N 2.8Å
55	A	64.4	Low	71.9	Confident	56 Å²	56	95.9 Å²	95.9	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-36.7	175.1	0	0	0	0	0	111.8	L51 L52 H58 T59	L51-A55 VanDerWaalsContact O-CB 3.23Å; L51-A55 WeakPolarHBondContact O-CB 3.45Å; L51-A55 PolarHBondContact O-N 2.73Å; L52-A55 PolarHBondContact O-N 3.17Å; A55-H58 PolarHBondContact O-N 3.37Å; A55-T59 PolarHBondContact O-N 3.41Å; A55-T59 PolarHBondContact O-OG1 3.37Å
56	W	60.3	Low	72.4	Confident	155 Å²	155	91.5 Å²	91.5	59%	0.587	50%	0.499	S	S	*	.	H	α-helix	trans	-70.2	-36.7	174.5	-166.6	22.4	0	0	0	112	L52 V54 H58 T59	L52-W56 WeakPolarHBondContact O-CB 2.97Å; L52-W56 PolarHBondContact O-N 3.15Å; V54-W56 VanDerWaalsContact C-N 3.34Å; W56-H58 VanDerWaalsContact C-N 3.35Å; W56-H58 PolarHBondContact O-N 2.78Å; W56-T59 WeakPolarHBondContact CA-OG1 3.38Å; W56-T59 PolarHBondContact O-OG1 2.83Å; W56-T59 VanDerWaalsContact O-OG1 3.07Å
57	S	56.3	Low	72.9	Confident	76 Å²	76	88 Å²	88	53%	0.531	48%	0.481	S	S	.	.	H	α-helix	trans	-70.1	-28.7	175	71.3	0	0	0	0	113.4	V53 V54	V53-S57 WeakPolarHBondContact O-CB 3.45Å; V53-S57 PolarHBondContact O-N 3Å; V53-S57 PolarHBondContact O-OG 3Å; V54-S57 WeakPolarHBondContact CA-OG 3.36Å; V54-S57 PolarHBondContact O-N 3.04Å; V54-S57 PolarHBondContact O-OG 2.76Å
58	H	50.8	Low	73.1	Confident	137 Å²	137	87.2 Å²	87.2	63%	0.634	49%	0.486	S	S	*	.	H	α-helix	trans	-81.9	-17.9	177.9	-89.4	-66.7	0	0	0	115	V54 A55 W56 E60	V54-H58 PolarHBondContact O-CD2 2.93Å; V54-H58 PolarHBondContact O-N 2.8Å; A55-H58 PolarHBondContact O-N 3.37Å; W56-H58 VanDerWaalsContact C-N 3.35Å; W56-H58 PolarHBondContact O-N 2.78Å; H58-E60 VanDerWaalsContact C-N 3.34Å
59	T	49.7	Very low	73.3	Confident	113 Å²	113	86.8 Å²	86.8	69%	0.693	48%	0.48	S	S	*	.	S	Bend	trans	-82.9	-9.8	177.9	30	0	0	0	0	113.3	A55 W56 K61	A55-T59 PolarHBondContact O-N 3.41Å; A55-T59 PolarHBondContact O-OG1 3.37Å; W56-T59 WeakPolarHBondContact CA-OG1 3.38Å; W56-T59 PolarHBondContact O-OG1 2.83Å; W56-T59 VanDerWaalsContact O-OG1 3.07Å; T59-K61 PolarHBondContact O-N 2.7Å
60	E	52.7	Low	73.5	Confident	84 Å²	84	87.2 Å²	87.2	39%	0.393	49%	0.485	S	S	.	.			trans	-91.9	36.2	-174.1	-85.8	-157.3	171.6	0	0	115.2	H58 N62 T63	H58-E60 VanDerWaalsContact C-N 3.34Å; E60-N62 PolarHBondContact O-N 3.44Å; E60-T63 HydrophobicContact CB-CG2 3.74Å; E60-T63 WeakPolarHBondContact CB-OG1 3.33Å; E60-T63 VanDerWaalsContact CD-CG2 3.43Å; E60-T63 HydrophobicContact CG-CG2 3.46Å; E60-T63 VanDerWaalsContact CG-CG2 3.46Å; E60-T63 PolarHBondContact O-N 2.71Å; E60-T63 PolarHBondContact O-OG1 3.01Å; E60-T63 PolarHBondContact OE2-OG1 3.38Å
61	K	50.4	Low	73.8	Confident	188 Å²	188	91.5 Å²	91.5	82%	0.817	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-7.1	-179.1	-79.2	-174.6	177.8	179.7	0	115.7	T59	T59-K61 PolarHBondContact O-N 2.7Å
62	N	58.3	Low	74.2	Confident	151 Å²	151	87.2 Å²	87.2	81%	0.807	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	13	178.2	-70.6	-18.3	0	0	0	114	E60	E60-N62 PolarHBondContact O-N 3.44Å
63	T	80.7	Confident	74.8	Confident	60 Å²	60	88.8 Å²	88.8	37%	0.368	49%	0.487	S	S	.	.	S	Bend	trans	-86.4	149.3	179.3	63	0	0	0	0	111.6	E60	E60-T63 HydrophobicContact CB-CG2 3.74Å; E60-T63 WeakPolarHBondContact CB-OG1 3.33Å; E60-T63 VanDerWaalsContact CD-CG2 3.43Å; E60-T63 HydrophobicContact CG-CG2 3.46Å; E60-T63 VanDerWaalsContact CG-CG2 3.46Å; E60-T63 PolarHBondContact O-N 2.71Å; E60-T63 PolarHBondContact O-OG1 3.01Å; E60-T63 PolarHBondContact OE2-OG1 3.38Å
64	V	90.4	Very high	75.9	Confident	18 Å²	18	85.2 Å²	85.2	11%	0.109	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-63.9	130	176.6	-177.9	0	0	0	0	108.9	I101 R103 L112 Y397	V64-I101 HydrophobicContact CG1-CG2 3.9Å; V64-R103 HydrophobicContact CB-CB 3.94Å; V64-R103 HydrophobicContact CG1-CB 3.82Å; V64-L112 HydrophobicContact CG1-CD2 4.11Å; V64-L112 HydrophobicContact CG2-CD2 4.33Å; V64-Y397 HydrophobicContact CB-CD1 4.26Å; V64-Y397 HydrophobicContact CG2-CD1 3.54Å; V64-Y397 HydrophobicContact CG2-CE1 4.31Å; V64-Y397 HydrophobicContact CG2-CG 3.79Å
65	P	95	Very high	77.1	Confident	48 Å²	48	82.4 Å²	82.4	31%	0.312	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-54.4	147	177	-26	33.9	0	0	0	112.5	V102 R103	P65-V102 CarbonylContact O-C 3.5Å; P65-V102 VanDerWaalsContact O-CA 3.24Å; P65-V102 WeakPolarHBondContact O-CA 3.48Å; P65-R103 PolarHBondContact O-N 3.37Å
66	G	95.5	Very high	78.6	Confident	19 Å²	19	86.2 Å²	86.2	20%	0.196	46%	0.457	C	S	.	.	S	Bend	trans	163.4	178.8	174.7	0	0	0	0	0	113.8	S68	G66-S68 PolarHBondContact O-N 3.13Å
67	P	94.6	Very high	80.2	Confident	15 Å²	15	84.3 Å²	84.3	10%	0.097	46%	0.458	C	S	.	.	S	Bend	trans	-51.8	138.5	170.5	20.8	-33.4	0	0	0	111.7	Y94 R103 V104 W105	P67-Y94 HydrophobicContact CG-CD1 4.5Å; P67-Y94 HydrophobicContact CG-CE1 3.97Å; P67-R103 WeakPolarHBondContact CD-O 3.37Å; P67-V104 HydrophobicContact CG-CG1 4.41Å; P67-W105 HydrophobicContact CB-CZ3 4.35Å; P67-W105 HydrophobicContact CG-CZ3 3.98Å; P67-W105 VanDerWaalsContact O-CH2 3.29Å; P67-W105 WeakPolarHBondContact O-CH2 3.41Å; P67-W105 VanDerWaalsContact O-CZ3 3.32Å; P67-W105 WeakPolarHBondContact O-CZ3 3.46Å
68	S	90.6	Very high	82.2	Confident	96 Å²	96	80.8 Å²	80.8	67%	0.671	43%	0.433	S	S	*	.			trans	-64.6	145.6	174.9	-49	0	0	0	0	110.9	G66 C70 G74	G66-S68 PolarHBondContact O-N 3.13Å; S68-C70 VanDerWaalsContact C-N 3.33Å; S68-C70 PolarHBondContact O-N 2.77Å; S68-G74 VanDerWaalsContact O-CA 3.3Å; S68-G74 WeakPolarHBondContact O-CA 3.43Å
69	F	89.5	Confident	84.4	Confident	95 Å²	95	75.6 Å²	75.6	42%	0.417	41%	0.408	S	S	.	.			trans	-63.7	-36.6	178.8	179.1	-103.4	0	0	0	112.9	L71 G72 F73 G74 P75 W105	F69-L71 PolarHBondContact O-N 2.67Å; F69-G72 PolarHBondContact O-N 3.18Å; F69-F73 PolarHBondContact O-N 2.86Å; F69-G74 PolarHBondContact O-N 2.78Å; F69-P75 HydrophobicContact CD2-CG 3.61Å; F69-P75 HydrophobicContact CE2-CG 3.62Å; F69-P75 WeakPolarHBondContact O-CD 3.24Å; F69-W105 HydrophobicContact CB-CH2 4.1Å; F69-W105 HydrophobicContact CB-CZ2 4.15Å; F69-W105 HydrophobicContact CD2-CH2 4.37Å; F69-W105 AromaticContact CD2-CZ2 3.79Å; F69-W105 HydrophobicContact CD2-CZ2 3.79Å; F69-W105 HydrophobicContact CG-CZ2 4.47Å
70	C	89.4	Confident	86.6	Confident	83 Å²	83	75.2 Å²	75.2	56%	0.561	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	41.4	63.8	175.7	-163.3	0	0	0	0	113.3	S68 G72 F73	S68-C70 VanDerWaalsContact C-N 3.33Å; S68-C70 PolarHBondContact O-N 2.77Å; C70-G72 PolarHBondContact O-N 2.8Å; C70-F73 HydrophobicContact CB-CB 4.44Å; C70-F73 WeakPolarHBondContact O-CB 3.43Å; C70-F73 VanDerWaalsContact O-CD2 3.32Å; C70-F73 WeakPolarHBondContact O-CD2 3.48Å; C70-F73 PolarHBondContact O-N 3.12Å
71	L	86.7	Confident	88.7	Confident	157 Å²	157	75.3 Å²	75.3	82%	0.822	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	49.8	32.2	179.8	-59.9	174.3	0	0	0	114.7	F69	F69-L71 PolarHBondContact O-N 2.67Å
72	G	87.6	Confident	91	Very high	17 Å²	17	66.4 Å²	66.4	18%	0.175	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	94.4	-12.6	179.9	0	0	0	0	0	115	F69 C70 G74 P75 H76	F69-G72 PolarHBondContact O-N 3.18Å; C70-G72 PolarHBondContact O-N 2.8Å; G72-G74 VanDerWaalsContact C-N 3.33Å; G72-G74 PolarHBondContact O-N 3.27Å; G72-P75 VanDerWaalsContact O-CD 3.29Å; G72-P75 WeakPolarHBondContact O-CD 3.47Å; G72-H76 PolarHBondContact O-CD2 2.87Å; G72-H76 PolarHBondContact O-N 3.26Å
73	F	90.3	Very high	92.8	Very high	141 Å²	141	62 Å²	62	62%	0.618	34%	0.335	S	S	*	.	H	α-helix	trans	-65.6	-35.6	175.7	-72.8	-77.2	0	0	0	112.6	F69 C70 H76 L77	F69-F73 PolarHBondContact O-N 2.86Å; C70-F73 HydrophobicContact CB-CB 4.44Å; C70-F73 WeakPolarHBondContact O-CB 3.43Å; C70-F73 VanDerWaalsContact O-CD2 3.32Å; C70-F73 WeakPolarHBondContact O-CD2 3.48Å; C70-F73 PolarHBondContact O-N 3.12Å; F73-H76 PolarHBondContact O-N 2.98Å; F73-L77 WeakPolarHBondContact O-CG 3.19Å; F73-L77 PolarHBondContact O-N 3.39Å
74	G	92.1	Very high	93.5	Very high	6 Å²	6	69.5 Å²	69.5	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-55.8	-53.9	176.7	0	0	0	0	0	112.9	S68 F69 G72 H76 L77 S78	S68-G74 VanDerWaalsContact O-CA 3.3Å; S68-G74 WeakPolarHBondContact O-CA 3.43Å; F69-G74 PolarHBondContact O-N 2.78Å; G72-G74 VanDerWaalsContact C-N 3.33Å; G72-G74 PolarHBondContact O-N 3.27Å; G74-H76 VanDerWaalsContact C-N 3.32Å; G74-H76 PolarHBondContact O-N 3.4Å; G74-L77 PolarHBondContact O-N 3.44Å; G74-S78 VanDerWaalsContact O-CB 3.29Å; G74-S78 WeakPolarHBondContact O-CB 3.23Å; G74-S78 PolarHBondContact O-N 3.19Å
75	P	94.5	Very high	93.8	Very high	15 Å²	15	71 Å²	71	10%	0.097	37%	0.367	C	S	.	.	H	α-helix	trans	-52.8	-43.8	173.8	-28.8	29.9	0	0	0	114.8	F69 G72 S78 Y79 W105	F69-P75 HydrophobicContact CD2-CG 3.61Å; F69-P75 HydrophobicContact CE2-CG 3.62Å; F69-P75 WeakPolarHBondContact O-CD 3.24Å; G72-P75 VanDerWaalsContact O-CD 3.29Å; G72-P75 WeakPolarHBondContact O-CD 3.47Å; P75-S78 PolarHBondContact O-N 2.87Å; P75-Y79 VanDerWaalsContact O-CB 3.31Å; P75-Y79 WeakPolarHBondContact O-CB 3.45Å; P75-Y79 PolarHBondContact O-N 3.33Å; P75-W105 HydrophobicContact CB-CB 3.82Å; P75-W105 HydrophobicContact CB-CD2 4.04Å; P75-W105 HydrophobicContact CB-CE3 4.38Å; P75-W105 HydrophobicContact CB-CG 3.8Å; P75-W105 HydrophobicContact CG-CB 4.43Å; P75-W105 HydrophobicContact CG-CD2 3.69Å; P75-W105 HydrophobicContact CG-CE3 4.06Å; P75-W105 HydrophobicContact CG-CG 3.85Å; P75-W105 HydrophobicContact CG-CZ2 4.35Å
76	H	94.1	Very high	93.8	Very high	137 Å²	137	69 Å²	69	63%	0.634	36%	0.355	S	S	*	.	H	α-helix	trans	-66.7	-45.5	179.6	-71.1	-62.6	0	0	0	112.5	G72 F73 G74 S78 Y79 L80	G72-H76 PolarHBondContact O-CD2 2.87Å; G72-H76 PolarHBondContact O-N 3.26Å; F73-H76 PolarHBondContact O-N 2.98Å; G74-H76 VanDerWaalsContact C-N 3.32Å; G74-H76 PolarHBondContact O-N 3.4Å; H76-S78 VanDerWaalsContact C-N 3.33Å; H76-S78 PolarHBondContact O-N 2.92Å; H76-Y79 PolarHBondContact O-N 3.22Å; H76-L80 VanDerWaalsContact O-CB 3.28Å; H76-L80 WeakPolarHBondContact O-CB 3.3Å; H76-L80 PolarHBondContact O-N 3.32Å
77	L	95.7	Very high	94	Very high	115 Å²	115	68.2 Å²	68.2	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-64.9	-39.3	177	-69.9	175.4	0	0	0	111.9	F73 G74 R81	F73-L77 WeakPolarHBondContact O-CG 3.19Å; F73-L77 PolarHBondContact O-N 3.39Å; G74-L77 PolarHBondContact O-N 3.44Å; L77-R81 PolarHBondContact O-N 2.83Å; L77-R81 VanDerWaalsContact O-N 3.12Å
78	S	96.6	Very high	94.1	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.007	34%	0.341	C	S	.	.	H	α-helix	trans	-56.2	-56.3	173.8	170.5	0	0	0	0	110.7	G74 P75 H76 L80 R81 F82 Y94 V104 W105	G74-S78 VanDerWaalsContact O-CB 3.29Å; G74-S78 WeakPolarHBondContact O-CB 3.23Å; G74-S78 PolarHBondContact O-N 3.19Å; P75-S78 PolarHBondContact O-N 2.87Å; H76-S78 VanDerWaalsContact C-N 3.33Å; H76-S78 PolarHBondContact O-N 2.92Å; S78-L80 PolarHBondContact O-N 3.24Å; S78-R81 WeakPolarHBondContact O-CB 2.89Å; S78-R81 PolarHBondContact O-N 2.71Å; S78-F82 VanDerWaalsContact O-CD2 3.28Å; S78-F82 WeakPolarHBondContact O-CD2 3.48Å; S78-F82 PolarHBondContact O-N 3.11Å; S78-Y94 WeakPolarHBondContact CA-OH 3.45Å; S78-V104 WeakPolarHBondContact OG-CB 3.29Å; S78-W105 PolarHBondContact OG-N 2.73Å; S78-W105 PolarHBondContact OG-O 2.9Å
79	Y	97.1	Very high	94.4	Very high	29 Å²	29	65.7 Å²	65.7	11%	0.114	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-40.6	-176.7	-177.6	-144.9	0	0	0	112.7	P75 H76 R81 F82 I83 W105 I106 N107 I242 P244	P75-Y79 VanDerWaalsContact O-CB 3.31Å; P75-Y79 WeakPolarHBondContact O-CB 3.45Å; P75-Y79 PolarHBondContact O-N 3.33Å; H76-Y79 PolarHBondContact O-N 3.22Å; Y79-R81 VanDerWaalsContact C-N 3.26Å; Y79-R81 PolarHBondContact O-N 2.78Å; Y79-F82 WeakPolarHBondContact O-CB 3.39Å; Y79-F82 PolarHBondContact O-N 3.38Å; Y79-F82 VanDerWaalsContact O-N 3.11Å; Y79-I83 HydrophobicContact CD2-CG1 4.09Å; Y79-I83 HydrophobicContact CE2-CD1 3.82Å; Y79-I83 HydrophobicContact CE2-CG1 3.84Å; Y79-I83 WeakPolarHBondContact O-CG1 3.42Å; Y79-I83 PolarHBondContact O-N 3.39Å; Y79-W105 PolarHBondContact N-O 3.27Å; Y79-I106 HydrophobicContact CD2-CG2 4.03Å; Y79-I106 HydrophobicContact CE2-CG2 3.99Å; Y79-N107 HydrophobicContact CE1-CB 4.25Å; Y79-N107 HydrophobicContact CE2-CB 4.23Å; Y79-I242 WeakPolarHBondContact CE2-O 3.23Å; Y79-I242 PolarHBondContact OH-O 3.45Å; Y79-P244 HydrophobicContact CE1-CB 4.27Å; Y79-P244 HydrophobicContact CE1-CG 4.5Å; Y79-P244 WeakPolarHBondContact OH-CA 3.2Å; Y79-P244 WeakPolarHBondContact OH-CB 3.35Å; Y79-P244 WeakPolarHBondContact OH-CD 3.17Å
80	L	96.8	Very high	94.9	Very high	105 Å²	105	61.1 Å²	61.1	55%	0.55	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-39.5	175.7	-178.1	63.1	0	0	0	111.5	H76 S78 I83 W84	H76-L80 VanDerWaalsContact O-CB 3.28Å; H76-L80 WeakPolarHBondContact O-CB 3.3Å; H76-L80 PolarHBondContact O-N 3.32Å; S78-L80 PolarHBondContact O-N 3.24Å; L80-I83 PolarHBondContact O-N 3.13Å; L80-W84 VanDerWaalsContact O-CB 3.32Å; L80-W84 WeakPolarHBondContact O-CB 2.74Å; L80-W84 PolarHBondContact O-N 2.78Å
81	R	97.6	Very high	95.3	Very high	86 Å²	86	57.2 Å²	57.2	33%	0.325	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-46.1	174.6	178	167.8	-80.6	133.7	-6.5	111.6	L77 S78 Y79 I83 W84 T85 A90 Y93 Y94	L77-R81 PolarHBondContact O-N 2.83Å; L77-R81 VanDerWaalsContact O-N 3.12Å; S78-R81 WeakPolarHBondContact O-CB 2.89Å; S78-R81 PolarHBondContact O-N 2.71Å; Y79-R81 VanDerWaalsContact C-N 3.26Å; Y79-R81 PolarHBondContact O-N 2.78Å; R81-I83 VanDerWaalsContact C-N 3.28Å; R81-I83 PolarHBondContact O-N 2.85Å; R81-W84 PolarHBondContact O-N 3.36Å; R81-T85 HydrophobicContact CG-CG2 4.3Å; R81-T85 PolarHBondContact O-N 3.26Å; R81-T85 PolarHBondContact O-OG1 2.85Å; R81-A90 HydrophobicContact CG-CB 4.12Å; R81-Y93 VanDerWaalsContact NH1-CZ 3.28Å; R81-Y93 PolarHBondContact NH1-OH 3.33Å; R81-Y93 PolarHBondContact NH2-OH 2.97Å; R81-Y94 HydrophobicContact CG-CE2 4.44Å; R81-Y94 PolarHBondContact NH1-OH 3.14Å
82	F	97.7	Very high	95.8	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-41.3	175.6	-81.5	-81.7	0	0	0	112.5	S78 Y79 G86 I87 A90 Y94 V104 I106 I113 I242 I406	S78-F82 VanDerWaalsContact O-CD2 3.28Å; S78-F82 WeakPolarHBondContact O-CD2 3.48Å; S78-F82 PolarHBondContact O-N 3.11Å; Y79-F82 WeakPolarHBondContact O-CB 3.39Å; Y79-F82 PolarHBondContact O-N 3.38Å; Y79-F82 VanDerWaalsContact O-N 3.11Å; F82-G86 WeakPolarHBondContact O-CA 3.4Å; F82-G86 PolarHBondContact O-N 3.12Å; F82-G86 VanDerWaalsContact O-N 3.14Å; F82-I87 HydrophobicContact CD1-CB 4.42Å; F82-I87 HydrophobicContact CD1-CG1 4.4Å; F82-I87 HydrophobicContact CD1-CG2 4.33Å; F82-I87 HydrophobicContact CE1-CG2 4.22Å; F82-A90 HydrophobicContact CD1-CB 3.6Å; F82-A90 HydrophobicContact CD2-CB 4.35Å; F82-A90 HydrophobicContact CE1-CB 3.66Å; F82-A90 HydrophobicContact CE2-CB 4.4Å; F82-A90 HydrophobicContact CG-CB 3.94Å; F82-A90 HydrophobicContact CZ-CB 4.07Å; F82-Y94 HydrophobicContact CD2-CE2 4.45Å; F82-Y94 HydrophobicContact CE2-CD2 4.1Å; F82-Y94 AromaticContact CE2-CE2 3.83Å; F82-Y94 HydrophobicContact CE2-CE2 3.83Å; F82-Y94 HydrophobicContact CZ-CD2 4.21Å; F82-Y94 HydrophobicContact CZ-CE2 4.36Å; F82-V104 HydrophobicContact CE2-CB 4.21Å; F82-V104 HydrophobicContact CE2-CG2 3.76Å; F82-V104 HydrophobicContact CZ-CG2 3.96Å; F82-I106 HydrophobicContact CD1-CD1 4.02Å; F82-I106 HydrophobicContact CD2-CD1 4.19Å; F82-I106 HydrophobicContact CD2-CG1 3.87Å; F82-I106 HydrophobicContact CE1-CD1 3.96Å; F82-I106 HydrophobicContact CE2-CD1 4.14Å; F82-I106 HydrophobicContact CE2-CG1 3.98Å; F82-I106 HydrophobicContact CG-CD1 4.16Å; F82-I106 HydrophobicContact CG-CG1 4.19Å; F82-I106 HydrophobicContact CZ-CD1 4.02Å; F82-I106 HydrophobicContact CZ-CG1 4.38Å; F82-I113 HydrophobicContact CZ-CD1 3.84Å; F82-I242 HydrophobicContact CB-CD1 3.92Å; F82-I406 HydrophobicContact CE1-CD1 4Å; F82-I406 HydrophobicContact CZ-CD1 4.34Å
83	I	96.1	Very high	96.3	Very high	58 Å²	58	55.1 Å²	55.1	30%	0.297	26%	0.26	S	S	.	.	H	α-helix	trans	-69.1	-35.9	178.1	-63.8	-63.3	0	0	0	112.2	Y79 L80 R81 I242 K243	Y79-I83 HydrophobicContact CD2-CG1 4.09Å; Y79-I83 HydrophobicContact CE2-CD1 3.82Å; Y79-I83 HydrophobicContact CE2-CG1 3.84Å; Y79-I83 WeakPolarHBondContact O-CG1 3.42Å; Y79-I83 PolarHBondContact O-N 3.39Å; L80-I83 PolarHBondContact O-N 3.13Å; R81-I83 VanDerWaalsContact C-N 3.28Å; R81-I83 PolarHBondContact O-N 2.85Å; I83-I242 HydrophobicContact CD1-CD1 3.93Å; I83-I242 HydrophobicContact CD1-CG1 3.99Å; I83-K243 HydrophobicContact CD1-CD 4.29Å
84	W	95.6	Very high	96.7	Very high	217 Å²	217	48.6 Å²	48.6	82%	0.822	23%	0.231	S	C	*	.	H	α-helix	trans	-83.4	-43.1	-175.1	-173.1	-84.8	0	0	0	113.5	L80 R81	L80-W84 VanDerWaalsContact O-CB 3.32Å; L80-W84 WeakPolarHBondContact O-CB 2.74Å; L80-W84 PolarHBondContact O-N 2.78Å; R81-W84 PolarHBondContact O-N 3.36Å
85	T	96	Very high	97	Very high	51 Å²	51	48.3 Å²	48.3	31%	0.313	23%	0.228	S	C	.	.	H	α-helix	trans	-100.5	-13.7	-173.5	64.1	0	0	0	0	113.6	R81 T89	R81-T85 HydrophobicContact CG-CG2 4.3Å; R81-T85 PolarHBondContact O-N 3.26Å; R81-T85 PolarHBondContact O-OG1 2.85Å; T85-T89 VanDerWaalsContact O-CB 3.3Å; T85-T89 WeakPolarHBondContact O-CB 3.34Å; T85-T89 PolarHBondContact O-OG1 3.26Å
86	G	96.6	Very high	97.1	Very high	6 Å²	6	55.9 Å²	55.9	6%	0.062	26%	0.259	C	S	.	.			trans	86.8	161	-171	0	0	0	0	0	113.7	F82 A90 N487	F82-G86 WeakPolarHBondContact O-CA 3.4Å; F82-G86 PolarHBondContact O-N 3.12Å; F82-G86 VanDerWaalsContact O-N 3.14Å; G86-A90 WeakPolarHBondContact O-CB 3.46Å; G86-A90 PolarHBondContact O-N 3.12Å; G86-N487 VanDerWaalsContact CA-OD1 3.22Å; G86-N487 WeakPolarHBondContact CA-OD1 3.14Å
87	I	97.9	Very high	97.2	Very high	1 Å²	1	55 Å²	55	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-50.5	-168.6	-57.4	168.1	0	0	0	112.6	F82 A90 S91 L241 I242 F383 I406 N487	F82-I87 HydrophobicContact CD1-CB 4.42Å; F82-I87 HydrophobicContact CD1-CG1 4.4Å; F82-I87 HydrophobicContact CD1-CG2 4.33Å; F82-I87 HydrophobicContact CE1-CG2 4.22Å; I87-A90 PolarHBondContact O-N 3.45Å; I87-S91 VanDerWaalsContact O-CB 3.32Å; I87-S91 WeakPolarHBondContact O-CB 3.46Å; I87-S91 PolarHBondContact O-N 3.26Å; I87-S91 PolarHBondContact O-OG 3.15Å; I87-L241 HydrophobicContact CD1-CD2 4.21Å; I87-I242 HydrophobicContact CD1-CD1 4.27Å; I87-I242 HydrophobicContact CD1-CG1 4.48Å; I87-I242 HydrophobicContact CD1-CG2 4.03Å; I87-I242 HydrophobicContact CG1-CD1 3.94Å; I87-F383 HydrophobicContact CB-CE1 4.09Å; I87-F383 HydrophobicContact CB-CE2 4.41Å; I87-F383 HydrophobicContact CB-CZ 3.69Å; I87-F383 HydrophobicContact CD1-CZ 4.45Å; I87-F383 HydrophobicContact CG2-CD2 4.37Å; I87-F383 HydrophobicContact CG2-CE1 3.89Å; I87-F383 HydrophobicContact CG2-CE2 3.65Å; I87-F383 HydrophobicContact CG2-CZ 3.39Å; I87-I406 HydrophobicContact CG2-CD1 3.97Å; I87-N487 WeakPolarHBondContact CB-O 3.47Å; I87-N487 PolarHBondContact N-O 3.06Å; I87-N487 PolarHBondContact N-OD1 3.37Å
88	G	97.5	Very high	97.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-46.4	-179.7	0	0	0	0	0	112.3	A90 S91 N92 N486 N487	G88-A90 PolarHBondContact O-N 2.76Å; G88-S91 WeakPolarHBondContact O-CB 3.38Å; G88-S91 PolarHBondContact O-N 2.84Å; G88-S91 VanDerWaalsContact O-N 3.17Å; G88-N92 PolarHBondContact O-N 2.99Å; G88-N92 PolarHBondContact O-ND2 3.16Å; G88-N486 WeakPolarHBondContact CA-OD1 3.39Å; G88-N487 PolarHBondContact N-O 3.32Å
89	T	97.8	Very high	97.2	Very high	57 Å²	57	54.1 Å²	54.1	35%	0.35	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-46.5	176.1	-55.7	0	0	0	0	112.4	T85 S91 N92 Y93 N486	T85-T89 VanDerWaalsContact O-CB 3.3Å; T85-T89 WeakPolarHBondContact O-CB 3.34Å; T85-T89 PolarHBondContact O-OG1 3.26Å; T89-S91 VanDerWaalsContact C-N 3.32Å; T89-S91 PolarHBondContact O-N 2.77Å; T89-N92 PolarHBondContact O-N 3.2Å; T89-Y93 PolarHBondContact O-N 2.97Å; T89-N486 PolarHBondContact N-O 3.37Å; T89-N486 PolarHBondContact OG1-O 3.4Å
90	A	98.3	Very high	97.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-39.9	176.8	0	0	0	0	0	111.7	R81 F82 G86 I87 G88 Y93 Y94	R81-A90 HydrophobicContact CG-CB 4.12Å; F82-A90 HydrophobicContact CD1-CB 3.6Å; F82-A90 HydrophobicContact CD2-CB 4.35Å; F82-A90 HydrophobicContact CE1-CB 3.66Å; F82-A90 HydrophobicContact CE2-CB 4.4Å; F82-A90 HydrophobicContact CG-CB 3.94Å; F82-A90 HydrophobicContact CZ-CB 4.07Å; G86-A90 WeakPolarHBondContact O-CB 3.46Å; G86-A90 PolarHBondContact O-N 3.12Å; I87-A90 PolarHBondContact O-N 3.45Å; G88-A90 PolarHBondContact O-N 2.76Å; A90-Y93 WeakPolarHBondContact O-CB 3.37Å; A90-Y93 PolarHBondContact O-N 2.91Å; A90-Y94 WeakPolarHBondContact O-CD2 3.46Å; A90-Y94 PolarHBondContact O-N 3.18Å
91	S	98.4	Very high	97.2	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-44.3	178.4	-59.4	0	0	0	0	111.8	I87 G88 T89 Y94 N95	I87-S91 VanDerWaalsContact O-CB 3.32Å; I87-S91 WeakPolarHBondContact O-CB 3.46Å; I87-S91 PolarHBondContact O-N 3.26Å; I87-S91 PolarHBondContact O-OG 3.15Å; G88-S91 WeakPolarHBondContact O-CB 3.38Å; G88-S91 PolarHBondContact O-N 2.84Å; G88-S91 VanDerWaalsContact O-N 3.17Å; T89-S91 VanDerWaalsContact C-N 3.32Å; T89-S91 PolarHBondContact O-N 2.77Å; S91-Y94 PolarHBondContact O-N 3.09Å; S91-N95 PolarHBondContact O-N 3.49Å; S91-N95 PolarHBondContact O-OD1 2.85Å
92	N	97.8	Very high	97.2	Very high	50 Å²	50	46 Å²	46	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-62.5	-41.7	174.3	-75.6	-39.4	0	0	0	112.2	G88 T89 Y94 K96 N408	G88-N92 PolarHBondContact O-N 2.99Å; G88-N92 PolarHBondContact O-ND2 3.16Å; T89-N92 PolarHBondContact O-N 3.2Å; N92-Y94 PolarHBondContact O-N 3.48Å; N92-K96 VanDerWaalsContact O-CB 3.24Å; N92-K96 WeakPolarHBondContact O-CB 3.37Å; N92-K96 PolarHBondContact O-N 2.88Å; N92-N408 PolarHBondContact OD1-ND2 3.26Å
93	Y	98.3	Very high	97.3	Very high	81 Å²	81	47.9 Å²	47.9	32%	0.318	23%	0.225	S	C	.	.	H	α-helix	trans	-57.2	-50.4	174.1	171	-87.6	0	0	0	111.8	R81 T89 A90 K96 K97	R81-Y93 VanDerWaalsContact NH1-CZ 3.28Å; R81-Y93 PolarHBondContact NH1-OH 3.33Å; R81-Y93 PolarHBondContact NH2-OH 2.97Å; T89-Y93 PolarHBondContact O-N 2.97Å; A90-Y93 WeakPolarHBondContact O-CB 3.37Å; A90-Y93 PolarHBondContact O-N 2.91Å; Y93-K96 PolarHBondContact O-N 3.44Å; Y93-K97 HydrophobicContact CE1-CD 4.01Å; Y93-K97 WeakPolarHBondContact O-CB 3.34Å; Y93-K97 PolarHBondContact O-N 2.92Å; Y93-K97 WeakPolarHBondContact OH-CD 3.47Å; Y93-K97 PolarHBondContact OH-NZ 3.23Å
94	Y	98.4	Very high	97.4	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-67.6	-43.3	-176.8	-79.2	-63.6	0	0	0	112	P67 S78 R81 F82 A90 S91 N92 K96 K97 Y98 V104 I113	P67-Y94 HydrophobicContact CG-CD1 4.5Å; P67-Y94 HydrophobicContact CG-CE1 3.97Å; S78-Y94 WeakPolarHBondContact CA-OH 3.45Å; R81-Y94 HydrophobicContact CG-CE2 4.44Å; R81-Y94 PolarHBondContact NH1-OH 3.14Å; F82-Y94 HydrophobicContact CD2-CE2 4.45Å; F82-Y94 HydrophobicContact CE2-CD2 4.1Å; F82-Y94 AromaticContact CE2-CE2 3.83Å; F82-Y94 HydrophobicContact CE2-CE2 3.83Å; F82-Y94 HydrophobicContact CZ-CD2 4.21Å; F82-Y94 HydrophobicContact CZ-CE2 4.36Å; A90-Y94 WeakPolarHBondContact O-CD2 3.46Å; A90-Y94 PolarHBondContact O-N 3.18Å; S91-Y94 PolarHBondContact O-N 3.09Å; N92-Y94 PolarHBondContact O-N 3.48Å; Y94-K96 PolarHBondContact O-N 3.17Å; Y94-K97 PolarHBondContact O-N 3.41Å; Y94-Y98 AromaticContact CD1-CD2 3.87Å; Y94-Y98 HydrophobicContact CD1-CD2 3.87Å; Y94-Y98 AromaticContact CD1-CE2 3.66Å; Y94-Y98 HydrophobicContact CD1-CE2 3.66Å; Y94-Y98 HydrophobicContact CE1-CE2 4.05Å; Y94-Y98 PolarHBondContact O-N 2.95Å; Y94-V104 HydrophobicContact CD1-CG1 3.8Å; Y94-V104 HydrophobicContact CD2-CG1 3.75Å; Y94-V104 HydrophobicContact CE1-CG1 4.14Å; Y94-V104 HydrophobicContact CE2-CG1 4.08Å; Y94-V104 HydrophobicContact CG-CG1 3.65Å; Y94-I113 HydrophobicContact CD2-CD1 4.13Å; Y94-I113 HydrophobicContact CG-CD1 4.32Å
95	N	97.6	Very high	97.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-37.8	176.1	-72.7	136.1	0	0	0	112.6	S91 K97 G99 D100 I113 N408	S91-N95 PolarHBondContact O-N 3.49Å; S91-N95 PolarHBondContact O-OD1 2.85Å; N95-K97 VanDerWaalsContact C-N 3.28Å; N95-K97 PolarHBondContact O-N 3.35Å; N95-G99 CarbonylContact C-O 3.57Å; N95-G99 WeakPolarHBondContact CA-O 3.29Å; N95-G99 PolarHBondContact ND2-O 3.46Å; N95-G99 CarbonylContact O-C 3.49Å; N95-G99 WeakPolarHBondContact O-CA 3.43Å; N95-G99 PolarHBondContact O-N 2.83Å; N95-D100 PolarHBondContact ND2-O 3.35Å; N95-I113 PolarHBondContact ND2-O 3.44Å; N95-I113 WeakPolarHBondContact OD1-CG2 3.3Å; N95-N408 PolarHBondContact OD1-ND2 2.88Å; N95-N408 VanDerWaalsContact OD1-ND2 3.09Å
96	K	96.8	Very high	97.5	Very high	173 Å²	173	33.3 Å²	33.3	75%	0.752	16%	0.16	S	C	*	.	H	α-helix	trans	-63.4	-35.2	175	-174.4	174	-178.5	175	0	112	N92 Y93 Y94	N92-K96 VanDerWaalsContact O-CB 3.24Å; N92-K96 WeakPolarHBondContact O-CB 3.37Å; N92-K96 PolarHBondContact O-N 2.88Å; Y93-K96 PolarHBondContact O-N 3.44Å; Y94-K96 PolarHBondContact O-N 3.17Å
97	K	97.4	Very high	97.2	Very high	119 Å²	119	36.1 Å²	36.1	52%	0.517	17%	0.174	S	C	.	.	H	α-helix	trans	-84.4	-38.9	-175.8	-175.2	169.1	179.3	179.4	0	114.2	Y93 Y94 N95	Y93-K97 HydrophobicContact CE1-CD 4.01Å; Y93-K97 WeakPolarHBondContact O-CB 3.34Å; Y93-K97 PolarHBondContact O-N 2.92Å; Y93-K97 WeakPolarHBondContact OH-CD 3.47Å; Y93-K97 PolarHBondContact OH-NZ 3.23Å; Y94-K97 PolarHBondContact O-N 3.41Å; N95-K97 VanDerWaalsContact C-N 3.28Å; N95-K97 PolarHBondContact O-N 3.35Å
98	Y	96.6	Very high	96.8	Very high	68 Å²	68	38.9 Å²	38.9	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-117.5	-2.7	-170.2	-59.8	-81.4	0	0	0	114.1	Y94 V102	Y94-Y98 AromaticContact CD1-CD2 3.87Å; Y94-Y98 HydrophobicContact CD1-CD2 3.87Å; Y94-Y98 AromaticContact CD1-CE2 3.66Å; Y94-Y98 HydrophobicContact CD1-CE2 3.66Å; Y94-Y98 HydrophobicContact CE1-CE2 4.05Å; Y94-Y98 PolarHBondContact O-N 2.95Å; Y98-V102 HydrophobicContact CD2-CG1 4.02Å; Y98-V102 HydrophobicContact CG-CG1 4.15Å
99	G	95.6	Very high	96.7	Very high	30 Å²	30	42.4 Å²	42.4	31%	0.309	22%	0.219	S	C	.	.			trans	101.8	-168.1	179.5	0	0	0	0	0	113.8	N95 I101 V102	N95-G99 CarbonylContact C-O 3.57Å; N95-G99 WeakPolarHBondContact CA-O 3.29Å; N95-G99 PolarHBondContact ND2-O 3.46Å; N95-G99 CarbonylContact O-C 3.49Å; N95-G99 WeakPolarHBondContact O-CA 3.43Å; N95-G99 PolarHBondContact O-N 2.83Å; G99-I101 PolarHBondContact O-N 3.34Å; G99-V102 WeakPolarHBondContact O-CG2 3.5Å
100	D	96.4	Very high	96.6	Very high	41 Å²	41	43 Å²	43	22%	0.219	22%	0.218	C	C	.	.	S	Bend	trans	-81	-14.3	-165.8	-52.4	-39.7	0	0	0	114.8	N95 L114 S115 R116 R411	N95-D100 PolarHBondContact ND2-O 3.35Å; D100-L114 CarbonylContact O-C 3.55Å; D100-L114 WeakPolarHBondContact O-CA 3.28Å; D100-S115 VanDerWaalsContact CA-OG 3.3Å; D100-S115 WeakPolarHBondContact CA-OG 3.26Å; D100-S115 PolarHBondContact O-N 2.87Å; D100-S115 PolarHBondContact O-OG 3.45Å; D100-R116 HydrophobicContact CB-CB 3.84Å; D100-R411 IonicContact OD1-NE 3.7Å
101	I	97.4	Very high	96.6	Very high	7 Å²	7	43 Å²	43	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	111.7	177.3	-59.9	-179.1	0	0	0	106.8	V64 G99 I113 L114 R116 A119 D395 Y397	V64-I101 HydrophobicContact CG1-CG2 3.9Å; G99-I101 PolarHBondContact O-N 3.34Å; I101-I113 WeakPolarHBondContact CA-O 3.4Å; I101-L114 HydrophobicContact CB-CD2 4.2Å; I101-L114 HydrophobicContact CG1-CD2 4.09Å; I101-L114 HydrophobicContact CG2-CD2 3.67Å; I101-R116 HydrophobicContact CG1-CB 4.45Å; I101-A119 HydrophobicContact CD1-CB 4.12Å; I101-D395 HydrophobicContact CD1-CB 3.94Å; I101-Y397 HydrophobicContact CB-CE2 4.46Å; I101-Y397 HydrophobicContact CD1-CD2 4.1Å; I101-Y397 HydrophobicContact CD1-CE2 3.98Å; I101-Y397 HydrophobicContact CG2-CD2 4.05Å; I101-Y397 HydrophobicContact CG2-CE2 4.16Å
102	V	97.9	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.5	-171.7	-172.2	0	0	0	0	111.3	P65 Y98 G99 V104 L112 I113	P65-V102 CarbonylContact O-C 3.5Å; P65-V102 VanDerWaalsContact O-CA 3.24Å; P65-V102 WeakPolarHBondContact O-CA 3.48Å; Y98-V102 HydrophobicContact CD2-CG1 4.02Å; Y98-V102 HydrophobicContact CG-CG1 4.15Å; G99-V102 WeakPolarHBondContact O-CG2 3.5Å; V102-V104 HydrophobicContact CG1-CG1 4.19Å; V102-L112 CarbonylContact O-C 3.59Å; V102-L112 VanDerWaalsContact O-CA 3.32Å; V102-L112 WeakPolarHBondContact O-CA 3.18Å; V102-I113 PolarHBondContact N-O 3.38Å; V102-I113 PolarHBondContact O-N 3.29Å
103	R	97.9	Very high	96.6	Very high	42 Å²	42	40.8 Å²	40.8	16%	0.158	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.6	171.5	-176.3	-77.8	-53.8	-91.6	-1.5	110.5	V64 P65 P67 W105 E110 L112	V64-R103 HydrophobicContact CB-CB 3.94Å; V64-R103 HydrophobicContact CG1-CB 3.82Å; P65-R103 PolarHBondContact O-N 3.37Å; P67-R103 WeakPolarHBondContact CD-O 3.37Å; R103-W105 VanDerWaalsContact NE-CZ2 3.3Å; R103-E110 HydrophobicContact CG-CG 3.64Å; R103-L112 HydrophobicContact CB-CD2 3.88Å; R103-L112 HydrophobicContact CG-CD2 4.1Å
104	V	98.2	Very high	96.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	-179.2	172.6	-59.6	0	0	0	0	110.3	P67 S78 F82 Y94 V102 T111 I113	P67-V104 HydrophobicContact CG-CG1 4.41Å; S78-V104 WeakPolarHBondContact OG-CB 3.29Å; F82-V104 HydrophobicContact CE2-CB 4.21Å; F82-V104 HydrophobicContact CE2-CG2 3.76Å; F82-V104 HydrophobicContact CZ-CG2 3.96Å; Y94-V104 HydrophobicContact CD1-CG1 3.8Å; Y94-V104 HydrophobicContact CD2-CG1 3.75Å; Y94-V104 HydrophobicContact CE1-CG1 4.14Å; Y94-V104 HydrophobicContact CE2-CG1 4.08Å; Y94-V104 HydrophobicContact CG-CG1 3.65Å; V102-V104 HydrophobicContact CG1-CG1 4.19Å; V104-T111 HydrophobicContact CG2-CG2 4.31Å; V104-T111 WeakPolarHBondContact CG2-O 3.38Å; V104-T111 PolarHBondContact N-O 3.46Å; V104-T111 PolarHBondContact O-N 3.33Å; V104-I113 HydrophobicContact CG1-CD1 3.94Å; V104-I113 HydrophobicContact CG1-CG1 4.43Å; V104-I113 HydrophobicContact CG2-CD1 3.86Å; V104-I113 HydrophobicContact CG2-CG1 3.89Å
105	W	97.8	Very high	96.6	Very high	14 Å²	14	36.8 Å²	36.8	5%	0.053	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.4	171.3	-57.3	-98.1	0	0	0	111.2	P67 F69 P75 S78 Y79 R103 E109	P67-W105 HydrophobicContact CB-CZ3 4.35Å; P67-W105 HydrophobicContact CG-CZ3 3.98Å; P67-W105 VanDerWaalsContact O-CH2 3.29Å; P67-W105 WeakPolarHBondContact O-CH2 3.41Å; P67-W105 VanDerWaalsContact O-CZ3 3.32Å; P67-W105 WeakPolarHBondContact O-CZ3 3.46Å; F69-W105 HydrophobicContact CB-CH2 4.1Å; F69-W105 HydrophobicContact CB-CZ2 4.15Å; F69-W105 HydrophobicContact CD2-CH2 4.37Å; F69-W105 AromaticContact CD2-CZ2 3.79Å; F69-W105 HydrophobicContact CD2-CZ2 3.79Å; F69-W105 HydrophobicContact CG-CZ2 4.47Å; P75-W105 HydrophobicContact CB-CB 3.82Å; P75-W105 HydrophobicContact CB-CD2 4.04Å; P75-W105 HydrophobicContact CB-CE3 4.38Å; P75-W105 HydrophobicContact CB-CG 3.8Å; P75-W105 HydrophobicContact CG-CB 4.43Å; P75-W105 HydrophobicContact CG-CD2 3.69Å; P75-W105 HydrophobicContact CG-CE3 4.06Å; P75-W105 HydrophobicContact CG-CG 3.85Å; P75-W105 HydrophobicContact CG-CZ2 4.35Å; S78-W105 PolarHBondContact OG-N 2.73Å; S78-W105 PolarHBondContact OG-O 2.9Å; Y79-W105 PolarHBondContact N-O 3.27Å; R103-W105 VanDerWaalsContact NE-CZ2 3.3Å; W105-E109 WeakPolarHBondContact CA-O 3.47Å
106	I	96.8	Very high	96.6	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.7	173.4	-60.5	179.7	0	0	0	106.6	Y79 F82 G108 E109 T111 F133 I242 I406	Y79-I106 HydrophobicContact CD2-CG2 4.03Å; Y79-I106 HydrophobicContact CE2-CG2 3.99Å; F82-I106 HydrophobicContact CD1-CD1 4.02Å; F82-I106 HydrophobicContact CD2-CD1 4.19Å; F82-I106 HydrophobicContact CD2-CG1 3.87Å; F82-I106 HydrophobicContact CE1-CD1 3.96Å; F82-I106 HydrophobicContact CE2-CD1 4.14Å; F82-I106 HydrophobicContact CE2-CG1 3.98Å; F82-I106 HydrophobicContact CG-CD1 4.16Å; F82-I106 HydrophobicContact CG-CG1 4.19Å; F82-I106 HydrophobicContact CZ-CD1 4.02Å; F82-I106 HydrophobicContact CZ-CG1 4.38Å; I106-G108 PolarHBondContact O-N 3.42Å; I106-E109 PolarHBondContact N-O 2.91Å; I106-E109 PolarHBondContact O-N 3.32Å; I106-T111 HydrophobicContact CD1-CG2 4.07Å; I106-F133 HydrophobicContact CD1-CE2 4.24Å; I106-F133 HydrophobicContact CD1-CZ 4.34Å; I106-I242 HydrophobicContact CG2-CB 4.15Å; I106-I242 HydrophobicContact CG2-CG2 4.24Å; I106-I406 HydrophobicContact CD1-CD1 3.94Å
107	N	91.1	Very high	96.5	Very high	66 Å²	66	32.2 Å²	32.2	35%	0.353	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	37.5	-177.4	-162.8	44.3	0	0	0	113.9	Y79 E109 P244	Y79-N107 HydrophobicContact CE1-CB 4.25Å; Y79-N107 HydrophobicContact CE2-CB 4.23Å; N107-E109 PolarHBondContact O-N 2.95Å; N107-P244 WeakPolarHBondContact OD1-CB 3.46Å
108	G	89.3	Confident	96.5	Very high	59 Å²	59	28.1 Å²	28.1	61%	0.608	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.7	-12.2	-179	0	0	0	0	0	115.3	I106	I106-G108 PolarHBondContact O-N 3.42Å
109	E	94.3	Very high	96.5	Very high	74 Å²	74	24.9 Å²	24.9	35%	0.346	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.9	175.3	-63.9	-170	129.2	0	0	111	W105 I106 N107 T111 R387 N404	W105-E109 WeakPolarHBondContact CA-O 3.47Å; I106-E109 PolarHBondContact N-O 2.91Å; I106-E109 PolarHBondContact O-N 3.32Å; N107-E109 PolarHBondContact O-N 2.95Å; E109-T111 PolarHBondContact O-N 3.04Å; E109-T111 PolarHBondContact O-OG1 2.85Å; E109-R387 IonicContact OE1-CZ 3.55Å; E109-R387 IonicContact OE1-NH1 3.77Å; E109-R387 PolarHBondContact OE1-NH1 3.39Å; E109-R387 IonicContact OE1-NH2 2.81Å; E109-R387 PolarHBondContact OE1-NH2 2.69Å; E109-R387 IonicContact OE2-NH1 2.8Å; E109-R387 PolarHBondContact OE2-NH1 3.1Å; E109-R387 VanDerWaalsContact OE2-NH1 3.1Å; E109-N404 WeakPolarHBondContact CB-ND2 3.29Å; E109-N404 PolarHBondContact OE2-ND2 2.98Å
110	E	95.8	Very high	96.6	Very high	70 Å²	70	23.4 Å²	23.4	33%	0.327	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	130.6	172.3	-172.6	170.7	144.7	0	0	110.6	R103 N404	R103-E110 HydrophobicContact CG-CG 3.64Å; E110-N404 PolarHBondContact O-N 3.4Å; E110-N404 VanDerWaalsContact O-N 3.08Å
111	T	98.4	Very high	96.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.8	-179.1	-54.6	0	0	0	0	110	V104 I106 E109 F133 N404 I406	V104-T111 HydrophobicContact CG2-CG2 4.31Å; V104-T111 WeakPolarHBondContact CG2-O 3.38Å; V104-T111 PolarHBondContact N-O 3.46Å; V104-T111 PolarHBondContact O-N 3.33Å; I106-T111 HydrophobicContact CD1-CG2 4.07Å; E109-T111 PolarHBondContact O-N 3.04Å; E109-T111 PolarHBondContact O-OG1 2.85Å; T111-F133 HydrophobicContact CG2-CZ 3.99Å; T111-N404 CarbonylContact C-O 3.54Å; T111-N404 VanDerWaalsContact CA-O 3.25Å; T111-N404 WeakPolarHBondContact CA-O 3.39Å; T111-N404 HydrophobicContact CG2-CB 3.87Å; T111-N404 WeakPolarHBondContact OG1-CB 3.37Å; T111-I406 HydrophobicContact CG2-CD1 4.06Å; T111-I406 HydrophobicContact CG2-CG1 4Å
112	L	98.7	Very high	96.7	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.016	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.5	174.1	-57.1	-177.1	0	0	0	110.6	V64 V102 R103 L114 V399 T403 N404 I405 I406	V64-L112 HydrophobicContact CG1-CD2 4.11Å; V64-L112 HydrophobicContact CG2-CD2 4.33Å; V102-L112 CarbonylContact O-C 3.59Å; V102-L112 VanDerWaalsContact O-CA 3.32Å; V102-L112 WeakPolarHBondContact O-CA 3.18Å; R103-L112 HydrophobicContact CB-CD2 3.88Å; R103-L112 HydrophobicContact CG-CD2 4.1Å; L112-L114 HydrophobicContact CB-CD2 4.1Å; L112-L114 HydrophobicContact CB-CG 4.47Å; L112-V399 HydrophobicContact CD1-CG1 4.12Å; L112-V399 HydrophobicContact CD1-CG2 3.7Å; L112-T403 HydrophobicContact CD1-CG2 4.07Å; L112-T403 HydrophobicContact CG-CG2 3.78Å; L112-N404 PolarHBondContact N-O 3.46Å; L112-I405 HydrophobicContact CB-CG1 4.43Å; L112-I405 CarbonylContact O-C 3.52Å; L112-I405 VanDerWaalsContact O-CA 3.26Å; L112-I405 WeakPolarHBondContact O-CA 3.35Å; L112-I406 PolarHBondContact O-N 3.27Å
113	I	98.7	Very high	96.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.6	172.8	-43.2	-176.6	0	0	0	108.2	F82 Y94 N95 I101 V102 V104 I406 N408	F82-I113 HydrophobicContact CZ-CD1 3.84Å; Y94-I113 HydrophobicContact CD2-CD1 4.13Å; Y94-I113 HydrophobicContact CG-CD1 4.32Å; N95-I113 PolarHBondContact ND2-O 3.44Å; N95-I113 WeakPolarHBondContact OD1-CG2 3.3Å; I101-I113 WeakPolarHBondContact CA-O 3.4Å; V102-I113 PolarHBondContact N-O 3.38Å; V102-I113 PolarHBondContact O-N 3.29Å; V104-I113 HydrophobicContact CG1-CD1 3.94Å; V104-I113 HydrophobicContact CG1-CG1 4.43Å; V104-I113 HydrophobicContact CG2-CD1 3.86Å; V104-I113 HydrophobicContact CG2-CG1 3.89Å; I113-I406 CarbonylContact C-O 3.42Å; I113-I406 WeakPolarHBondContact CA-O 3.32Å; I113-I406 HydrophobicContact CG2-CB 4.31Å; I113-I406 HydrophobicContact CG2-CG2 4.32Å; I113-N408 HydrophobicContact CG2-CB 4.25Å
114	L	98.5	Very high	96.7	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.6	-172.7	-48.8	-179.7	0	0	0	109.9	D100 I101 L112 A119 V120 V123 I394 I405 I406 L407 N408	D100-L114 CarbonylContact O-C 3.55Å; D100-L114 WeakPolarHBondContact O-CA 3.28Å; I101-L114 HydrophobicContact CB-CD2 4.2Å; I101-L114 HydrophobicContact CG1-CD2 4.09Å; I101-L114 HydrophobicContact CG2-CD2 3.67Å; L112-L114 HydrophobicContact CB-CD2 4.1Å; L112-L114 HydrophobicContact CB-CG 4.47Å; L114-A119 HydrophobicContact CB-CB 4.44Å; L114-A119 HydrophobicContact CD1-CB 4.3Å; L114-V120 HydrophobicContact CB-CG2 4.27Å; L114-V120 WeakPolarHBondContact O-CG2 3.5Å; L114-V123 HydrophobicContact CD1-CG2 3.82Å; L114-I394 HydrophobicContact CD1-CD1 4.48Å; L114-I405 HydrophobicContact CD1-CG2 3.62Å; L114-I405 HydrophobicContact CG-CG2 4Å; L114-I406 PolarHBondContact N-O 2.86Å; L114-L407 HydrophobicContact CB-CD2 4.08Å; L114-L407 HydrophobicContact CD1-CD2 3.9Å; L114-L407 HydrophobicContact CG-CD2 4.37Å; L114-L407 CarbonylContact O-C 3.37Å; L114-L407 WeakPolarHBondContact O-CA 3.47Å; L114-N408 PolarHBondContact O-N 3.5Å
115	S	97.4	Very high	96.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.			trans	-124.5	-6.6	173.4	52.7	0	0	0	0	113.5	D100 M412	D100-S115 VanDerWaalsContact CA-OG 3.3Å; D100-S115 WeakPolarHBondContact CA-OG 3.26Å; D100-S115 PolarHBondContact O-N 2.87Å; D100-S115 PolarHBondContact O-OG 3.45Å; S115-M412 VanDerWaalsContact O-CA 3.32Å; S115-M412 WeakPolarHBondContact O-CA 3.4Å; S115-M412 WeakPolarHBondContact O-CB 3.08Å; S115-M412 WeakPolarHBondContact O-CG 3.42Å
116	R	96.8	Very high	96.5	Very high	78 Å²	78	31.2 Å²	31.2	29%	0.294	16%	0.164	S	C	.	.	S	Bend	trans	-71.3	132.9	173.4	-168.5	-179.4	-73.1	159.4	-1.1	110.8	D100 I101 S118 A119 V120 D395 E416	D100-R116 HydrophobicContact CB-CB 3.84Å; I101-R116 HydrophobicContact CG1-CB 4.45Å; R116-S118 VanDerWaalsContact C-N 3.32Å; R116-S118 WeakPolarHBondContact CD-OG 3.25Å; R116-S118 WeakPolarHBondContact CG-OG 3.37Å; R116-S118 PolarHBondContact O-N 2.96Å; R116-A119 HydrophobicContact CB-CB 4.32Å; R116-A119 PolarHBondContact O-N 2.91Å; R116-V120 WeakPolarHBondContact O-CG2 3.3Å; R116-V120 PolarHBondContact O-N 2.95Å; R116-D395 VanDerWaalsContact CD-OD2 3.24Å; R116-D395 WeakPolarHBondContact CD-OD2 3.3Å; R116-D395 IonicContact NH1-OD2 2.76Å; R116-E416 WeakPolarHBondContact CA-OE1 3.3Å; R116-E416 WeakPolarHBondContact CG-OE1 3.29Å
117	A	96.3	Very high	96.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-34	-171.7	0	0	0	0	0	113.2	N121 M412 E416 Y437	A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.46Å; A117-M412 HydrophobicContact CB-CG 4Å; A117-M412 HydrophobicContact CB-SD 4.08Å; A117-E416 VanDerWaalsContact CB-OE2 3.31Å; A117-E416 WeakPolarHBondContact CB-OE2 3.39Å; A117-E416 PolarHBondContact N-OE1 3.39Å; A117-Y437 HydrophobicContact CB-CD1 3.63Å; A117-Y437 HydrophobicContact CB-CE1 3.89Å
118	S	96.4	Very high	96.7	Very high	32 Å²	32	32.9 Å²	32.9	22%	0.224	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-53.3	172.9	46	0	0	0	0	112	R116 N121 H122 D395	R116-S118 VanDerWaalsContact C-N 3.32Å; R116-S118 WeakPolarHBondContact CD-OG 3.25Å; R116-S118 WeakPolarHBondContact CG-OG 3.37Å; R116-S118 PolarHBondContact O-N 2.96Å; S118-N121 PolarHBondContact O-N 3.4Å; S118-H122 WeakPolarHBondContact O-CB 3.37Å; S118-H122 PolarHBondContact O-N 3.45Å; S118-D395 PolarHBondContact OG-OD2 2.79Å
119	A	97.4	Very high	97.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-44.8	-178.6	0	0	0	0	0	112	I101 L114 R116 H122 V123 I394	I101-A119 HydrophobicContact CD1-CB 4.12Å; L114-A119 HydrophobicContact CB-CB 4.44Å; L114-A119 HydrophobicContact CD1-CB 4.3Å; R116-A119 HydrophobicContact CB-CB 4.32Å; R116-A119 PolarHBondContact O-N 2.91Å; A119-H122 WeakPolarHBondContact O-CB 3.42Å; A119-H122 PolarHBondContact O-N 3.37Å; A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 3.26Å; A119-V123 VanDerWaalsContact O-N 3.1Å; A119-I394 HydrophobicContact CB-CG2 3.64Å
120	V	97.8	Very high	97.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-47.3	177.2	173.6	0	0	0	0	111	L114 R116 H122 V123 L124 L407 T409 M412	L114-V120 HydrophobicContact CB-CG2 4.27Å; L114-V120 WeakPolarHBondContact O-CG2 3.5Å; R116-V120 WeakPolarHBondContact O-CG2 3.3Å; R116-V120 PolarHBondContact O-N 2.95Å; V120-H122 VanDerWaalsContact C-N 3.34Å; V120-H122 PolarHBondContact O-N 3.03Å; V120-V123 PolarHBondContact O-N 3.39Å; V120-L124 HydrophobicContact CG1-CD1 3.79Å; V120-L124 HydrophobicContact CG1-CG 4.47Å; V120-L124 WeakPolarHBondContact O-CG 3.26Å; V120-L124 PolarHBondContact O-N 3.11Å; V120-L407 HydrophobicContact CG1-CB 4.38Å; V120-L407 HydrophobicContact CG1-CD1 4.45Å; V120-L407 HydrophobicContact CG2-CD2 4.29Å; V120-T409 HydrophobicContact CG1-CG2 4.1Å; V120-M412 HydrophobicContact CB-SD 3.63Å; V120-M412 HydrophobicContact CG1-CE 4.35Å; V120-M412 HydrophobicContact CG1-SD 3.61Å; V120-M412 HydrophobicContact CG2-SD 3.9Å
121	N	97	Very high	97.3	Very high	26 Å²	26	24 Å²	24	14%	0.139	12%	0.123	C	C	.	.	H	α-helix	trans	-64.2	-36.5	178.3	171.8	83.7	0	0	0	112.5	A117 S118 K125 R436	A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.46Å; S118-N121 PolarHBondContact O-N 3.4Å; N121-K125 WeakPolarHBondContact O-CB 3.3Å; N121-K125 WeakPolarHBondContact O-CG 3.48Å; N121-K125 PolarHBondContact O-N 2.88Å; N121-K125 VanDerWaalsContact O-N 3.14Å; N121-K125 WeakPolarHBondContact OD1-CD 3.38Å; N121-K125 WeakPolarHBondContact OD1-CE 3.48Å; N121-K125 PolarHBondContact OD1-NZ 3.02Å; N121-R436 HydrophobicContact CB-CB 4.2Å
122	H	97.8	Very high	97.3	Very high	62 Å²	62	26.2 Å²	26.2	29%	0.287	13%	0.132	S	C	.	.	H	α-helix	trans	-59.1	-51.9	174.2	-179.8	93.6	0	0	0	111.3	S118 A119 V120 L124 K125 N126 Y129 D392	S118-H122 WeakPolarHBondContact O-CB 3.37Å; S118-H122 PolarHBondContact O-N 3.45Å; A119-H122 WeakPolarHBondContact O-CB 3.42Å; A119-H122 PolarHBondContact O-N 3.37Å; V120-H122 VanDerWaalsContact C-N 3.34Å; V120-H122 PolarHBondContact O-N 3.03Å; H122-L124 PolarHBondContact O-N 3.39Å; H122-K125 PolarHBondContact O-N 3.24Å; H122-N126 VanDerWaalsContact O-CB 3.29Å; H122-N126 WeakPolarHBondContact O-CB 3.13Å; H122-N126 PolarHBondContact O-N 2.92Å; H122-Y129 AromaticContact CD2-CE2 4Å; H122-D392 IonicContact CD2-OD2 2.77Å; H122-D392 IonicContact CE1-OD2 3.42Å; H122-D392 IonicContact NE2-OD2 3.8Å; H122-D392 PolarHBondContact NE2-OD2 3.42Å
123	V	98.3	Very high	97.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.8	-45.8	-179.1	174.3	0	0	0	0	111.4	L114 A119 V120 K125 N126 Y129 R386 I394 I405 L407	L114-V123 HydrophobicContact CD1-CG2 3.82Å; A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 3.26Å; A119-V123 VanDerWaalsContact O-N 3.1Å; V120-V123 PolarHBondContact O-N 3.39Å; V123-K125 PolarHBondContact O-N 3.05Å; V123-N126 PolarHBondContact O-N 2.88Å; V123-Y129 HydrophobicContact CB-CD2 4.19Å; V123-Y129 HydrophobicContact CB-CG 4.36Å; V123-Y129 HydrophobicContact CG1-CD1 4.14Å; V123-Y129 HydrophobicContact CG1-CD2 3.98Å; V123-Y129 HydrophobicContact CG1-CG 3.66Å; V123-Y129 HydrophobicContact CG2-CD2 4.36Å; V123-Y129 HydrophobicContact CG2-CE2 4.29Å; V123-Y129 WeakPolarHBondContact O-CD2 3.36Å; V123-R386 HydrophobicContact CG1-CB 4.18Å; V123-R386 HydrophobicContact CG1-CG 3.94Å; V123-I394 HydrophobicContact CG2-CD1 3.52Å; V123-I405 HydrophobicContact CG1-CD1 4.47Å; V123-I405 HydrophobicContact CG2-CD1 4.17Å; V123-L407 HydrophobicContact CB-CD1 4.29Å; V123-L407 HydrophobicContact CB-CD2 3.95Å; V123-L407 HydrophobicContact CG1-CD1 3.89Å; V123-L407 HydrophobicContact CG1-CD2 3.95Å; V123-L407 HydrophobicContact CG1-CG 4.34Å; V123-L407 HydrophobicContact CG2-CD2 4.19Å
124	L	97.4	Very high	97.1	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-69	-34.9	-175.6	-71.4	171.8	0	0	0	113.5	V120 H122 L407 S443 G444	V120-L124 HydrophobicContact CG1-CD1 3.79Å; V120-L124 HydrophobicContact CG1-CG 4.47Å; V120-L124 WeakPolarHBondContact O-CG 3.26Å; V120-L124 PolarHBondContact O-N 3.11Å; H122-L124 PolarHBondContact O-N 3.39Å; L124-L407 HydrophobicContact CD1-CD1 4.24Å; L124-L407 HydrophobicContact CD2-CD1 3.48Å; L124-L407 VanDerWaalsContact CD2-CD1 3.48Å; L124-L407 HydrophobicContact CG-CD1 3.6Å; L124-S443 VanDerWaalsContact CB-OG 3.29Å; L124-S443 WeakPolarHBondContact CB-OG 3.3Å; L124-G444 WeakPolarHBondContact O-CA 3.43Å
125	K	95.8	Very high	97	Very high	133 Å²	133	27.8 Å²	27.8	58%	0.578	15%	0.147	S	C	*	.	H	α-helix	trans	-78	-25.1	-179.6	-74.7	-175.3	171.4	177.2	0	113.4	N121 H122 V123	N121-K125 WeakPolarHBondContact O-CB 3.3Å; N121-K125 WeakPolarHBondContact O-CG 3.48Å; N121-K125 PolarHBondContact O-N 2.88Å; N121-K125 VanDerWaalsContact O-N 3.14Å; N121-K125 WeakPolarHBondContact OD1-CD 3.38Å; N121-K125 WeakPolarHBondContact OD1-CE 3.48Å; N121-K125 PolarHBondContact OD1-NZ 3.02Å; H122-K125 PolarHBondContact O-N 3.24Å; V123-K125 PolarHBondContact O-N 3.05Å
126	N	95.9	Very high	97	Very high	45 Å²	45	34.2 Å²	34.2	24%	0.241	17%	0.174	C	C	.	.			trans	-90.9	129.8	-170.8	-170.1	-16.9	0	0	0	112.4	H122 V123 K128 Y129 D392	H122-N126 VanDerWaalsContact O-CB 3.29Å; H122-N126 WeakPolarHBondContact O-CB 3.13Å; H122-N126 PolarHBondContact O-N 2.92Å; V123-N126 PolarHBondContact O-N 2.88Å; N126-K128 PolarHBondContact O-N 2.87Å; N126-K128 VanDerWaalsContact O-N 3.15Å; N126-K128 VanDerWaalsContact OD1-CG 3.32Å; N126-K128 WeakPolarHBondContact OD1-CG 3.37Å; N126-K128 PolarHBondContact OD1-N 3.1Å; N126-Y129 HydrophobicContact CB-CD2 3.91Å; N126-Y129 HydrophobicContact CB-CE2 4.09Å; N126-Y129 PolarHBondContact O-N 3.31Å; N126-Y129 VanDerWaalsContact O-N 3.17Å; N126-D392 PolarHBondContact ND2-OD2 3.34Å
127	G	95.4	Very high	96.9	Very high	40 Å²	40	32.5 Å²	32.5	41%	0.412	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-59.7	-21.2	177.1	0	0	0	0	0	114.1	Y129 T130	G127-Y129 PolarHBondContact O-N 3.43Å; G127-Y129 VanDerWaalsContact O-N 3.1Å; G127-T130 WeakPolarHBondContact O-CG2 3.22Å; G127-T130 PolarHBondContact O-N 3.44Å; G127-T130 PolarHBondContact O-OG1 3.34Å
128	K	97.1	Very high	96.9	Very high	65 Å²	65	32.5 Å²	32.5	28%	0.283	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-61.6	-14.5	175	-64.9	179.1	175.9	-171.7	0	113.9	N126 L389 S390 D391 D392	N126-K128 PolarHBondContact O-N 2.87Å; N126-K128 VanDerWaalsContact O-N 3.15Å; N126-K128 VanDerWaalsContact OD1-CG 3.32Å; N126-K128 WeakPolarHBondContact OD1-CG 3.37Å; N126-K128 PolarHBondContact OD1-N 3.1Å; K128-L389 VanDerWaalsContact O-CB 3.24Å; K128-L389 WeakPolarHBondContact O-CB 3.18Å; K128-L389 WeakPolarHBondContact O-CG 3.4Å; K128-L389 PolarHBondContact O-N 3.33Å; K128-S390 WeakPolarHBondContact CD-OG 3.21Å; K128-S390 WeakPolarHBondContact CE-OG 3.49Å; K128-S390 VanDerWaalsContact CG-OG 3.26Å; K128-S390 WeakPolarHBondContact CG-OG 3.26Å; K128-D391 PolarHBondContact NZ-O 3.08Å; K128-D392 HydrophobicContact CD-CB 4.31Å; K128-D392 IonicContact NZ-OD1 3.07Å; K128-D392 PolarHBondContact NZ-OD1 3.42Å
129	Y	98.1	Very high	97	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-120	29.7	-177.5	-51	-78.5	0	0	0	112.7	H122 V123 N126 G127 S131 R386 A388 D392 I394 I405	H122-Y129 AromaticContact CD2-CE2 4Å; V123-Y129 HydrophobicContact CB-CD2 4.19Å; V123-Y129 HydrophobicContact CB-CG 4.36Å; V123-Y129 HydrophobicContact CG1-CD1 4.14Å; V123-Y129 HydrophobicContact CG1-CD2 3.98Å; V123-Y129 HydrophobicContact CG1-CG 3.66Å; V123-Y129 HydrophobicContact CG2-CD2 4.36Å; V123-Y129 HydrophobicContact CG2-CE2 4.29Å; V123-Y129 WeakPolarHBondContact O-CD2 3.36Å; N126-Y129 HydrophobicContact CB-CD2 3.91Å; N126-Y129 HydrophobicContact CB-CE2 4.09Å; N126-Y129 PolarHBondContact O-N 3.31Å; N126-Y129 VanDerWaalsContact O-N 3.17Å; G127-Y129 PolarHBondContact O-N 3.43Å; G127-Y129 VanDerWaalsContact O-N 3.1Å; Y129-S131 PolarHBondContact O-N 3.33Å; Y129-R386 WeakPolarHBondContact O-CD 3.39Å; Y129-R386 PolarHBondContact O-NH1 3.04Å; Y129-A388 HydrophobicContact CD1-CB 4.07Å; Y129-A388 HydrophobicContact CE1-CB 3.74Å; Y129-D392 WeakPolarHBondContact OH-CB 3.2Å; Y129-D392 PolarHBondContact OH-OD2 3.35Å; Y129-D392 VanDerWaalsContact OH-OD2 3.08Å; Y129-I394 HydrophobicContact CE1-CD1 4.32Å; Y129-I394 HydrophobicContact CE2-CD1 4.47Å; Y129-I394 VanDerWaalsContact OH-CD1 3.22Å; Y129-I394 WeakPolarHBondContact OH-CD1 3.34Å; Y129-I405 HydrophobicContact CD1-CD1 3.67Å; Y129-I405 HydrophobicContact CE1-CD1 3.53Å
130	T	97	Very high	96.9	Very high	11 Å²	11	33.9 Å²	33.9	7%	0.067	18%	0.183	C	C	.	.			trans	-82.3	22	176.7	55.9	0	0	0	0	113.6	G127 P445 R446	G127-T130 WeakPolarHBondContact O-CG2 3.22Å; G127-T130 PolarHBondContact O-N 3.44Å; G127-T130 PolarHBondContact O-OG1 3.34Å; T130-P445 HydrophobicContact CG2-CB 3.75Å; T130-P445 HydrophobicContact CG2-CG 3.37Å; T130-R446 WeakPolarHBondContact O-CD 3.42Å; T130-R446 PolarHBondContact O-NH1 2.87Å
131	S	97.6	Very high	96.8	Very high	5 Å²	5	35 Å²	35	4%	0.035	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-122	159.8	173.7	-169.3	0	0	0	0	110.8	Y129 R386 R387	Y129-S131 PolarHBondContact O-N 3.33Å; S131-R386 CarbonylContact O-C 3.53Å; S131-R386 WeakPolarHBondContact O-CA 3.47Å; S131-R387 PolarHBondContact O-N 3.03Å
132	R	97.9	Very high	96.8	Very high	47 Å²	47	33.8 Å²	33.8	18%	0.177	18%	0.184	C	C	.	.			trans	-112.5	-176.9	171.1	-58.1	-160.2	-176.9	-97.7	14.6	109.5	I150 F151 N153 S384 M385	R132-I150 WeakPolarHBondContact CD-O 3.33Å; R132-I150 PolarHBondContact NE-O 3.01Å; R132-F151 HydrophobicContact CB-CD1 3.9Å; R132-F151 HydrophobicContact CB-CE1 4.02Å; R132-N153 VanDerWaalsContact C-OD1 3.25Å; R132-N153 WeakPolarHBondContact CA-OD1 3.35Å; R132-N153 PolarHBondContact N-OD1 2.97Å; R132-N153 VanDerWaalsContact N-OD1 3.09Å; R132-N153 PolarHBondContact O-OD1 3.28Å; R132-S384 PolarHBondContact NH1-OG 3.39Å; R132-S384 VanDerWaalsContact NH1-OG 3.1Å; R132-M385 WeakPolarHBondContact CG-O 3.28Å; R132-M385 PolarHBondContact NH1-O 3.41Å
133	F	97.4	Very high	96.7	Very high	6 Å²	6	31 Å²	31	3%	0.026	17%	0.172	C	C	.	.			trans	-139	155.7	175.2	72.9	-82.5	0	0	0	110.3	I106 T111 F151 M385 R386 R387 N404 I406	I106-F133 HydrophobicContact CD1-CE2 4.24Å; I106-F133 HydrophobicContact CD1-CZ 4.34Å; T111-F133 HydrophobicContact CG2-CZ 3.99Å; F133-F151 VanDerWaalsContact O-CE1 3.29Å; F133-F151 WeakPolarHBondContact O-CE1 3.43Å; F133-M385 HydrophobicContact CD1-CB 4.04Å; F133-M385 HydrophobicContact CD1-CE 3.96Å; F133-M385 HydrophobicContact CD2-CE 3.81Å; F133-M385 HydrophobicContact CE1-CB 3.73Å; F133-M385 HydrophobicContact CE1-CE 3.55Å; F133-M385 HydrophobicContact CE1-CG 4Å; F133-M385 HydrophobicContact CE2-CE 3.38Å; F133-M385 HydrophobicContact CG-CE 4.09Å; F133-M385 HydrophobicContact CZ-CE 3.24Å; F133-M385 HydrophobicContact CZ-CG 4.34Å; F133-M385 WeakPolarHBondContact O-CE 3.2Å; F133-R386 VanDerWaalsContact CD1-O 3.26Å; F133-R386 WeakPolarHBondContact CD1-O 3.25Å; F133-R387 HydrophobicContact CB-CB 4.42Å; F133-N404 HydrophobicContact CB-CB 4.5Å; F133-N404 WeakPolarHBondContact CB-OD1 3.21Å; F133-N404 HydrophobicContact CD1-CB 3.71Å; F133-N404 HydrophobicContact CD2-CB 3.91Å; F133-N404 VanDerWaalsContact CD2-CG 3.44Å; F133-N404 WeakPolarHBondContact CD2-ND2 3.4Å; F133-N404 HydrophobicContact CE1-CB 3.74Å; F133-N404 HydrophobicContact CE2-CB 3.94Å; F133-N404 HydrophobicContact CG-CB 3.79Å; F133-N404 VanDerWaalsContact CG-OD1 3.26Å; F133-N404 WeakPolarHBondContact CG-OD1 3.31Å; F133-N404 HydrophobicContact CZ-CB 3.85Å; F133-I406 HydrophobicContact CE1-CG1 4.28Å; F133-I406 HydrophobicContact CZ-CD1 4.39Å; F133-I406 HydrophobicContact CZ-CG1 4.01Å
134	G	96.6	Very high	96.7	Very high	24 Å²	24	31 Å²	31	25%	0.247	17%	0.172	C	C	.	.			trans	174.5	166.2	179.9	0	0	0	0	0	110.1	K136 L241	G134-K136 PolarHBondContact O-N 3.05Å; G134-L241 CarbonylContact C-O 3.52Å; G134-L241 WeakPolarHBondContact CA-O 3.06Å
135	S	96.6	Very high	96.7	Very high	8 Å²	8	32.6 Å²	32.6	6%	0.056	18%	0.18	C	C	.	.			trans	-58.1	115.9	175.3	-177.8	0	0	0	0	109.5	G138 L139 V240 L241 K243 F248	S135-G138 PolarHBondContact O-N 2.94Å; S135-G138 VanDerWaalsContact O-N 3.11Å; S135-G138 PolarHBondContact OG-N 2.97Å; S135-L139 WeakPolarHBondContact O-CG 3.23Å; S135-L139 PolarHBondContact O-N 2.69Å; S135-V240 WeakPolarHBondContact CB-O 3.46Å; S135-L241 WeakPolarHBondContact CB-O 3.46Å; S135-L241 PolarHBondContact N-O 3.46Å; S135-K243 VanDerWaalsContact CB-O 3.31Å; S135-K243 WeakPolarHBondContact CB-O 3.24Å; S135-K243 PolarHBondContact OG-O 3.5Å; S135-F248 WeakPolarHBondContact OG-CE2 3.43Å
136	K	95.9	Very high	96.8	Very high	134 Å²	134	30.6 Å²	30.6	58%	0.583	17%	0.173	S	C	*	.	H	α-helix	trans	-58.5	-44.9	179.7	-178.5	175.6	-177.6	176.9	0	112	G134 G138 L139 S140	G134-K136 PolarHBondContact O-N 3.05Å; K136-G138 VanDerWaalsContact C-N 3.34Å; K136-G138 PolarHBondContact O-N 3.36Å; K136-L139 PolarHBondContact O-N 3.35Å; K136-S140 WeakPolarHBondContact O-CB 3.3Å; K136-S140 PolarHBondContact O-N 3.28Å; K136-S140 PolarHBondContact O-OG 3.38Å
137	P	96	Very high	96.8	Very high	43 Å²	43	32.4 Å²	32.4	28%	0.279	18%	0.177	S	C	.	.	H	α-helix	trans	-60.8	-40.8	172.5	-23.8	34.3	0	0	0	113	S140 C141 F248	P137-S140 PolarHBondContact O-N 2.95Å; P137-C141 WeakPolarHBondContact O-CB 3.28Å; P137-C141 PolarHBondContact O-N 3.19Å; P137-F248 HydrophobicContact CB-CB 4.08Å; P137-F248 HydrophobicContact CB-CD1 3.95Å; P137-F248 HydrophobicContact CB-CD2 3.58Å; P137-F248 HydrophobicContact CB-CE1 4.26Å; P137-F248 HydrophobicContact CB-CE2 3.93Å; P137-F248 HydrophobicContact CB-CG 3.58Å; P137-F248 HydrophobicContact CB-CZ 4.25Å; P137-F248 HydrophobicContact CG-CD2 4.17Å; P137-F248 HydrophobicContact CG-CG 4.49Å
138	G	96.4	Very high	96.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-47.9	176.7	0	0	0	0	0	113	S135 K136 S140 C141 L142 F248	S135-G138 PolarHBondContact O-N 2.94Å; S135-G138 VanDerWaalsContact O-N 3.11Å; S135-G138 PolarHBondContact OG-N 2.97Å; K136-G138 VanDerWaalsContact C-N 3.34Å; K136-G138 PolarHBondContact O-N 3.36Å; G138-S140 VanDerWaalsContact C-N 3.25Å; G138-S140 PolarHBondContact O-N 2.7Å; G138-C141 VanDerWaalsContact O-CB 3.3Å; G138-C141 WeakPolarHBondContact O-CB 3.49Å; G138-C141 PolarHBondContact O-N 3.11Å; G138-L142 WeakPolarHBondContact O-CG 3.43Å; G138-L142 PolarHBondContact O-N 3.43Å; G138-L142 VanDerWaalsContact O-N 3.13Å; G138-F248 VanDerWaalsContact CA-CZ 3.41Å
139	L	97.4	Very high	97	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-31.5	175.5	-66.7	179.2	0	0	0	112	S135 K136 L142 G143 M144 N145 F151 L241	S135-L139 WeakPolarHBondContact O-CG 3.23Å; S135-L139 PolarHBondContact O-N 2.69Å; K136-L139 PolarHBondContact O-N 3.35Å; L139-L142 PolarHBondContact O-N 2.94Å; L139-G143 CarbonylContact O-C 3.58Å; L139-G143 PolarHBondContact O-N 3.47Å; L139-G143 VanDerWaalsContact O-N 3.12Å; L139-M144 HydrophobicContact CD2-CB 4.13Å; L139-M144 PolarHBondContact O-N 3.43Å; L139-N145 HydrophobicContact CB-CB 3.85Å; L139-N145 PolarHBondContact O-N 3.24Å; L139-F151 HydrophobicContact CD1-CB 4.32Å; L139-F151 HydrophobicContact CD1-CD1 4.46Å; L139-F151 HydrophobicContact CD2-CB 3.66Å; L139-F151 HydrophobicContact CD2-CD1 4.09Å; L139-F151 HydrophobicContact CD2-CG 3.9Å; L139-L241 HydrophobicContact CD2-CD1 3.82Å
140	S	96.2	Very high	97	Very high	60 Å²	60	29.7 Å²	29.7	42%	0.42	16%	0.155	S	C	.	.	H	α-helix	trans	-72	-39.2	176.9	-56.5	0	0	0	0	111.3	K136 P137 G138 L142 G143 N145	K136-S140 WeakPolarHBondContact O-CB 3.3Å; K136-S140 PolarHBondContact O-N 3.28Å; K136-S140 PolarHBondContact O-OG 3.38Å; P137-S140 PolarHBondContact O-N 2.95Å; G138-S140 VanDerWaalsContact C-N 3.25Å; G138-S140 PolarHBondContact O-N 2.7Å; S140-L142 VanDerWaalsContact C-N 3.3Å; S140-L142 PolarHBondContact O-N 2.91Å; S140-G143 PolarHBondContact O-N 2.77Å; S140-N145 WeakPolarHBondContact OG-CB 3.26Å
141	C	94.9	Very high	97	Very high	23 Å²	23	29.6 Å²	29.6	16%	0.155	15%	0.154	C	C	.	.	H	α-helix	trans	-55.9	-45.3	171.3	-176.4	0	0	0	0	111.4	P137 G138 G143 Q265	P137-C141 WeakPolarHBondContact O-CB 3.28Å; P137-C141 PolarHBondContact O-N 3.19Å; G138-C141 VanDerWaalsContact O-CB 3.3Å; G138-C141 WeakPolarHBondContact O-CB 3.49Å; G138-C141 PolarHBondContact O-N 3.11Å; C141-G143 VanDerWaalsContact C-N 3.28Å; C141-G143 PolarHBondContact O-N 3.21Å; C141-Q265 PolarHBondContact O-NE2 3.36Å
142	L	96.5	Very high	97	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-74.3	-15.5	179.3	-67.5	166.5	0	0	0	114.2	G138 L139 S140 M144 Y233 T236 W237 V240 Q265 Q309	G138-L142 WeakPolarHBondContact O-CG 3.43Å; G138-L142 PolarHBondContact O-N 3.43Å; G138-L142 VanDerWaalsContact O-N 3.13Å; L139-L142 PolarHBondContact O-N 2.94Å; S140-L142 VanDerWaalsContact C-N 3.3Å; S140-L142 PolarHBondContact O-N 2.91Å; L142-M144 VanDerWaalsContact C-N 3.3Å; L142-M144 HydrophobicContact CB-CB 4.44Å; L142-M144 HydrophobicContact CB-CG 4.16Å; L142-M144 HydrophobicContact CD1-SD 4.37Å; L142-Y233 HydrophobicContact CB-CE2 4.5Å; L142-Y233 HydrophobicContact CD2-CD2 4.4Å; L142-Y233 HydrophobicContact CD2-CE1 4.08Å; L142-Y233 HydrophobicContact CD2-CE2 3.94Å; L142-Y233 PolarHBondContact O-OH 2.91Å; L142-T236 HydrophobicContact CD2-CG2 3.93Å; L142-W237 HydrophobicContact CD1-CB 3.88Å; L142-W237 VanDerWaalsContact CD1-CD1 3.44Å; L142-W237 HydrophobicContact CD1-CG 3.85Å; L142-W237 HydrophobicContact CD2-CB 3.85Å; L142-V240 HydrophobicContact CD1-CG2 3.77Å; L142-V240 HydrophobicContact CD2-CG2 4.47Å; L142-V240 HydrophobicContact CG-CG2 3.97Å; L142-Q265 PolarHBondContact O-NE2 3.43Å; L142-Q309 PolarHBondContact O-OE1 3.23Å
143	G	96.5	Very high	96.9	Very high	3 Å²	3	29.1 Å²	29.1	3%	0.031	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	3.4	-170.8	0	0	0	0	0	114.6	L139 S140 C141 R147 Q309	L139-G143 CarbonylContact O-C 3.58Å; L139-G143 PolarHBondContact O-N 3.47Å; L139-G143 VanDerWaalsContact O-N 3.12Å; S140-G143 PolarHBondContact O-N 2.77Å; C141-G143 VanDerWaalsContact C-N 3.28Å; C141-G143 PolarHBondContact O-N 3.21Å; G143-R147 WeakPolarHBondContact O-CB 3.26Å; G143-Q309 VanDerWaalsContact O-CD 3.31Å; G143-Q309 WeakPolarHBondContact O-CG 3.41Å; G143-Q309 PolarHBondContact O-OE1 2.81Å
144	M	97.9	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.			trans	-85.8	-11.1	-179.3	-68.7	-176.8	177.5	0	0	114.4	L139 L142 E146 I150 F151 Y233 W237 Q309 I316	L139-M144 HydrophobicContact CD2-CB 4.13Å; L139-M144 PolarHBondContact O-N 3.43Å; L142-M144 VanDerWaalsContact C-N 3.3Å; L142-M144 HydrophobicContact CB-CB 4.44Å; L142-M144 HydrophobicContact CB-CG 4.16Å; L142-M144 HydrophobicContact CD1-SD 4.37Å; M144-E146 PolarHBondContact O-N 2.76Å; M144-E146 VanDerWaalsContact O-N 3.08Å; M144-I150 HydrophobicContact CE-CD1 4.42Å; M144-F151 HydrophobicContact CB-CB 4.16Å; M144-F151 HydrophobicContact SD-CB 4.19Å; M144-F151 HydrophobicContact SD-CD2 4.26Å; M144-Y233 HydrophobicContact CE-CE1 3.91Å; M144-Y233 WeakPolarHBondContact CE-OH 3.41Å; M144-W237 HydrophobicContact CE-CD2 4.19Å; M144-W237 HydrophobicContact CE-CE3 4.39Å; M144-W237 HydrophobicContact CE-CH2 4.38Å; M144-W237 HydrophobicContact CE-CZ2 4.13Å; M144-W237 HydrophobicContact SD-CZ2 4.3Å; M144-Q309 VanDerWaalsContact CG-NE2 3.33Å; M144-I316 HydrophobicContact CE-CD1 4.27Å
145	N	97.6	Very high	96.9	Very high	36 Å²	36	32.3 Å²	32.3	19%	0.193	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	109.2	178.8	-178.9	66	0	0	0	110.5	L139 S140 R147	L139-N145 HydrophobicContact CB-CB 3.85Å; L139-N145 PolarHBondContact O-N 3.24Å; S140-N145 WeakPolarHBondContact OG-CB 3.26Å; N145-R147 PolarHBondContact O-N 3.3Å
146	E	97.1	Very high	96.9	Very high	91 Å²	91	35.6 Å²	35.6	43%	0.425	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	26.7	-178.2	-55.1	-170.1	140.1	0	0	114.5	M144 N152 N154 L157	M144-E146 PolarHBondContact O-N 2.76Å; M144-E146 VanDerWaalsContact O-N 3.08Å; E146-N152 WeakPolarHBondContact CA-OD1 3.16Å; E146-N154 HydrophobicContact CB-CB 4.16Å; E146-N154 HydrophobicContact CG-CB 4.02Å; E146-L157 WeakPolarHBondContact O-CD2 3.21Å
147	R	97.6	Very high	97	Very high	83 Å²	83	31.2 Å²	31.2	31%	0.313	18%	0.178	S	C	.	.	S	Bend	trans	-137.8	161.1	175.4	-60.5	175.5	-174.2	157.3	-1.9	110.2	G143 N145 N152 N306 Q309	G143-R147 WeakPolarHBondContact O-CB 3.26Å; N145-R147 PolarHBondContact O-N 3.3Å; R147-N152 WeakPolarHBondContact O-CB 3.31Å; R147-N306 VanDerWaalsContact CA-OD1 3.3Å; R147-N306 WeakPolarHBondContact CA-OD1 3.49Å; R147-N306 WeakPolarHBondContact CB-OD1 3.43Å; R147-Q309 HydrophobicContact CB-CB 4.12Å; R147-Q309 HydrophobicContact CB-CG 3.93Å
148	G	97.6	Very high	97.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	62	-151.2	-174.4	0	0	0	0	0	111.9	N152	G148-N152 WeakPolarHBondContact O-CB 3.3Å; G148-N152 PolarHBondContact O-ND2 2.92Å
149	I	98.1	Very high	97.1	Very high	11 Å²	11	36.7 Å²	36.7	6%	0.056	20%	0.197	C	C	.	.	S	Bend	trans	-131.5	-24.1	-178.2	64.1	162.6	0	0	0	115	W158 I161 R162 F165 E313 R446 V449	I149-W158 PolarHBondContact O-NE1 2.95Å; I149-I161 HydrophobicContact CG2-CB 4Å; I149-I161 HydrophobicContact CG2-CG2 3.49Å; I149-I161 VanDerWaalsContact CG2-CG2 3.49Å; I149-R162 HydrophobicContact CG2-CB 4.27Å; I149-F165 HydrophobicContact CB-CE2 4.47Å; I149-F165 HydrophobicContact CD1-CB 4.03Å; I149-F165 HydrophobicContact CD1-CD1 3.65Å; I149-F165 HydrophobicContact CD1-CD2 3.73Å; I149-F165 HydrophobicContact CD1-CE1 3.94Å; I149-F165 HydrophobicContact CD1-CE2 4.01Å; I149-F165 HydrophobicContact CD1-CG 3.53Å; I149-F165 HydrophobicContact CD1-CZ 4.1Å; I149-F165 HydrophobicContact CG1-CD1 4.38Å; I149-F165 HydrophobicContact CG1-CD2 4.1Å; I149-F165 HydrophobicContact CG1-CE1 4.2Å; I149-F165 HydrophobicContact CG1-CE2 3.89Å; I149-F165 HydrophobicContact CG1-CG 4.33Å; I149-F165 HydrophobicContact CG1-CZ 3.93Å; I149-F165 HydrophobicContact CG2-CD2 3.83Å; I149-F165 HydrophobicContact CG2-CE2 3.8Å; I149-E313 PolarHBondContact N-OE2 3.38Å; I149-R446 PolarHBondContact O-NH2 3.34Å; I149-R446 VanDerWaalsContact O-NH2 3.11Å; I149-V449 HydrophobicContact CD1-CG1 3.83Å
150	I	97.4	Very high	97.1	Very high	38 Å²	38	40.5 Å²	40.5	20%	0.195	21%	0.214	C	C	.	.	S	Bend	trans	-63.9	-58.9	-171.5	-61.3	173.8	0	0	0	109.6	R132 M144 W237 E313 R446	R132-I150 WeakPolarHBondContact CD-O 3.33Å; R132-I150 PolarHBondContact NE-O 3.01Å; M144-I150 HydrophobicContact CE-CD1 4.42Å; I150-W237 HydrophobicContact CD1-CH2 4.48Å; I150-W237 HydrophobicContact CG2-CH2 3.92Å; I150-W237 HydrophobicContact CG2-CZ2 3.8Å; I150-E313 HydrophobicContact CD1-CB 3.95Å; I150-E313 HydrophobicContact CD1-CG 3.73Å; I150-E313 HydrophobicContact CG1-CB 4.36Å; I150-E313 HydrophobicContact CG1-CG 4.12Å; I150-E313 WeakPolarHBondContact CG1-OE2 3.4Å; I150-E313 PolarHBondContact N-OE2 2.96Å; I150-R446 PolarHBondContact O-NH2 2.85Å
151	F	98	Very high	97.2	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.035	19%	0.194	C	C	.	.	S	Bend	trans	-113.8	15.6	179.4	-87.9	-88.6	0	0	0	114.2	R132 F133 L139 M144 N153 W237 L241 M385	R132-F151 HydrophobicContact CB-CD1 3.9Å; R132-F151 HydrophobicContact CB-CE1 4.02Å; F133-F151 VanDerWaalsContact O-CE1 3.29Å; F133-F151 WeakPolarHBondContact O-CE1 3.43Å; L139-F151 HydrophobicContact CD1-CB 4.32Å; L139-F151 HydrophobicContact CD1-CD1 4.46Å; L139-F151 HydrophobicContact CD2-CB 3.66Å; L139-F151 HydrophobicContact CD2-CD1 4.09Å; L139-F151 HydrophobicContact CD2-CG 3.9Å; M144-F151 HydrophobicContact CB-CB 4.16Å; M144-F151 HydrophobicContact SD-CB 4.19Å; M144-F151 HydrophobicContact SD-CD2 4.26Å; F151-N153 VanDerWaalsContact O-CG 3.3Å; F151-N153 PolarHBondContact O-N 3.05Å; F151-N153 VanDerWaalsContact O-N 3.07Å; F151-N153 PolarHBondContact O-ND2 3.48Å; F151-N153 PolarHBondContact O-OD1 3.44Å; F151-W237 AromaticContact CD2-CZ2 3.65Å; F151-W237 HydrophobicContact CD2-CZ2 3.65Å; F151-W237 AromaticContact CD2-NE1 3.84Å; F151-W237 AromaticContact CE2-CE2 3.91Å; F151-W237 AromaticContact CE2-CZ2 3.47Å; F151-W237 HydrophobicContact CE2-CZ2 3.47Å; F151-W237 VanDerWaalsContact CE2-CZ2 3.47Å; F151-W237 AromaticContact CE2-NE1 3.75Å; F151-L241 HydrophobicContact CD1-CD1 3.97Å; F151-L241 HydrophobicContact CE1-CD1 3.64Å; F151-L241 HydrophobicContact CE1-CD2 4.33Å; F151-L241 HydrophobicContact CE2-CD1 4.37Å; F151-L241 HydrophobicContact CE2-CD2 4.49Å; F151-L241 HydrophobicContact CG-CD1 4.47Å; F151-L241 HydrophobicContact CZ-CD1 3.86Å; F151-L241 HydrophobicContact CZ-CD2 3.87Å; F151-M385 HydrophobicContact CE1-SD 4.06Å; F151-M385 HydrophobicContact CZ-SD 3.85Å
152	N	98	Very high	97.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.			trans	-65	109	174	-169.1	-19.9	0	0	0	111.6	E146 R147 G148 N154 W158 R446	E146-N152 WeakPolarHBondContact CA-OD1 3.16Å; R147-N152 WeakPolarHBondContact O-CB 3.31Å; G148-N152 WeakPolarHBondContact O-CB 3.3Å; G148-N152 PolarHBondContact O-ND2 2.92Å; N152-N154 WeakPolarHBondContact OD1-CB 3.38Å; N152-N154 PolarHBondContact OD1-N 3.45Å; N152-N154 PolarHBondContact OD1-O 3.06Å; N152-W158 HydrophobicContact CB-CB 4.19Å; N152-R446 PolarHBondContact O-NH1 3.43Å; N152-R446 PolarHBondContact O-NH2 3.15Å
153	N	95.3	Very high	97.3	Very high	42 Å²	42	42 Å²	42	23%	0.225	22%	0.216	C	C	.	.			trans	-93.6	-6.3	-177.5	-61.6	-34	0	0	0	113.2	R132 F151 V155	R132-N153 VanDerWaalsContact C-OD1 3.25Å; R132-N153 WeakPolarHBondContact CA-OD1 3.35Å; R132-N153 PolarHBondContact N-OD1 2.97Å; R132-N153 VanDerWaalsContact N-OD1 3.09Å; R132-N153 PolarHBondContact O-OD1 3.28Å; F151-N153 VanDerWaalsContact O-CG 3.3Å; F151-N153 PolarHBondContact O-N 3.05Å; F151-N153 VanDerWaalsContact O-N 3.07Å; F151-N153 PolarHBondContact O-ND2 3.48Å; F151-N153 PolarHBondContact O-OD1 3.44Å; N153-V155 PolarHBondContact O-N 3.47Å; N153-V155 VanDerWaalsContact O-N 3.15Å
154	N	97.1	Very high	97.3	Very high	56 Å²	56	43.5 Å²	43.5	30%	0.299	22%	0.221	S	C	.	.			trans	-77.2	97.2	167.6	-178	-31.4	0	0	0	108.5	E146 N152 A156 L157 W158	E146-N154 HydrophobicContact CB-CB 4.16Å; E146-N154 HydrophobicContact CG-CB 4.02Å; N152-N154 WeakPolarHBondContact OD1-CB 3.38Å; N152-N154 PolarHBondContact OD1-N 3.45Å; N152-N154 PolarHBondContact OD1-O 3.06Å; N154-A156 VanDerWaalsContact C-N 3.28Å; N154-A156 PolarHBondContact O-N 2.88Å; N154-A156 PolarHBondContact OD1-N 2.64Å; N154-L157 HydrophobicContact CB-CB 4.14Å; N154-L157 PolarHBondContact O-N 3.18Å; N154-L157 PolarHBondContact OD1-N 2.89Å; N154-L157 VanDerWaalsContact OD1-N 3.14Å; N154-W158 VanDerWaalsContact O-CB 3.24Å; N154-W158 WeakPolarHBondContact O-CB 3.23Å; N154-W158 PolarHBondContact O-N 2.87Å
155	V	96.9	Very high	97.3	Very high	42 Å²	42	43.7 Å²	43.7	26%	0.255	22%	0.222	S	C	.	.	H	α-helix	trans	-60.2	-36.5	-171.4	179.2	0	0	0	0	112.5	N153 W158 K159 L389	N153-V155 PolarHBondContact O-N 3.47Å; N153-V155 VanDerWaalsContact O-N 3.15Å; V155-W158 HydrophobicContact CG1-CE3 4.42Å; V155-K159 VanDerWaalsContact O-CB 3.28Å; V155-K159 WeakPolarHBondContact O-CB 3.43Å; V155-K159 PolarHBondContact O-N 3.47Å; V155-L389 HydrophobicContact CG2-CD1 3.87Å; V155-L389 HydrophobicContact CG2-CD2 4.25Å
156	A	96.9	Very high	97.2	Very high	76 Å²	76	44.8 Å²	44.8	63%	0.628	23%	0.23	S	C	*	.	H	α-helix	trans	-66.4	-49.7	179.4	0	0	0	0	0	111	N154 K159 K160	N154-A156 VanDerWaalsContact C-N 3.28Å; N154-A156 PolarHBondContact O-N 2.88Å; N154-A156 PolarHBondContact OD1-N 2.64Å; A156-K159 PolarHBondContact O-N 3.27Å; A156-K160 PolarHBondContact O-N 3.49Å
157	L	97.1	Very high	96.9	Very high	42 Å²	42	45.8 Å²	45.8	22%	0.22	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-44	178.2	-177.5	58.3	0	0	0	111.7	E146 N154 K159 K160 I161	E146-L157 WeakPolarHBondContact O-CD2 3.21Å; N154-L157 HydrophobicContact CB-CB 4.14Å; N154-L157 PolarHBondContact O-N 3.18Å; N154-L157 PolarHBondContact OD1-N 2.89Å; N154-L157 VanDerWaalsContact OD1-N 3.14Å; L157-K159 VanDerWaalsContact C-N 3.28Å; L157-K159 PolarHBondContact O-N 2.93Å; L157-K160 PolarHBondContact O-N 3.19Å; L157-I161 HydrophobicContact CD1-CD1 3.78Å; L157-I161 HydrophobicContact CD1-CG1 3.97Å; L157-I161 HydrophobicContact CD2-CD1 4.32Å; L157-I161 HydrophobicContact CG-CD1 3.7Å; L157-I161 HydrophobicContact CG-CG1 4.27Å; L157-I161 WeakPolarHBondContact O-CG1 3.5Å; L157-I161 PolarHBondContact O-N 2.88Å
158	W	98.2	Very high	96.7	Very high	9 Å²	9	42 Å²	42	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-53.9	-44.7	173.8	167.4	81.9	0	0	0	111.8	I149 N152 N154 V155 K160 I161 R162 P445 R446	I149-W158 PolarHBondContact O-NE1 2.95Å; N152-W158 HydrophobicContact CB-CB 4.19Å; N154-W158 VanDerWaalsContact O-CB 3.24Å; N154-W158 WeakPolarHBondContact O-CB 3.23Å; N154-W158 PolarHBondContact O-N 2.87Å; V155-W158 HydrophobicContact CG1-CE3 4.42Å; W158-K160 VanDerWaalsContact C-N 3.34Å; W158-K160 PolarHBondContact O-N 3.01Å; W158-I161 PolarHBondContact O-N 3.28Å; W158-R162 WeakPolarHBondContact O-CB 3.46Å; W158-R162 PolarHBondContact O-N 2.88Å; W158-P445 WeakPolarHBondContact CH2-O 3.25Å; W158-R446 HydrophobicContact CH2-CB 3.78Å; W158-R446 HydrophobicContact CH2-CG 4.2Å; W158-R446 HydrophobicContact CZ2-CB 3.47Å; W158-R446 VanDerWaalsContact CZ2-CB 3.47Å; W158-R446 HydrophobicContact CZ2-CG 3.44Å; W158-R446 VanDerWaalsContact CZ2-CG 3.44Å
159	K	97.5	Very high	96.4	Very high	149 Å²	149	42.4 Å²	42.4	65%	0.648	22%	0.221	S	C	*	.	H	α-helix	trans	-65.5	-38.6	-178.6	-156.3	178.2	-172.3	-177	0	111.4	V155 A156 L157	V155-K159 VanDerWaalsContact O-CB 3.28Å; V155-K159 WeakPolarHBondContact O-CB 3.43Å; V155-K159 PolarHBondContact O-N 3.47Å; A156-K159 PolarHBondContact O-N 3.27Å; L157-K159 VanDerWaalsContact C-N 3.28Å; L157-K159 PolarHBondContact O-N 2.93Å
160	K	97.1	Very high	95.7	Very high	82 Å²	82	44.4 Å²	44.4	36%	0.357	23%	0.234	S	C	.	.	H	α-helix	trans	-65.3	-55.8	173.3	-175.1	-177.3	-178.7	-177.6	0	111.1	A156 L157 W158 R162 T163 E301	A156-K160 PolarHBondContact O-N 3.49Å; L157-K160 PolarHBondContact O-N 3.19Å; W158-K160 VanDerWaalsContact C-N 3.34Å; W158-K160 PolarHBondContact O-N 3.01Å; K160-R162 VanDerWaalsContact C-N 3.27Å; K160-R162 PolarHBondContact O-N 3.35Å; K160-T163 PolarHBondContact O-N 2.65Å; K160-T163 PolarHBondContact O-OG1 2.9Å; K160-E301 PolarHBondContact NZ-O 3.13Å; K160-E301 IonicContact NZ-OE2 2.98Å
161	I	98.1	Very high	94.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-37.9	-176.3	-65.2	175.2	0	0	0	111.4	I149 L157 W158 T163 Y164 F165 L302 N306 C310	I149-I161 HydrophobicContact CG2-CB 4Å; I149-I161 HydrophobicContact CG2-CG2 3.49Å; I149-I161 VanDerWaalsContact CG2-CG2 3.49Å; L157-I161 HydrophobicContact CD1-CD1 3.78Å; L157-I161 HydrophobicContact CD1-CG1 3.97Å; L157-I161 HydrophobicContact CD2-CD1 4.32Å; L157-I161 HydrophobicContact CG-CD1 3.7Å; L157-I161 HydrophobicContact CG-CG1 4.27Å; L157-I161 WeakPolarHBondContact O-CG1 3.5Å; L157-I161 PolarHBondContact O-N 2.88Å; W158-I161 PolarHBondContact O-N 3.28Å; I161-T163 PolarHBondContact O-N 2.86Å; I161-T163 VanDerWaalsContact O-N 3.11Å; I161-Y164 WeakPolarHBondContact O-CB 3.13Å; I161-Y164 PolarHBondContact O-N 3.4Å; I161-Y164 VanDerWaalsContact O-N 3.12Å; I161-F165 HydrophobicContact CG2-CD2 4.25Å; I161-F165 HydrophobicContact CG2-CE2 3.94Å; I161-L302 HydrophobicContact CG1-CD2 3.92Å; I161-N306 VanDerWaalsContact CD1-OD1 3.3Å; I161-N306 WeakPolarHBondContact CD1-OD1 3.46Å; I161-C310 WeakPolarHBondContact CG2-SG 3.49Å
162	R	97.8	Very high	93.6	Very high	32 Å²	32	49 Å²	49	12%	0.121	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-26.5	-179.5	-179.7	171.6	-179.2	81.7	-2.2	113.7	I149 W158 K160 Y164 F165 V166 P445 S447	I149-R162 HydrophobicContact CG2-CB 4.27Å; W158-R162 WeakPolarHBondContact O-CB 3.46Å; W158-R162 PolarHBondContact O-N 2.88Å; K160-R162 VanDerWaalsContact C-N 3.27Å; K160-R162 PolarHBondContact O-N 3.35Å; R162-Y164 VanDerWaalsContact C-N 3.29Å; R162-Y164 PolarHBondContact O-N 3.24Å; R162-F165 PolarHBondContact O-N 3.36Å; R162-V166 HydrophobicContact CG-CG2 4.1Å; R162-V166 WeakPolarHBondContact O-CG2 3.43Å; R162-V166 PolarHBondContact O-N 3.4Å; R162-P445 PolarHBondContact NE-O 2.81Å; R162-P445 PolarHBondContact NH2-O 3.38Å; R162-S447 PolarHBondContact NH1-O 2.9Å; R162-S447 PolarHBondContact NH2-O 3.26Å
163	T	96.7	Very high	92.3	Very high	83 Å²	83	51.6 Å²	51.6	51%	0.509	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-35.5	178.9	62.2	0	0	0	0	112	K160 I161 V166 K167	K160-T163 PolarHBondContact O-N 2.65Å; K160-T163 PolarHBondContact O-OG1 2.9Å; I161-T163 PolarHBondContact O-N 2.86Å; I161-T163 VanDerWaalsContact O-N 3.11Å; T163-V166 PolarHBondContact O-N 2.64Å; T163-K167 WeakPolarHBondContact O-CB 3.39Å; T163-K167 PolarHBondContact O-N 3.5Å
164	Y	96.3	Very high	91.2	Very high	33 Å²	33	51.5 Å²	51.5	13%	0.129	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-45.8	175.9	-67.5	-84.2	0	0	0	111.4	I161 R162 K167 A168 D292 L293 A296 E301 L302	I161-Y164 WeakPolarHBondContact O-CB 3.13Å; I161-Y164 PolarHBondContact O-N 3.4Å; I161-Y164 VanDerWaalsContact O-N 3.12Å; R162-Y164 VanDerWaalsContact C-N 3.29Å; R162-Y164 PolarHBondContact O-N 3.24Å; Y164-K167 PolarHBondContact O-N 2.9Å; Y164-A168 PolarHBondContact O-N 3.06Å; Y164-D292 HydrophobicContact CD1-CB 4.36Å; Y164-L293 HydrophobicContact CD1-CD2 4.05Å; Y164-L293 HydrophobicContact CD2-CD2 4.38Å; Y164-L293 HydrophobicContact CG-CD2 3.86Å; Y164-A296 HydrophobicContact CE1-CB 3.83Å; Y164-A296 WeakPolarHBondContact OH-CB 3.34Å; Y164-E301 PolarHBondContact OH-OE2 3.47Å; Y164-L302 HydrophobicContact CD2-CD1 4.32Å; Y164-L302 HydrophobicContact CE2-CD1 4.04Å; Y164-L302 HydrophobicContact CE2-CG 4.5Å
165	F	96.6	Very high	90	Very high	5 Å²	5	54.9 Å²	54.9	2%	0.022	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-43	175.3	-76.2	-98.3	0	0	0	112.4	I149 I161 R162 K167 A168 L169 F289 C310 E313 M314 V449	I149-F165 HydrophobicContact CB-CE2 4.47Å; I149-F165 HydrophobicContact CD1-CB 4.03Å; I149-F165 HydrophobicContact CD1-CD1 3.65Å; I149-F165 HydrophobicContact CD1-CD2 3.73Å; I149-F165 HydrophobicContact CD1-CE1 3.94Å; I149-F165 HydrophobicContact CD1-CE2 4.01Å; I149-F165 HydrophobicContact CD1-CG 3.53Å; I149-F165 HydrophobicContact CD1-CZ 4.1Å; I149-F165 HydrophobicContact CG1-CD1 4.38Å; I149-F165 HydrophobicContact CG1-CD2 4.1Å; I149-F165 HydrophobicContact CG1-CE1 4.2Å; I149-F165 HydrophobicContact CG1-CE2 3.89Å; I149-F165 HydrophobicContact CG1-CG 4.33Å; I149-F165 HydrophobicContact CG1-CZ 3.93Å; I149-F165 HydrophobicContact CG2-CD2 3.83Å; I149-F165 HydrophobicContact CG2-CE2 3.8Å; I161-F165 HydrophobicContact CG2-CD2 4.25Å; I161-F165 HydrophobicContact CG2-CE2 3.94Å; R162-F165 PolarHBondContact O-N 3.36Å; F165-K167 VanDerWaalsContact C-N 3.34Å; F165-A168 PolarHBondContact O-N 2.86Å; F165-L169 HydrophobicContact CB-CD1 4.49Å; F165-L169 HydrophobicContact CD1-CD1 4.47Å; F165-L169 VanDerWaalsContact O-CB 3.3Å; F165-L169 WeakPolarHBondContact O-CB 3.31Å; F165-L169 WeakPolarHBondContact O-CG 3.47Å; F165-L169 PolarHBondContact O-N 3.28Å; F165-F289 HydrophobicContact CD1-CE2 4.16Å; F165-F289 AromaticContact CD1-CZ 3.99Å; F165-F289 HydrophobicContact CD1-CZ 3.99Å; F165-F289 AromaticContact CD2-CE2 3.98Å; F165-F289 HydrophobicContact CD2-CE2 3.98Å; F165-F289 AromaticContact CD2-CZ 3.99Å; F165-F289 HydrophobicContact CD2-CZ 3.99Å; F165-F289 HydrophobicContact CE1-CE1 4.47Å; F165-F289 HydrophobicContact CE1-CE2 4.36Å; F165-F289 AromaticContact CE1-CZ 3.73Å; F165-F289 HydrophobicContact CE1-CZ 3.73Å; F165-F289 HydrophobicContact CE2-CE2 4.19Å; F165-F289 AromaticContact CE2-CZ 3.74Å; F165-F289 HydrophobicContact CE2-CZ 3.74Å; F165-F289 AromaticContact CG-CE2 3.97Å; F165-F289 HydrophobicContact CG-CE2 3.97Å; F165-F289 HydrophobicContact CG-CZ 4.12Å; F165-F289 HydrophobicContact CZ-CE1 4.46Å; F165-F289 HydrophobicContact CZ-CE2 4.39Å; F165-F289 AromaticContact CZ-CZ 3.61Å; F165-F289 HydrophobicContact CZ-CZ 3.61Å; F165-C310 HydrophobicContact CE2-CB 3.88Å; F165-C310 HydrophobicContact CZ-CB 3.97Å; F165-C310 WeakPolarHBondContact CZ-O 3.41Å; F165-E313 HydrophobicContact CZ-CB 4.27Å; F165-M314 HydrophobicContact CD1-CE 3.4Å; F165-M314 VanDerWaalsContact CD1-CE 3.4Å; F165-M314 HydrophobicContact CD1-SD 4.28Å; F165-M314 HydrophobicContact CE1-CB 4.17Å; F165-M314 HydrophobicContact CE1-CE 3.78Å; F165-M314 HydrophobicContact CE1-SD 4.35Å; F165-M314 HydrophobicContact CG-CE 4.24Å; F165-V449 HydrophobicContact CB-CG1 4.18Å; F165-V449 HydrophobicContact CB-CG2 3.82Å; F165-V449 HydrophobicContact CD1-CG1 4.33Å
166	V	95	Very high	89.2	Confident	58 Å²	58	58.8 Å²	58.8	35%	0.352	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-43.5	178.1	171.4	0	0	0	0	110.5	R162 T163 A168 L169 T170 V449	R162-V166 HydrophobicContact CG-CG2 4.1Å; R162-V166 WeakPolarHBondContact O-CG2 3.43Å; R162-V166 PolarHBondContact O-N 3.4Å; T163-V166 PolarHBondContact O-N 2.64Å; V166-A168 PolarHBondContact O-N 2.96Å; V166-L169 PolarHBondContact O-N 2.88Å; V166-T170 HydrophobicContact CG1-CG2 4.34Å; V166-T170 WeakPolarHBondContact O-CB 3.19Å; V166-T170 WeakPolarHBondContact O-CG2 3.48Å; V166-T170 PolarHBondContact O-N 2.97Å; V166-T170 PolarHBondContact O-OG1 3.26Å; V166-V449 HydrophobicContact CB-CG2 4.4Å; V166-V449 HydrophobicContact CG2-CG2 3.68Å
167	K	92.5	Very high	88.7	Confident	113 Å²	113	55.3 Å²	55.3	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-58.2	-47.6	176.4	-176.3	-170.4	174	-159.5	0	111	T163 Y164 F165 L169 D292	T163-K167 WeakPolarHBondContact O-CB 3.39Å; T163-K167 PolarHBondContact O-N 3.5Å; Y164-K167 PolarHBondContact O-N 2.9Å; F165-K167 VanDerWaalsContact C-N 3.34Å; K167-L169 PolarHBondContact O-N 3Å; K167-D292 WeakPolarHBondContact CD-OD2 3.38Å; K167-D292 WeakPolarHBondContact CE-OD2 3.45Å; K167-D292 IonicContact NZ-OD1 2.8Å; K167-D292 PolarHBondContact NZ-OD1 3.15Å; K167-D292 IonicContact NZ-OD2 2.61Å; K167-D292 PolarHBondContact NZ-OD2 3.42Å
168	A	92.1	Very high	88.6	Confident	3 Å²	3	53.4 Å²	53.4	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-36.3	-178.7	0	0	0	0	0	113.7	Y164 F165 V166 N173 F216 F289 M314	Y164-A168 PolarHBondContact O-N 3.06Å; F165-A168 PolarHBondContact O-N 2.86Å; V166-A168 PolarHBondContact O-N 2.96Å; A168-N173 WeakPolarHBondContact O-CB 3.3Å; A168-N173 PolarHBondContact O-ND2 2.94Å; A168-F216 HydrophobicContact CB-CD1 4.37Å; A168-F216 HydrophobicContact CB-CE1 4.43Å; A168-F289 HydrophobicContact CB-CB 3.78Å; A168-F289 HydrophobicContact CB-CD2 3.59Å; A168-F289 HydrophobicContact CB-CG 4.03Å; A168-M314 HydrophobicContact CB-CE 4.3Å
169	L	91.3	Very high	88.3	Confident	9 Å²	9	59.7 Å²	59.7	5%	0.047	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	11.2	-171.2	-64.4	166.2	0	0	0	113.9	F165 V166 K167 F216 M314 V449 V453	F165-L169 HydrophobicContact CB-CD1 4.49Å; F165-L169 HydrophobicContact CD1-CD1 4.47Å; F165-L169 VanDerWaalsContact O-CB 3.3Å; F165-L169 WeakPolarHBondContact O-CB 3.31Å; F165-L169 WeakPolarHBondContact O-CG 3.47Å; F165-L169 PolarHBondContact O-N 3.28Å; V166-L169 PolarHBondContact O-N 2.88Å; K167-L169 PolarHBondContact O-N 3Å; L169-F216 HydrophobicContact CD2-CE1 3.69Å; L169-F216 HydrophobicContact CD2-CE2 4.16Å; L169-F216 HydrophobicContact CD2-CZ 3.33Å; L169-F216 HydrophobicContact CG-CE1 4.47Å; L169-M314 HydrophobicContact CD1-CE 3.96Å; L169-M314 HydrophobicContact CD1-SD 4.17Å; L169-M314 HydrophobicContact CD2-CE 4.39Å; L169-M314 HydrophobicContact CD2-SD 4.15Å; L169-M314 HydrophobicContact CG-CE 4.08Å; L169-M314 HydrophobicContact CG-SD 4.4Å; L169-V449 HydrophobicContact CD1-CB 4.24Å; L169-V449 HydrophobicContact CD1-CG1 3.64Å; L169-V449 HydrophobicContact CD1-CG2 3.93Å; L169-V453 HydrophobicContact CB-CG2 4.17Å; L169-V453 HydrophobicContact CD2-CB 4.2Å; L169-V453 HydrophobicContact CD2-CG1 4.29Å; L169-V453 HydrophobicContact CD2-CG2 3.86Å; L169-V453 WeakPolarHBondContact O-CG2 3.43Å
170	T	84.5	Confident	88.2	Confident	52 Å²	52	53.9 Å²	53.9	32%	0.319	29%	0.287	S	S	.	.	S	Bend	trans	-138.2	170.4	178.3	66	0	0	0	0	111.9	V166	V166-T170 HydrophobicContact CG1-CG2 4.34Å; V166-T170 WeakPolarHBondContact O-CB 3.19Å; V166-T170 WeakPolarHBondContact O-CG2 3.48Å; V166-T170 PolarHBondContact O-N 2.97Å; V166-T170 PolarHBondContact O-OG1 3.26Å
171	G	78.9	Confident	88.2	Confident	49 Å²	49	50 Å²	50	51%	0.505	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-141.1	172.9	0	0	0	0	0	113.5	N173 L174	G171-N173 VanDerWaalsContact C-N 3.29Å; G171-N173 PolarHBondContact O-N 2.89Å; G171-L174 VanDerWaalsContact O-CB 3.3Å; G171-L174 WeakPolarHBondContact O-CB 3.36Å; G171-L174 PolarHBondContact O-N 2.76Å; G171-L174 VanDerWaalsContact O-N 3.16Å
172	P	71.4	Confident	88.1	Confident	95 Å²	95	50.3 Å²	50.3	62%	0.617	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.3	-171.7	25	-32.9	0	0	0	113.5	L174 Q175	P172-L174 PolarHBondContact O-N 2.8Å; P172-L174 VanDerWaalsContact O-N 3.15Å; P172-Q175 WeakPolarHBondContact O-CB 3.44Å; P172-Q175 PolarHBondContact O-N 3.42Å
173	N	70.4	Confident	88.1	Confident	54 Å²	54	51 Å²	51	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-26.4	177	-63.5	-6.7	0	0	0	112.6	A168 G171 Q175 T177	A168-N173 WeakPolarHBondContact O-CB 3.3Å; A168-N173 PolarHBondContact O-ND2 2.94Å; G171-N173 VanDerWaalsContact C-N 3.29Å; G171-N173 PolarHBondContact O-N 2.89Å; N173-Q175 VanDerWaalsContact C-N 3.25Å; N173-Q175 PolarHBondContact O-N 2.77Å; N173-T177 PolarHBondContact O-N 3.01Å; N173-T177 PolarHBondContact O-OG1 2.57Å
174	L	71.8	Confident	88.1	Confident	39 Å²	39	47 Å²	47	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-26.6	176.1	-166.1	68.2	0	0	0	112.1	G171 P172 T177 H452 V453 V456	G171-L174 VanDerWaalsContact O-CB 3.3Å; G171-L174 WeakPolarHBondContact O-CB 3.36Å; G171-L174 PolarHBondContact O-N 2.76Å; G171-L174 VanDerWaalsContact O-N 3.16Å; P172-L174 PolarHBondContact O-N 2.8Å; P172-L174 VanDerWaalsContact O-N 3.15Å; L174-T177 WeakPolarHBondContact CA-OG1 3.46Å; L174-T177 VanDerWaalsContact O-CB 3.27Å; L174-T177 WeakPolarHBondContact O-CB 3.45Å; L174-T177 PolarHBondContact O-N 3.36Å; L174-T177 PolarHBondContact O-OG1 3.34Å; L174-H452 HydrophobicContact CD2-CB 4.36Å; L174-V453 HydrophobicContact CD1-CB 4.17Å; L174-V453 HydrophobicContact CD1-CG2 3.42Å; L174-V453 VanDerWaalsContact CD1-CG2 3.42Å; L174-V456 HydrophobicContact CD1-CB 4.39Å; L174-V456 HydrophobicContact CD1-CG2 3.83Å; L174-V456 HydrophobicContact CD2-CG2 4.45Å; L174-V456 HydrophobicContact CG-CG2 4.16Å
175	Q	73.7	Confident	88.2	Confident	128 Å²	128	45.6 Å²	45.6	60%	0.598	25%	0.252	S	S	*	.	H	α-helix	trans	-71.4	-40.5	-178.2	-59.1	-173.6	-18.3	0	0	111.7	P172 N173 T177	P172-Q175 WeakPolarHBondContact O-CB 3.44Å; P172-Q175 PolarHBondContact O-N 3.42Å; N173-Q175 VanDerWaalsContact C-N 3.25Å; N173-Q175 PolarHBondContact O-N 2.77Å; Q175-T177 PolarHBondContact O-N 3.36Å
176	Q	79.9	Confident	88.2	Confident	123 Å²	123	47.9 Å²	47.9	58%	0.575	26%	0.262	S	S	*	.	H	α-helix	trans	-70.1	-22.6	175.3	-68.3	174.5	-15.8	0	0	112.5	V178 E179 V180	Q176-V178 PolarHBondContact O-N 2.97Å; Q176-E179 PolarHBondContact O-N 3.4Å; Q176-V180 WeakPolarHBondContact O-CG2 3.42Å; Q176-V180 PolarHBondContact O-N 3.4Å; Q176-V180 VanDerWaalsContact O-N 3.13Å
177	T	86.8	Confident	88.3	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-55.6	-38.3	-178.9	-56.9	0	0	0	0	111.8	N173 L174 Q175 C181 L215 V453 V456 M457	N173-T177 PolarHBondContact O-N 3.01Å; N173-T177 PolarHBondContact O-OG1 2.57Å; L174-T177 WeakPolarHBondContact CA-OG1 3.46Å; L174-T177 VanDerWaalsContact O-CB 3.27Å; L174-T177 WeakPolarHBondContact O-CB 3.45Å; L174-T177 PolarHBondContact O-N 3.36Å; L174-T177 PolarHBondContact O-OG1 3.34Å; Q175-T177 PolarHBondContact O-N 3.36Å; T177-C181 VanDerWaalsContact O-CB 3.31Å; T177-C181 WeakPolarHBondContact O-CB 3.37Å; T177-C181 PolarHBondContact O-N 3.44Å; T177-C181 PolarHBondContact O-SG 3.4Å; T177-L215 HydrophobicContact CG2-CD1 4.02Å; T177-V453 HydrophobicContact CG2-CG1 4.25Å; T177-V456 HydrophobicContact CG2-CB 4.31Å; T177-V456 HydrophobicContact CG2-CG1 3.62Å; T177-M457 HydrophobicContact CG2-CG 4.29Å
178	V	93.2	Very high	88.5	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-48.8	-177.7	-177.4	0	0	0	0	111.7	Q176 V180 C181 V182 M356 N358 L361 V456	Q176-V178 PolarHBondContact O-N 2.97Å; V178-V180 PolarHBondContact O-N 3.41Å; V178-C181 PolarHBondContact O-N 3.49Å; V178-V182 HydrophobicContact CG1-CG2 4.41Å; V178-V182 VanDerWaalsContact O-CG2 3.29Å; V178-V182 WeakPolarHBondContact O-CG2 3.31Å; V178-V182 PolarHBondContact O-N 3.3Å; V178-M356 HydrophobicContact CG1-CE 3.63Å; V178-N358 HydrophobicContact CB-CB 4.47Å; V178-N358 HydrophobicContact CG2-CB 4.01Å; V178-L361 HydrophobicContact CG2-CD1 3.5Å; V178-L361 HydrophobicContact CG2-CG 4.36Å; V178-V456 HydrophobicContact CG2-CG1 3.7Å
179	E	93.3	Very high	88.7	Confident	140 Å²	140	43.4 Å²	43.4	65%	0.654	24%	0.243	S	C	*	.	H	α-helix	trans	-61.9	-45.7	180	-176	176.9	-177.9	0	0	111.1	Q176 C181 V182 S183	Q176-E179 PolarHBondContact O-N 3.4Å; E179-C181 PolarHBondContact O-N 2.93Å; E179-V182 PolarHBondContact O-N 2.91Å; E179-S183 VanDerWaalsContact O-CB 3.3Å; E179-S183 WeakPolarHBondContact O-CB 3.27Å; E179-S183 PolarHBondContact O-N 3.45Å
180	V	95.2	Very high	88.9	Confident	28 Å²	28	47.9 Å²	47.9	17%	0.17	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-43.8	176.3	176.3	0	0	0	0	111.2	Q176 V178 S184 I211 R214 L215	Q176-V180 WeakPolarHBondContact O-CG2 3.42Å; Q176-V180 PolarHBondContact O-N 3.4Å; Q176-V180 VanDerWaalsContact O-N 3.13Å; V178-V180 PolarHBondContact O-N 3.41Å; V180-S184 WeakPolarHBondContact O-CB 3.37Å; V180-S184 PolarHBondContact O-N 3.28Å; V180-I211 HydrophobicContact CG1-CB 4.49Å; V180-I211 HydrophobicContact CG1-CG1 4.48Å; V180-I211 HydrophobicContact CG1-CG2 4.21Å; V180-R214 HydrophobicContact CG1-CB 3.79Å; V180-L215 HydrophobicContact CB-CD2 4.14Å; V180-L215 HydrophobicContact CG1-CD2 4.29Å; V180-L215 HydrophobicContact CG1-CG 4.18Å; V180-L215 HydrophobicContact CG2-CD2 3.93Å
181	C	96.8	Very high	89.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-48	177.6	-70.4	0	0	0	0	111.7	T177 V178 E179 T185 I211 M457 S460	T177-C181 VanDerWaalsContact O-CB 3.31Å; T177-C181 WeakPolarHBondContact O-CB 3.37Å; T177-C181 PolarHBondContact O-N 3.44Å; T177-C181 PolarHBondContact O-SG 3.4Å; V178-C181 PolarHBondContact O-N 3.49Å; E179-C181 PolarHBondContact O-N 2.93Å; C181-T185 VanDerWaalsContact O-CB 3.24Å; C181-T185 WeakPolarHBondContact O-CB 3.44Å; C181-T185 PolarHBondContact O-N 3.39Å; C181-T185 PolarHBondContact O-OG1 3.49Å; C181-I211 HydrophobicContact CB-CD1 4.14Å; C181-M457 VanDerWaalsContact SG-CG 3.59Å; C181-S460 VanDerWaalsContact CB-CB 3.45Å
182	V	96.1	Very high	90	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-46.8	-178.9	178.1	0	0	0	0	110.5	V178 E179 T185 Q186 Q355 M356 T464	V178-V182 HydrophobicContact CG1-CG2 4.41Å; V178-V182 VanDerWaalsContact O-CG2 3.29Å; V178-V182 WeakPolarHBondContact O-CG2 3.31Å; V178-V182 PolarHBondContact O-N 3.3Å; E179-V182 PolarHBondContact O-N 2.91Å; V182-T185 PolarHBondContact O-N 2.91Å; V182-Q186 WeakPolarHBondContact O-CB 3.35Å; V182-Q186 PolarHBondContact O-N 3.25Å; V182-Q355 HydrophobicContact CG1-CG 3.64Å; V182-M356 HydrophobicContact CG2-CB 4.27Å; V182-M356 HydrophobicContact CG2-CE 3.33Å; V182-T464 HydrophobicContact CG1-CG2 4.31Å
183	S	97.1	Very high	90.7	Very high	46 Å²	46	54.6 Å²	54.6	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-50	179.7	172.4	0	0	0	0	111.8	E179 T185 Q186 T187	E179-S183 VanDerWaalsContact O-CB 3.3Å; E179-S183 WeakPolarHBondContact O-CB 3.27Å; E179-S183 PolarHBondContact O-N 3.45Å; S183-T185 PolarHBondContact O-N 2.92Å; S183-Q186 PolarHBondContact O-N 3.05Å; S183-T187 PolarHBondContact O-N 2.6Å; S183-T187 PolarHBondContact O-OG1 3.41Å; S183-T187 VanDerWaalsContact O-OG1 3.06Å
184	S	97.6	Very high	91.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-45.5	178.9	179	0	0	0	0	111.5	V180 Q186 T187 H188 T207 D210	V180-S184 WeakPolarHBondContact O-CB 3.37Å; V180-S184 PolarHBondContact O-N 3.28Å; S184-Q186 VanDerWaalsContact C-N 3.32Å; S184-Q186 PolarHBondContact O-N 3.14Å; S184-T187 PolarHBondContact O-N 3.1Å; S184-H188 PolarHBondContact O-N 3.48Å; S184-H188 PolarHBondContact O-ND1 3.41Å; S184-T207 PolarHBondContact OG-O 2.85Å; S184-D210 VanDerWaalsContact CB-OD2 3.23Å; S184-D210 WeakPolarHBondContact CB-OD2 3.49Å; S184-D210 PolarHBondContact OG-OD2 2.88Å
185	T	97.8	Very high	92.4	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-44.8	176.9	-54.3	0	0	0	0	111	C181 V182 S183 H188 L189 I461 T464	C181-T185 VanDerWaalsContact O-CB 3.24Å; C181-T185 WeakPolarHBondContact O-CB 3.44Å; C181-T185 PolarHBondContact O-N 3.39Å; C181-T185 PolarHBondContact O-OG1 3.49Å; V182-T185 PolarHBondContact O-N 2.91Å; S183-T185 PolarHBondContact O-N 2.92Å; T185-H188 PolarHBondContact O-N 3.18Å; T185-L189 HydrophobicContact CG2-CD1 3.89Å; T185-L189 HydrophobicContact CG2-CG 4.41Å; T185-L189 VanDerWaalsContact O-CG 3.25Å; T185-L189 WeakPolarHBondContact O-CG 3.48Å; T185-L189 PolarHBondContact O-N 2.86Å; T185-I461 HydrophobicContact CG2-CG2 4.27Å; T185-I461 WeakPolarHBondContact OG1-CG1 3.44Å; T185-T464 HydrophobicContact CG2-CG2 3.88Å
186	Q	96.7	Very high	93	Very high	53 Å²	53	52.2 Å²	52.2	25%	0.248	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-48.9	178.6	-169.9	65.4	50	0	0	111.7	V182 S183 S184 H188 L189 D190	V182-Q186 WeakPolarHBondContact O-CB 3.35Å; V182-Q186 PolarHBondContact O-N 3.25Å; S183-Q186 PolarHBondContact O-N 3.05Å; S184-Q186 VanDerWaalsContact C-N 3.32Å; S184-Q186 PolarHBondContact O-N 3.14Å; Q186-H188 PolarHBondContact O-N 3.26Å; Q186-L189 PolarHBondContact O-N 3.26Å; Q186-L189 VanDerWaalsContact O-N 3.11Å; Q186-D190 PolarHBondContact NE2-OD1 3.27Å; Q186-D190 WeakPolarHBondContact O-CB 3.27Å; Q186-D190 PolarHBondContact O-N 3.48Å
187	T	97.4	Very high	93.4	Very high	55 Å²	55	51.3 Å²	51.3	34%	0.337	28%	0.284	S	S	.	.	H	α-helix	trans	-55.9	-41.6	178.7	-61	0	0	0	0	111.8	S183 S184 N191	S183-T187 PolarHBondContact O-N 2.6Å; S183-T187 PolarHBondContact O-OG1 3.41Å; S183-T187 VanDerWaalsContact O-OG1 3.06Å; S184-T187 PolarHBondContact O-N 3.1Å; T187-N191 WeakPolarHBondContact O-CB 3.47Å; T187-N191 VanDerWaalsContact O-CG 3.24Å; T187-N191 PolarHBondContact O-N 3.42Å; T187-N191 PolarHBondContact O-ND2 3.39Å
188	H	97.3	Very high	93.6	Very high	20 Å²	20	51.3 Å²	51.3	9%	0.093	28%	0.284	C	S	.	.	H	α-helix	trans	-71.1	-36	178.9	-76.1	82.3	0	0	0	113.2	S184 T185 Q186 L203 T207 D210 E223	S184-H188 PolarHBondContact O-N 3.48Å; S184-H188 PolarHBondContact O-ND1 3.41Å; T185-H188 PolarHBondContact O-N 3.18Å; Q186-H188 PolarHBondContact O-N 3.26Å; H188-L203 HydrophobicContact CB-CD1 3.74Å; H188-T207 WeakPolarHBondContact CB-OG1 3.45Å; H188-D210 IonicContact CE1-OD2 3.17Å; H188-E223 IonicContact CE1-OE1 2.7Å; H188-E223 IonicContact CE1-OE2 3.59Å; H188-E223 IonicContact NE2-OE1 3.33Å; H188-E223 IonicContact NE2-OE2 3.38Å; H188-E223 PolarHBondContact NE2-OE2 3.49Å
189	L	96	Very high	93.5	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-68.5	-39.3	175.1	-70.5	170.7	0	0	0	112.1	T185 Q186 N191 L192 L203 L465 Y469 F506	T185-L189 HydrophobicContact CG2-CD1 3.89Å; T185-L189 HydrophobicContact CG2-CG 4.41Å; T185-L189 VanDerWaalsContact O-CG 3.25Å; T185-L189 WeakPolarHBondContact O-CG 3.48Å; T185-L189 PolarHBondContact O-N 2.86Å; Q186-L189 PolarHBondContact O-N 3.26Å; Q186-L189 VanDerWaalsContact O-N 3.11Å; L189-N191 PolarHBondContact O-N 3.2Å; L189-L192 HydrophobicContact CD2-CD1 4.1Å; L189-L192 WeakPolarHBondContact O-CG 3.35Å; L189-L192 PolarHBondContact O-N 3.38Å; L189-L203 HydrophobicContact CD2-CD2 4.16Å; L189-L465 HydrophobicContact CD2-CD1 4.45Å; L189-Y469 HydrophobicContact CB-CE2 4.26Å; L189-Y469 HydrophobicContact CD1-CD2 4.41Å; L189-Y469 HydrophobicContact CD1-CE2 4.19Å; L189-Y469 HydrophobicContact CD2-CD2 4.22Å; L189-Y469 HydrophobicContact CD2-CE2 4.07Å; L189-Y469 HydrophobicContact CG-CE2 4.41Å; L189-F506 HydrophobicContact CD2-CD2 4.42Å; L189-F506 HydrophobicContact CD2-CE2 3.96Å
190	D	95.1	Very high	93.5	Very high	103 Å²	103	48 Å²	48	55%	0.551	27%	0.27	S	S	*	.	H	α-helix	trans	-67.4	-26.9	179.6	-66.8	-16.5	0	0	0	112.4	Q186	Q186-D190 PolarHBondContact NE2-OD1 3.27Å; Q186-D190 WeakPolarHBondContact O-CB 3.27Å; Q186-D190 PolarHBondContact O-N 3.48Å
191	N	93.9	Very high	93.3	Very high	118 Å²	118	46.7 Å²	46.7	63%	0.631	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	10.6	-179.5	-69.6	-29.5	0	0	0	113.8	T187 L189 D193	T187-N191 WeakPolarHBondContact O-CB 3.47Å; T187-N191 VanDerWaalsContact O-CG 3.24Å; T187-N191 PolarHBondContact O-N 3.42Å; T187-N191 PolarHBondContact O-ND2 3.39Å; L189-N191 PolarHBondContact O-N 3.2Å; N191-D193 PolarHBondContact O-N 2.95Å
192	L	92.8	Very high	93.1	Very high	44 Å²	44	49 Å²	49	23%	0.23	28%	0.278	C	S	.	.			trans	-70.6	120.5	176.7	-73.3	175.4	0	0	0	111.3	L189 S194 L195 V198 L203 F506	L189-L192 HydrophobicContact CD2-CD1 4.1Å; L189-L192 WeakPolarHBondContact O-CG 3.35Å; L189-L192 PolarHBondContact O-N 3.38Å; L192-S194 VanDerWaalsContact C-N 3.28Å; L192-S194 PolarHBondContact O-N 3.39Å; L192-L195 HydrophobicContact CB-CD2 4.36Å; L192-L195 HydrophobicContact CD1-CD2 3.97Å; L192-V198 HydrophobicContact CD1-CG1 4.42Å; L192-V198 HydrophobicContact CD1-CG2 4.26Å; L192-V198 HydrophobicContact CD2-CG1 3.96Å; L192-L203 HydrophobicContact CD1-CD2 4.41Å; L192-L203 HydrophobicContact CD2-CD1 4.13Å; L192-L203 HydrophobicContact CD2-CD2 4.35Å; L192-F506 HydrophobicContact CD1-CD2 4.02Å; L192-F506 HydrophobicContact CD1-CE2 4.18Å
193	D	85.5	Confident	93.1	Very high	176 Å²	176	49.5 Å²	49.5	94%	0.941	28%	0.281	S	S	*	.	S	Bend	trans	-65	-31	177.8	-65.4	-43.1	0	0	0	113.1	N191	N191-D193 PolarHBondContact O-N 2.95Å
194	S	88.1	Confident	93.1	Very high	55 Å²	55	47.4 Å²	47.4	39%	0.385	27%	0.266	S	S	.	.			trans	-151.4	133.6	-179.2	178.7	0	0	0	0	111	L192 A196 V198	L192-S194 VanDerWaalsContact C-N 3.28Å; L192-S194 PolarHBondContact O-N 3.39Å; S194-A196 VanDerWaalsContact C-N 3.34Å; S194-A196 PolarHBondContact OG-N 2.98Å; S194-A196 VanDerWaalsContact OG-N 3.12Å; S194-V198 WeakPolarHBondContact O-CG2 3.25Å
195	L	89.6	Confident	93	Very high	52 Å²	52	48.2 Å²	48.2	27%	0.272	27%	0.269	S	S	.	.	S	Bend	trans	-85.1	-10.4	170.7	-58.9	179.8	0	0	0	112.4	L192 Y469 R505 F506 P508	L192-L195 HydrophobicContact CB-CD2 4.36Å; L192-L195 HydrophobicContact CD1-CD2 3.97Å; L195-Y469 HydrophobicContact CD1-CE1 3.91Å; L195-Y469 HydrophobicContact CD2-CE1 3.88Å; L195-R505 CarbonylContact O-C 3.56Å; L195-R505 WeakPolarHBondContact O-CA 3.22Å; L195-F506 HydrophobicContact CB-CB 4.36Å; L195-F506 WeakPolarHBondContact CB-O 3.48Å; L195-F506 HydrophobicContact CD2-CB 4.15Å; L195-F506 PolarHBondContact O-N 3.4Å; L195-P508 HydrophobicContact CD1-CG 3.77Å
196	A	87	Confident	93	Very high	63 Å²	63	48.8 Å²	48.8	52%	0.521	27%	0.273	S	S	.	.	S	Bend	trans	-78.2	-31.9	-178.5	0	0	0	0	0	112.8	S194	S194-A196 VanDerWaalsContact C-N 3.34Å; S194-A196 PolarHBondContact OG-N 2.98Å; S194-A196 VanDerWaalsContact OG-N 3.12Å
197	H	87.5	Confident	93	Very high	104 Å²	104	46.4 Å²	46.4	48%	0.481	26%	0.262	S	S	.	.	S	Bend	trans	-142.1	89.4	-177.2	-172.7	88	0	0	0	109	S503	H197-S503 WeakPolarHBondContact CE1-CB 3.22Å; H197-S503 PolarHBondContact CE1-OG 2.91Å; H197-S503 WeakPolarHBondContact ND1-CB 3.45Å; H197-S503 PolarHBondContact ND1-OG 3.01Å
198	V	91.3	Very high	93	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-100.1	121	178.3	-176.6	0	0	0	0	108.3	L192 S194 V200 L203 S503 M504 F506	L192-V198 HydrophobicContact CD1-CG1 4.42Å; L192-V198 HydrophobicContact CD1-CG2 4.26Å; L192-V198 HydrophobicContact CD2-CG1 3.96Å; S194-V198 WeakPolarHBondContact O-CG2 3.25Å; V198-V200 VanDerWaalsContact C-N 3.27Å; V198-V200 HydrophobicContact CB-CG2 4.24Å; V198-V200 HydrophobicContact CG1-CG2 4.01Å; V198-V200 PolarHBondContact O-N 3.26Å; V198-L203 HydrophobicContact CG1-CB 4.47Å; V198-L203 HydrophobicContact CG1-CD2 3.91Å; V198-S503 WeakPolarHBondContact O-CA 3.33Å; V198-M504 WeakPolarHBondContact CB-O 3.41Å; V198-M504 PolarHBondContact N-O 2.92Å; V198-M504 PolarHBondContact O-N 3.37Å; V198-F506 HydrophobicContact CB-CD1 4.44Å; V198-F506 HydrophobicContact CB-CE1 4.33Å; V198-F506 HydrophobicContact CB-CZ 4.44Å; V198-F506 HydrophobicContact CG1-CE1 4.37Å; V198-F506 HydrophobicContact CG1-CE2 4.15Å; V198-F506 HydrophobicContact CG1-CZ 4.01Å; V198-F506 HydrophobicContact CG2-CB 4.41Å; V198-F506 HydrophobicContact CG2-CD1 4.21Å; V198-F506 HydrophobicContact CG2-CD2 4.13Å; V198-F506 HydrophobicContact CG2-CE2 4.46Å; V198-F506 HydrophobicContact CG2-CG 4Å
199	D	91.4	Very high	93	Very high	74 Å²	74	42.9 Å²	42.9	40%	0.396	24%	0.242	S	C	.	.			trans	-72	89.1	162.3	-179.6	-10.9	0	0	0	108.3	L201 S202 L203	D199-L201 VanDerWaalsContact C-N 3.28Å; D199-L201 PolarHBondContact O-N 3.45Å; D199-L201 PolarHBondContact OD1-N 3.38Å; D199-S202 PolarHBondContact O-N 2.82Å; D199-S202 PolarHBondContact OD1-N 3.33Å; D199-S202 PolarHBondContact OD1-OG 3.15Å; D199-S202 WeakPolarHBondContact OD2-CB 3.42Å; D199-S202 PolarHBondContact OD2-OG 3.02Å; D199-L203 WeakPolarHBondContact O-CB 3.19Å; D199-L203 PolarHBondContact O-N 3.2Å
200	V	92.4	Very high	93.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-35.9	-174.1	175.1	0	0	0	0	111.4	V198 L203 L204 F327 L330 M504 F506	V198-V200 VanDerWaalsContact C-N 3.27Å; V198-V200 HydrophobicContact CB-CG2 4.24Å; V198-V200 HydrophobicContact CG1-CG2 4.01Å; V198-V200 PolarHBondContact O-N 3.26Å; V200-L203 PolarHBondContact O-N 2.91Å; V200-L204 HydrophobicContact CG1-CD1 3.68Å; V200-L204 HydrophobicContact CG1-CG 4.12Å; V200-L204 WeakPolarHBondContact O-CB 3.39Å; V200-L204 WeakPolarHBondContact O-CG 3.44Å; V200-L204 PolarHBondContact O-N 3.46Å; V200-F327 HydrophobicContact CB-CD2 4.38Å; V200-F327 HydrophobicContact CG1-CD2 4.22Å; V200-L330 HydrophobicContact CG1-CD1 3.66Å; V200-M504 HydrophobicContact CB-CG 4.4Å; V200-M504 HydrophobicContact CB-SD 4.21Å; V200-M504 HydrophobicContact CG1-SD 4.27Å; V200-M504 HydrophobicContact CG2-CB 3.57Å; V200-M504 HydrophobicContact CG2-CG 3.65Å; V200-M504 HydrophobicContact CG2-SD 3.74Å; V200-F506 HydrophobicContact CG2-CE1 3.6Å; V200-F506 HydrophobicContact CG2-CZ 3.81Å
201	L	92.4	Very high	93.1	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-69.7	-43.1	-178.6	-176	56.1	0	0	0	110.9	D199 L204 R205 I324 F327 E494	D199-L201 VanDerWaalsContact C-N 3.28Å; D199-L201 PolarHBondContact O-N 3.45Å; D199-L201 PolarHBondContact OD1-N 3.38Å; L201-L204 PolarHBondContact O-N 2.82Å; L201-R205 HydrophobicContact CD1-CG 4.5Å; L201-R205 WeakPolarHBondContact O-CB 3.44Å; L201-R205 WeakPolarHBondContact O-CG 3.18Å; L201-R205 PolarHBondContact O-N 2.79Å; L201-I324 HydrophobicContact CD1-CG1 4.09Å; L201-F327 HydrophobicContact CB-CD2 4.21Å; L201-F327 HydrophobicContact CD1-CB 4.28Å; L201-E494 VanDerWaalsContact CD2-CD 3.44Å; L201-E494 HydrophobicContact CD2-CG 4.14Å; L201-E494 WeakPolarHBondContact CD2-OE1 3.49Å
202	S	93.1	Very high	93.1	Very high	47 Å²	47	32.8 Å²	32.8	33%	0.329	19%	0.188	S	C	.	.	H	α-helix	trans	-63	-44.7	172.6	-68.8	0	0	0	0	112.1	D199 L204 R205 C206	D199-S202 PolarHBondContact O-N 2.82Å; D199-S202 PolarHBondContact OD1-N 3.33Å; D199-S202 PolarHBondContact OD1-OG 3.15Å; D199-S202 WeakPolarHBondContact OD2-CB 3.42Å; D199-S202 PolarHBondContact OD2-OG 3.02Å; S202-L204 VanDerWaalsContact C-N 3.34Å; S202-L204 PolarHBondContact O-N 3.49Å; S202-R205 PolarHBondContact O-N 3.49Å; S202-C206 PolarHBondContact O-N 2.7Å; S202-C206 PolarHBondContact O-SG 3.05Å; S202-C206 VanDerWaalsContact O-SG 3.4Å
203	L	95.3	Very high	93.2	Very high	18 Å²	18	31.3 Å²	31.3	9%	0.094	18%	0.18	C	C	.	.	H	α-helix	trans	-54.7	-49.6	175.3	171.2	64.8	0	0	0	111.6	H188 L189 L192 V198 D199 V200 C206 T207 F506	H188-L203 HydrophobicContact CB-CD1 3.74Å; L189-L203 HydrophobicContact CD2-CD2 4.16Å; L192-L203 HydrophobicContact CD1-CD2 4.41Å; L192-L203 HydrophobicContact CD2-CD1 4.13Å; L192-L203 HydrophobicContact CD2-CD2 4.35Å; V198-L203 HydrophobicContact CG1-CB 4.47Å; V198-L203 HydrophobicContact CG1-CD2 3.91Å; D199-L203 WeakPolarHBondContact O-CB 3.19Å; D199-L203 PolarHBondContact O-N 3.2Å; V200-L203 PolarHBondContact O-N 2.91Å; L203-C206 PolarHBondContact O-N 3.46Å; L203-T207 WeakPolarHBondContact O-CB 3.47Å; L203-T207 PolarHBondContact O-N 2.74Å; L203-T207 PolarHBondContact O-OG1 3.31Å; L203-F506 HydrophobicContact CD2-CE2 3.83Å; L203-F506 HydrophobicContact CD2-CZ 4.04Å
204	L	96.9	Very high	93.6	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-41	-179.8	-69.8	171.3	0	0	0	111.3	V200 L201 S202 T207 V208 L326 F327 L330 I461	V200-L204 HydrophobicContact CG1-CD1 3.68Å; V200-L204 HydrophobicContact CG1-CG 4.12Å; V200-L204 WeakPolarHBondContact O-CB 3.39Å; V200-L204 WeakPolarHBondContact O-CG 3.44Å; V200-L204 PolarHBondContact O-N 3.46Å; L201-L204 PolarHBondContact O-N 2.82Å; S202-L204 VanDerWaalsContact C-N 3.34Å; S202-L204 PolarHBondContact O-N 3.49Å; L204-T207 PolarHBondContact O-N 2.91Å; L204-V208 VanDerWaalsContact O-CB 3.32Å; L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 WeakPolarHBondContact O-CG2 3.48Å; L204-V208 PolarHBondContact O-N 3.37Å; L204-L326 HydrophobicContact CD1-CB 3.76Å; L204-L326 HydrophobicContact CD2-CB 4.09Å; L204-L326 HydrophobicContact CD2-CD1 3.9Å; L204-L326 HydrophobicContact CG-CB 4.49Å; L204-F327 HydrophobicContact CD1-CB 4.13Å; L204-L330 HydrophobicContact CD1-CD1 4.33Å; L204-I461 HydrophobicContact CD2-CG2 4.05Å
205	R	96.3	Very high	93.8	Very high	17 Å²	17	25.7 Å²	25.7	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-45.6	176.7	-79.7	176.6	173.6	144.4	-0.1	112.4	L201 S202 V208 V209 L227 S323 E494	L201-R205 HydrophobicContact CD1-CG 4.5Å; L201-R205 WeakPolarHBondContact O-CB 3.44Å; L201-R205 WeakPolarHBondContact O-CG 3.18Å; L201-R205 PolarHBondContact O-N 2.79Å; S202-R205 PolarHBondContact O-N 3.49Å; R205-V208 PolarHBondContact O-N 2.89Å; R205-V209 WeakPolarHBondContact O-CG1 3.47Å; R205-V209 PolarHBondContact O-N 3.44Å; R205-L227 HydrophobicContact CB-CD1 3.8Å; R205-L227 HydrophobicContact CB-CD2 3.84Å; R205-L227 HydrophobicContact CB-CG 4.47Å; R205-L227 HydrophobicContact CG-CD2 4.45Å; R205-S323 WeakPolarHBondContact CA-OG 3.34Å; R205-E494 IonicContact CZ-OE1 2.7Å; R205-E494 IonicContact CZ-OE2 2.73Å; R205-E494 VanDerWaalsContact NH1-CD 3.31Å; R205-E494 IonicContact NH1-OE1 3.67Å; R205-E494 PolarHBondContact NH1-OE1 3.11Å; R205-E494 VanDerWaalsContact NH1-OE1 3.13Å; R205-E494 IonicContact NH1-OE2 3.54Å; R205-E494 PolarHBondContact NH1-OE2 3.23Å; R205-E494 IonicContact NH2-OE1 3.46Å; R205-E494 PolarHBondContact NH2-OE1 3.04Å; R205-E494 IonicContact NH2-OE2 3.33Å
206	C	96.8	Very high	94	Very high	14 Å²	14	23.8 Å²	23.8	10%	0.095	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-49.4	175.3	-71	0	0	0	0	111.1	S202 L203 V208 V209 D210 E223 L227	S202-C206 PolarHBondContact O-N 2.7Å; S202-C206 PolarHBondContact O-SG 3.05Å; S202-C206 VanDerWaalsContact O-SG 3.4Å; L203-C206 PolarHBondContact O-N 3.46Å; C206-V208 VanDerWaalsContact C-N 3.31Å; C206-V208 PolarHBondContact O-N 3.3Å; C206-V209 VanDerWaalsContact O-CG1 3.3Å; C206-V209 WeakPolarHBondContact O-CG1 3.32Å; C206-V209 PolarHBondContact O-N 2.98Å; C206-D210 WeakPolarHBondContact O-CB 3.3Å; C206-D210 PolarHBondContact O-N 3Å; C206-E223 WeakPolarHBondContact CB-OE2 3.17Å; C206-L227 HydrophobicContact CB-CD1 4.42Å
207	T	97.6	Very high	94.3	Very high	4 Å²	4	20.8 Å²	20.8	3%	0.025	10%	0.104	C	C	.	.	H	α-helix	trans	-56.5	-46.5	177.2	-54.8	0	0	0	0	111.3	S184 H188 L203 L204 I211	S184-T207 PolarHBondContact OG-O 2.85Å; H188-T207 WeakPolarHBondContact CB-OG1 3.45Å; L203-T207 WeakPolarHBondContact O-CB 3.47Å; L203-T207 PolarHBondContact O-N 2.74Å; L203-T207 PolarHBondContact O-OG1 3.31Å; L204-T207 PolarHBondContact O-N 2.91Å; T207-I211 HydrophobicContact CG2-CD1 3.9Å; T207-I211 WeakPolarHBondContact O-CD1 3.42Å; T207-I211 WeakPolarHBondContact O-CG1 3.49Å; T207-I211 PolarHBondContact O-N 2.96Å
208	V	97.3	Very high	94.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-72.6	-35.9	-176.2	172	0	0	0	0	112.6	L204 R205 C206 S212 A318 P319 L322 I461	L204-V208 VanDerWaalsContact O-CB 3.32Å; L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 WeakPolarHBondContact O-CG2 3.48Å; L204-V208 PolarHBondContact O-N 3.37Å; R205-V208 PolarHBondContact O-N 2.89Å; C206-V208 VanDerWaalsContact C-N 3.31Å; C206-V208 PolarHBondContact O-N 3.3Å; V208-S212 WeakPolarHBondContact O-CB 3.32Å; V208-S212 PolarHBondContact O-N 2.67Å; V208-S212 PolarHBondContact O-OG 2.93Å; V208-A318 VanDerWaalsContact CG1-C 3.42Å; V208-A318 HydrophobicContact CG1-CB 3.3Å; V208-P319 HydrophobicContact CG1-CG 4.32Å; V208-L322 HydrophobicContact CG1-CB 4.48Å; V208-L322 HydrophobicContact CG1-CD2 4.39Å; V208-L322 HydrophobicContact CG2-CD2 3.51Å; V208-I461 HydrophobicContact CG2-CD1 3.98Å
209	V	96.9	Very high	94.7	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-70.3	-37.8	176	76.2	0	0	0	0	111.2	R205 C206 S212 N213 E223 L226 L227 I230 V315 P319	R205-V209 WeakPolarHBondContact O-CG1 3.47Å; R205-V209 PolarHBondContact O-N 3.44Å; C206-V209 VanDerWaalsContact O-CG1 3.3Å; C206-V209 WeakPolarHBondContact O-CG1 3.32Å; C206-V209 PolarHBondContact O-N 2.98Å; V209-S212 PolarHBondContact O-N 2.7Å; V209-N213 WeakPolarHBondContact O-CB 3.46Å; V209-N213 PolarHBondContact O-N 2.9Å; V209-E223 HydrophobicContact CG1-CB 3.97Å; V209-E223 HydrophobicContact CG1-CG 4.04Å; V209-L226 HydrophobicContact CG2-CD2 3.87Å; V209-L227 HydrophobicContact CB-CD2 4.19Å; V209-L227 HydrophobicContact CG1-CD1 4.13Å; V209-L227 HydrophobicContact CG1-CD2 4.27Å; V209-L227 HydrophobicContact CG1-CG 4.1Å; V209-I230 HydrophobicContact CG2-CD1 4.35Å; V209-V315 HydrophobicContact CG2-CG1 4.32Å; V209-P319 HydrophobicContact CB-CG 3.92Å; V209-P319 HydrophobicContact CG2-CG 4.19Å
210	D	97	Very high	94.8	Very high	10 Å²	10	20.9 Å²	20.9	5%	0.053	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-47.2	173.9	178.4	39.2	0	0	0	111.6	S184 H188 C206 S212 N213 R214 E223	S184-D210 VanDerWaalsContact CB-OD2 3.23Å; S184-D210 WeakPolarHBondContact CB-OD2 3.49Å; S184-D210 PolarHBondContact OG-OD2 2.88Å; H188-D210 IonicContact CE1-OD2 3.17Å; C206-D210 WeakPolarHBondContact O-CB 3.3Å; C206-D210 PolarHBondContact O-N 3Å; D210-S212 VanDerWaalsContact C-N 3.27Å; D210-S212 PolarHBondContact O-N 3.13Å; D210-N213 WeakPolarHBondContact O-CB 3.17Å; D210-N213 PolarHBondContact O-N 3.05Å; D210-R214 VanDerWaalsContact CG-NE 3.31Å; D210-R214 WeakPolarHBondContact O-CG 3.43Å; D210-R214 PolarHBondContact O-N 3.25Å; D210-R214 IonicContact OD1-CZ 3.12Å; D210-R214 IonicContact OD1-NE 2.67Å; D210-R214 PolarHBondContact OD1-NE 3.16Å; D210-R214 IonicContact OD1-NH2 3.62Å; D210-R214 PolarHBondContact OD1-NH2 3.32Å; D210-R214 IonicContact OD2-CZ 2.89Å; D210-R214 IonicContact OD2-NE 3.81Å; D210-R214 PolarHBondContact OD2-NE 3.07Å; D210-R214 IonicContact OD2-NH2 2.71Å; D210-R214 PolarHBondContact OD2-NH2 3.01Å; D210-E223 WeakPolarHBondContact CB-OE1 3.41Å
211	I	95.6	Very high	94.9	Very high	1 Å²	1	23 Å²	23	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-56.4	-45.1	173.4	-67.1	163.5	0	0	0	110.5	V180 C181 T207 N213 L215 M457 I461	V180-I211 HydrophobicContact CG1-CB 4.49Å; V180-I211 HydrophobicContact CG1-CG1 4.48Å; V180-I211 HydrophobicContact CG1-CG2 4.21Å; C181-I211 HydrophobicContact CB-CD1 4.14Å; T207-I211 HydrophobicContact CG2-CD1 3.9Å; T207-I211 WeakPolarHBondContact O-CD1 3.42Å; T207-I211 WeakPolarHBondContact O-CG1 3.49Å; T207-I211 PolarHBondContact O-N 2.96Å; I211-N213 VanDerWaalsContact C-N 3.34Å; I211-N213 PolarHBondContact O-N 2.8Å; I211-L215 HydrophobicContact CG2-CD1 3.72Å; I211-L215 HydrophobicContact CG2-CG 4.4Å; I211-L215 WeakPolarHBondContact O-CB 3.25Å; I211-L215 VanDerWaalsContact O-CG 3.24Å; I211-L215 WeakPolarHBondContact O-CG 3.25Å; I211-L215 PolarHBondContact O-N 2.85Å; I211-L215 VanDerWaalsContact O-N 3.11Å; I211-M457 HydrophobicContact CG2-CE 3.72Å; I211-M457 HydrophobicContact CG2-CG 4.41Å; I211-I461 HydrophobicContact CD1-CD1 3.94Å; I211-I461 HydrophobicContact CD1-CG1 4.21Å
212	S	94.6	Very high	95	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-40.3	-179.8	-58.3	0	0	0	0	111.6	V208 V209 D210 F216	V208-S212 WeakPolarHBondContact O-CB 3.32Å; V208-S212 PolarHBondContact O-N 2.67Å; V208-S212 PolarHBondContact O-OG 2.93Å; V209-S212 PolarHBondContact O-N 2.7Å; D210-S212 VanDerWaalsContact C-N 3.27Å; D210-S212 PolarHBondContact O-N 3.13Å; S212-F216 WeakPolarHBondContact O-CB 3.39Å; S212-F216 WeakPolarHBondContact O-CD2 2.96Å; S212-F216 PolarHBondContact O-N 2.99Å; S212-F216 VanDerWaalsContact O-N 3.07Å
213	N	95.3	Very high	95.1	Very high	13 Å²	13	27.5 Å²	27.5	7%	0.07	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-58.1	175.4	-178.6	37.2	0	0	0	110.9	V209 D210 I211 L215 F216 L217 D218 V219 L221	V209-N213 WeakPolarHBondContact O-CB 3.46Å; V209-N213 PolarHBondContact O-N 2.9Å; D210-N213 WeakPolarHBondContact O-CB 3.17Å; D210-N213 PolarHBondContact O-N 3.05Å; I211-N213 VanDerWaalsContact C-N 3.34Å; I211-N213 PolarHBondContact O-N 2.8Å; N213-L215 PolarHBondContact O-N 3.19Å; N213-L215 VanDerWaalsContact O-N 3.12Å; N213-F216 PolarHBondContact O-N 3.14Å; N213-L217 PolarHBondContact O-N 2.91Å; N213-D218 PolarHBondContact O-N 3.21Å; N213-D218 PolarHBondContact OD1-N 3.27Å; N213-V219 PolarHBondContact ND2-O 3.18Å; N213-V219 PolarHBondContact OD1-N 3.11Å; N213-V219 PolarHBondContact OD1-O 3.13Å; N213-L221 HydrophobicContact CB-CD2 3.71Å; N213-L221 WeakPolarHBondContact ND2-CD2 3.14Å
214	R	93.6	Very high	95	Very high	88 Å²	88	34 Å²	34	33%	0.332	17%	0.171	S	C	.	.	H	α-helix	trans	-57.7	-30.1	-177.8	-67	-179	-166.2	-160.7	10.7	113.3	V180 D210	V180-R214 HydrophobicContact CG1-CB 3.79Å; D210-R214 VanDerWaalsContact CG-NE 3.31Å; D210-R214 WeakPolarHBondContact O-CG 3.43Å; D210-R214 PolarHBondContact O-N 3.25Å; D210-R214 IonicContact OD1-CZ 3.12Å; D210-R214 IonicContact OD1-NE 2.67Å; D210-R214 PolarHBondContact OD1-NE 3.16Å; D210-R214 IonicContact OD1-NH2 3.62Å; D210-R214 PolarHBondContact OD1-NH2 3.32Å; D210-R214 IonicContact OD2-CZ 2.89Å; D210-R214 IonicContact OD2-NE 3.81Å; D210-R214 PolarHBondContact OD2-NE 3.07Å; D210-R214 IonicContact OD2-NH2 2.71Å; D210-R214 PolarHBondContact OD2-NH2 3.01Å
215	L	92	Very high	95	Very high	24 Å²	24	38.5 Å²	38.5	13%	0.126	19%	0.191	C	C	.	.	H	α-helix	trans	-84.7	-34.9	179.6	-68.7	175.1	0	0	0	114.2	T177 V180 I211 N213 M457	T177-L215 HydrophobicContact CG2-CD1 4.02Å; V180-L215 HydrophobicContact CB-CD2 4.14Å; V180-L215 HydrophobicContact CG1-CD2 4.29Å; V180-L215 HydrophobicContact CG1-CG 4.18Å; V180-L215 HydrophobicContact CG2-CD2 3.93Å; I211-L215 HydrophobicContact CG2-CD1 3.72Å; I211-L215 HydrophobicContact CG2-CG 4.4Å; I211-L215 WeakPolarHBondContact O-CB 3.25Å; I211-L215 VanDerWaalsContact O-CG 3.24Å; I211-L215 WeakPolarHBondContact O-CG 3.25Å; I211-L215 PolarHBondContact O-N 2.85Å; I211-L215 VanDerWaalsContact O-N 3.11Å; N213-L215 PolarHBondContact O-N 3.19Å; N213-L215 VanDerWaalsContact O-N 3.12Å; L215-M457 HydrophobicContact CD1-CE 3.92Å
216	F	93.6	Very high	94.9	Very high	12 Å²	12	38.1 Å²	38.1	5%	0.053	19%	0.191	C	C	.	.	H	α-helix	trans	-123.1	-18.6	-163.5	-53.9	-55.5	0	0	0	115	A168 L169 S212 N213 N288 F289 T290 M314	A168-F216 HydrophobicContact CB-CD1 4.37Å; A168-F216 HydrophobicContact CB-CE1 4.43Å; L169-F216 HydrophobicContact CD2-CE1 3.69Å; L169-F216 HydrophobicContact CD2-CE2 4.16Å; L169-F216 HydrophobicContact CD2-CZ 3.33Å; L169-F216 HydrophobicContact CG-CE1 4.47Å; S212-F216 WeakPolarHBondContact O-CB 3.39Å; S212-F216 WeakPolarHBondContact O-CD2 2.96Å; S212-F216 PolarHBondContact O-N 2.99Å; S212-F216 VanDerWaalsContact O-N 3.07Å; N213-F216 PolarHBondContact O-N 3.14Å; F216-N288 PolarHBondContact O-OD1 2.87Å; F216-F289 HydrophobicContact CB-CB 4Å; F216-F289 HydrophobicContact CB-CD1 4.33Å; F216-F289 HydrophobicContact CD1-CB 4.07Å; F216-F289 HydrophobicContact CG-CB 4.47Å; F216-T290 WeakPolarHBondContact O-CB 3.31Å; F216-T290 PolarHBondContact O-N 3.32Å; F216-T290 PolarHBondContact O-OG1 3.09Å; F216-M314 HydrophobicContact CB-CG 3.76Å; F216-M314 HydrophobicContact CD1-CE 4.3Å; F216-M314 HydrophobicContact CD1-CG 4.4Å; F216-M314 HydrophobicContact CD1-SD 4.32Å; F216-M314 HydrophobicContact CD2-CG 3.58Å; F216-M314 HydrophobicContact CD2-SD 3.84Å; F216-M314 HydrophobicContact CE1-SD 4.47Å; F216-M314 HydrophobicContact CE2-CG 4.34Å; F216-M314 HydrophobicContact CE2-SD 4.01Å; F216-M314 HydrophobicContact CG-CE 4.44Å; F216-M314 HydrophobicContact CG-CG 3.64Å; F216-M314 HydrophobicContact CG-SD 4.03Å; F216-M314 HydrophobicContact CZ-SD 4.34Å
217	L	93.3	Very high	94.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-53.3	-174.9	178.2	62.9	0	0	0	110.7	N213 V219 L271 K275 N288 T290 V311	N213-L217 PolarHBondContact O-N 2.91Å; L217-V219 HydrophobicContact CD1-CG1 4.29Å; L217-V219 HydrophobicContact CD1-CG2 4.32Å; L217-V219 HydrophobicContact CD2-CG2 3.6Å; L217-V219 HydrophobicContact CG-CB 4.44Å; L217-V219 HydrophobicContact CG-CG1 4.17Å; L217-V219 HydrophobicContact CG-CG2 3.66Å; L217-L271 HydrophobicContact CD2-CB 4.03Å; L217-L271 HydrophobicContact CD2-CD1 3.94Å; L217-L271 HydrophobicContact CD2-CG 4.5Å; L217-K275 HydrophobicContact CD1-CB 4.35Å; L217-K275 VanDerWaalsContact O-CD 3.31Å; L217-K275 WeakPolarHBondContact O-CD 3.39Å; L217-K275 WeakPolarHBondContact O-CE 3.3Å; L217-K275 PolarHBondContact O-NZ 3.42Å; L217-N288 PolarHBondContact O-ND2 3.14Å; L217-T290 HydrophobicContact CD1-CG2 3.8Å; L217-V311 HydrophobicContact CD1-CG1 4.28Å
218	D	93.1	Very high	94.7	Very high	84 Å²	84	43.2 Å²	43.2	45%	0.449	22%	0.216	S	C	.	.			trans	55.9	62.9	178.1	-168.4	41.6	0	0	0	111.7	N213 K275	N213-D218 PolarHBondContact O-N 3.21Å; N213-D218 PolarHBondContact OD1-N 3.27Å; D218-K275 PolarHBondContact O-NZ 3.46Å
219	V	94.4	Very high	94.7	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.03	23%	0.225	C	C	.	.			trans	-135.9	151.3	171.4	-56.1	0	0	0	0	110	N213 L217 L221 L271 Q274 K275	N213-V219 PolarHBondContact ND2-O 3.18Å; N213-V219 PolarHBondContact OD1-N 3.11Å; N213-V219 PolarHBondContact OD1-O 3.13Å; L217-V219 HydrophobicContact CD1-CG1 4.29Å; L217-V219 HydrophobicContact CD1-CG2 4.32Å; L217-V219 HydrophobicContact CD2-CG2 3.6Å; L217-V219 HydrophobicContact CG-CB 4.44Å; L217-V219 HydrophobicContact CG-CG1 4.17Å; L217-V219 HydrophobicContact CG-CG2 3.66Å; V219-L221 PolarHBondContact O-N 3.48Å; V219-L271 HydrophobicContact CG2-CB 4.27Å; V219-L271 HydrophobicContact CG2-CD2 3.79Å; V219-Q274 HydrophobicContact CG1-CG 4.49Å; V219-K275 HydrophobicContact CG1-CB 3.81Å; V219-K275 HydrophobicContact CG1-CD 3.7Å; V219-K275 HydrophobicContact CG1-CG 4.31Å
220	P	93.9	Very high	94.6	Very high	93 Å²	93	45.2 Å²	45.2	60%	0.604	23%	0.225	S	C	*	.			trans	-53.8	130.3	167.9	-25.6	30.7	0	0	0	112.3
221	L	94.3	Very high	94.4	Very high	46 Å²	46	47.8 Å²	47.8	24%	0.241	24%	0.236	C	C	.	.			trans	-146.1	156.8	174.8	64.8	81	0	0	0	112.1	N213 V219 E223 L226 L271	N213-L221 HydrophobicContact CB-CD2 3.71Å; N213-L221 WeakPolarHBondContact ND2-CD2 3.14Å; V219-L221 PolarHBondContact O-N 3.48Å; L221-E223 HydrophobicContact CD1-CB 4.27Å; L221-E223 HydrophobicContact CD1-CG 3.71Å; L221-L226 HydrophobicContact CD1-CD2 4.18Å; L221-L226 HydrophobicContact CD2-CD2 3.89Å; L221-L271 HydrophobicContact CB-CD2 4.22Å
222	D	95.3	Very high	94.4	Very high	93 Å²	93	53.5 Å²	53.5	50%	0.497	26%	0.258	S	S	.	.			trans	-89	108.4	166.7	-174.7	-37.7	0	0	0	108.9	K224 E225 L226	D222-K224 PolarHBondContact O-N 2.95Å; D222-K224 PolarHBondContact OD1-N 3.03Å; D222-E225 HydrophobicContact CB-CB 3.92Å; D222-E225 PolarHBondContact OD1-N 3.46Å; D222-L226 VanDerWaalsContact O-CB 3.27Å; D222-L226 WeakPolarHBondContact O-CB 3.47Å; D222-L226 PolarHBondContact O-N 3.49Å
223	E	94.8	Very high	94.5	Very high	49 Å²	49	53.5 Å²	53.5	23%	0.229	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-43.4	-176.7	-63.6	169.3	-174	0	0	112	H188 C206 V209 D210 L221 L226 L227	H188-E223 IonicContact CE1-OE1 2.7Å; H188-E223 IonicContact CE1-OE2 3.59Å; H188-E223 IonicContact NE2-OE1 3.33Å; H188-E223 IonicContact NE2-OE2 3.38Å; H188-E223 PolarHBondContact NE2-OE2 3.49Å; C206-E223 WeakPolarHBondContact CB-OE2 3.17Å; V209-E223 HydrophobicContact CG1-CB 3.97Å; V209-E223 HydrophobicContact CG1-CG 4.04Å; D210-E223 WeakPolarHBondContact CB-OE1 3.41Å; L221-E223 HydrophobicContact CD1-CB 4.27Å; L221-E223 HydrophobicContact CD1-CG 3.71Å; E223-L226 PolarHBondContact O-N 2.8Å; E223-L227 VanDerWaalsContact O-CB 3.31Å; E223-L227 WeakPolarHBondContact O-CB 3.18Å; E223-L227 WeakPolarHBondContact O-CD1 3.32Å; E223-L227 WeakPolarHBondContact O-CG 3.39Å; E223-L227 PolarHBondContact O-N 3.5Å
224	K	93.2	Very high	94.4	Very high	155 Å²	155	53.1 Å²	53.1	67%	0.674	26%	0.255	S	S	*	.	H	α-helix	trans	-69.8	-44.8	-175.9	-67.9	-176.1	-179.5	179.5	0	110.3	D222 L226 L227 L228	D222-K224 PolarHBondContact O-N 2.95Å; D222-K224 PolarHBondContact OD1-N 3.03Å; K224-L226 VanDerWaalsContact C-N 3.34Å; K224-L226 PolarHBondContact O-N 2.92Å; K224-L227 PolarHBondContact O-N 2.88Å; K224-L228 WeakPolarHBondContact O-CG 3.45Å; K224-L228 PolarHBondContact O-N 2.8Å; K224-L228 VanDerWaalsContact O-N 3.1Å
225	E	95.4	Very high	94.4	Very high	96 Å²	96	52.7 Å²	52.7	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-44	176.9	-164.5	-163.5	156.9	0	0	111.2	D222 L228 K229	D222-E225 HydrophobicContact CB-CB 3.92Å; D222-E225 PolarHBondContact OD1-N 3.46Å; E225-L228 PolarHBondContact O-N 2.67Å; E225-K229 PolarHBondContact O-N 3.35Å; E225-K229 VanDerWaalsContact OE1-CE 3.26Å; E225-K229 WeakPolarHBondContact OE1-CE 3.42Å; E225-K229 IonicContact OE1-NZ 3.56Å; E225-K229 PolarHBondContact OE1-NZ 2.77Å
226	L	96.1	Very high	94.6	Very high	9 Å²	9	51.7 Å²	51.7	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-46.5	178.3	-178.8	58.6	0	0	0	111.4	V209 L221 D222 E223 K224 L228 K229 I230 L264 I268 V315	V209-L226 HydrophobicContact CG2-CD2 3.87Å; L221-L226 HydrophobicContact CD1-CD2 4.18Å; L221-L226 HydrophobicContact CD2-CD2 3.89Å; D222-L226 VanDerWaalsContact O-CB 3.27Å; D222-L226 WeakPolarHBondContact O-CB 3.47Å; D222-L226 PolarHBondContact O-N 3.49Å; E223-L226 PolarHBondContact O-N 2.8Å; K224-L226 VanDerWaalsContact C-N 3.34Å; K224-L226 PolarHBondContact O-N 2.92Å; L226-L228 VanDerWaalsContact C-N 3.31Å; L226-L228 PolarHBondContact O-N 3.41Å; L226-K229 WeakPolarHBondContact O-CB 3.35Å; L226-K229 PolarHBondContact O-N 2.92Å; L226-I230 HydrophobicContact CD1-CD1 4.37Å; L226-I230 HydrophobicContact CD1-CG1 4.35Å; L226-I230 HydrophobicContact CG-CD1 3.94Å; L226-I230 HydrophobicContact CG-CG1 4.34Å; L226-I230 WeakPolarHBondContact O-CG1 3.24Å; L226-I230 PolarHBondContact O-N 3.07Å; L226-L264 HydrophobicContact CD1-CD1 3.75Å; L226-I268 HydrophobicContact CD1-CD1 4.39Å; L226-V315 HydrophobicContact CD2-CG1 4.03Å
227	L	95.3	Very high	94.7	Very high	20 Å²	20	52.3 Å²	52.3	11%	0.105	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-37.9	179.2	-76.2	168.9	0	0	0	112.8	R205 C206 V209 E223 K224 K229 I230 H231 P319	R205-L227 HydrophobicContact CB-CD1 3.8Å; R205-L227 HydrophobicContact CB-CD2 3.84Å; R205-L227 HydrophobicContact CB-CG 4.47Å; R205-L227 HydrophobicContact CG-CD2 4.45Å; C206-L227 HydrophobicContact CB-CD1 4.42Å; V209-L227 HydrophobicContact CB-CD2 4.19Å; V209-L227 HydrophobicContact CG1-CD1 4.13Å; V209-L227 HydrophobicContact CG1-CD2 4.27Å; V209-L227 HydrophobicContact CG1-CG 4.1Å; E223-L227 VanDerWaalsContact O-CB 3.31Å; E223-L227 WeakPolarHBondContact O-CB 3.18Å; E223-L227 WeakPolarHBondContact O-CD1 3.32Å; E223-L227 WeakPolarHBondContact O-CG 3.39Å; E223-L227 PolarHBondContact O-N 3.5Å; K224-L227 PolarHBondContact O-N 2.88Å; L227-K229 VanDerWaalsContact C-N 3.3Å; L227-K229 PolarHBondContact O-N 3.45Å; L227-I230 HydrophobicContact CD2-CD1 4.42Å; L227-I230 PolarHBondContact O-N 3.2Å; L227-H231 WeakPolarHBondContact O-CB 3.43Å; L227-H231 PolarHBondContact O-N 3.25Å; L227-P319 HydrophobicContact CD2-CB 3.84Å; L227-P319 HydrophobicContact CD2-CG 4.35Å
228	L	94.6	Very high	94.7	Very high	105 Å²	105	52.9 Å²	52.9	55%	0.55	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-40.7	173.9	-72.8	170.3	0	0	0	111.9	K224 E225 L226 R232	K224-L228 WeakPolarHBondContact O-CG 3.45Å; K224-L228 PolarHBondContact O-N 2.8Å; K224-L228 VanDerWaalsContact O-N 3.1Å; E225-L228 PolarHBondContact O-N 2.67Å; L226-L228 VanDerWaalsContact C-N 3.31Å; L226-L228 PolarHBondContact O-N 3.41Å; L228-R232 WeakPolarHBondContact O-CG 3.24Å; L228-R232 PolarHBondContact O-N 3.32Å
229	K	96.4	Very high	94.7	Very high	42 Å²	42	50.7 Å²	50.7	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-69.7	-39.7	176.2	-64.4	172.8	-172.7	169.9	0	111.5	E225 L226 L227 R232 Y233 L264 A267	E225-K229 PolarHBondContact O-N 3.35Å; E225-K229 VanDerWaalsContact OE1-CE 3.26Å; E225-K229 WeakPolarHBondContact OE1-CE 3.42Å; E225-K229 IonicContact OE1-NZ 3.56Å; E225-K229 PolarHBondContact OE1-NZ 2.77Å; L226-K229 WeakPolarHBondContact O-CB 3.35Å; L226-K229 PolarHBondContact O-N 2.92Å; L227-K229 VanDerWaalsContact C-N 3.3Å; L227-K229 PolarHBondContact O-N 3.45Å; K229-R232 PolarHBondContact O-N 3Å; K229-Y233 WeakPolarHBondContact O-CB 3.17Å; K229-Y233 PolarHBondContact O-N 3.44Å; K229-L264 HydrophobicContact CB-CB 4.19Å; K229-L264 HydrophobicContact CB-CD1 3.85Å; K229-A267 HydrophobicContact CD-CB 3.82Å
230	I	95.7	Very high	94.7	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-49.9	174.9	-66.6	177.2	0	0	0	110.4	V209 L226 L227 R232 Y233 F234 L264 V315 I316 P319 D320	V209-I230 HydrophobicContact CG2-CD1 4.35Å; L226-I230 HydrophobicContact CD1-CD1 4.37Å; L226-I230 HydrophobicContact CD1-CG1 4.35Å; L226-I230 HydrophobicContact CG-CD1 3.94Å; L226-I230 HydrophobicContact CG-CG1 4.34Å; L226-I230 WeakPolarHBondContact O-CG1 3.24Å; L226-I230 PolarHBondContact O-N 3.07Å; L227-I230 HydrophobicContact CD2-CD1 4.42Å; L227-I230 PolarHBondContact O-N 3.2Å; I230-R232 PolarHBondContact O-N 2.83Å; I230-Y233 WeakPolarHBondContact O-CB 3.36Å; I230-Y233 PolarHBondContact O-N 3.18Å; I230-Y233 VanDerWaalsContact O-N 3.15Å; I230-F234 WeakPolarHBondContact O-CB 3.36Å; I230-F234 PolarHBondContact O-N 3.27Å; I230-L264 HydrophobicContact CG1-CD1 3.97Å; I230-L264 HydrophobicContact CG1-CD2 4.27Å; I230-V315 HydrophobicContact CD1-CG1 4.04Å; I230-I316 HydrophobicContact CD1-CG2 4.35Å; I230-I316 HydrophobicContact CG1-CG2 3.99Å; I230-I316 HydrophobicContact CG2-CB 4.2Å; I230-I316 HydrophobicContact CG2-CG2 4.06Å; I230-P319 HydrophobicContact CD1-CG 4.46Å; I230-D320 WeakPolarHBondContact CG2-OD2 3.46Å
231	H	92.9	Very high	94.9	Very high	64 Å²	64	46 Å²	46	30%	0.296	22%	0.216	S	C	.	.	H	α-helix	trans	-59.3	-47	179.5	-179.1	73.7	0	0	0	111.9	L227 Y233 F234 E235	L227-H231 WeakPolarHBondContact O-CB 3.43Å; L227-H231 PolarHBondContact O-N 3.25Å; H231-Y233 VanDerWaalsContact C-N 3.32Å; H231-Y233 PolarHBondContact O-N 3.12Å; H231-F234 PolarHBondContact O-N 3.25Å; H231-E235 WeakPolarHBondContact O-CG 3.25Å; H231-E235 PolarHBondContact O-N 3.26Å
232	R	94.6	Very high	94.9	Very high	122 Å²	122	44.3 Å²	44.3	46%	0.46	21%	0.207	S	C	.	.	H	α-helix	trans	-62.1	-37.1	176	-69.6	175	-173.6	176.4	4.7	113.1	L228 K229 I230 T236 A260 E263	L228-R232 WeakPolarHBondContact O-CG 3.24Å; L228-R232 PolarHBondContact O-N 3.32Å; K229-R232 PolarHBondContact O-N 3Å; I230-R232 PolarHBondContact O-N 2.83Å; R232-T236 WeakPolarHBondContact O-CB 3.16Å; R232-T236 PolarHBondContact O-N 3.29Å; R232-T236 VanDerWaalsContact O-N 3.08Å; R232-T236 PolarHBondContact O-OG1 2.81Å; R232-A260 HydrophobicContact CB-CB 4.08Å; R232-E263 IonicContact NH1-OE1 3.71Å; R232-E263 IonicContact NH1-OE2 3.93Å; R232-E263 PolarHBondContact NH1-OE2 2.76Å
233	Y	96.6	Very high	94.9	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-44	174.8	-178.9	-84.1	0	0	0	111	L142 M144 K229 I230 H231 T236 W237 A261 L264 L312 I316	L142-Y233 HydrophobicContact CB-CE2 4.5Å; L142-Y233 HydrophobicContact CD2-CD2 4.4Å; L142-Y233 HydrophobicContact CD2-CE1 4.08Å; L142-Y233 HydrophobicContact CD2-CE2 3.94Å; L142-Y233 PolarHBondContact O-OH 2.91Å; M144-Y233 HydrophobicContact CE-CE1 3.91Å; M144-Y233 WeakPolarHBondContact CE-OH 3.41Å; K229-Y233 WeakPolarHBondContact O-CB 3.17Å; K229-Y233 PolarHBondContact O-N 3.44Å; I230-Y233 WeakPolarHBondContact O-CB 3.36Å; I230-Y233 PolarHBondContact O-N 3.18Å; I230-Y233 VanDerWaalsContact O-N 3.15Å; H231-Y233 VanDerWaalsContact C-N 3.32Å; H231-Y233 PolarHBondContact O-N 3.12Å; Y233-T236 WeakPolarHBondContact O-CB 3.44Å; Y233-T236 PolarHBondContact O-N 2.91Å; Y233-W237 WeakPolarHBondContact O-CB 3.47Å; Y233-W237 PolarHBondContact O-N 3.38Å; Y233-A261 HydrophobicContact CD2-CB 4.24Å; Y233-A261 HydrophobicContact CE2-CB 4.35Å; Y233-L264 VanDerWaalsContact CB-CD2 3.48Å; Y233-L264 HydrophobicContact CD1-CD2 4.09Å; Y233-L264 HydrophobicContact CD2-CB 4.11Å; Y233-L264 HydrophobicContact CD2-CD2 3.73Å; Y233-L264 HydrophobicContact CD2-CG 4.46Å; Y233-L264 HydrophobicContact CE2-CD2 4.49Å; Y233-L264 HydrophobicContact CG-CB 4.48Å; Y233-L264 HydrophobicContact CG-CD2 3.51Å; Y233-L312 HydrophobicContact CE1-CD2 4.05Å; Y233-L312 HydrophobicContact CE2-CD1 4.18Å; Y233-L312 HydrophobicContact CE2-CD2 4.28Å; Y233-I316 HydrophobicContact CD1-CD1 4.16Å; Y233-I316 HydrophobicContact CE1-CD1 3.79Å
234	F	94.4	Very high	94.8	Very high	6 Å²	6	41 Å²	41	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-45.9	179	-171.4	-88.1	0	0	0	112.1	I230 H231 T236 W237 Q238 D320 L488 S489 Q491	I230-F234 WeakPolarHBondContact O-CB 3.36Å; I230-F234 PolarHBondContact O-N 3.27Å; H231-F234 PolarHBondContact O-N 3.25Å; F234-T236 VanDerWaalsContact C-N 3.25Å; F234-T236 PolarHBondContact O-N 2.82Å; F234-W237 AromaticContact CD2-CE3 3.52Å; F234-W237 HydrophobicContact CD2-CE3 3.52Å; F234-W237 AromaticContact CD2-CZ3 3.78Å; F234-W237 HydrophobicContact CD2-CZ3 3.78Å; F234-W237 AromaticContact CE2-CE3 3.64Å; F234-W237 HydrophobicContact CE2-CE3 3.64Å; F234-W237 AromaticContact CE2-CZ3 3.62Å; F234-W237 HydrophobicContact CE2-CZ3 3.62Å; F234-W237 HydrophobicContact CG-CE3 4.48Å; F234-W237 WeakPolarHBondContact O-CA 3.31Å; F234-W237 WeakPolarHBondContact O-CB 3.46Å; F234-W237 PolarHBondContact O-N 2.85Å; F234-Q238 HydrophobicContact CD1-CG 3.85Å; F234-Q238 HydrophobicContact CE1-CG 3.36Å; F234-Q238 HydrophobicContact CZ-CG 3.92Å; F234-Q238 WeakPolarHBondContact O-CG 3.3Å; F234-Q238 PolarHBondContact O-N 3.39Å; F234-D320 WeakPolarHBondContact CB-OD2 3.49Å; F234-D320 HydrophobicContact CD2-CB 4.03Å; F234-D320 WeakPolarHBondContact CD2-OD2 3.12Å; F234-D320 HydrophobicContact CE2-CB 4.27Å; F234-D320 HydrophobicContact CG-CB 4.5Å; F234-D320 WeakPolarHBondContact CG-OD2 3.44Å; F234-L488 HydrophobicContact CE2-CD2 4.39Å; F234-L488 HydrophobicContact CZ-CD2 4.26Å; F234-S489 WeakPolarHBondContact CZ-OG 3.32Å; F234-Q491 VanDerWaalsContact CZ-NE2 3.25Å
235	E	92.8	Very high	94.7	Very high	78 Å²	78	37.9 Å²	37.9	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-55.9	-42.6	172.4	-76.8	-59.9	121.2	0	0	111.9	H231 T239	H231-E235 WeakPolarHBondContact O-CG 3.25Å; H231-E235 PolarHBondContact O-N 3.26Å; E235-T239 WeakPolarHBondContact O-CB 3.16Å; E235-T239 PolarHBondContact O-N 2.88Å; E235-T239 PolarHBondContact O-OG1 2.89Å
236	T	95.1	Very high	94.5	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-45.7	173.8	-68.8	0	0	0	0	111.2	L142 R232 Y233 F234 T239 V240 H257 A261	L142-T236 HydrophobicContact CD2-CG2 3.93Å; R232-T236 WeakPolarHBondContact O-CB 3.16Å; R232-T236 PolarHBondContact O-N 3.29Å; R232-T236 VanDerWaalsContact O-N 3.08Å; R232-T236 PolarHBondContact O-OG1 2.81Å; Y233-T236 WeakPolarHBondContact O-CB 3.44Å; Y233-T236 PolarHBondContact O-N 2.91Å; F234-T236 VanDerWaalsContact C-N 3.25Å; F234-T236 PolarHBondContact O-N 2.82Å; T236-T239 PolarHBondContact O-N 2.95Å; T236-V240 HydrophobicContact CG2-CG1 4.15Å; T236-V240 HydrophobicContact CG2-CG2 4.38Å; T236-V240 WeakPolarHBondContact O-CG1 3.1Å; T236-V240 VanDerWaalsContact O-CG2 3.25Å; T236-V240 WeakPolarHBondContact O-CG2 3.47Å; T236-V240 PolarHBondContact O-N 3.35Å; T236-H257 HydrophobicContact CG2-CB 3.59Å; T236-H257 WeakPolarHBondContact CG2-O 3.41Å; T236-H257 PolarHBondContact OG1-ND1 3.41Å; T236-A261 HydrophobicContact CG2-CB 4.44Å
237	W	95.6	Very high	94.3	Very high	25 Å²	25	39.5 Å²	39.5	10%	0.095	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-51.5	178.9	176.8	21.6	0	0	0	112	L142 M144 I150 F151 Y233 F234 T239 V240 L241 L488	L142-W237 HydrophobicContact CD1-CB 3.88Å; L142-W237 VanDerWaalsContact CD1-CD1 3.44Å; L142-W237 HydrophobicContact CD1-CG 3.85Å; L142-W237 HydrophobicContact CD2-CB 3.85Å; M144-W237 HydrophobicContact CE-CD2 4.19Å; M144-W237 HydrophobicContact CE-CE3 4.39Å; M144-W237 HydrophobicContact CE-CH2 4.38Å; M144-W237 HydrophobicContact CE-CZ2 4.13Å; M144-W237 HydrophobicContact SD-CZ2 4.3Å; I150-W237 HydrophobicContact CD1-CH2 4.48Å; I150-W237 HydrophobicContact CG2-CH2 3.92Å; I150-W237 HydrophobicContact CG2-CZ2 3.8Å; F151-W237 AromaticContact CD2-CZ2 3.65Å; F151-W237 HydrophobicContact CD2-CZ2 3.65Å; F151-W237 AromaticContact CD2-NE1 3.84Å; F151-W237 AromaticContact CE2-CE2 3.91Å; F151-W237 AromaticContact CE2-CZ2 3.47Å; F151-W237 HydrophobicContact CE2-CZ2 3.47Å; F151-W237 VanDerWaalsContact CE2-CZ2 3.47Å; F151-W237 AromaticContact CE2-NE1 3.75Å; Y233-W237 WeakPolarHBondContact O-CB 3.47Å; Y233-W237 PolarHBondContact O-N 3.38Å; F234-W237 AromaticContact CD2-CE3 3.52Å; F234-W237 HydrophobicContact CD2-CE3 3.52Å; F234-W237 AromaticContact CD2-CZ3 3.78Å; F234-W237 HydrophobicContact CD2-CZ3 3.78Å; F234-W237 AromaticContact CE2-CE3 3.64Å; F234-W237 HydrophobicContact CE2-CE3 3.64Å; F234-W237 AromaticContact CE2-CZ3 3.62Å; F234-W237 HydrophobicContact CE2-CZ3 3.62Å; F234-W237 HydrophobicContact CG-CE3 4.48Å; F234-W237 WeakPolarHBondContact O-CA 3.31Å; F234-W237 WeakPolarHBondContact O-CB 3.46Å; F234-W237 PolarHBondContact O-N 2.85Å; W237-T239 PolarHBondContact O-N 3.43Å; W237-V240 PolarHBondContact O-N 3.44Å; W237-L241 VanDerWaalsContact O-CB 3.24Å; W237-L241 WeakPolarHBondContact O-CB 3.36Å; W237-L241 PolarHBondContact O-N 3.38Å; W237-L488 HydrophobicContact CD2-CD2 3.58Å; W237-L488 HydrophobicContact CE3-CD2 3.96Å; W237-L488 HydrophobicContact CG-CD2 4Å; W237-L488 HydrophobicContact CH2-CD2 4.32Å; W237-L488 HydrophobicContact CZ2-CD2 4Å; W237-L488 HydrophobicContact CZ3-CD2 4.3Å
238	Q	93.3	Very high	94.2	Very high	13 Å²	13	39.9 Å²	39.9	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-55.3	-40	176.1	-65.8	-159.9	-50.5	0	0	112.1	F234 L488	F234-Q238 HydrophobicContact CD1-CG 3.85Å; F234-Q238 HydrophobicContact CE1-CG 3.36Å; F234-Q238 HydrophobicContact CZ-CG 3.92Å; F234-Q238 WeakPolarHBondContact O-CG 3.3Å; F234-Q238 PolarHBondContact O-N 3.39Å; Q238-L488 HydrophobicContact CB-CB 4.36Å; Q238-L488 HydrophobicContact CG-CB 3.65Å; Q238-L488 HydrophobicContact CG-CD2 4.09Å
239	T	93.4	Very high	94	Very high	37 Å²	37	42.8 Å²	42.8	23%	0.227	20%	0.199	C	C	.	.	H	α-helix	trans	-71.2	-50.9	-178.1	-58.1	0	0	0	0	111.8	E235 T236 W237 K243	E235-T239 WeakPolarHBondContact O-CB 3.16Å; E235-T239 PolarHBondContact O-N 2.88Å; E235-T239 PolarHBondContact O-OG1 2.89Å; T236-T239 PolarHBondContact O-N 2.95Å; W237-T239 PolarHBondContact O-N 3.43Å; T239-K243 VanDerWaalsContact O-CE 3.3Å; T239-K243 WeakPolarHBondContact O-CE 3.27Å; T239-K243 WeakPolarHBondContact O-CG 3.31Å
240	V	95.6	Very high	93.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-85.8	-16.7	-167.6	-56.2	0	0	0	0	113.8	S135 L142 T236 W237 I242 K243 F248 H257	S135-V240 WeakPolarHBondContact CB-O 3.46Å; L142-V240 HydrophobicContact CD1-CG2 3.77Å; L142-V240 HydrophobicContact CD2-CG2 4.47Å; L142-V240 HydrophobicContact CG-CG2 3.97Å; T236-V240 HydrophobicContact CG2-CG1 4.15Å; T236-V240 HydrophobicContact CG2-CG2 4.38Å; T236-V240 WeakPolarHBondContact O-CG1 3.1Å; T236-V240 VanDerWaalsContact O-CG2 3.25Å; T236-V240 WeakPolarHBondContact O-CG2 3.47Å; T236-V240 PolarHBondContact O-N 3.35Å; W237-V240 PolarHBondContact O-N 3.44Å; V240-I242 VanDerWaalsContact C-N 3.26Å; V240-I242 PolarHBondContact O-N 3.1Å; V240-I242 VanDerWaalsContact O-N 3.16Å; V240-K243 PolarHBondContact O-N 3.42Å; V240-F248 HydrophobicContact CB-CE1 4.19Å; V240-F248 HydrophobicContact CB-CZ 3.94Å; V240-F248 HydrophobicContact CG1-CE1 4.29Å; V240-F248 HydrophobicContact CG1-CZ 4.41Å; V240-H257 HydrophobicContact CG1-CB 4.1Å
241	L	96.8	Very high	93	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37.7	-171.5	179.8	62	0	0	0	113.8	I87 G134 S135 L139 F151 W237 M385 L488	I87-L241 HydrophobicContact CD1-CD2 4.21Å; G134-L241 CarbonylContact C-O 3.52Å; G134-L241 WeakPolarHBondContact CA-O 3.06Å; S135-L241 WeakPolarHBondContact CB-O 3.46Å; S135-L241 PolarHBondContact N-O 3.46Å; L139-L241 HydrophobicContact CD2-CD1 3.82Å; F151-L241 HydrophobicContact CD1-CD1 3.97Å; F151-L241 HydrophobicContact CE1-CD1 3.64Å; F151-L241 HydrophobicContact CE1-CD2 4.33Å; F151-L241 HydrophobicContact CE2-CD1 4.37Å; F151-L241 HydrophobicContact CE2-CD2 4.49Å; F151-L241 HydrophobicContact CG-CD1 4.47Å; F151-L241 HydrophobicContact CZ-CD1 3.86Å; F151-L241 HydrophobicContact CZ-CD2 3.87Å; W237-L241 VanDerWaalsContact O-CB 3.24Å; W237-L241 WeakPolarHBondContact O-CB 3.36Å; W237-L241 PolarHBondContact O-N 3.38Å; L241-M385 HydrophobicContact CD2-CE 4.35Å; L241-M385 HydrophobicContact CD2-SD 3.86Å; L241-L488 HydrophobicContact CD2-CD1 3.53Å; L241-L488 HydrophobicContact CD2-CD2 4.41Å
242	I	95.8	Very high	92.6	Very high	11 Å²	11	53.7 Å²	53.7	6%	0.056	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	17.8	-178.8	62.8	161.6	0	0	0	112.6	Y79 F82 I83 I87 I106 V240 M385	Y79-I242 WeakPolarHBondContact CE2-O 3.23Å; Y79-I242 PolarHBondContact OH-O 3.45Å; F82-I242 HydrophobicContact CB-CD1 3.92Å; I83-I242 HydrophobicContact CD1-CD1 3.93Å; I83-I242 HydrophobicContact CD1-CG1 3.99Å; I87-I242 HydrophobicContact CD1-CD1 4.27Å; I87-I242 HydrophobicContact CD1-CG1 4.48Å; I87-I242 HydrophobicContact CD1-CG2 4.03Å; I87-I242 HydrophobicContact CG1-CD1 3.94Å; I106-I242 HydrophobicContact CG2-CB 4.15Å; I106-I242 HydrophobicContact CG2-CG2 4.24Å; V240-I242 VanDerWaalsContact C-N 3.26Å; V240-I242 PolarHBondContact O-N 3.1Å; V240-I242 VanDerWaalsContact O-N 3.16Å; I242-M385 HydrophobicContact CG2-CE 4.38Å
243	K	94.6	Very high	92	Very high	40 Å²	40	50.2 Å²	50.2	17%	0.174	24%	0.24	C	C	.	.			trans	-72.2	145.6	178.7	-72.3	-74.3	179.2	-170.8	0	111.2	I83 S135 T239 V240 Y247 F248	I83-K243 HydrophobicContact CD1-CD 4.29Å; S135-K243 VanDerWaalsContact CB-O 3.31Å; S135-K243 WeakPolarHBondContact CB-O 3.24Å; S135-K243 PolarHBondContact OG-O 3.5Å; T239-K243 VanDerWaalsContact O-CE 3.3Å; T239-K243 WeakPolarHBondContact O-CE 3.27Å; T239-K243 WeakPolarHBondContact O-CG 3.31Å; V240-K243 PolarHBondContact O-N 3.42Å; K243-Y247 HydrophobicContact CB-CD1 4.02Å; K243-Y247 HydrophobicContact CB-CG 3.98Å; K243-Y247 HydrophobicContact CD-CD2 3.91Å; K243-Y247 HydrophobicContact CD-CE2 4.06Å; K243-Y247 HydrophobicContact CD-CG 4.18Å; K243-Y247 HydrophobicContact CG-CD1 4.17Å; K243-Y247 HydrophobicContact CG-CD2 4.36Å; K243-Y247 HydrophobicContact CG-CE1 4.35Å; K243-Y247 HydrophobicContact CG-CG 4.17Å; K243-F248 HydrophobicContact CB-CE2 3.83Å; K243-F248 HydrophobicContact CB-CZ 4.11Å
244	P	93	Very high	91.6	Very high	32 Å²	32	51.8 Å²	51.8	21%	0.208	25%	0.247	C	C	.	.			trans	-72.6	154.2	179.9	31.6	-33	0	0	0	110	Y79 N107 I246 Y247	Y79-P244 HydrophobicContact CE1-CB 4.27Å; Y79-P244 HydrophobicContact CE1-CG 4.5Å; Y79-P244 WeakPolarHBondContact OH-CA 3.2Å; Y79-P244 WeakPolarHBondContact OH-CB 3.35Å; Y79-P244 WeakPolarHBondContact OH-CD 3.17Å; N107-P244 WeakPolarHBondContact OD1-CB 3.46Å; P244-I246 HydrophobicContact CB-CG2 4.07Å; P244-I246 HydrophobicContact CG-CG2 3.85Å; P244-I246 PolarHBondContact O-N 3Å; P244-Y247 WeakPolarHBondContact O-CB 3.41Å; P244-Y247 PolarHBondContact O-N 3.01Å
245	D	91.6	Very high	91.4	Very high	90 Å²	90	55.7 Å²	55.7	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-55.2	-31.2	-178.3	-67.2	-4.3	0	0	0	113.1	Y247 F248	D245-Y247 PolarHBondContact O-N 3.48Å; D245-F248 PolarHBondContact O-N 2.92Å; D245-F248 VanDerWaalsContact O-N 3.14Å
246	I	91.2	Very high	91.2	Very high	103 Å²	103	62 Å²	62	53%	0.528	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-28.4	176.8	-165.9	160.3	0	0	0	113.1	P244 F248 K249 F250	P244-I246 HydrophobicContact CB-CG2 4.07Å; P244-I246 HydrophobicContact CG-CG2 3.85Å; P244-I246 PolarHBondContact O-N 3Å; I246-F248 VanDerWaalsContact C-N 3.27Å; I246-F248 PolarHBondContact O-N 3.41Å; I246-K249 WeakPolarHBondContact O-CB 3.14Å; I246-K249 PolarHBondContact O-N 2.93Å; I246-F250 HydrophobicContact CG1-CE2 3.84Å; I246-F250 WeakPolarHBondContact O-CD2 3.4Å
247	Y	91.9	Very high	91	Very high	35 Å²	35	63.1 Å²	63.1	14%	0.137	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-40.8	174.6	-177.2	-96.6	0	0	0	111.7	K243 P244 D245 K249 F250 I253 H254 H257	K243-Y247 HydrophobicContact CB-CD1 4.02Å; K243-Y247 HydrophobicContact CB-CG 3.98Å; K243-Y247 HydrophobicContact CD-CD2 3.91Å; K243-Y247 HydrophobicContact CD-CE2 4.06Å; K243-Y247 HydrophobicContact CD-CG 4.18Å; K243-Y247 HydrophobicContact CG-CD1 4.17Å; K243-Y247 HydrophobicContact CG-CD2 4.36Å; K243-Y247 HydrophobicContact CG-CE1 4.35Å; K243-Y247 HydrophobicContact CG-CG 4.17Å; P244-Y247 WeakPolarHBondContact O-CB 3.41Å; P244-Y247 PolarHBondContact O-N 3.01Å; D245-Y247 PolarHBondContact O-N 3.48Å; Y247-K249 VanDerWaalsContact C-N 3.3Å; Y247-K249 PolarHBondContact O-N 3.37Å; Y247-F250 PolarHBondContact O-N 2.63Å; Y247-I253 HydrophobicContact CD2-CG2 3.91Å; Y247-I253 HydrophobicContact CE1-CG2 4.35Å; Y247-I253 HydrophobicContact CE2-CB 4.46Å; Y247-I253 HydrophobicContact CE2-CG2 3.24Å; Y247-H254 HydrophobicContact CD1-CB 4.1Å; Y247-H254 HydrophobicContact CE1-CB 3.74Å; Y247-H257 PolarHBondContact OH-CD2 3.22Å; Y247-H257 VanDerWaalsContact OH-CD2 3.23Å; Y247-H257 PolarHBondContact OH-NE2 2.99Å
248	F	92	Very high	90.9	Very high	29 Å²	29	66 Å²	66	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-81.5	-9.4	-176.8	-58.2	-88	0	0	0	113.1	S135 P137 G138 V240 K243 D245 I246 F250 H254	S135-F248 WeakPolarHBondContact OG-CE2 3.43Å; P137-F248 HydrophobicContact CB-CB 4.08Å; P137-F248 HydrophobicContact CB-CD1 3.95Å; P137-F248 HydrophobicContact CB-CD2 3.58Å; P137-F248 HydrophobicContact CB-CE1 4.26Å; P137-F248 HydrophobicContact CB-CE2 3.93Å; P137-F248 HydrophobicContact CB-CG 3.58Å; P137-F248 HydrophobicContact CB-CZ 4.25Å; P137-F248 HydrophobicContact CG-CD2 4.17Å; P137-F248 HydrophobicContact CG-CG 4.49Å; G138-F248 VanDerWaalsContact CA-CZ 3.41Å; V240-F248 HydrophobicContact CB-CE1 4.19Å; V240-F248 HydrophobicContact CB-CZ 3.94Å; V240-F248 HydrophobicContact CG1-CE1 4.29Å; V240-F248 HydrophobicContact CG1-CZ 4.41Å; K243-F248 HydrophobicContact CB-CE2 3.83Å; K243-F248 HydrophobicContact CB-CZ 4.11Å; D245-F248 PolarHBondContact O-N 2.92Å; D245-F248 VanDerWaalsContact O-N 3.14Å; I246-F248 VanDerWaalsContact C-N 3.27Å; I246-F248 PolarHBondContact O-N 3.41Å; F248-F250 VanDerWaalsContact C-N 3.29Å; F248-H254 HydrophobicContact CD1-CB 4.28Å; F248-H254 PolarHBondContact O-CE1 2.98Å; F248-H254 PolarHBondContact O-ND1 3.29Å
249	K	89.9	Confident	91	Very high	165 Å²	165	68 Å²	68	72%	0.717	32%	0.317	S	S	*	.	H	α-helix	trans	-73.7	-23.9	171.4	-64.1	-173.6	178.9	-177.1	0	112.1	I246 Y247	I246-K249 WeakPolarHBondContact O-CB 3.14Å; I246-K249 PolarHBondContact O-N 2.93Å; Y247-K249 VanDerWaalsContact C-N 3.3Å; Y247-K249 PolarHBondContact O-N 3.37Å
250	F	88.6	Confident	91	Very high	94 Å²	94	66.8 Å²	66.8	41%	0.412	31%	0.311	S	S	.	.			trans	-96.2	99.3	180	-60.6	-68.3	0	0	0	110.4	I246 Y247 F248 W252 I253 H254	I246-F250 HydrophobicContact CG1-CE2 3.84Å; I246-F250 WeakPolarHBondContact O-CD2 3.4Å; Y247-F250 PolarHBondContact O-N 2.63Å; F248-F250 VanDerWaalsContact C-N 3.29Å; F250-W252 VanDerWaalsContact C-N 3.34Å; F250-W252 PolarHBondContact O-N 3.44Å; F250-I253 HydrophobicContact CB-CB 4.34Å; F250-I253 HydrophobicContact CB-CD1 3.64Å; F250-I253 HydrophobicContact CB-CG1 3.8Å; F250-I253 HydrophobicContact CD2-CD1 4.08Å; F250-I253 HydrophobicContact CG-CD1 4.08Å; F250-I253 PolarHBondContact O-N 3.13Å; F250-I253 VanDerWaalsContact O-N 3.16Å; F250-H254 PolarHBondContact O-N 3.33Å; F250-H254 PolarHBondContact O-ND1 3.14Å
251	G	83	Confident	91	Very high	34 Å²	34	66.8 Å²	66.8	35%	0.351	31%	0.311	S	S	.	.	H	α-helix	trans	-49.6	-51.1	-179.8	0	0	0	0	0	113.2	I253 H254 Q255	G251-I253 PolarHBondContact O-N 3.18Å; G251-I253 VanDerWaalsContact O-N 3.07Å; G251-H254 PolarHBondContact O-N 2.65Å; G251-Q255 WeakPolarHBondContact O-CB 3.29Å; G251-Q255 PolarHBondContact O-N 2.97Å
252	W	83.9	Confident	91	Very high	209 Å²	209	70.5 Å²	70.5	79%	0.792	33%	0.328	S	S	*	.	H	α-helix	trans	-59.8	-23	-177.1	64	-87.5	0	0	0	114.8	F250	F250-W252 VanDerWaalsContact C-N 3.34Å; F250-W252 PolarHBondContact O-N 3.44Å
253	I	82.6	Confident	91.1	Very high	49 Å²	49	73.2 Å²	73.2	25%	0.251	34%	0.341	S	S	.	.	H	α-helix	trans	-85	-48.5	179.4	-52.9	-178.1	0	0	0	110.9	Y247 F250 G251	Y247-I253 HydrophobicContact CD2-CG2 3.91Å; Y247-I253 HydrophobicContact CE1-CG2 4.35Å; Y247-I253 HydrophobicContact CE2-CB 4.46Å; Y247-I253 HydrophobicContact CE2-CG2 3.24Å; F250-I253 HydrophobicContact CB-CB 4.34Å; F250-I253 HydrophobicContact CB-CD1 3.64Å; F250-I253 HydrophobicContact CB-CG1 3.8Å; F250-I253 HydrophobicContact CD2-CD1 4.08Å; F250-I253 HydrophobicContact CG-CD1 4.08Å; F250-I253 PolarHBondContact O-N 3.13Å; F250-I253 VanDerWaalsContact O-N 3.16Å; G251-I253 PolarHBondContact O-N 3.18Å; G251-I253 VanDerWaalsContact O-N 3.07Å
254	H	87.5	Confident	91.2	Very high	33 Å²	33	71.3 Å²	71.3	15%	0.153	33%	0.333	C	S	.	.	H	α-helix	trans	-93.5	-10.9	-172.5	79.8	-80.9	0	0	0	113.9	Y247 F248 F250 G251 R256 H257 K258	Y247-H254 HydrophobicContact CD1-CB 4.1Å; Y247-H254 HydrophobicContact CE1-CB 3.74Å; F248-H254 HydrophobicContact CD1-CB 4.28Å; F248-H254 PolarHBondContact O-CE1 2.98Å; F248-H254 PolarHBondContact O-ND1 3.29Å; F250-H254 PolarHBondContact O-N 3.33Å; F250-H254 PolarHBondContact O-ND1 3.14Å; G251-H254 PolarHBondContact O-N 2.65Å; H254-R256 VanDerWaalsContact C-N 3.3Å; H254-R256 PolarHBondContact O-N 2.89Å; H254-H257 WeakPolarHBondContact O-CB 3.4Å; H254-H257 PolarHBondContact O-N 2.76Å; H254-H257 VanDerWaalsContact O-N 3.14Å; H254-K258 PolarHBondContact O-N 3.5Å
255	Q	90.1	Very high	91.5	Very high	89 Å²	89	70.6 Å²	70.6	42%	0.416	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-40.2	-178.2	-172.1	65.1	23.9	0	0	111.9	G251 H257 K258 T259	G251-Q255 WeakPolarHBondContact O-CB 3.29Å; G251-Q255 PolarHBondContact O-N 2.97Å; Q255-H257 VanDerWaalsContact C-N 3.32Å; Q255-H257 PolarHBondContact O-N 3.37Å; Q255-K258 PolarHBondContact O-N 2.9Å; Q255-T259 PolarHBondContact O-N 3.49Å; Q255-T259 PolarHBondContact O-OG1 3.02Å; Q255-T259 VanDerWaalsContact O-OG1 3.13Å
256	R	90	Very high	91.8	Very high	209 Å²	209	71 Å²	71	79%	0.789	33%	0.329	S	S	*	.	H	α-helix	trans	-56.5	-46.8	175.9	178.6	-179	168.9	113.9	-2.2	111.7	H254 T259 A260	H254-R256 VanDerWaalsContact C-N 3.3Å; H254-R256 PolarHBondContact O-N 2.89Å; R256-T259 PolarHBondContact O-N 3.36Å; R256-A260 WeakPolarHBondContact O-CB 3.42Å; R256-A260 PolarHBondContact O-N 3.4Å
257	H	91.3	Very high	92.1	Very high	28 Å²	28	67 Å²	67	13%	0.13	31%	0.31	C	S	.	.	H	α-helix	trans	-65.7	-42.1	177.7	-70.2	-58.9	0	0	0	112	T236 V240 Y247 H254 Q255 T259 A260 A261	T236-H257 HydrophobicContact CG2-CB 3.59Å; T236-H257 WeakPolarHBondContact CG2-O 3.41Å; T236-H257 PolarHBondContact OG1-ND1 3.41Å; V240-H257 HydrophobicContact CG1-CB 4.1Å; Y247-H257 PolarHBondContact OH-CD2 3.22Å; Y247-H257 VanDerWaalsContact OH-CD2 3.23Å; Y247-H257 PolarHBondContact OH-NE2 2.99Å; H254-H257 WeakPolarHBondContact O-CB 3.4Å; H254-H257 PolarHBondContact O-N 2.76Å; H254-H257 VanDerWaalsContact O-N 3.14Å; Q255-H257 VanDerWaalsContact C-N 3.32Å; Q255-H257 PolarHBondContact O-N 3.37Å; H257-T259 PolarHBondContact O-N 3.25Å; H257-A260 PolarHBondContact O-N 3.04Å; H257-A261 WeakPolarHBondContact O-CB 3.38Å; H257-A261 PolarHBondContact O-N 3Å
258	K	92.7	Very high	92.4	Very high	85 Å²	85	65.3 Å²	65.3	37%	0.37	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-46.1	176.3	-173.5	-178	175.4	-176.7	0	111.6	H254 Q255 A261 Q262	H254-K258 PolarHBondContact O-N 3.5Å; Q255-K258 PolarHBondContact O-N 2.9Å; K258-A261 PolarHBondContact O-N 3.25Å; K258-Q262 WeakPolarHBondContact O-CB 3.38Å; K258-Q262 PolarHBondContact O-N 3.38Å
259	T	94.7	Very high	92.7	Very high	56 Å²	56	66.5 Å²	66.5	34%	0.344	31%	0.31	S	S	.	.	H	α-helix	trans	-60.9	-48.7	176.1	-62.4	0	0	0	0	111.3	Q255 R256 H257 A261 Q262 E263	Q255-T259 PolarHBondContact O-N 3.49Å; Q255-T259 PolarHBondContact O-OG1 3.02Å; Q255-T259 VanDerWaalsContact O-OG1 3.13Å; R256-T259 PolarHBondContact O-N 3.36Å; H257-T259 PolarHBondContact O-N 3.25Å; T259-A261 VanDerWaalsContact C-N 3.31Å; T259-A261 PolarHBondContact O-N 3.49Å; T259-Q262 PolarHBondContact O-N 2.79Å; T259-Q262 VanDerWaalsContact O-N 3.15Å; T259-E263 HydrophobicContact CG2-CG 4.48Å; T259-E263 WeakPolarHBondContact O-CG 3.47Å; T259-E263 PolarHBondContact O-N 3.31Å
260	A	94.4	Very high	93	Very high	11 Å²	11	61.9 Å²	61.9	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-41	177	0	0	0	0	0	113	R232 R256 H257	R232-A260 HydrophobicContact CB-CB 4.08Å; R256-A260 WeakPolarHBondContact O-CB 3.42Å; R256-A260 PolarHBondContact O-N 3.4Å; H257-A260 PolarHBondContact O-N 3.04Å
261	A	95.9	Very high	93.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66	-41.1	176.1	0	0	0	0	0	112.1	Y233 T236 H257 K258 T259 Q265	Y233-A261 HydrophobicContact CD2-CB 4.24Å; Y233-A261 HydrophobicContact CE2-CB 4.35Å; T236-A261 HydrophobicContact CG2-CB 4.44Å; H257-A261 WeakPolarHBondContact O-CB 3.38Å; H257-A261 PolarHBondContact O-N 3Å; K258-A261 PolarHBondContact O-N 3.25Å; T259-A261 VanDerWaalsContact C-N 3.31Å; T259-A261 PolarHBondContact O-N 3.49Å; A261-Q265 VanDerWaalsContact O-CG 3.25Å; A261-Q265 WeakPolarHBondContact O-CG 3.07Å; A261-Q265 PolarHBondContact O-N 3.44Å; A261-Q265 VanDerWaalsContact O-N 3.15Å
262	Q	96.8	Very high	94.1	Very high	78 Å²	78	56.8 Å²	56.8	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-66.7	-39.7	176.9	-91.7	173.1	-66.7	0	0	112.8	K258 T259 L264 Q265 D266	K258-Q262 WeakPolarHBondContact O-CB 3.38Å; K258-Q262 PolarHBondContact O-N 3.38Å; T259-Q262 PolarHBondContact O-N 2.79Å; T259-Q262 VanDerWaalsContact O-N 3.15Å; Q262-L264 VanDerWaalsContact C-N 3.29Å; Q262-L264 PolarHBondContact O-N 2.78Å; Q262-Q265 PolarHBondContact O-N 2.98Å; Q262-Q265 VanDerWaalsContact O-N 3.1Å; Q262-D266 WeakPolarHBondContact O-CB 3.3Å; Q262-D266 VanDerWaalsContact O-CG 3.25Å; Q262-D266 PolarHBondContact O-N 3.37Å
263	E	97.4	Very high	94.8	Very high	69 Å²	69	50.2 Å²	50.2	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-53.5	-45	177.1	-77.4	174.2	-172	0	0	112.3	R232 T259 A267	R232-E263 IonicContact NH1-OE1 3.71Å; R232-E263 IonicContact NH1-OE2 3.93Å; R232-E263 PolarHBondContact NH1-OE2 2.76Å; T259-E263 HydrophobicContact CG2-CG 4.48Å; T259-E263 WeakPolarHBondContact O-CG 3.47Å; T259-E263 PolarHBondContact O-N 3.31Å; E263-A267 WeakPolarHBondContact O-CB 3.19Å; E263-A267 PolarHBondContact O-N 3.16Å; E263-A267 VanDerWaalsContact O-N 3.15Å
264	L	97.5	Very high	95.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-72.7	-41.7	176.5	-176.7	63.4	0	0	0	111.9	L226 K229 I230 Y233 Q262 D266 A267 I268 L312 I316	L226-L264 HydrophobicContact CD1-CD1 3.75Å; K229-L264 HydrophobicContact CB-CB 4.19Å; K229-L264 HydrophobicContact CB-CD1 3.85Å; I230-L264 HydrophobicContact CG1-CD1 3.97Å; I230-L264 HydrophobicContact CG1-CD2 4.27Å; Y233-L264 VanDerWaalsContact CB-CD2 3.48Å; Y233-L264 HydrophobicContact CD1-CD2 4.09Å; Y233-L264 HydrophobicContact CD2-CB 4.11Å; Y233-L264 HydrophobicContact CD2-CD2 3.73Å; Y233-L264 HydrophobicContact CD2-CG 4.46Å; Y233-L264 HydrophobicContact CE2-CD2 4.49Å; Y233-L264 HydrophobicContact CG-CB 4.48Å; Y233-L264 HydrophobicContact CG-CD2 3.51Å; Q262-L264 VanDerWaalsContact C-N 3.29Å; Q262-L264 PolarHBondContact O-N 2.78Å; L264-D266 VanDerWaalsContact C-N 3.32Å; L264-D266 PolarHBondContact O-N 2.93Å; L264-A267 PolarHBondContact O-N 2.9Å; L264-I268 HydrophobicContact CD1-CD1 4.43Å; L264-I268 HydrophobicContact CD1-CG1 4.19Å; L264-I268 HydrophobicContact CG-CG1 4.31Å; L264-I268 VanDerWaalsContact O-CG1 3.32Å; L264-I268 WeakPolarHBondContact O-CG1 3.36Å; L264-I268 PolarHBondContact O-N 2.97Å; L264-L312 HydrophobicContact CD2-CD1 4.12Å; L264-L312 HydrophobicContact CD2-CD2 4.29Å; L264-L312 HydrophobicContact CD2-CG 4.09Å; L264-L312 HydrophobicContact CG-CD1 4.05Å; L264-L312 HydrophobicContact CG-CG 4.33Å; L264-I316 HydrophobicContact CD2-CG2 3.75Å
265	Q	97.8	Very high	95.8	Very high	16 Å²	16	48.7 Å²	48.7	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-58.1	-45.8	177.8	-72.8	168.2	3.1	0	0	111.4	C141 L142 A261 Q262 I268 E269 R308 L312	C141-Q265 PolarHBondContact O-NE2 3.36Å; L142-Q265 PolarHBondContact O-NE2 3.43Å; A261-Q265 VanDerWaalsContact O-CG 3.25Å; A261-Q265 WeakPolarHBondContact O-CG 3.07Å; A261-Q265 PolarHBondContact O-N 3.44Å; A261-Q265 VanDerWaalsContact O-N 3.15Å; Q262-Q265 PolarHBondContact O-N 2.98Å; Q262-Q265 VanDerWaalsContact O-N 3.1Å; Q265-I268 PolarHBondContact O-N 3.41Å; Q265-E269 PolarHBondContact O-N 3.09Å; Q265-R308 VanDerWaalsContact O-CD 3.22Å; Q265-R308 WeakPolarHBondContact O-CD 3.36Å; Q265-L312 HydrophobicContact CG-CD1 3.89Å
266	D	98	Very high	96	Very high	100 Å²	100	46.2 Å²	46.2	54%	0.535	22%	0.224	S	C	.	.	H	α-helix	trans	-67.1	-38.4	179.5	-64.9	-18.6	0	0	0	111.3	Q262 L264 E269 S270	Q262-D266 WeakPolarHBondContact O-CB 3.3Å; Q262-D266 VanDerWaalsContact O-CG 3.25Å; Q262-D266 PolarHBondContact O-N 3.37Å; L264-D266 VanDerWaalsContact C-N 3.32Å; L264-D266 PolarHBondContact O-N 2.93Å; D266-E269 PolarHBondContact O-N 2.96Å; D266-S270 PolarHBondContact O-N 3.41Å
267	A	98	Very high	96.2	Very high	17 Å²	17	42 Å²	42	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-46.2	173.5	0	0	0	0	0	111.8	K229 E263 L264 S270 L271	K229-A267 HydrophobicContact CD-CB 3.82Å; E263-A267 WeakPolarHBondContact O-CB 3.19Å; E263-A267 PolarHBondContact O-N 3.16Å; E263-A267 VanDerWaalsContact O-N 3.15Å; L264-A267 PolarHBondContact O-N 2.9Å; A267-S270 WeakPolarHBondContact O-CB 3.35Å; A267-S270 PolarHBondContact O-N 3.33Å; A267-L271 WeakPolarHBondContact O-CG 3.25Å; A267-L271 PolarHBondContact O-N 2.91Å; A267-L271 VanDerWaalsContact O-N 3.11Å
268	I	97.9	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-39.9	177.2	-62.9	-62.4	0	0	0	111.3	L226 L264 Q265 S270 L271 V272 R308 V311 L312 V315	L226-I268 HydrophobicContact CD1-CD1 4.39Å; L264-I268 HydrophobicContact CD1-CD1 4.43Å; L264-I268 HydrophobicContact CD1-CG1 4.19Å; L264-I268 HydrophobicContact CG-CG1 4.31Å; L264-I268 VanDerWaalsContact O-CG1 3.32Å; L264-I268 WeakPolarHBondContact O-CG1 3.36Å; L264-I268 PolarHBondContact O-N 2.97Å; Q265-I268 PolarHBondContact O-N 3.41Å; I268-S270 VanDerWaalsContact C-N 3.3Å; I268-S270 PolarHBondContact O-N 3.24Å; I268-L271 HydrophobicContact CD1-CD1 4.26Å; I268-L271 PolarHBondContact O-N 3.02Å; I268-V272 HydrophobicContact CG2-CG2 4.28Å; I268-V272 WeakPolarHBondContact O-CG2 3.3Å; I268-V272 PolarHBondContact O-N 3.38Å; I268-R308 HydrophobicContact CB-CG 4.39Å; I268-R308 HydrophobicContact CG2-CG 4.04Å; I268-V311 HydrophobicContact CG2-CB 3.99Å; I268-V311 HydrophobicContact CG2-CG1 3.82Å; I268-L312 HydrophobicContact CB-CB 4.41Å; I268-L312 HydrophobicContact CG1-CB 3.97Å; I268-L312 HydrophobicContact CG1-CD1 4.23Å; I268-L312 HydrophobicContact CG1-CG 4.04Å; I268-L312 HydrophobicContact CG2-CB 4.13Å; I268-V315 HydrophobicContact CD1-CB 4.4Å; I268-V315 HydrophobicContact CD1-CG1 4.36Å; I268-V315 HydrophobicContact CD1-CG2 4.47Å
269	E	97.9	Very high	96.2	Very high	54 Å²	54	42.4 Å²	42.4	25%	0.252	21%	0.212	S	C	.	.	H	α-helix	trans	-58.1	-44.1	174.9	-168.6	71.3	-136.3	0	0	111.2	Q265 D266 L271 V272 E273 R308	Q265-E269 PolarHBondContact O-N 3.09Å; D266-E269 PolarHBondContact O-N 2.96Å; E269-L271 VanDerWaalsContact C-N 3.33Å; E269-L271 PolarHBondContact O-N 3.41Å; E269-V272 PolarHBondContact O-N 3.01Å; E269-E273 PolarHBondContact O-N 3.15Å; E269-R308 VanDerWaalsContact OE2-CD 3.23Å; E269-R308 WeakPolarHBondContact OE2-CD 3.47Å; E269-R308 IonicContact OE2-CZ 3.1Å; E269-R308 IonicContact OE2-NE 3.05Å; E269-R308 IonicContact OE2-NH1 3.36Å; E269-R308 PolarHBondContact OE2-NH1 3.34Å
270	S	97.9	Very high	95.9	Very high	68 Å²	68	46.8 Å²	46.8	48%	0.476	23%	0.229	S	C	.	.	H	α-helix	trans	-60.5	-41.3	176	-175.9	0	0	0	0	112.5	D266 A267 I268 E273 Q274	D266-S270 PolarHBondContact O-N 3.41Å; A267-S270 WeakPolarHBondContact O-CB 3.35Å; A267-S270 PolarHBondContact O-N 3.33Å; I268-S270 VanDerWaalsContact C-N 3.3Å; I268-S270 PolarHBondContact O-N 3.24Å; S270-E273 PolarHBondContact O-N 3.21Å; S270-Q274 WeakPolarHBondContact O-CB 3.41Å; S270-Q274 PolarHBondContact O-N 3.42Å
271	L	97.5	Very high	95.6	Very high	20 Å²	20	54 Å²	54	11%	0.105	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-38.8	177.3	-64.4	176.4	0	0	0	112.2	L217 V219 L221 A267 I268 E269 Q274 K275	L217-L271 HydrophobicContact CD2-CB 4.03Å; L217-L271 HydrophobicContact CD2-CD1 3.94Å; L217-L271 HydrophobicContact CD2-CG 4.5Å; V219-L271 HydrophobicContact CG2-CB 4.27Å; V219-L271 HydrophobicContact CG2-CD2 3.79Å; L221-L271 HydrophobicContact CB-CD2 4.22Å; A267-L271 WeakPolarHBondContact O-CG 3.25Å; A267-L271 PolarHBondContact O-N 2.91Å; A267-L271 VanDerWaalsContact O-N 3.11Å; I268-L271 HydrophobicContact CD1-CD1 4.26Å; I268-L271 PolarHBondContact O-N 3.02Å; E269-L271 VanDerWaalsContact C-N 3.33Å; E269-L271 PolarHBondContact O-N 3.41Å; L271-Q274 PolarHBondContact O-N 2.93Å; L271-K275 WeakPolarHBondContact O-CB 3.48Å; L271-K275 PolarHBondContact O-N 2.7Å
272	V	97.3	Very high	95.1	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-40.9	174.8	171.6	0	0	0	0	111.1	I268 E269 K275 R276 T290 I294 V307 V311	I268-V272 HydrophobicContact CG2-CG2 4.28Å; I268-V272 WeakPolarHBondContact O-CG2 3.3Å; I268-V272 PolarHBondContact O-N 3.38Å; E269-V272 PolarHBondContact O-N 3.01Å; V272-K275 WeakPolarHBondContact O-CB 3.48Å; V272-K275 PolarHBondContact O-N 3.01Å; V272-R276 PolarHBondContact O-N 3.08Å; V272-T290 HydrophobicContact CG2-CG2 4.39Å; V272-I294 HydrophobicContact CG1-CD1 4.31Å; V272-I294 HydrophobicContact CG1-CG1 4.32Å; V272-V307 HydrophobicContact CG1-CG1 4.21Å; V272-V311 HydrophobicContact CG2-CB 4.05Å; V272-V311 HydrophobicContact CG2-CG1 3.98Å; V272-V311 HydrophobicContact CG2-CG2 3.91Å
273	E	96.9	Very high	94	Very high	71 Å²	71	61 Å²	61	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-68.7	-37.8	176.8	-174	56.7	-148.5	0	0	112.1	E269 S270 K275 R276 R277	E269-E273 PolarHBondContact O-N 3.15Å; S270-E273 PolarHBondContact O-N 3.21Å; E273-K275 VanDerWaalsContact C-N 3.34Å; E273-R276 PolarHBondContact O-N 3.23Å; E273-R276 IonicContact OE2-CZ 3.58Å; E273-R276 IonicContact OE2-NH1 3.17Å; E273-R276 PolarHBondContact OE2-NH1 3.35Å; E273-R277 WeakPolarHBondContact O-CG 3.06Å; E273-R277 PolarHBondContact O-N 2.98Å; E273-R277 VanDerWaalsContact O-N 3.11Å; E273-R277 PolarHBondContact O-NE 3.31Å
274	Q	95.9	Very high	93.1	Very high	47 Å²	47	66.5 Å²	66.5	22%	0.22	33%	0.33	C	S	.	.	H	α-helix	trans	-59.6	-46.9	169.8	179.8	171.5	-13.2	0	0	111.2	V219 S270 L271 R276 R277 E278	V219-Q274 HydrophobicContact CG1-CG 4.49Å; S270-Q274 WeakPolarHBondContact O-CB 3.41Å; S270-Q274 PolarHBondContact O-N 3.42Å; L271-Q274 PolarHBondContact O-N 2.93Å; Q274-R276 VanDerWaalsContact C-N 3.3Å; Q274-R276 PolarHBondContact O-N 3.44Å; Q274-R277 PolarHBondContact O-N 3.06Å; Q274-R277 VanDerWaalsContact O-N 3.16Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.32Å; Q274-E278 PolarHBondContact NE2-OE1 2.98Å; Q274-E278 PolarHBondContact O-N 3.38Å
275	K	95.2	Very high	92.1	Very high	3 Å²	3	73.8 Å²	73.8	1%	0.013	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-42.8	178	-172.1	55.4	170.9	-170.3	0	112.2	L217 D218 V219 L271 V272 E273 R277 E278 M279 D286 N288 T290 I294	L217-K275 HydrophobicContact CD1-CB 4.35Å; L217-K275 VanDerWaalsContact O-CD 3.31Å; L217-K275 WeakPolarHBondContact O-CD 3.39Å; L217-K275 WeakPolarHBondContact O-CE 3.3Å; L217-K275 PolarHBondContact O-NZ 3.42Å; D218-K275 PolarHBondContact O-NZ 3.46Å; V219-K275 HydrophobicContact CG1-CB 3.81Å; V219-K275 HydrophobicContact CG1-CD 3.7Å; V219-K275 HydrophobicContact CG1-CG 4.31Å; L271-K275 WeakPolarHBondContact O-CB 3.48Å; L271-K275 PolarHBondContact O-N 2.7Å; V272-K275 WeakPolarHBondContact O-CB 3.48Å; V272-K275 PolarHBondContact O-N 3.01Å; E273-K275 VanDerWaalsContact C-N 3.34Å; K275-R277 VanDerWaalsContact C-N 3.35Å; K275-R277 PolarHBondContact O-N 2.73Å; K275-E278 PolarHBondContact O-N 2.6Å; K275-M279 HydrophobicContact CD-CG 4.5Å; K275-M279 HydrophobicContact CG-CG 4.48Å; K275-M279 HydrophobicContact CG-SD 4.14Å; K275-M279 VanDerWaalsContact O-CG 3.26Å; K275-M279 WeakPolarHBondContact O-CG 3.29Å; K275-M279 PolarHBondContact O-N 2.99Å; K275-D286 WeakPolarHBondContact CE-OD2 2.99Å; K275-D286 IonicContact NZ-OD2 3.73Å; K275-D286 PolarHBondContact NZ-OD2 3.42Å; K275-N288 VanDerWaalsContact CE-ND2 3.31Å; K275-N288 WeakPolarHBondContact CE-ND2 3.31Å; K275-N288 PolarHBondContact NZ-ND2 2.91Å; K275-T290 HydrophobicContact CB-CG2 4.31Å; K275-T290 HydrophobicContact CG-CG2 3.99Å; K275-I294 HydrophobicContact CB-CD1 4.37Å; K275-I294 HydrophobicContact CG-CD1 4.22Å
276	R	94.4	Very high	90.9	Very high	37 Å²	37	75.2 Å²	75.2	14%	0.14	38%	0.376	C	S	.	.	H	α-helix	trans	-56.9	-46.9	176	-176.7	178	-72.4	125	2.5	111.5	V272 E273 Q274 M279 E280 I294	V272-R276 PolarHBondContact O-N 3.08Å; E273-R276 PolarHBondContact O-N 3.23Å; E273-R276 IonicContact OE2-CZ 3.58Å; E273-R276 IonicContact OE2-NH1 3.17Å; E273-R276 PolarHBondContact OE2-NH1 3.35Å; Q274-R276 VanDerWaalsContact C-N 3.3Å; Q274-R276 PolarHBondContact O-N 3.44Å; R276-M279 PolarHBondContact O-N 3.46Å; R276-E280 WeakPolarHBondContact O-CG 3.18Å; R276-E280 PolarHBondContact O-N 3.43Å; R276-E280 VanDerWaalsContact O-N 3.08Å; R276-I294 HydrophobicContact CB-CD1 4.38Å
277	R	93.8	Very high	90.1	Very high	122 Å²	122	76 Å²	76	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-41	178.1	-70	-179.7	-68.5	-167	0.2	112.9	E273 Q274 K275 E280 Q281	E273-R277 WeakPolarHBondContact O-CG 3.06Å; E273-R277 PolarHBondContact O-N 2.98Å; E273-R277 VanDerWaalsContact O-N 3.11Å; E273-R277 PolarHBondContact O-NE 3.31Å; Q274-R277 PolarHBondContact O-N 3.06Å; Q274-R277 VanDerWaalsContact O-N 3.16Å; K275-R277 VanDerWaalsContact C-N 3.35Å; K275-R277 PolarHBondContact O-N 2.73Å; R277-E280 PolarHBondContact O-N 3.5Å; R277-Q281 WeakPolarHBondContact O-CG 3.5Å; R277-Q281 PolarHBondContact O-N 2.97Å
278	E	92.9	Very high	89.6	Confident	65 Å²	65	75.9 Å²	75.9	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-40.4	176.7	-71.2	173	-169.9	0	0	111.4	Q274 K275 E280 Q281 A282	Q274-E278 WeakPolarHBondContact CG-OE1 3.32Å; Q274-E278 PolarHBondContact NE2-OE1 2.98Å; Q274-E278 PolarHBondContact O-N 3.38Å; K275-E278 PolarHBondContact O-N 2.6Å; E278-E280 VanDerWaalsContact C-N 3.35Å; E278-E280 PolarHBondContact O-N 3.47Å; E278-Q281 PolarHBondContact O-N 2.99Å; E278-A282 WeakPolarHBondContact O-CB 3.31Å; E278-A282 PolarHBondContact O-N 3.29Å; E278-A282 VanDerWaalsContact O-N 3.08Å
279	M	91.6	Very high	89.5	Confident	55 Å²	55	76 Å²	76	27%	0.271	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-36.4	175.2	-71.1	172.2	64.2	0	0	113	K275 R276 Q281 A282 D286 A291 I294	K275-M279 HydrophobicContact CD-CG 4.5Å; K275-M279 HydrophobicContact CG-CG 4.48Å; K275-M279 HydrophobicContact CG-SD 4.14Å; K275-M279 VanDerWaalsContact O-CG 3.26Å; K275-M279 WeakPolarHBondContact O-CG 3.29Å; K275-M279 PolarHBondContact O-N 2.99Å; R276-M279 PolarHBondContact O-N 3.46Å; M279-Q281 VanDerWaalsContact C-N 3.27Å; M279-Q281 PolarHBondContact O-N 3.17Å; M279-A282 PolarHBondContact O-N 2.93Å; M279-D286 HydrophobicContact CG-CB 4.29Å; M279-A291 HydrophobicContact CE-CB 3.66Å; M279-A291 HydrophobicContact SD-CB 3.75Å; M279-I294 HydrophobicContact SD-CD1 3.85Å
280	E	89.1	Confident	89.4	Confident	149 Å²	149	73.5 Å²	73.5	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-67.8	-28	176.4	-74.1	173	-177.1	0	0	112.8	R276 R277 E278	R276-E280 WeakPolarHBondContact O-CG 3.18Å; R276-E280 PolarHBondContact O-N 3.43Å; R276-E280 VanDerWaalsContact O-N 3.08Å; R277-E280 PolarHBondContact O-N 3.5Å; E278-E280 VanDerWaalsContact C-N 3.35Å; E278-E280 PolarHBondContact O-N 3.47Å
281	Q	87.7	Confident	89.2	Confident	162 Å²	162	70.5 Å²	70.5	76%	0.757	35%	0.345	S	S	*	.	H	α-helix	trans	-93.2	-10.1	-179.5	-65.9	175.2	16.5	0	0	113.3	R277 E278 M279	R277-Q281 WeakPolarHBondContact O-CG 3.5Å; R277-Q281 PolarHBondContact O-N 2.97Å; E278-Q281 PolarHBondContact O-N 2.99Å; M279-Q281 VanDerWaalsContact C-N 3.27Å; M279-Q281 PolarHBondContact O-N 3.17Å
282	A	85.4	Confident	89.1	Confident	51 Å²	51	71 Å²	71	42%	0.421	35%	0.348	S	S	.	.			trans	-80.3	131.1	-174.2	0	0	0	0	0	112.5	E278 M279 K284	E278-A282 WeakPolarHBondContact O-CB 3.31Å; E278-A282 PolarHBondContact O-N 3.29Å; E278-A282 VanDerWaalsContact O-N 3.08Å; M279-A282 PolarHBondContact O-N 2.93Å; A282-K284 PolarHBondContact O-N 3.02Å
283	D	74.8	Confident	89.1	Confident	175 Å²	175	71 Å²	71	94%	0.936	35%	0.348	S	S	*	.	S	Bend	trans	-70.5	-16.7	173.4	-68.5	-38	0	0	0	113.2
284	K	77.2	Confident	89.1	Confident	183 Å²	183	67.8 Å²	67.8	80%	0.796	33%	0.333	S	S	*	.	S	Bend	trans	-120.6	145.5	-178.6	-68.2	-179.6	-177.7	173.9	0	110.2	A282 D286	A282-K284 PolarHBondContact O-N 3.02Å; K284-D286 PolarHBondContact O-N 2.95Å; K284-D286 VanDerWaalsContact O-N 3.16Å
285	L	75.9	Confident	89.1	Confident	153 Å²	153	71.2 Å²	71.2	80%	0.801	35%	0.347	S	S	*	.			trans	-62.6	117.6	172.8	-167	78.1	0	0	0	109.2	I287	L285-I287 HydrophobicContact CD2-CD1 4.37Å; L285-I287 HydrophobicContact CD2-CG1 4.14Å; L285-I287 HydrophobicContact CG-CG1 4.36Å
286	D	73.6	Confident	89.1	Confident	46 Å²	46	71.1 Å²	71.1	25%	0.246	35%	0.347	C	S	.	.			trans	-76.9	130.7	170.4	-169.6	-2.6	0	0	0	109.9	K275 M279 K284	K275-D286 WeakPolarHBondContact CE-OD2 2.99Å; K275-D286 IonicContact NZ-OD2 3.73Å; K275-D286 PolarHBondContact NZ-OD2 3.42Å; M279-D286 HydrophobicContact CG-CB 4.29Å; K284-D286 PolarHBondContact O-N 2.95Å; K284-D286 VanDerWaalsContact O-N 3.16Å
287	I	80.4	Confident	89.2	Confident	118 Å²	118	71.5 Å²	71.5	61%	0.605	35%	0.35	S	S	*	.			trans	-124.3	87	-175.9	-52.2	176.9	0	0	0	108	L285	L285-I287 HydrophobicContact CD2-CD1 4.37Å; L285-I287 HydrophobicContact CD2-CG1 4.14Å; L285-I287 HydrophobicContact CG-CG1 4.36Å
288	N	89	Confident	89.3	Confident	14 Å²	14	71.4 Å²	71.4	8%	0.075	36%	0.359	C	S	.	.	S	Bend	trans	-140.7	177	170	76.9	30.7	0	0	0	111.6	F216 L217 K275 T290 A291 D292	F216-N288 PolarHBondContact O-OD1 2.87Å; L217-N288 PolarHBondContact O-ND2 3.14Å; K275-N288 VanDerWaalsContact CE-ND2 3.31Å; K275-N288 WeakPolarHBondContact CE-ND2 3.31Å; K275-N288 PolarHBondContact NZ-ND2 2.91Å; N288-T290 PolarHBondContact O-N 2.98Å; N288-T290 PolarHBondContact OD1-N 2.92Å; N288-A291 PolarHBondContact O-N 2.96Å; N288-A291 PolarHBondContact OD1-N 3.01Å; N288-D292 PolarHBondContact O-N 3Å
289	F	94.4	Very high	89.4	Confident	3 Å²	3	73.5 Å²	73.5	1%	0.013	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-44.6	-177.4	173.7	-108.1	0	0	0	112.9	F165 A168 F216 D292 L293 C310 M314	F165-F289 HydrophobicContact CD1-CE2 4.16Å; F165-F289 AromaticContact CD1-CZ 3.99Å; F165-F289 HydrophobicContact CD1-CZ 3.99Å; F165-F289 AromaticContact CD2-CE2 3.98Å; F165-F289 HydrophobicContact CD2-CE2 3.98Å; F165-F289 AromaticContact CD2-CZ 3.99Å; F165-F289 HydrophobicContact CD2-CZ 3.99Å; F165-F289 HydrophobicContact CE1-CE1 4.47Å; F165-F289 HydrophobicContact CE1-CE2 4.36Å; F165-F289 AromaticContact CE1-CZ 3.73Å; F165-F289 HydrophobicContact CE1-CZ 3.73Å; F165-F289 HydrophobicContact CE2-CE2 4.19Å; F165-F289 AromaticContact CE2-CZ 3.74Å; F165-F289 HydrophobicContact CE2-CZ 3.74Å; F165-F289 AromaticContact CG-CE2 3.97Å; F165-F289 HydrophobicContact CG-CE2 3.97Å; F165-F289 HydrophobicContact CG-CZ 4.12Å; F165-F289 HydrophobicContact CZ-CE1 4.46Å; F165-F289 HydrophobicContact CZ-CE2 4.39Å; F165-F289 AromaticContact CZ-CZ 3.61Å; F165-F289 HydrophobicContact CZ-CZ 3.61Å; A168-F289 HydrophobicContact CB-CB 3.78Å; A168-F289 HydrophobicContact CB-CD2 3.59Å; A168-F289 HydrophobicContact CB-CG 4.03Å; F216-F289 HydrophobicContact CB-CB 4Å; F216-F289 HydrophobicContact CB-CD1 4.33Å; F216-F289 HydrophobicContact CD1-CB 4.07Å; F216-F289 HydrophobicContact CG-CB 4.47Å; F289-D292 PolarHBondContact O-N 3.19Å; F289-L293 HydrophobicContact CD1-CD1 4.05Å; F289-L293 HydrophobicContact CE1-CD1 3.49Å; F289-L293 VanDerWaalsContact CE1-CD1 3.49Å; F289-L293 HydrophobicContact CE2-CD1 4.03Å; F289-L293 HydrophobicContact CE2-CG 4.32Å; F289-L293 HydrophobicContact CZ-CD1 3.5Å; F289-L293 HydrophobicContact CZ-CG 4.28Å; F289-L293 WeakPolarHBondContact O-CG 3.36Å; F289-L293 PolarHBondContact O-N 2.89Å; F289-L293 VanDerWaalsContact O-N 3.17Å; F289-C310 HydrophobicContact CZ-CB 4.12Å; F289-M314 HydrophobicContact CD1-CB 4.04Å; F289-M314 HydrophobicContact CD1-CE 3.84Å; F289-M314 HydrophobicContact CD1-CG 3.98Å; F289-M314 HydrophobicContact CD2-CE 3.73Å; F289-M314 HydrophobicContact CE1-CB 3.58Å; F289-M314 HydrophobicContact CE1-CE 3.79Å; F289-M314 HydrophobicContact CE1-CG 3.99Å; F289-M314 HydrophobicContact CE2-CE 3.68Å; F289-M314 HydrophobicContact CG-CE 3.79Å; F289-M314 HydrophobicContact CZ-CB 4.29Å; F289-M314 HydrophobicContact CZ-CE 3.68Å
290	T	96.2	Very high	89.5	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.006	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-40.7	-179.1	-58.4	0	0	0	0	111.4	F216 L217 V272 K275 N288 D292 L293 I294 V311	F216-T290 WeakPolarHBondContact O-CB 3.31Å; F216-T290 PolarHBondContact O-N 3.32Å; F216-T290 PolarHBondContact O-OG1 3.09Å; L217-T290 HydrophobicContact CD1-CG2 3.8Å; V272-T290 HydrophobicContact CG2-CG2 4.39Å; K275-T290 HydrophobicContact CB-CG2 4.31Å; K275-T290 HydrophobicContact CG-CG2 3.99Å; N288-T290 PolarHBondContact O-N 2.98Å; N288-T290 PolarHBondContact OD1-N 2.92Å; T290-D292 PolarHBondContact O-N 2.87Å; T290-L293 PolarHBondContact O-N 3.26Å; T290-I294 HydrophobicContact CG2-CD1 3.95Å; T290-I294 HydrophobicContact CG2-CG1 4.46Å; T290-I294 WeakPolarHBondContact O-CG1 3.4Å; T290-I294 PolarHBondContact O-N 3.38Å; T290-V311 HydrophobicContact CG2-CG2 3.87Å
291	A	94.9	Very high	89.8	Confident	5 Å²	5	70.8 Å²	70.8	4%	0.041	37%	0.373	C	S	.	.	H	α-helix	trans	-60.1	-44.5	174.6	0	0	0	0	0	112.1	M279 N288 L293 I294 F295	M279-A291 HydrophobicContact CE-CB 3.66Å; M279-A291 HydrophobicContact SD-CB 3.75Å; N288-A291 PolarHBondContact O-N 2.96Å; N288-A291 PolarHBondContact OD1-N 3.01Å; A291-L293 VanDerWaalsContact C-N 3.29Å; A291-L293 PolarHBondContact O-N 3.05Å; A291-I294 PolarHBondContact O-N 2.88Å; A291-F295 WeakPolarHBondContact O-CB 2.81Å; A291-F295 PolarHBondContact O-N 2.84Å
292	D	94.8	Very high	90.3	Very high	31 Å²	31	63.6 Å²	63.6	17%	0.166	34%	0.34	C	S	.	.	H	α-helix	trans	-57.9	-41	174.9	-85.7	-22.6	0	0	0	111.9	Y164 K167 N288 F289 T290 A296	Y164-D292 HydrophobicContact CD1-CB 4.36Å; K167-D292 WeakPolarHBondContact CD-OD2 3.38Å; K167-D292 WeakPolarHBondContact CE-OD2 3.45Å; K167-D292 IonicContact NZ-OD1 2.8Å; K167-D292 PolarHBondContact NZ-OD1 3.15Å; K167-D292 IonicContact NZ-OD2 2.61Å; K167-D292 PolarHBondContact NZ-OD2 3.42Å; N288-D292 PolarHBondContact O-N 3Å; F289-D292 PolarHBondContact O-N 3.19Å; T290-D292 PolarHBondContact O-N 2.87Å; D292-A296 WeakPolarHBondContact O-CB 3.1Å; D292-A296 PolarHBondContact O-N 3.33Å
293	L	97.3	Very high	90.8	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.8	-40.3	178.6	-68.8	176.3	0	0	0	112.6	Y164 F289 T290 A291 F295 A296 Q297 L302 V307 C310 V311	Y164-L293 HydrophobicContact CD1-CD2 4.05Å; Y164-L293 HydrophobicContact CD2-CD2 4.38Å; Y164-L293 HydrophobicContact CG-CD2 3.86Å; F289-L293 HydrophobicContact CD1-CD1 4.05Å; F289-L293 HydrophobicContact CE1-CD1 3.49Å; F289-L293 VanDerWaalsContact CE1-CD1 3.49Å; F289-L293 HydrophobicContact CE2-CD1 4.03Å; F289-L293 HydrophobicContact CE2-CG 4.32Å; F289-L293 HydrophobicContact CZ-CD1 3.5Å; F289-L293 HydrophobicContact CZ-CG 4.28Å; F289-L293 WeakPolarHBondContact O-CG 3.36Å; F289-L293 PolarHBondContact O-N 2.89Å; F289-L293 VanDerWaalsContact O-N 3.17Å; T290-L293 PolarHBondContact O-N 3.26Å; A291-L293 VanDerWaalsContact C-N 3.29Å; A291-L293 PolarHBondContact O-N 3.05Å; L293-F295 VanDerWaalsContact C-N 3.32Å; L293-A296 PolarHBondContact O-N 2.65Å; L293-Q297 PolarHBondContact O-N 3.35Å; L293-L302 HydrophobicContact CD2-CD1 3.52Å; L293-V307 HydrophobicContact CB-CG1 3.97Å; L293-V307 HydrophobicContact CB-CG2 4.13Å; L293-V307 WeakPolarHBondContact O-CG2 3.44Å; L293-C310 HydrophobicContact CD1-CB 3.52Å; L293-C310 HydrophobicContact CD2-CB 4.33Å; L293-V311 HydrophobicContact CD1-CG2 3.85Å
294	I	96.5	Very high	91.9	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-43.2	175.1	-69.5	166.6	0	0	0	109.9	V272 K275 R276 M279 T290 A291 A296 Q297 N298	V272-I294 HydrophobicContact CG1-CD1 4.31Å; V272-I294 HydrophobicContact CG1-CG1 4.32Å; K275-I294 HydrophobicContact CB-CD1 4.37Å; K275-I294 HydrophobicContact CG-CD1 4.22Å; R276-I294 HydrophobicContact CB-CD1 4.38Å; M279-I294 HydrophobicContact SD-CD1 3.85Å; T290-I294 HydrophobicContact CG2-CD1 3.95Å; T290-I294 HydrophobicContact CG2-CG1 4.46Å; T290-I294 WeakPolarHBondContact O-CG1 3.4Å; T290-I294 PolarHBondContact O-N 3.38Å; A291-I294 PolarHBondContact O-N 2.88Å; I294-A296 PolarHBondContact O-N 2.91Å; I294-Q297 WeakPolarHBondContact O-CB 3.42Å; I294-Q297 PolarHBondContact O-N 2.95Å; I294-N298 VanDerWaalsContact O-CG 3.31Å; I294-N298 PolarHBondContact O-N 3.45Å
295	F	95.1	Very high	92.8	Very high	119 Å²	119	51.6 Å²	51.6	52%	0.522	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-46.2	175.5	-178.7	-97.9	0	0	0	111.9	A291 L293 Q297 N298 Q299	A291-F295 WeakPolarHBondContact O-CB 2.81Å; A291-F295 PolarHBondContact O-N 2.84Å; L293-F295 VanDerWaalsContact C-N 3.32Å; F295-Q297 VanDerWaalsContact C-N 3.28Å; F295-Q297 PolarHBondContact O-N 3.47Å; F295-N298 PolarHBondContact O-N 3.48Å; F295-N298 VanDerWaalsContact O-N 3.15Å; F295-Q299 HydrophobicContact CD1-CG 4.48Å; F295-Q299 HydrophobicContact CE1-CG 4.17Å; F295-Q299 HydrophobicContact CZ-CG 4.33Å; F295-Q299 WeakPolarHBondContact O-CG 3.19Å; F295-Q299 PolarHBondContact O-N 3.18Å
296	A	96	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-37.5	175.5	0	0	0	0	0	112.4	Y164 D292 L293 I294 Q299 G300 E301 L302	Y164-A296 HydrophobicContact CE1-CB 3.83Å; Y164-A296 WeakPolarHBondContact OH-CB 3.34Å; D292-A296 WeakPolarHBondContact O-CB 3.1Å; D292-A296 PolarHBondContact O-N 3.33Å; L293-A296 PolarHBondContact O-N 2.65Å; I294-A296 PolarHBondContact O-N 2.91Å; A296-Q299 PolarHBondContact O-N 3.09Å; A296-G300 PolarHBondContact O-N 2.89Å; A296-E301 HydrophobicContact CB-CB 4.2Å; A296-E301 WeakPolarHBondContact O-CA 3.26Å; A296-E301 VanDerWaalsContact O-CB 3.31Å; A296-E301 WeakPolarHBondContact O-CB 3.4Å; A296-E301 PolarHBondContact O-N 3.1Å; A296-L302 HydrophobicContact CB-CD1 3.87Å; A296-L302 HydrophobicContact CB-CG 4.03Å; A296-L302 PolarHBondContact O-N 3.23Å
297	Q	96.5	Very high	95.1	Very high	45 Å²	45	42.9 Å²	42.9	21%	0.21	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-45.5	173.2	176.7	-172.8	-2.7	0	0	112	L293 I294 F295 Q299 G300 L302 V307	L293-Q297 PolarHBondContact O-N 3.35Å; I294-Q297 WeakPolarHBondContact O-CB 3.42Å; I294-Q297 PolarHBondContact O-N 2.95Å; F295-Q297 VanDerWaalsContact C-N 3.28Å; F295-Q297 PolarHBondContact O-N 3.47Å; Q297-Q299 PolarHBondContact O-N 3.03Å; Q297-G300 PolarHBondContact O-N 3.49Å; Q297-L302 WeakPolarHBondContact CA-O 3.49Å; Q297-V307 HydrophobicContact CB-CG2 3.74Å; Q297-V307 HydrophobicContact CG-CG2 4.41Å
298	N	95	Very high	95.9	Very high	120 Å²	120	39.2 Å²	39.2	64%	0.642	22%	0.216	S	C	*	.	H	α-helix	trans	-62.6	-28.8	179.1	-68.9	-13.5	0	0	0	112.4	I294 F295 G300	I294-N298 VanDerWaalsContact O-CG 3.31Å; I294-N298 PolarHBondContact O-N 3.45Å; F295-N298 PolarHBondContact O-N 3.48Å; F295-N298 VanDerWaalsContact O-N 3.15Å; N298-G300 VanDerWaalsContact C-N 3.28Å
299	Q	95.4	Very high	96.3	Very high	109 Å²	109	38.6 Å²	38.6	51%	0.509	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	0.2	173.4	-65.7	-167.9	-23.4	0	0	114	F295 A296 Q297 E301	F295-Q299 HydrophobicContact CD1-CG 4.48Å; F295-Q299 HydrophobicContact CE1-CG 4.17Å; F295-Q299 HydrophobicContact CZ-CG 4.33Å; F295-Q299 WeakPolarHBondContact O-CG 3.19Å; F295-Q299 PolarHBondContact O-N 3.18Å; A296-Q299 PolarHBondContact O-N 3.09Å; Q297-Q299 PolarHBondContact O-N 3.03Å; Q299-E301 HydrophobicContact CB-CG 4.31Å; Q299-E301 PolarHBondContact O-N 3.35Å
300	G	94.8	Very high	96.5	Very high	68 Å²	68	38.5 Å²	38.5	70%	0.701	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.8	12.9	-176.5	0	0	0	0	0	113.9	A296 Q297 N298	A296-G300 PolarHBondContact O-N 2.89Å; Q297-G300 PolarHBondContact O-N 3.49Å; N298-G300 VanDerWaalsContact C-N 3.28Å
301	E	95.4	Very high	96.6	Very high	80 Å²	80	38.5 Å²	38.5	37%	0.374	21%	0.213	S	C	.	.	S	Bend	trans	-76.4	-32.5	178.7	-71.5	-160.7	-167.5	0	0	113.3	K160 Y164 A296 Q299	K160-E301 PolarHBondContact NZ-O 3.13Å; K160-E301 IonicContact NZ-OE2 2.98Å; Y164-E301 PolarHBondContact OH-OE2 3.47Å; A296-E301 HydrophobicContact CB-CB 4.2Å; A296-E301 WeakPolarHBondContact O-CA 3.26Å; A296-E301 VanDerWaalsContact O-CB 3.31Å; A296-E301 WeakPolarHBondContact O-CB 3.4Å; A296-E301 PolarHBondContact O-N 3.1Å; Q299-E301 HydrophobicContact CB-CG 4.31Å; Q299-E301 PolarHBondContact O-N 3.35Å
302	L	96.9	Very high	96.8	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.052	21%	0.211	C	C	.	.	S	Bend	trans	-128.8	146.2	-180	-64.1	-179.2	0	0	0	110.1	I161 Y164 L293 A296 Q297 V307	I161-L302 HydrophobicContact CG1-CD2 3.92Å; Y164-L302 HydrophobicContact CD2-CD1 4.32Å; Y164-L302 HydrophobicContact CE2-CD1 4.04Å; Y164-L302 HydrophobicContact CE2-CG 4.5Å; L293-L302 HydrophobicContact CD2-CD1 3.52Å; A296-L302 HydrophobicContact CB-CD1 3.87Å; A296-L302 HydrophobicContact CB-CG 4.03Å; A296-L302 PolarHBondContact O-N 3.23Å; Q297-L302 WeakPolarHBondContact CA-O 3.49Å; L302-V307 HydrophobicContact CB-CG2 4.18Å
303	S	97.4	Very high	96.9	Very high	46 Å²	46	36.9 Å²	36.9	32%	0.322	20%	0.203	S	C	.	.			trans	-79.7	158.3	171.2	82	0	0	0	0	111	E305 N306 V307	S303-E305 VanDerWaalsContact C-N 3.26Å; S303-E305 VanDerWaalsContact CB-OE2 3.25Å; S303-E305 WeakPolarHBondContact CB-OE2 3.21Å; S303-E305 PolarHBondContact O-N 3.49Å; S303-E305 PolarHBondContact OG-OE2 2.85Å; S303-N306 WeakPolarHBondContact O-CB 3.47Å; S303-N306 PolarHBondContact O-N 3.02Å; S303-N306 PolarHBondContact OG-N 3.28Å; S303-N306 PolarHBondContact OG-ND2 3.37Å; S303-N306 VanDerWaalsContact OG-ND2 3.13Å; S303-V307 PolarHBondContact O-N 2.97Å
304	A	97.1	Very high	96.9	Very high	35 Å²	35	37.5 Å²	37.5	29%	0.289	21%	0.206	S	C	.	.	H	α-helix	trans	-55.1	-42	175.5	0	0	0	0	0	112	N306 V307 R308	A304-N306 VanDerWaalsContact C-N 3.29Å; A304-N306 PolarHBondContact O-N 3.42Å; A304-V307 PolarHBondContact O-N 3.34Å; A304-R308 PolarHBondContact O-N 3.12Å
305	E	97.3	Very high	96.7	Very high	76 Å²	76	37.6 Å²	37.6	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-66.8	-31.8	178.5	-52.3	81	177.1	0	0	112.2	S303 Q309	S303-E305 VanDerWaalsContact C-N 3.26Å; S303-E305 VanDerWaalsContact CB-OE2 3.25Å; S303-E305 WeakPolarHBondContact CB-OE2 3.21Å; S303-E305 PolarHBondContact O-N 3.49Å; S303-E305 PolarHBondContact OG-OE2 2.85Å; E305-Q309 WeakPolarHBondContact O-CB 3.43Å; E305-Q309 PolarHBondContact O-N 3.11Å
306	N	97.6	Very high	96.6	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-70.7	-42.2	173.2	-87.1	-66.6	0	0	0	111.1	R147 I161 S303 A304 Q309 C310	R147-N306 VanDerWaalsContact CA-OD1 3.3Å; R147-N306 WeakPolarHBondContact CA-OD1 3.49Å; R147-N306 WeakPolarHBondContact CB-OD1 3.43Å; I161-N306 VanDerWaalsContact CD1-OD1 3.3Å; I161-N306 WeakPolarHBondContact CD1-OD1 3.46Å; S303-N306 WeakPolarHBondContact O-CB 3.47Å; S303-N306 PolarHBondContact O-N 3.02Å; S303-N306 PolarHBondContact OG-N 3.28Å; S303-N306 PolarHBondContact OG-ND2 3.37Å; S303-N306 VanDerWaalsContact OG-ND2 3.13Å; A304-N306 VanDerWaalsContact C-N 3.29Å; A304-N306 PolarHBondContact O-N 3.42Å; N306-Q309 PolarHBondContact O-N 3.18Å; N306-C310 WeakPolarHBondContact O-CB 3.22Å; N306-C310 PolarHBondContact O-N 3.2Å; N306-C310 PolarHBondContact O-SG 2.78Å
307	V	98.2	Very high	96.4	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-54.3	174.5	172.5	0	0	0	0	110.2	V272 L293 Q297 L302 S303 A304 Q309 C310 V311	V272-V307 HydrophobicContact CG1-CG1 4.21Å; L293-V307 HydrophobicContact CB-CG1 3.97Å; L293-V307 HydrophobicContact CB-CG2 4.13Å; L293-V307 WeakPolarHBondContact O-CG2 3.44Å; Q297-V307 HydrophobicContact CB-CG2 3.74Å; Q297-V307 HydrophobicContact CG-CG2 4.41Å; L302-V307 HydrophobicContact CB-CG2 4.18Å; S303-V307 PolarHBondContact O-N 2.97Å; A304-V307 PolarHBondContact O-N 3.34Å; V307-Q309 VanDerWaalsContact C-N 3.32Å; V307-Q309 PolarHBondContact O-N 3.43Å; V307-C310 PolarHBondContact O-N 2.73Å; V307-C310 VanDerWaalsContact O-N 3.1Å; V307-V311 HydrophobicContact CG1-CG2 4.44Å; V307-V311 WeakPolarHBondContact O-CG2 3.42Å; V307-V311 PolarHBondContact O-N 2.98Å
308	R	98.1	Very high	96.2	Very high	42 Å²	42	32.8 Å²	32.8	16%	0.158	20%	0.196	C	C	.	.	H	α-helix	trans	-53.4	-49.8	176.7	-177.2	-170.4	54.4	-126.3	16.1	111.5	Q265 I268 E269 A304 C310 V311 L312	Q265-R308 VanDerWaalsContact O-CD 3.22Å; Q265-R308 WeakPolarHBondContact O-CD 3.36Å; I268-R308 HydrophobicContact CB-CG 4.39Å; I268-R308 HydrophobicContact CG2-CG 4.04Å; E269-R308 VanDerWaalsContact OE2-CD 3.23Å; E269-R308 WeakPolarHBondContact OE2-CD 3.47Å; E269-R308 IonicContact OE2-CZ 3.1Å; E269-R308 IonicContact OE2-NE 3.05Å; E269-R308 IonicContact OE2-NH1 3.36Å; E269-R308 PolarHBondContact OE2-NH1 3.34Å; A304-R308 PolarHBondContact O-N 3.12Å; R308-C310 VanDerWaalsContact C-N 3.31Å; R308-C310 PolarHBondContact O-N 2.88Å; R308-V311 PolarHBondContact O-N 2.76Å; R308-L312 VanDerWaalsContact O-CB 3.31Å; R308-L312 WeakPolarHBondContact O-CB 3.34Å; R308-L312 PolarHBondContact O-N 2.83Å
309	Q	98.4	Very high	96	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-36.2	-178.7	-173.6	62.2	30.5	0	0	112.1	L142 G143 M144 R147 E305 N306 V307 E313	L142-Q309 PolarHBondContact O-OE1 3.23Å; G143-Q309 VanDerWaalsContact O-CD 3.31Å; G143-Q309 WeakPolarHBondContact O-CG 3.41Å; G143-Q309 PolarHBondContact O-OE1 2.81Å; M144-Q309 VanDerWaalsContact CG-NE2 3.33Å; R147-Q309 HydrophobicContact CB-CB 4.12Å; R147-Q309 HydrophobicContact CB-CG 3.93Å; E305-Q309 WeakPolarHBondContact O-CB 3.43Å; E305-Q309 PolarHBondContact O-N 3.11Å; N306-Q309 PolarHBondContact O-N 3.18Å; V307-Q309 VanDerWaalsContact C-N 3.32Å; V307-Q309 PolarHBondContact O-N 3.43Å; Q309-E313 HydrophobicContact CG-CG 4.46Å; Q309-E313 PolarHBondContact NE2-OE1 3.1Å; Q309-E313 WeakPolarHBondContact O-CB 3.45Å; Q309-E313 VanDerWaalsContact O-CG 3.28Å; Q309-E313 WeakPolarHBondContact O-CG 3.49Å; Q309-E313 PolarHBondContact O-N 2.75Å
310	C	98.5	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.2	-42.5	178	-68.4	0	0	0	0	112.1	I161 F165 F289 L293 N306 V307 R308 E313 M314	I161-C310 WeakPolarHBondContact CG2-SG 3.49Å; F165-C310 HydrophobicContact CE2-CB 3.88Å; F165-C310 HydrophobicContact CZ-CB 3.97Å; F165-C310 WeakPolarHBondContact CZ-O 3.41Å; F289-C310 HydrophobicContact CZ-CB 4.12Å; L293-C310 HydrophobicContact CD1-CB 3.52Å; L293-C310 HydrophobicContact CD2-CB 4.33Å; N306-C310 WeakPolarHBondContact O-CB 3.22Å; N306-C310 PolarHBondContact O-N 3.2Å; N306-C310 PolarHBondContact O-SG 2.78Å; V307-C310 PolarHBondContact O-N 2.73Å; V307-C310 VanDerWaalsContact O-N 3.1Å; R308-C310 VanDerWaalsContact C-N 3.31Å; R308-C310 PolarHBondContact O-N 2.88Å; C310-E313 PolarHBondContact O-N 2.85Å; C310-M314 PolarHBondContact O-N 3.42Å
311	V	98	Very high	95.6	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-63.7	-45.5	175	177.6	0	0	0	0	110.1	L217 I268 V272 T290 L293 V307 R308 E313 M314 V315	L217-V311 HydrophobicContact CD1-CG1 4.28Å; I268-V311 HydrophobicContact CG2-CB 3.99Å; I268-V311 HydrophobicContact CG2-CG1 3.82Å; V272-V311 HydrophobicContact CG2-CB 4.05Å; V272-V311 HydrophobicContact CG2-CG1 3.98Å; V272-V311 HydrophobicContact CG2-CG2 3.91Å; T290-V311 HydrophobicContact CG2-CG2 3.87Å; L293-V311 HydrophobicContact CD1-CG2 3.85Å; V307-V311 HydrophobicContact CG1-CG2 4.44Å; V307-V311 WeakPolarHBondContact O-CG2 3.42Å; V307-V311 PolarHBondContact O-N 2.98Å; R308-V311 PolarHBondContact O-N 2.76Å; V311-E313 PolarHBondContact O-N 2.73Å; V311-M314 PolarHBondContact O-N 3.11Å; V311-V315 HydrophobicContact CG1-CG2 4.47Å; V311-V315 WeakPolarHBondContact O-CG2 3.37Å; V311-V315 PolarHBondContact O-N 3.17Å
312	L	97.8	Very high	95.7	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-55.5	-52.5	174.5	-173.1	158	0	0	0	110.7	Y233 L264 Q265 I268 R308 M314 V315 I316	Y233-L312 HydrophobicContact CE1-CD2 4.05Å; Y233-L312 HydrophobicContact CE2-CD1 4.18Å; Y233-L312 HydrophobicContact CE2-CD2 4.28Å; L264-L312 HydrophobicContact CD2-CD1 4.12Å; L264-L312 HydrophobicContact CD2-CD2 4.29Å; L264-L312 HydrophobicContact CD2-CG 4.09Å; L264-L312 HydrophobicContact CG-CD1 4.05Å; L264-L312 HydrophobicContact CG-CG 4.33Å; Q265-L312 HydrophobicContact CG-CD1 3.89Å; I268-L312 HydrophobicContact CB-CB 4.41Å; I268-L312 HydrophobicContact CG1-CB 3.97Å; I268-L312 HydrophobicContact CG1-CD1 4.23Å; I268-L312 HydrophobicContact CG1-CG 4.04Å; I268-L312 HydrophobicContact CG2-CB 4.13Å; R308-L312 VanDerWaalsContact O-CB 3.31Å; R308-L312 WeakPolarHBondContact O-CB 3.34Å; R308-L312 PolarHBondContact O-N 2.83Å; L312-M314 VanDerWaalsContact C-N 3.27Å; L312-M314 PolarHBondContact O-N 3.37Å; L312-V315 PolarHBondContact O-N 3.2Å; L312-V315 VanDerWaalsContact O-N 3.15Å; L312-I316 HydrophobicContact CD2-CD1 3.79Å; L312-I316 HydrophobicContact CD2-CG1 4.27Å; L312-I316 HydrophobicContact CD2-CG2 3.96Å; L312-I316 HydrophobicContact CG-CG2 4.42Å; L312-I316 WeakPolarHBondContact O-CG1 3.33Å; L312-I316 WeakPolarHBondContact O-CG2 3.45Å; L312-I316 PolarHBondContact O-N 3.46Å
313	E	97.9	Very high	95.7	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.009	11%	0.106	C	C	.	.	H	α-helix	trans	-62.3	-32.1	-179.3	-76.2	-175.7	-165.8	0	0	113.3	I149 I150 F165 Q309 C310 V311 A317	I149-E313 PolarHBondContact N-OE2 3.38Å; I150-E313 HydrophobicContact CD1-CB 3.95Å; I150-E313 HydrophobicContact CD1-CG 3.73Å; I150-E313 HydrophobicContact CG1-CB 4.36Å; I150-E313 HydrophobicContact CG1-CG 4.12Å; I150-E313 WeakPolarHBondContact CG1-OE2 3.4Å; I150-E313 PolarHBondContact N-OE2 2.96Å; F165-E313 HydrophobicContact CZ-CB 4.27Å; Q309-E313 HydrophobicContact CG-CG 4.46Å; Q309-E313 PolarHBondContact NE2-OE1 3.1Å; Q309-E313 WeakPolarHBondContact O-CB 3.45Å; Q309-E313 VanDerWaalsContact O-CG 3.28Å; Q309-E313 WeakPolarHBondContact O-CG 3.49Å; Q309-E313 PolarHBondContact O-N 2.75Å; C310-E313 PolarHBondContact O-N 2.85Å; V311-E313 PolarHBondContact O-N 2.73Å; E313-A317 VanDerWaalsContact O-CB 3.29Å; E313-A317 WeakPolarHBondContact O-CB 3.39Å; E313-A317 PolarHBondContact O-N 2.81Å
314	M	96.2	Very high	95.6	Very high	12 Å²	12	15.3 Å²	15.3	6%	0.059	9%	0.091	C	C	.	.	H	α-helix	trans	-68	-44.5	173.7	-172.8	64.4	82.4	0	0	111.5	F165 A168 L169 F216 F289 C310 V311 L312	F165-M314 HydrophobicContact CD1-CE 3.4Å; F165-M314 VanDerWaalsContact CD1-CE 3.4Å; F165-M314 HydrophobicContact CD1-SD 4.28Å; F165-M314 HydrophobicContact CE1-CB 4.17Å; F165-M314 HydrophobicContact CE1-CE 3.78Å; F165-M314 HydrophobicContact CE1-SD 4.35Å; F165-M314 HydrophobicContact CG-CE 4.24Å; A168-M314 HydrophobicContact CB-CE 4.3Å; L169-M314 HydrophobicContact CD1-CE 3.96Å; L169-M314 HydrophobicContact CD1-SD 4.17Å; L169-M314 HydrophobicContact CD2-CE 4.39Å; L169-M314 HydrophobicContact CD2-SD 4.15Å; L169-M314 HydrophobicContact CG-CE 4.08Å; L169-M314 HydrophobicContact CG-SD 4.4Å; F216-M314 HydrophobicContact CB-CG 3.76Å; F216-M314 HydrophobicContact CD1-CE 4.3Å; F216-M314 HydrophobicContact CD1-CG 4.4Å; F216-M314 HydrophobicContact CD1-SD 4.32Å; F216-M314 HydrophobicContact CD2-CG 3.58Å; F216-M314 HydrophobicContact CD2-SD 3.84Å; F216-M314 HydrophobicContact CE1-SD 4.47Å; F216-M314 HydrophobicContact CE2-CG 4.34Å; F216-M314 HydrophobicContact CE2-SD 4.01Å; F216-M314 HydrophobicContact CG-CE 4.44Å; F216-M314 HydrophobicContact CG-CG 3.64Å; F216-M314 HydrophobicContact CG-SD 4.03Å; F216-M314 HydrophobicContact CZ-SD 4.34Å; F289-M314 HydrophobicContact CD1-CB 4.04Å; F289-M314 HydrophobicContact CD1-CE 3.84Å; F289-M314 HydrophobicContact CD1-CG 3.98Å; F289-M314 HydrophobicContact CD2-CE 3.73Å; F289-M314 HydrophobicContact CE1-CB 3.58Å; F289-M314 HydrophobicContact CE1-CE 3.79Å; F289-M314 HydrophobicContact CE1-CG 3.99Å; F289-M314 HydrophobicContact CE2-CE 3.68Å; F289-M314 HydrophobicContact CG-CE 3.79Å; F289-M314 HydrophobicContact CZ-CB 4.29Å; F289-M314 HydrophobicContact CZ-CE 3.68Å; C310-M314 PolarHBondContact O-N 3.42Å; V311-M314 PolarHBondContact O-N 3.11Å; L312-M314 VanDerWaalsContact C-N 3.27Å; L312-M314 PolarHBondContact O-N 3.37Å
315	V	92.4	Very high	95.7	Very high	6 Å²	6	14.2 Å²	14.2	4%	0.036	8%	0.082	C	C	.	.	H	α-helix	trans	-70.7	-40.7	-176.6	171.2	0	0	0	0	112.3	V209 L226 I230 I268 V311 L312 P319	V209-V315 HydrophobicContact CG2-CG1 4.32Å; L226-V315 HydrophobicContact CD2-CG1 4.03Å; I230-V315 HydrophobicContact CD1-CG1 4.04Å; I268-V315 HydrophobicContact CD1-CB 4.4Å; I268-V315 HydrophobicContact CD1-CG1 4.36Å; I268-V315 HydrophobicContact CD1-CG2 4.47Å; V311-V315 HydrophobicContact CG1-CG2 4.47Å; V311-V315 WeakPolarHBondContact O-CG2 3.37Å; V311-V315 PolarHBondContact O-N 3.17Å; L312-V315 PolarHBondContact O-N 3.2Å; L312-V315 VanDerWaalsContact O-N 3.15Å; V315-P319 WeakPolarHBondContact O-CD 3.33Å; V315-P319 WeakPolarHBondContact O-CG 3.44Å
316	I	93	Very high	95.8	Very high	5 Å²	5	10.6 Å²	10.6	3%	0.026	7%	0.065	C	C	.	.	H	α-helix	trans	-76.9	-21.9	-178.7	69.6	171.1	0	0	0	113.8	M144 I230 Y233 L264 L312 A318	M144-I316 HydrophobicContact CE-CD1 4.27Å; I230-I316 HydrophobicContact CD1-CG2 4.35Å; I230-I316 HydrophobicContact CG1-CG2 3.99Å; I230-I316 HydrophobicContact CG2-CB 4.2Å; I230-I316 HydrophobicContact CG2-CG2 4.06Å; Y233-I316 HydrophobicContact CD1-CD1 4.16Å; Y233-I316 HydrophobicContact CE1-CD1 3.79Å; L264-I316 HydrophobicContact CD2-CG2 3.75Å; L312-I316 HydrophobicContact CD2-CD1 3.79Å; L312-I316 HydrophobicContact CD2-CG1 4.27Å; L312-I316 HydrophobicContact CD2-CG2 3.96Å; L312-I316 HydrophobicContact CG-CG2 4.42Å; L312-I316 WeakPolarHBondContact O-CG1 3.33Å; L312-I316 WeakPolarHBondContact O-CG2 3.45Å; L312-I316 PolarHBondContact O-N 3.46Å; I316-A318 PolarHBondContact O-N 3.49Å
317	A	92.2	Very high	95.7	Very high	45 Å²	45	9.9 Å²	9.9	37%	0.372	6%	0.061	S	C	.	.	H	α-helix	trans	-62.8	-42.4	-167.2	0	0	0	0	0	112.8	E313 T321	E313-A317 VanDerWaalsContact O-CB 3.29Å; E313-A317 WeakPolarHBondContact O-CB 3.39Å; E313-A317 PolarHBondContact O-N 2.81Å; A317-T321 PolarHBondContact O-OG1 3.46Å
318	A	91.8	Very high	95.7	Very high	14 Å²	14	10 Å²	10	12%	0.116	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-45.5	-174.3	0	0	0	0	0	113.4	V208 I316 D320 T321 L322	V208-A318 VanDerWaalsContact CG1-C 3.42Å; V208-A318 HydrophobicContact CG1-CB 3.3Å; I316-A318 PolarHBondContact O-N 3.49Å; A318-D320 PolarHBondContact O-N 2.94Å; A318-T321 PolarHBondContact O-N 3.29Å; A318-L322 HydrophobicContact CB-CB 4.47Å; A318-L322 WeakPolarHBondContact O-CA 3.29Å; A318-L322 VanDerWaalsContact O-CB 3.25Å; A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.94Å
319	P	92.1	Very high	95.7	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-42.6	-176.9	-29.5	37.5	0	0	0	114.7	V208 V209 L227 I230 V315 S323	V208-P319 HydrophobicContact CG1-CG 4.32Å; V209-P319 HydrophobicContact CB-CG 3.92Å; V209-P319 HydrophobicContact CG2-CG 4.19Å; L227-P319 HydrophobicContact CD2-CB 3.84Å; L227-P319 HydrophobicContact CD2-CG 4.35Å; I230-P319 HydrophobicContact CD1-CG 4.46Å; V315-P319 WeakPolarHBondContact O-CD 3.33Å; V315-P319 WeakPolarHBondContact O-CG 3.44Å; P319-S323 WeakPolarHBondContact CA-OG 3.38Å; P319-S323 WeakPolarHBondContact O-CB 3.13Å; P319-S323 PolarHBondContact O-OG 2.89Å
320	D	86.3	Confident	95.5	Very high	5 Å²	5	8.1 Å²	8.1	3%	0.027	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-16.7	-176.6	-70	-27.4	0	0	0	114.1	I230 F234 A318 I324	I230-D320 WeakPolarHBondContact CG2-OD2 3.46Å; F234-D320 WeakPolarHBondContact CB-OD2 3.49Å; F234-D320 HydrophobicContact CD2-CB 4.03Å; F234-D320 WeakPolarHBondContact CD2-OD2 3.12Å; F234-D320 HydrophobicContact CE2-CB 4.27Å; F234-D320 HydrophobicContact CG-CB 4.5Å; F234-D320 WeakPolarHBondContact CG-OD2 3.44Å; A318-D320 PolarHBondContact O-N 2.94Å; D320-I324 WeakPolarHBondContact O-CD1 3.26Å
321	T	94.9	Very high	95.3	Very high	51 Å²	51	8.1 Å²	8.1	31%	0.313	5%	0.054	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-48.6	-177	64.2	0	0	0	0	112.7	A317 A318 S325 V381	A317-T321 PolarHBondContact O-OG1 3.46Å; A318-T321 PolarHBondContact O-N 3.29Å; T321-S325 WeakPolarHBondContact O-CB 3.48Å; T321-S325 PolarHBondContact O-N 3.04Å; T321-S325 PolarHBondContact O-OG 3.37Å; T321-V381 HydrophobicContact CG2-CG2 4.17Å
322	L	97.3	Very high	95.2	Very high	9 Å²	9	8.3 Å²	8.3	5%	0.047	6%	0.055	C	C	.	.	H	α-helix	trans	-77	-43.2	-173.4	-167.9	144.7	0	0	0	111.2	V208 A318 I324 S325 L326 A454 M457 M458 I461	V208-L322 HydrophobicContact CG1-CB 4.48Å; V208-L322 HydrophobicContact CG1-CD2 4.39Å; V208-L322 HydrophobicContact CG2-CD2 3.51Å; A318-L322 HydrophobicContact CB-CB 4.47Å; A318-L322 WeakPolarHBondContact O-CA 3.29Å; A318-L322 VanDerWaalsContact O-CB 3.25Å; A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.94Å; L322-I324 VanDerWaalsContact C-N 3.35Å; L322-I324 PolarHBondContact O-N 3.45Å; L322-S325 WeakPolarHBondContact O-CB 3.34Å; L322-S325 PolarHBondContact O-N 3.42Å; L322-L326 HydrophobicContact CD2-CD1 3.45Å; L322-L326 VanDerWaalsContact CD2-CD1 3.45Å; L322-L326 HydrophobicContact CD2-CG 4.04Å; L322-L326 WeakPolarHBondContact O-CB 3.39Å; L322-L326 WeakPolarHBondContact O-CG 3.49Å; L322-L326 PolarHBondContact O-N 3.31Å; L322-A454 HydrophobicContact CD1-CB 4.14Å; L322-M457 HydrophobicContact CD1-CB 3.69Å; L322-M457 HydrophobicContact CD1-CG 4.43Å; L322-M457 HydrophobicContact CD1-SD 3.84Å; L322-M457 HydrophobicContact CD2-CB 4.39Å; L322-M458 HydrophobicContact CD1-CG 3.99Å; L322-M458 HydrophobicContact CD2-CG 4.32Å; L322-M458 HydrophobicContact CG-CG 3.9Å; L322-I461 HydrophobicContact CD2-CD1 4Å
323	S	97.1	Very high	95.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.2	-42.6	177.9	-35.4	0	0	0	0	111.6	R205 P319 L326 F327	R205-S323 WeakPolarHBondContact CA-OG 3.34Å; P319-S323 WeakPolarHBondContact CA-OG 3.38Å; P319-S323 WeakPolarHBondContact O-CB 3.13Å; P319-S323 PolarHBondContact O-OG 2.89Å; S323-L326 PolarHBondContact O-N 3.45Å; S323-F327 WeakPolarHBondContact O-CB 3.32Å; S323-F327 PolarHBondContact O-N 3.08Å
324	I	96.4	Very high	94.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-66.8	-39.9	176.1	-56.5	-174.3	0	0	0	110.7	L201 D320 L322 L326 F327 F328 V380 Q491	L201-I324 HydrophobicContact CD1-CG1 4.09Å; D320-I324 WeakPolarHBondContact O-CD1 3.26Å; L322-I324 VanDerWaalsContact C-N 3.35Å; L322-I324 PolarHBondContact O-N 3.45Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 2.95Å; I324-F327 WeakPolarHBondContact O-CB 3.35Å; I324-F327 PolarHBondContact O-N 3.36Å; I324-F328 HydrophobicContact CG2-CD2 3.86Å; I324-F328 HydrophobicContact CG2-CE2 3.47Å; I324-F328 VanDerWaalsContact CG2-CE2 3.47Å; I324-F328 HydrophobicContact CG2-CZ 4.1Å; I324-F328 WeakPolarHBondContact O-CD2 3.45Å; I324-F328 PolarHBondContact O-N 3.49Å; I324-V380 HydrophobicContact CB-CG1 4.38Å; I324-V380 HydrophobicContact CB-CG2 4.01Å; I324-V380 HydrophobicContact CG2-CG1 4.35Å; I324-V380 HydrophobicContact CG2-CG2 3.69Å; I324-Q491 HydrophobicContact CD1-CB 4.12Å; I324-Q491 VanDerWaalsContact CD1-CD 3.46Å; I324-Q491 HydrophobicContact CD1-CG 3.62Å
325	S	98.3	Very high	94.4	Very high	13 Å²	13	13.2 Å²	13.2	9%	0.091	8%	0.077	C	C	.	.	H	α-helix	trans	-61.8	-43.9	175.9	-61.3	0	0	0	0	111.1	T321 L322 F328 M329 V380	T321-S325 WeakPolarHBondContact O-CB 3.48Å; T321-S325 PolarHBondContact O-N 3.04Å; T321-S325 PolarHBondContact O-OG 3.37Å; L322-S325 WeakPolarHBondContact O-CB 3.34Å; L322-S325 PolarHBondContact O-N 3.42Å; S325-F328 PolarHBondContact O-N 2.96Å; S325-M329 WeakPolarHBondContact O-CB 3.26Å; S325-M329 WeakPolarHBondContact O-CG 3.4Å; S325-M329 PolarHBondContact O-N 3.47Å; S325-V380 VanDerWaalsContact OG-CG2 3.27Å; S325-V380 WeakPolarHBondContact OG-CG2 3.24Å
326	L	98.3	Very high	94.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.3	-75.7	176.6	0	0	0	112.1	L204 L322 S323 I324 M329 L330 M458 I461 L462	L204-L326 HydrophobicContact CD1-CB 3.76Å; L204-L326 HydrophobicContact CD2-CB 4.09Å; L204-L326 HydrophobicContact CD2-CD1 3.9Å; L204-L326 HydrophobicContact CG-CB 4.49Å; L322-L326 HydrophobicContact CD2-CD1 3.45Å; L322-L326 VanDerWaalsContact CD2-CD1 3.45Å; L322-L326 HydrophobicContact CD2-CG 4.04Å; L322-L326 WeakPolarHBondContact O-CB 3.39Å; L322-L326 WeakPolarHBondContact O-CG 3.49Å; L322-L326 PolarHBondContact O-N 3.31Å; S323-L326 PolarHBondContact O-N 3.45Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 2.95Å; L326-M329 HydrophobicContact CD2-SD 4.08Å; L326-M329 WeakPolarHBondContact O-CB 3.38Å; L326-M329 PolarHBondContact O-N 3.35Å; L326-L330 WeakPolarHBondContact O-CG 3.18Å; L326-L330 PolarHBondContact O-N 2.88Å; L326-M458 HydrophobicContact CD2-CB 4.23Å; L326-M458 HydrophobicContact CD2-CG 4.18Å; L326-M458 HydrophobicContact CG-CG 4.44Å; L326-I461 HydrophobicContact CD1-CB 4.03Å; L326-I461 HydrophobicContact CD1-CD1 3.68Å; L326-I461 HydrophobicContact CD1-CG1 4.46Å; L326-I461 HydrophobicContact CD1-CG2 3.76Å; L326-L462 HydrophobicContact CD2-CD1 3.98Å; L326-L462 HydrophobicContact CD2-CD2 3.83Å; L326-L462 HydrophobicContact CD2-CG 3.56Å
327	F	96.8	Very high	94.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-50	174.7	176.2	-92.4	0	0	0	111.4	V200 L201 L204 S323 I324 M329 L330 L331 L482 P492 L502 M504	V200-F327 HydrophobicContact CB-CD2 4.38Å; V200-F327 HydrophobicContact CG1-CD2 4.22Å; L201-F327 HydrophobicContact CB-CD2 4.21Å; L201-F327 HydrophobicContact CD1-CB 4.28Å; L204-F327 HydrophobicContact CD1-CB 4.13Å; S323-F327 WeakPolarHBondContact O-CB 3.32Å; S323-F327 PolarHBondContact O-N 3.08Å; I324-F327 WeakPolarHBondContact O-CB 3.35Å; I324-F327 PolarHBondContact O-N 3.36Å; F327-M329 VanDerWaalsContact C-N 3.3Å; F327-M329 PolarHBondContact O-N 3.28Å; F327-L330 PolarHBondContact O-N 3.19Å; F327-L331 PolarHBondContact O-N 3.42Å; F327-L482 HydrophobicContact CE1-CD2 3.88Å; F327-P492 HydrophobicContact CD1-CG 3.95Å; F327-P492 HydrophobicContact CE1-CG 3.83Å; F327-L502 HydrophobicContact CE2-CB 4.45Å; F327-L502 HydrophobicContact CZ-CB 4.35Å; F327-L502 HydrophobicContact CZ-CD2 4.03Å; F327-M504 HydrophobicContact CD2-CE 3.89Å; F327-M504 HydrophobicContact CE2-CE 3.46Å; F327-M504 VanDerWaalsContact CE2-CE 3.46Å; F327-M504 HydrophobicContact CZ-CE 3.95Å
328	F	97.1	Very high	94.5	Very high	3 Å²	3	20 Å²	20	1%	0.013	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-34.9	175.6	-69	-44.8	0	0	0	112.8	I324 S325 L331 L332 H378 V380 L479 L482 Q484 P492	I324-F328 HydrophobicContact CG2-CD2 3.86Å; I324-F328 HydrophobicContact CG2-CE2 3.47Å; I324-F328 VanDerWaalsContact CG2-CE2 3.47Å; I324-F328 HydrophobicContact CG2-CZ 4.1Å; I324-F328 WeakPolarHBondContact O-CD2 3.45Å; I324-F328 PolarHBondContact O-N 3.49Å; S325-F328 PolarHBondContact O-N 2.96Å; F328-L331 HydrophobicContact CD1-CD2 4.49Å; F328-L331 PolarHBondContact O-N 2.9Å; F328-L332 WeakPolarHBondContact O-CB 3.38Å; F328-L332 WeakPolarHBondContact O-CG 3.34Å; F328-L332 PolarHBondContact O-N 2.92Å; F328-H378 AromaticContact CD1-CD2 3.89Å; F328-H378 AromaticContact CD1-NE2 3.85Å; F328-H378 AromaticContact CD2-CD2 3.49Å; F328-H378 VanDerWaalsContact CD2-CD2 3.49Å; F328-H378 WeakPolarHBondContact CD2-CD2 3.45Å; F328-H378 AromaticContact CD2-NE2 3.91Å; F328-H378 AromaticContact CE1-NE2 3.58Å; F328-H378 AromaticContact CE2-CD2 3.66Å; F328-H378 AromaticContact CE2-NE2 3.61Å; F328-H378 AromaticContact CG-CD2 3.61Å; F328-H378 AromaticContact CZ-CD2 3.95Å; F328-H378 AromaticContact CZ-NE2 3.44Å; F328-H378 WeakPolarHBondContact CZ-NE2 3.37Å; F328-V380 HydrophobicContact CD2-CG2 3.76Å; F328-V380 HydrophobicContact CE2-CG2 3.92Å; F328-L479 HydrophobicContact CD1-CD1 3.89Å; F328-L479 HydrophobicContact CE1-CD1 4.31Å; F328-L482 HydrophobicContact CD1-CD2 4.28Å; F328-L482 HydrophobicContact CE1-CD2 3.67Å; F328-Q484 HydrophobicContact CE1-CG 4.49Å; F328-Q484 HydrophobicContact CZ-CG 4.46Å; F328-P492 HydrophobicContact CE1-CG 4.02Å; F328-P492 HydrophobicContact CZ-CG 4Å
329	M	97.9	Very high	94.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-60.6	-48.5	173.1	-73.8	165.1	-168.7	0	0	111.1	S325 L326 F327 L331 L332 L333 F370 I371 C374 L375 M458 L462	S325-M329 WeakPolarHBondContact O-CB 3.26Å; S325-M329 WeakPolarHBondContact O-CG 3.4Å; S325-M329 PolarHBondContact O-N 3.47Å; L326-M329 HydrophobicContact CD2-SD 4.08Å; L326-M329 WeakPolarHBondContact O-CB 3.38Å; L326-M329 PolarHBondContact O-N 3.35Å; F327-M329 VanDerWaalsContact C-N 3.3Å; F327-M329 PolarHBondContact O-N 3.28Å; M329-L331 VanDerWaalsContact C-N 3.29Å; M329-L331 PolarHBondContact O-N 3.42Å; M329-L332 PolarHBondContact O-N 2.69Å; M329-L333 VanDerWaalsContact O-CB 3.3Å; M329-L333 WeakPolarHBondContact O-CB 3.49Å; M329-L333 PolarHBondContact O-N 2.9Å; M329-F370 HydrophobicContact CB-CE1 3.9Å; M329-F370 HydrophobicContact CB-CZ 3.97Å; M329-F370 HydrophobicContact CG-CE1 4.18Å; M329-F370 HydrophobicContact CG-CZ 4.43Å; M329-F370 WeakPolarHBondContact O-CZ 3.5Å; M329-I371 HydrophobicContact CE-CB 4.41Å; M329-I371 HydrophobicContact CE-CG1 4.46Å; M329-I371 HydrophobicContact CE-CG2 3.9Å; M329-I371 HydrophobicContact SD-CG1 4.25Å; M329-C374 HydrophobicContact CE-CB 3.99Å; M329-C374 HydrophobicContact CG-CB 3.59Å; M329-L375 HydrophobicContact CE-CD2 4.12Å; M329-L375 HydrophobicContact CE-CG 4.11Å; M329-M458 HydrophobicContact CE-SD 3.66Å; M329-M458 HydrophobicContact SD-SD 4.35Å; M329-L462 HydrophobicContact SD-CD1 3.93Å
330	L	96.2	Very high	94.8	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-61	-39.9	177.7	-66.9	175	0	0	0	111.8	V200 L204 L326 F327 L333 K334 L462 L465 L466 V471 M504	V200-L330 HydrophobicContact CG1-CD1 3.66Å; L204-L330 HydrophobicContact CD1-CD1 4.33Å; L326-L330 WeakPolarHBondContact O-CG 3.18Å; L326-L330 PolarHBondContact O-N 2.88Å; F327-L330 PolarHBondContact O-N 3.19Å; L330-L333 PolarHBondContact O-N 3.4Å; L330-K334 PolarHBondContact O-N 3.39Å; L330-L462 HydrophobicContact CD2-CD2 3.98Å; L330-L462 HydrophobicContact CG-CD2 4.49Å; L330-L465 HydrophobicContact CD2-CD2 4.07Å; L330-L466 HydrophobicContact CD2-CD2 4.25Å; L330-V471 HydrophobicContact CD2-CG2 4.13Å; L330-M504 HydrophobicContact CB-SD 4.49Å
331	L	94.3	Very high	95.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-44.6	176	-174	67.5	0	0	0	112.7	F327 F328 M329 Q335 L473 L477 L479 L482	F327-L331 PolarHBondContact O-N 3.42Å; F328-L331 HydrophobicContact CD1-CD2 4.49Å; F328-L331 PolarHBondContact O-N 2.9Å; M329-L331 VanDerWaalsContact C-N 3.29Å; M329-L331 PolarHBondContact O-N 3.42Å; L331-Q335 PolarHBondContact O-NE2 3.28Å; L331-L473 HydrophobicContact CD1-CD1 3.55Å; L331-L473 HydrophobicContact CD1-CD2 3.65Å; L331-L473 HydrophobicContact CD1-CG 4.21Å; L331-L477 HydrophobicContact CD1-CD2 4.07Å; L331-L477 HydrophobicContact CD1-CG 4.02Å; L331-L479 HydrophobicContact CD2-CB 4.27Å; L331-L479 HydrophobicContact CD2-CD1 3.81Å; L331-L482 HydrophobicContact CD2-CD2 3.82Å
332	L	95.3	Very high	95.3	Very high	6 Å²	6	24 Å²	24	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-68.7	-37	177.3	-80	166.3	0	0	0	112.3	F328 M329 K334 Q335 T336 C374 F377 H378 F424 L479	F328-L332 WeakPolarHBondContact O-CB 3.38Å; F328-L332 WeakPolarHBondContact O-CG 3.34Å; F328-L332 PolarHBondContact O-N 2.92Å; M329-L332 PolarHBondContact O-N 2.69Å; L332-K334 VanDerWaalsContact C-N 3.29Å; L332-K334 PolarHBondContact O-N 3.43Å; L332-Q335 PolarHBondContact O-N 3.27Å; L332-T336 PolarHBondContact O-N 3.01Å; L332-T336 PolarHBondContact O-OG1 3.45Å; L332-C374 HydrophobicContact CD1-CB 4.25Å; L332-F377 HydrophobicContact CD2-CD1 4.03Å; L332-F377 HydrophobicContact CD2-CE1 4.11Å; L332-H378 HydrophobicContact CD1-CB 4.24Å; L332-F424 HydrophobicContact CB-CE2 4.25Å; L332-F424 HydrophobicContact CB-CZ 4.38Å; L332-F424 HydrophobicContact CD1-CD2 4.11Å; L332-F424 HydrophobicContact CD1-CE2 3.86Å; L332-F424 HydrophobicContact CD2-CD2 3.89Å; L332-F424 HydrophobicContact CD2-CE2 4.27Å; L332-F424 HydrophobicContact CD2-CG 4.27Å; L332-F424 HydrophobicContact CG-CD2 4.46Å; L332-F424 HydrophobicContact CG-CE2 4.37Å; L332-L479 HydrophobicContact CD2-CD2 3.86Å; L332-L479 HydrophobicContact CG-CD2 4.41Å
333	L	94.8	Very high	95.2	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-60.8	-41.1	179.7	-170.6	61.2	0	0	0	111.3	M329 L330 Q335 T336 V339 E340 L343 F370 L466	M329-L333 VanDerWaalsContact O-CB 3.3Å; M329-L333 WeakPolarHBondContact O-CB 3.49Å; M329-L333 PolarHBondContact O-N 2.9Å; L330-L333 PolarHBondContact O-N 3.4Å; L333-Q335 VanDerWaalsContact C-N 3.31Å; L333-Q335 PolarHBondContact O-N 3.36Å; L333-T336 CarbonylContact O-C 3.47Å; L333-T336 VanDerWaalsContact O-C 3.24Å; L333-T336 WeakPolarHBondContact O-CA 3.33Å; L333-T336 PolarHBondContact O-N 3.16Å; L333-T336 PolarHBondContact O-OG1 3.11Å; L333-V339 HydrophobicContact CD1-CB 4.47Å; L333-V339 HydrophobicContact CD1-CG1 4.03Å; L333-E340 HydrophobicContact CD1-CB 3.89Å; L333-E340 HydrophobicContact CD1-CG 4.45Å; L333-E340 HydrophobicContact CD2-CG 4.23Å; L333-E340 HydrophobicContact CG-CB 3.98Å; L333-E340 HydrophobicContact CG-CG 4.17Å; L333-L343 HydrophobicContact CD1-CD1 3.59Å; L333-L343 HydrophobicContact CD2-CD1 4.31Å; L333-F370 HydrophobicContact CB-CE2 4.15Å; L333-F370 HydrophobicContact CB-CZ 3.87Å; L333-F370 HydrophobicContact CD1-CD2 4.31Å; L333-F370 HydrophobicContact CD1-CE2 3.77Å; L333-F370 HydrophobicContact CD1-CZ 3.96Å; L333-F370 HydrophobicContact CG-CZ 4.38Å; L333-L466 HydrophobicContact CD2-CD1 3.69Å; L333-L466 HydrophobicContact CD2-CD2 3.72Å; L333-L466 HydrophobicContact CD2-CG 4.38Å
334	K	90.1	Very high	95.1	Very high	41 Å²	41	23.8 Å²	23.8	18%	0.178	12%	0.121	C	C	.	.	H	α-helix	trans	-71.1	-25.6	178.5	-74.5	-66.3	139.1	169	0	114.3	L330 L332 T336 E340 S470 V471 L473	L330-K334 PolarHBondContact O-N 3.39Å; L332-K334 VanDerWaalsContact C-N 3.29Å; L332-K334 PolarHBondContact O-N 3.43Å; K334-T336 PolarHBondContact O-N 2.92Å; K334-E340 WeakPolarHBondContact CE-OE1 3.28Å; K334-E340 WeakPolarHBondContact CE-OE2 3.36Å; K334-E340 IonicContact NZ-OE1 3.35Å; K334-E340 PolarHBondContact NZ-OE1 3.36Å; K334-E340 IonicContact NZ-OE2 3.68Å; K334-E340 PolarHBondContact NZ-OE2 3.02Å; K334-S470 PolarHBondContact NZ-OG 2.93Å; K334-V471 WeakPolarHBondContact CD-O 3.25Å; K334-V471 WeakPolarHBondContact CE-O 3.39Å; K334-V471 WeakPolarHBondContact CG-O 3.33Å; K334-V471 PolarHBondContact NZ-O 2.93Å; K334-L473 HydrophobicContact CB-CD1 3.64Å; K334-L473 HydrophobicContact CB-CG 3.94Å; K334-L473 HydrophobicContact CG-CD1 4.4Å; K334-L473 HydrophobicContact CG-CG 4.17Å
335	Q	90.4	Very high	95	Very high	74 Å²	74	28 Å²	28	35%	0.346	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.1	170.1	-68.4	168.5	89.2	0	0	112.2	L331 L332 L333	L331-Q335 PolarHBondContact O-NE2 3.28Å; L332-Q335 PolarHBondContact O-N 3.27Å; L333-Q335 VanDerWaalsContact C-N 3.31Å; L333-Q335 PolarHBondContact O-N 3.36Å
336	T	92.4	Very high	94.9	Very high	14 Å²	14	28.6 Å²	28.6	9%	0.086	14%	0.142	C	C	.	.			trans	-133	68	-178.9	53.1	0	0	0	0	113.4	L332 L333 K334 H338 V339 E340 F424	L332-T336 PolarHBondContact O-N 3.01Å; L332-T336 PolarHBondContact O-OG1 3.45Å; L333-T336 CarbonylContact O-C 3.47Å; L333-T336 VanDerWaalsContact O-C 3.24Å; L333-T336 WeakPolarHBondContact O-CA 3.33Å; L333-T336 PolarHBondContact O-N 3.16Å; L333-T336 PolarHBondContact O-OG1 3.11Å; K334-T336 PolarHBondContact O-N 2.92Å; T336-H338 PolarHBondContact O-N 3.23Å; T336-V339 WeakPolarHBondContact O-CB 3.34Å; T336-V339 PolarHBondContact O-N 3.33Å; T336-E340 PolarHBondContact O-N 3.49Å; T336-E340 VanDerWaalsContact O-N 3.14Å; T336-F424 HydrophobicContact CG2-CD1 3.68Å; T336-F424 HydrophobicContact CG2-CE1 3.97Å
337	P	91.9	Very high	94.8	Very high	69 Å²	69	28.6 Å²	28.6	45%	0.448	14%	0.142	S	C	.	.	H	α-helix	trans	-56.6	-30.9	-174.8	-26	34.2	0	0	0	114.9	E340 L341	P337-E340 PolarHBondContact O-N 3.27Å; P337-L341 PolarHBondContact O-N 3.11Å
338	H	94.6	Very high	94.6	Very high	116 Å²	116	30.2 Å²	30.2	54%	0.537	15%	0.15	S	C	.	.	H	α-helix	trans	-67.4	-34.6	176.2	68.4	-81.8	0	0	0	112.6	T336 Q342	T336-H338 PolarHBondContact O-N 3.23Å; H338-Q342 WeakPolarHBondContact O-CG 3.33Å; H338-Q342 PolarHBondContact O-N 3.12Å
339	V	96	Very high	94.5	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-71.1	-43.2	173.7	174.1	0	0	0	0	109.8	L333 T336 L341 Q342 L343 F370 L426	L333-V339 HydrophobicContact CD1-CB 4.47Å; L333-V339 HydrophobicContact CD1-CG1 4.03Å; T336-V339 WeakPolarHBondContact O-CB 3.34Å; T336-V339 PolarHBondContact O-N 3.33Å; V339-L341 VanDerWaalsContact C-N 3.29Å; V339-L341 PolarHBondContact O-N 3.19Å; V339-Q342 PolarHBondContact O-N 3.25Å; V339-Q342 VanDerWaalsContact O-N 3.09Å; V339-L343 HydrophobicContact CG1-CD1 4.31Å; V339-L343 HydrophobicContact CG1-CG 4.22Å; V339-L343 WeakPolarHBondContact O-CG 3.42Å; V339-L343 PolarHBondContact O-N 2.82Å; V339-F370 HydrophobicContact CG1-CD2 3.75Å; V339-F370 HydrophobicContact CG1-CE2 4.4Å; V339-F370 HydrophobicContact CG1-CG 4.42Å; V339-L426 HydrophobicContact CB-CD1 4.49Å; V339-L426 HydrophobicContact CG1-CD1 3.77Å; V339-L426 HydrophobicContact CG1-CD2 4.48Å; V339-L426 HydrophobicContact CG1-CG 4.28Å; V339-L426 HydrophobicContact CG2-CD1 4.04Å; V339-L426 HydrophobicContact CG2-CG 3.97Å
340	E	94.9	Very high	94.5	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-53.6	-47.8	174.9	-172.1	-179	-177.4	0	0	111.3	L333 K334 T336 P337 Q342 L343 L344 R509	L333-E340 HydrophobicContact CD1-CB 3.89Å; L333-E340 HydrophobicContact CD1-CG 4.45Å; L333-E340 HydrophobicContact CD2-CG 4.23Å; L333-E340 HydrophobicContact CG-CB 3.98Å; L333-E340 HydrophobicContact CG-CG 4.17Å; K334-E340 WeakPolarHBondContact CE-OE1 3.28Å; K334-E340 WeakPolarHBondContact CE-OE2 3.36Å; K334-E340 IonicContact NZ-OE1 3.35Å; K334-E340 PolarHBondContact NZ-OE1 3.36Å; K334-E340 IonicContact NZ-OE2 3.68Å; K334-E340 PolarHBondContact NZ-OE2 3.02Å; T336-E340 PolarHBondContact O-N 3.49Å; T336-E340 VanDerWaalsContact O-N 3.14Å; P337-E340 PolarHBondContact O-N 3.27Å; E340-Q342 VanDerWaalsContact C-N 3.33Å; E340-Q342 PolarHBondContact O-N 3.06Å; E340-L343 PolarHBondContact O-N 2.88Å; E340-L344 HydrophobicContact CG-CD1 3.83Å; E340-L344 HydrophobicContact CG-CG 4.27Å; E340-L344 WeakPolarHBondContact O-CB 3.37Å; E340-L344 WeakPolarHBondContact O-CG 3.34Å; E340-L344 PolarHBondContact O-N 3.28Å; E340-R509 IonicContact OE1-NH2 2.7Å; E340-R509 PolarHBondContact OE1-NH2 3.28Å
341	L	94.5	Very high	94.4	Very high	59 Å²	59	37.4 Å²	37.4	31%	0.309	20%	0.195	S	C	.	.	H	α-helix	trans	-59	-41.6	177.1	-177.9	62	0	0	0	112.8	P337 V339 L344 Q345 W514	P337-L341 PolarHBondContact O-N 3.11Å; V339-L341 VanDerWaalsContact C-N 3.29Å; V339-L341 PolarHBondContact O-N 3.19Å; L341-L344 PolarHBondContact O-N 3.15Å; L341-Q345 HydrophobicContact CD1-CG 4.43Å; L341-Q345 WeakPolarHBondContact O-CB 3.36Å; L341-Q345 VanDerWaalsContact O-CG 3.27Å; L341-Q345 WeakPolarHBondContact O-CG 3.26Å; L341-Q345 PolarHBondContact O-N 2.89Å; L341-W514 HydrophobicContact CD1-CB 3.84Å; L341-W514 HydrophobicContact CD1-CG 4.3Å
342	Q	95.9	Very high	94.1	Very high	88 Å²	88	38.4 Å²	38.4	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-42.6	178.4	-69.6	176	6	0	0	112.4	H338 V339 E340 L344 Q345 E346 V366	H338-Q342 WeakPolarHBondContact O-CG 3.33Å; H338-Q342 PolarHBondContact O-N 3.12Å; V339-Q342 PolarHBondContact O-N 3.25Å; V339-Q342 VanDerWaalsContact O-N 3.09Å; E340-Q342 VanDerWaalsContact C-N 3.33Å; E340-Q342 PolarHBondContact O-N 3.06Å; Q342-L344 VanDerWaalsContact C-N 3.32Å; Q342-L344 PolarHBondContact O-N 3.19Å; Q342-Q345 PolarHBondContact O-N 3.07Å; Q342-E346 WeakPolarHBondContact O-CB 3.36Å; Q342-E346 PolarHBondContact O-N 3.38Å; Q342-V366 HydrophobicContact CB-CG1 3.94Å
343	L	95.6	Very high	93.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-44.9	176.5	-68.4	-174.3	0	0	0	111.3	L333 V339 E340 E346 I347 V366 L367 F370 L466	L333-L343 HydrophobicContact CD1-CD1 3.59Å; L333-L343 HydrophobicContact CD2-CD1 4.31Å; V339-L343 HydrophobicContact CG1-CD1 4.31Å; V339-L343 HydrophobicContact CG1-CG 4.22Å; V339-L343 WeakPolarHBondContact O-CG 3.42Å; V339-L343 PolarHBondContact O-N 2.82Å; E340-L343 PolarHBondContact O-N 2.88Å; L343-E346 PolarHBondContact O-N 3.42Å; L343-I347 WeakPolarHBondContact O-CB 3.28Å; L343-I347 WeakPolarHBondContact O-CD1 3.35Å; L343-I347 VanDerWaalsContact O-CG1 3.23Å; L343-I347 WeakPolarHBondContact O-CG1 3.31Å; L343-I347 PolarHBondContact O-N 3.33Å; L343-V366 HydrophobicContact CD2-CB 4.06Å; L343-V366 HydrophobicContact CD2-CG1 3.64Å; L343-V366 HydrophobicContact CG-CG1 4.46Å; L343-L367 HydrophobicContact CD1-CD1 4.2Å; L343-L367 HydrophobicContact CD2-CB 3.95Å; L343-L367 HydrophobicContact CD2-CD1 4.06Å; L343-L367 VanDerWaalsContact CD2-N 3.34Å; L343-F370 HydrophobicContact CD1-CB 4.22Å; L343-F370 HydrophobicContact CD1-CD1 3.81Å; L343-F370 HydrophobicContact CD1-CD2 4.29Å; L343-F370 HydrophobicContact CD1-CE1 4.25Å; L343-F370 HydrophobicContact CD1-CG 3.83Å; L343-F370 HydrophobicContact CD2-CB 4.01Å; L343-L466 HydrophobicContact CD1-CD1 4.48Å
344	L	94.8	Very high	93.5	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-50	178.6	-79.5	179	0	0	0	111.2	E340 L341 Q342 E346 I347 D348 L466 R509 W514	E340-L344 HydrophobicContact CG-CD1 3.83Å; E340-L344 HydrophobicContact CG-CG 4.27Å; E340-L344 WeakPolarHBondContact O-CB 3.37Å; E340-L344 WeakPolarHBondContact O-CG 3.34Å; E340-L344 PolarHBondContact O-N 3.28Å; L341-L344 PolarHBondContact O-N 3.15Å; Q342-L344 VanDerWaalsContact C-N 3.32Å; Q342-L344 PolarHBondContact O-N 3.19Å; L344-E346 VanDerWaalsContact C-N 3.31Å; L344-E346 PolarHBondContact O-N 2.93Å; L344-I347 PolarHBondContact O-N 3.11Å; L344-D348 PolarHBondContact O-N 3.15Å; L344-L466 HydrophobicContact CD2-CB 4.44Å; L344-R509 VanDerWaalsContact CD1-CZ 3.41Å; L344-W514 VanDerWaalsContact C-CZ3 3.49Å; L344-W514 HydrophobicContact CB-CE3 3.85Å; L344-W514 HydrophobicContact CB-CH2 4.18Å; L344-W514 HydrophobicContact CB-CZ3 3.41Å; L344-W514 VanDerWaalsContact CB-CZ3 3.41Å; L344-W514 HydrophobicContact CD1-CE3 4.4Å; L344-W514 HydrophobicContact CD2-CZ3 4.47Å; L344-W514 HydrophobicContact CG-CZ3 4.34Å; L344-W514 WeakPolarHBondContact O-CH2 3.33Å
345	Q	95.1	Very high	93.4	Very high	89 Å²	89	53 Å²	53	42%	0.416	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-41.4	174.8	-74.2	173	-11	0	0	112.7	L341 Q342 T349 W514	L341-Q345 HydrophobicContact CD1-CG 4.43Å; L341-Q345 WeakPolarHBondContact O-CB 3.36Å; L341-Q345 VanDerWaalsContact O-CG 3.27Å; L341-Q345 WeakPolarHBondContact O-CG 3.26Å; L341-Q345 PolarHBondContact O-N 2.89Å; Q342-Q345 PolarHBondContact O-N 3.07Å; Q345-T349 VanDerWaalsContact O-CB 3.3Å; Q345-T349 WeakPolarHBondContact O-CB 3.49Å; Q345-T349 PolarHBondContact O-N 3.1Å; Q345-T349 PolarHBondContact O-OG1 3.42Å; Q345-W514 HydrophobicContact CG-CZ2 4.24Å
346	E	96.8	Very high	93.5	Very high	24 Å²	24	50 Å²	50	11%	0.112	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-45.9	175.7	178.4	176.3	-109.8	0	0	111.5	Q342 L343 L344 T349 V350 L364 Q365 V366 L367	Q342-E346 WeakPolarHBondContact O-CB 3.36Å; Q342-E346 PolarHBondContact O-N 3.38Å; L343-E346 PolarHBondContact O-N 3.42Å; L344-E346 VanDerWaalsContact C-N 3.31Å; L344-E346 PolarHBondContact O-N 2.93Å; E346-T349 PolarHBondContact O-N 3.28Å; E346-V350 HydrophobicContact CG-CG2 4.25Å; E346-V350 WeakPolarHBondContact O-CB 3.43Å; E346-V350 WeakPolarHBondContact O-CG2 3.44Å; E346-V350 PolarHBondContact O-N 3.37Å; E346-L364 HydrophobicContact CG-CD2 3.96Å; E346-L364 WeakPolarHBondContact OE2-CA 3.38Å; E346-Q365 PolarHBondContact OE1-N 3.04Å; E346-Q365 PolarHBondContact OE2-N 3.17Å; E346-V366 HydrophobicContact CB-CB 4.47Å; E346-V366 HydrophobicContact CB-CG2 4.44Å; E346-V366 VanDerWaalsContact CD-N 3.33Å; E346-V366 WeakPolarHBondContact OE1-CG2 3.36Å; E346-V366 PolarHBondContact OE1-N 3.34Å; E346-V366 WeakPolarHBondContact OE2-CB 3.43Å; E346-V366 PolarHBondContact OE2-N 3.23Å; E346-L367 PolarHBondContact OE2-N 2.91Å
347	I	95.4	Very high	93.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.3	-49.6	178.6	-73.4	163.8	0	0	0	110.6	L343 L344 T349 V350 I351 G352 A463 L466	L343-I347 WeakPolarHBondContact O-CB 3.28Å; L343-I347 WeakPolarHBondContact O-CD1 3.35Å; L343-I347 VanDerWaalsContact O-CG1 3.23Å; L343-I347 WeakPolarHBondContact O-CG1 3.31Å; L343-I347 PolarHBondContact O-N 3.33Å; L344-I347 PolarHBondContact O-N 3.11Å; I347-T349 VanDerWaalsContact C-N 3.32Å; I347-T349 PolarHBondContact O-N 3.01Å; I347-V350 PolarHBondContact O-N 3.21Å; I347-I351 HydrophobicContact CG2-CD1 4.23Å; I347-I351 WeakPolarHBondContact O-CA 3.24Å; I347-I351 VanDerWaalsContact O-CB 3.28Å; I347-I351 WeakPolarHBondContact O-CB 3.46Å; I347-I351 PolarHBondContact O-N 3.29Å; I347-G352 PolarHBondContact O-N 2.95Å; I347-A463 HydrophobicContact CD1-CB 4.37Å; I347-A463 HydrophobicContact CG1-CB 4.41Å; I347-L466 HydrophobicContact CD1-CB 4.29Å
348	D	93.3	Very high	93.3	Very high	34 Å²	34	54.8 Å²	54.8	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-33.7	179.8	-77.6	10.4	0	0	0	112	L344 G352 G512 W514	L344-D348 PolarHBondContact O-N 3.15Å; D348-G352 WeakPolarHBondContact O-CA 3.49Å; D348-G352 PolarHBondContact O-N 3.08Å; D348-G512 PolarHBondContact OD2-N 2.95Å; D348-W514 HydrophobicContact CB-CH2 3.48Å; D348-W514 VanDerWaalsContact CB-CH2 3.48Å; D348-W514 HydrophobicContact CB-CZ2 3.75Å; D348-W514 WeakPolarHBondContact OD2-CH2 3.28Å; D348-W514 WeakPolarHBondContact OD2-CZ2 3.4Å
349	T	95.1	Very high	93.1	Very high	123 Å²	123	51.6 Å²	51.6	76%	0.755	28%	0.276	S	S	*	.	H	α-helix	trans	-69.3	-43	178.2	-59.3	0	0	0	0	112.1	Q345 E346 I347	Q345-T349 VanDerWaalsContact O-CB 3.3Å; Q345-T349 WeakPolarHBondContact O-CB 3.49Å; Q345-T349 PolarHBondContact O-N 3.1Å; Q345-T349 PolarHBondContact O-OG1 3.42Å; E346-T349 PolarHBondContact O-N 3.28Å; I347-T349 VanDerWaalsContact C-N 3.32Å; I347-T349 PolarHBondContact O-N 3.01Å
350	V	96.4	Very high	93	Very high	27 Å²	27	51.7 Å²	51.7	16%	0.164	28%	0.277	C	S	.	.	H	α-helix	trans	-84.6	-46.8	-174.3	173.1	0	0	0	0	111.3	E346 I347 R354 D360 K363 L364	E346-V350 HydrophobicContact CG-CG2 4.25Å; E346-V350 WeakPolarHBondContact O-CB 3.43Å; E346-V350 WeakPolarHBondContact O-CG2 3.44Å; E346-V350 PolarHBondContact O-N 3.37Å; I347-V350 PolarHBondContact O-N 3.21Å; V350-R354 PolarHBondContact O-NH2 2.81Å; V350-D360 HydrophobicContact CG1-CB 3.89Å; V350-K363 HydrophobicContact CG1-CB 3.77Å; V350-K363 HydrophobicContact CG1-CD 4.06Å; V350-K363 HydrophobicContact CG2-CB 3.91Å; V350-L364 HydrophobicContact CB-CD2 3.97Å; V350-L364 HydrophobicContact CG1-CD2 4.02Å; V350-L364 HydrophobicContact CG1-CG 4.44Å; V350-L364 HydrophobicContact CG2-CD2 4.23Å
351	I	94.3	Very high	92.9	Very high	9 Å²	9	52.1 Å²	52.1	5%	0.046	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-47.5	-172.3	-58.2	166.7	0	0	0	109.8	I347 R354 M356 D360 L364 A463	I347-I351 HydrophobicContact CG2-CD1 4.23Å; I347-I351 WeakPolarHBondContact O-CA 3.24Å; I347-I351 VanDerWaalsContact O-CB 3.28Å; I347-I351 WeakPolarHBondContact O-CB 3.46Å; I347-I351 PolarHBondContact O-N 3.29Å; I351-R354 VanDerWaalsContact CG2-O 3.24Å; I351-R354 WeakPolarHBondContact CG2-O 3.39Å; I351-R354 WeakPolarHBondContact O-CG 3.48Å; I351-R354 PolarHBondContact O-NE 3.21Å; I351-M356 HydrophobicContact CD1-CB 4.02Å; I351-M356 HydrophobicContact CD1-CG 3.86Å; I351-M356 HydrophobicContact CD1-SD 4.09Å; I351-M356 HydrophobicContact CG1-CB 4.39Å; I351-M356 HydrophobicContact CG1-CG 4.27Å; I351-M356 HydrophobicContact CG2-CB 4.29Å; I351-D360 HydrophobicContact CG1-CB 4.5Å; I351-L364 HydrophobicContact CD1-CD1 4.29Å; I351-L364 HydrophobicContact CD1-CD2 4.33Å; I351-A463 HydrophobicContact CD1-CB 4.09Å
352	G	89.1	Confident	92.8	Very high	21 Å²	21	57.2 Å²	57.2	22%	0.216	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	-139.9	-175.8	0	0	0	0	0	111.6	I347 D348 R354 R511	I347-G352 PolarHBondContact O-N 2.95Å; D348-G352 WeakPolarHBondContact O-CA 3.49Å; D348-G352 PolarHBondContact O-N 3.08Å; G352-R354 PolarHBondContact O-N 3.35Å; G352-R511 VanDerWaalsContact O-CZ 3.3Å; G352-R511 PolarHBondContact O-NH1 3.47Å
353	D	85.6	Confident	92.9	Very high	144 Å²	144	58.8 Å²	58.8	77%	0.77	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.3	-174.1	-68.5	-37.1	0	0	0	115.7	R511	D353-R511 PolarHBondContact O-NH1 2.89Å; D353-R511 IonicContact OD1-NH1 2.67Å
354	R	90.9	Very high	92.9	Very high	95 Å²	95	58.7 Å²	58.7	36%	0.358	31%	0.306	S	S	.	.	S	Bend	trans	-82.7	168.8	-178.3	55.2	171.5	-174.2	93.9	-2.2	112.1	V350 I351 G352 D360	V350-R354 PolarHBondContact O-NH2 2.81Å; I351-R354 VanDerWaalsContact CG2-O 3.24Å; I351-R354 WeakPolarHBondContact CG2-O 3.39Å; I351-R354 WeakPolarHBondContact O-CG 3.48Å; I351-R354 PolarHBondContact O-NE 3.21Å; G352-R354 PolarHBondContact O-N 3.35Å; R354-D360 IonicContact CZ-OD1 3.13Å; R354-D360 IonicContact CZ-OD2 2.91Å; R354-D360 IonicContact NH1-OD1 3.58Å; R354-D360 IonicContact NH1-OD2 3.56Å; R354-D360 PolarHBondContact NH1-OD2 2.88Å; R354-D360 IonicContact NH2-OD1 3.99Å; R354-D360 PolarHBondContact NH2-OD1 3.27Å; R354-D360 IonicContact NH2-OD2 3.95Å; R354-D360 PolarHBondContact NH2-OD2 3.08Å; R354-D360 VanDerWaalsContact NH2-OD2 3.12Å
355	Q	87.9	Confident	93	Very high	115 Å²	115	65 Å²	65	54%	0.537	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-69.2	143.7	167.2	-162.3	174.9	-7.3	0	0	110.4	V182	V182-Q355 HydrophobicContact CG1-CG 3.64Å
356	M	92.4	Very high	93.1	Very high	13 Å²	13	62.7 Å²	62.7	6%	0.064	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-66.5	140.2	177.2	-177.3	-173	62.8	0	0	110.9	V178 V182 I351 D360 L361 L364 S460 A463	V178-M356 HydrophobicContact CG1-CE 3.63Å; V182-M356 HydrophobicContact CG2-CB 4.27Å; V182-M356 HydrophobicContact CG2-CE 3.33Å; I351-M356 HydrophobicContact CD1-CB 4.02Å; I351-M356 HydrophobicContact CD1-CG 3.86Å; I351-M356 HydrophobicContact CD1-SD 4.09Å; I351-M356 HydrophobicContact CG1-CB 4.39Å; I351-M356 HydrophobicContact CG1-CG 4.27Å; I351-M356 HydrophobicContact CG2-CB 4.29Å; M356-D360 HydrophobicContact CG-CB 4.21Å; M356-L361 HydrophobicContact CE-CD2 4.38Å; M356-L361 HydrophobicContact SD-CD2 3.87Å; M356-L364 HydrophobicContact SD-CD1 4.26Å; M356-S460 VanDerWaalsContact CE-CB 3.41Å; M356-S460 WeakPolarHBondContact CE-OG 3.46Å; M356-A463 HydrophobicContact SD-CB 4.02Å
357	Q	91.6	Very high	93.2	Very high	123 Å²	123	61.5 Å²	61.5	58%	0.575	32%	0.322	S	S	*	.			trans	-122.2	163.1	179.9	-62.9	-179.5	-13	0	0	110.7	G359 D360	Q357-G359 VanDerWaalsContact C-N 3.26Å; Q357-G359 PolarHBondContact O-N 3.36Å; Q357-D360 PolarHBondContact N-OD2 2.76Å; Q357-D360 VanDerWaalsContact O-CB 3.29Å; Q357-D360 WeakPolarHBondContact O-CB 3.32Å; Q357-D360 PolarHBondContact O-N 3.37Å
358	N	89.5	Confident	93.3	Very high	59 Å²	59	65.5 Å²	65.5	32%	0.316	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-58	-35.5	-177.5	-173.5	29.8	0	0	0	113.9	V178 D360 L361	V178-N358 HydrophobicContact CB-CB 4.47Å; V178-N358 HydrophobicContact CG2-CB 4.01Å; N358-D360 PolarHBondContact O-N 3Å; N358-D360 VanDerWaalsContact O-N 3.15Å; N358-L361 PolarHBondContact O-N 2.91Å
359	G	90.5	Very high	93.5	Very high	49 Å²	49	65.3 Å²	65.3	51%	0.505	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-64.7	-14.2	177.2	0	0	0	0	0	114.7	Q357	Q357-G359 VanDerWaalsContact C-N 3.26Å; Q357-G359 PolarHBondContact O-N 3.36Å
360	D	93.9	Very high	93.6	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.027	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-83.1	-30	-178.5	-58.5	-37.6	0	0	0	112.7	V350 I351 R354 M356 Q357 N358 Q362 K363 L364	V350-D360 HydrophobicContact CG1-CB 3.89Å; I351-D360 HydrophobicContact CG1-CB 4.5Å; R354-D360 IonicContact CZ-OD1 3.13Å; R354-D360 IonicContact CZ-OD2 2.91Å; R354-D360 IonicContact NH1-OD1 3.58Å; R354-D360 IonicContact NH1-OD2 3.56Å; R354-D360 PolarHBondContact NH1-OD2 2.88Å; R354-D360 IonicContact NH2-OD1 3.99Å; R354-D360 PolarHBondContact NH2-OD1 3.27Å; R354-D360 IonicContact NH2-OD2 3.95Å; R354-D360 PolarHBondContact NH2-OD2 3.08Å; R354-D360 VanDerWaalsContact NH2-OD2 3.12Å; M356-D360 HydrophobicContact CG-CB 4.21Å; Q357-D360 PolarHBondContact N-OD2 2.76Å; Q357-D360 VanDerWaalsContact O-CB 3.29Å; Q357-D360 WeakPolarHBondContact O-CB 3.32Å; Q357-D360 PolarHBondContact O-N 3.37Å; N358-D360 PolarHBondContact O-N 3Å; N358-D360 VanDerWaalsContact O-N 3.15Å; D360-Q362 PolarHBondContact O-N 3.04Å; D360-Q362 VanDerWaalsContact O-N 3.09Å; D360-K363 WeakPolarHBondContact O-CA 3.48Å; D360-K363 WeakPolarHBondContact O-CB 3.25Å; D360-K363 PolarHBondContact O-N 3.15Å; D360-L364 PolarHBondContact O-N 3.1Å
361	L	92.5	Very high	93.7	Very high	12 Å²	12	58.2 Å²	58.2	6%	0.063	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.5	-172.7	-66.6	-178.4	0	0	0	113.4	V178 M356 N358 K363 L364 V456 K459	V178-L361 HydrophobicContact CG2-CD1 3.5Å; V178-L361 HydrophobicContact CG2-CG 4.36Å; M356-L361 HydrophobicContact CE-CD2 4.38Å; M356-L361 HydrophobicContact SD-CD2 3.87Å; N358-L361 PolarHBondContact O-N 2.91Å; L361-K363 VanDerWaalsContact C-N 3.29Å; L361-L364 HydrophobicContact CD2-CD1 4.31Å; L361-V456 HydrophobicContact CD1-CB 4.2Å; L361-V456 HydrophobicContact CD1-CG1 3.79Å; L361-V456 HydrophobicContact CD1-CG2 3.86Å; L361-K459 HydrophobicContact CD2-CB 3.77Å; L361-K459 HydrophobicContact CD2-CD 4.15Å; L361-K459 PolarHBondContact O-NZ 3.38Å
362	Q	93	Very high	93.9	Very high	166 Å²	166	59 Å²	59	78%	0.776	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-21.4	176.9	-65.5	-173.7	-3.3	0	0	112.9	D360	D360-Q362 PolarHBondContact O-N 3.04Å; D360-Q362 VanDerWaalsContact O-N 3.09Å
363	K	96.8	Very high	94.3	Very high	121 Å²	121	58 Å²	58	53%	0.526	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-20.8	179.7	-57.3	173.6	-174.5	169.3	0	112.4	V350 D360 L361 Q365	V350-K363 HydrophobicContact CG1-CB 3.77Å; V350-K363 HydrophobicContact CG1-CD 4.06Å; V350-K363 HydrophobicContact CG2-CB 3.91Å; D360-K363 WeakPolarHBondContact O-CA 3.48Å; D360-K363 WeakPolarHBondContact O-CB 3.25Å; D360-K363 PolarHBondContact O-N 3.15Å; L361-K363 VanDerWaalsContact C-N 3.29Å; K363-Q365 VanDerWaalsContact C-N 3.29Å; K363-Q365 PolarHBondContact O-N 3.34Å
364	L	96.9	Very high	94.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.			trans	-77.9	73.2	175.7	-59.7	175.4	0	0	0	110.9	E346 V350 I351 M356 D360 L361 L367 E368 K459 A463	E346-L364 HydrophobicContact CG-CD2 3.96Å; E346-L364 WeakPolarHBondContact OE2-CA 3.38Å; V350-L364 HydrophobicContact CB-CD2 3.97Å; V350-L364 HydrophobicContact CG1-CD2 4.02Å; V350-L364 HydrophobicContact CG1-CG 4.44Å; V350-L364 HydrophobicContact CG2-CD2 4.23Å; I351-L364 HydrophobicContact CD1-CD1 4.29Å; I351-L364 HydrophobicContact CD1-CD2 4.33Å; M356-L364 HydrophobicContact SD-CD1 4.26Å; D360-L364 PolarHBondContact O-N 3.1Å; L361-L364 HydrophobicContact CD2-CD1 4.31Å; L364-L367 HydrophobicContact CB-CB 4.09Å; L364-L367 HydrophobicContact CB-CD2 4.36Å; L364-L367 HydrophobicContact CD1-CD2 3.98Å; L364-E368 PolarHBondContact O-N 2.97Å; L364-K459 PolarHBondContact O-NZ 3.45Å; L364-A463 HydrophobicContact CD1-CB 4.47Å
365	Q	96.3	Very high	95.2	Very high	136 Å²	136	47.5 Å²	47.5	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-85	-37.4	-174.4	-65.8	-173.9	-10.8	0	0	112.9	E346 K363 E368 S369	E346-Q365 PolarHBondContact OE1-N 3.04Å; E346-Q365 PolarHBondContact OE2-N 3.17Å; K363-Q365 VanDerWaalsContact C-N 3.29Å; K363-Q365 PolarHBondContact O-N 3.34Å; Q365-E368 PolarHBondContact O-N 3.23Å; Q365-S369 WeakPolarHBondContact O-CB 3.4Å; Q365-S369 PolarHBondContact O-N 2.98Å; Q365-S369 PolarHBondContact O-OG 3.47Å
366	V	97.6	Very high	95.7	Very high	40 Å²	40	42 Å²	42	24%	0.242	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-44.5	173.4	-172.8	0	0	0	0	108.8	Q342 L343 E346 E368 S369 F370 L426	Q342-V366 HydrophobicContact CB-CG1 3.94Å; L343-V366 HydrophobicContact CD2-CB 4.06Å; L343-V366 HydrophobicContact CD2-CG1 3.64Å; L343-V366 HydrophobicContact CG-CG1 4.46Å; E346-V366 HydrophobicContact CB-CB 4.47Å; E346-V366 HydrophobicContact CB-CG2 4.44Å; E346-V366 VanDerWaalsContact CD-N 3.33Å; E346-V366 WeakPolarHBondContact OE1-CG2 3.36Å; E346-V366 PolarHBondContact OE1-N 3.34Å; E346-V366 WeakPolarHBondContact OE2-CB 3.43Å; E346-V366 PolarHBondContact OE2-N 3.23Å; V366-E368 VanDerWaalsContact C-N 3.32Å; V366-E368 PolarHBondContact O-N 3.49Å; V366-S369 PolarHBondContact O-N 3.32Å; V366-S369 VanDerWaalsContact O-N 3.17Å; V366-F370 WeakPolarHBondContact O-CB 3.36Å; V366-F370 PolarHBondContact O-N 2.82Å; V366-L426 HydrophobicContact CG1-CD1 4.01Å
367	L	98	Very high	95.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-39.5	174.3	-173.9	60.8	0	0	0	112.4	L343 E346 L364 F370 I371 K459 L462 A463	L343-L367 HydrophobicContact CD1-CD1 4.2Å; L343-L367 HydrophobicContact CD2-CB 3.95Å; L343-L367 HydrophobicContact CD2-CD1 4.06Å; L343-L367 VanDerWaalsContact CD2-N 3.34Å; E346-L367 PolarHBondContact OE2-N 2.91Å; L364-L367 HydrophobicContact CB-CB 4.09Å; L364-L367 HydrophobicContact CB-CD2 4.36Å; L364-L367 HydrophobicContact CD1-CD2 3.98Å; L367-F370 HydrophobicContact CD1-CD1 4.21Å; L367-F370 PolarHBondContact O-N 3.27Å; L367-I371 HydrophobicContact CD1-CD1 4.42Å; L367-I371 HydrophobicContact CG-CD1 4.11Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.32Å; L367-I371 PolarHBondContact O-N 2.92Å; L367-K459 HydrophobicContact CD2-CB 3.99Å; L367-K459 HydrophobicContact CD2-CG 4.02Å; L367-K459 HydrophobicContact CG-CG 4.24Å; L367-L462 HydrophobicContact CD1-CB 4.12Å; L367-L462 HydrophobicContact CD1-CD1 3.99Å; L367-A463 HydrophobicContact CD2-CB 4.27Å
368	E	97.6	Very high	96.1	Very high	84 Å²	84	38 Å²	38	39%	0.393	20%	0.198	S	C	.	.	H	α-helix	trans	-62.8	-44.5	173.8	-165.5	164.4	126.2	0	0	112.3	L364 Q365 V366 F370 I371 N372 M455 K459	L364-E368 PolarHBondContact O-N 2.97Å; Q365-E368 PolarHBondContact O-N 3.23Å; V366-E368 VanDerWaalsContact C-N 3.32Å; V366-E368 PolarHBondContact O-N 3.49Å; E368-F370 VanDerWaalsContact C-N 3.32Å; E368-F370 PolarHBondContact O-N 2.87Å; E368-I371 PolarHBondContact O-N 3.23Å; E368-N372 WeakPolarHBondContact O-CB 3.49Å; E368-N372 VanDerWaalsContact O-CG 3.27Å; E368-N372 PolarHBondContact O-N 2.69Å; E368-N372 PolarHBondContact O-ND2 2.81Å; E368-M455 HydrophobicContact CG-CE 3.92Å; E368-K459 WeakPolarHBondContact OE2-CE 3.46Å; E368-K459 IonicContact OE2-NZ 2.76Å; E368-K459 PolarHBondContact OE2-NZ 3.32Å
369	S	97.4	Very high	96.5	Very high	30 Å²	30	35.7 Å²	35.7	21%	0.21	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-40.5	178.7	-58.7	0	0	0	0	111.1	Q365 V366 N372 E373	Q365-S369 WeakPolarHBondContact O-CB 3.4Å; Q365-S369 PolarHBondContact O-N 2.98Å; Q365-S369 PolarHBondContact O-OG 3.47Å; V366-S369 PolarHBondContact O-N 3.32Å; V366-S369 VanDerWaalsContact O-N 3.17Å; S369-N372 PolarHBondContact O-N 2.9Å; S369-E373 WeakPolarHBondContact O-CB 3.46Å; S369-E373 PolarHBondContact O-N 3.46Å
370	F	98.3	Very high	96.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-48.9	173.9	169.7	-103.5	0	0	0	112.5	M329 L333 V339 L343 V366 L367 E368 N372 E373 C374 F424 L426 L462	M329-F370 HydrophobicContact CB-CE1 3.9Å; M329-F370 HydrophobicContact CB-CZ 3.97Å; M329-F370 HydrophobicContact CG-CE1 4.18Å; M329-F370 HydrophobicContact CG-CZ 4.43Å; M329-F370 WeakPolarHBondContact O-CZ 3.5Å; L333-F370 HydrophobicContact CB-CE2 4.15Å; L333-F370 HydrophobicContact CB-CZ 3.87Å; L333-F370 HydrophobicContact CD1-CD2 4.31Å; L333-F370 HydrophobicContact CD1-CE2 3.77Å; L333-F370 HydrophobicContact CD1-CZ 3.96Å; L333-F370 HydrophobicContact CG-CZ 4.38Å; V339-F370 HydrophobicContact CG1-CD2 3.75Å; V339-F370 HydrophobicContact CG1-CE2 4.4Å; V339-F370 HydrophobicContact CG1-CG 4.42Å; L343-F370 HydrophobicContact CD1-CB 4.22Å; L343-F370 HydrophobicContact CD1-CD1 3.81Å; L343-F370 HydrophobicContact CD1-CD2 4.29Å; L343-F370 HydrophobicContact CD1-CE1 4.25Å; L343-F370 HydrophobicContact CD1-CG 3.83Å; L343-F370 HydrophobicContact CD2-CB 4.01Å; V366-F370 WeakPolarHBondContact O-CB 3.36Å; V366-F370 PolarHBondContact O-N 2.82Å; L367-F370 HydrophobicContact CD1-CD1 4.21Å; L367-F370 PolarHBondContact O-N 3.27Å; E368-F370 VanDerWaalsContact C-N 3.32Å; E368-F370 PolarHBondContact O-N 2.87Å; F370-N372 VanDerWaalsContact C-N 3.32Å; F370-N372 PolarHBondContact O-N 3.18Å; F370-E373 PolarHBondContact O-N 3.18Å; F370-C374 VanDerWaalsContact CE2-SG 3.52Å; F370-C374 VanDerWaalsContact CZ-SG 3.56Å; F370-C374 WeakPolarHBondContact O-CB 3.41Å; F370-C374 PolarHBondContact O-N 2.84Å; F370-C374 PolarHBondContact O-SG 3.34Å; F370-F424 HydrophobicContact CD2-CE1 4.43Å; F370-F424 AromaticContact CD2-CZ 3.83Å; F370-F424 HydrophobicContact CD2-CZ 3.83Å; F370-F424 HydrophobicContact CE2-CE1 4.42Å; F370-F424 AromaticContact CE2-CZ 3.77Å; F370-F424 HydrophobicContact CE2-CZ 3.77Å; F370-L426 HydrophobicContact CB-CD2 4.11Å; F370-L462 HydrophobicContact CD1-CD1 4.46Å; F370-L462 HydrophobicContact CE1-CD1 4.16Å
371	I	98.6	Very high	97	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-46.2	176.5	-70.8	165	0	0	0	110.4	M329 L367 E368 E373 C374 L375 M455 M458 K459 L462	M329-I371 HydrophobicContact CE-CB 4.41Å; M329-I371 HydrophobicContact CE-CG1 4.46Å; M329-I371 HydrophobicContact CE-CG2 3.9Å; M329-I371 HydrophobicContact SD-CG1 4.25Å; L367-I371 HydrophobicContact CD1-CD1 4.42Å; L367-I371 HydrophobicContact CG-CD1 4.11Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.32Å; L367-I371 PolarHBondContact O-N 2.92Å; E368-I371 PolarHBondContact O-N 3.23Å; I371-E373 PolarHBondContact O-N 2.77Å; I371-C374 PolarHBondContact O-N 3.09Å; I371-L375 HydrophobicContact CG2-CD1 4.01Å; I371-L375 HydrophobicContact CG2-CG 4.45Å; I371-L375 VanDerWaalsContact O-CG 3.31Å; I371-L375 WeakPolarHBondContact O-CG 3.37Å; I371-L375 PolarHBondContact O-N 2.77Å; I371-M455 HydrophobicContact CB-CE 4.26Å; I371-M455 HydrophobicContact CD1-CE 4.47Å; I371-M455 HydrophobicContact CG2-CE 3.73Å; I371-M455 HydrophobicContact CG2-SD 3.76Å; I371-M458 HydrophobicContact CD1-CB 3.95Å; I371-M458 HydrophobicContact CG2-CE 3.71Å; I371-M458 HydrophobicContact CG2-SD 4.06Å; I371-K459 HydrophobicContact CD1-CB 4.38Å; I371-K459 HydrophobicContact CD1-CG 3.53Å; I371-L462 HydrophobicContact CD1-CD1 4.16Å; I371-L462 HydrophobicContact CG1-CD1 3.92Å
372	N	97.8	Very high	97.1	Very high	27 Å²	27	36.1 Å²	36.1	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-40.8	179.1	-74.3	-33.2	0	0	0	112.2	E368 S369 F370 L375 R376 F429 F438	E368-N372 WeakPolarHBondContact O-CB 3.49Å; E368-N372 VanDerWaalsContact O-CG 3.27Å; E368-N372 PolarHBondContact O-N 2.69Å; E368-N372 PolarHBondContact O-ND2 2.81Å; S369-N372 PolarHBondContact O-N 2.9Å; F370-N372 VanDerWaalsContact C-N 3.32Å; F370-N372 PolarHBondContact O-N 3.18Å; N372-L375 PolarHBondContact O-N 3.39Å; N372-R376 WeakPolarHBondContact O-CB 3.22Å; N372-R376 PolarHBondContact O-N 2.95Å; N372-F429 HydrophobicContact CB-CD1 3.9Å; N372-F429 HydrophobicContact CB-CD2 4.24Å; N372-F429 HydrophobicContact CB-CE1 3.68Å; N372-F429 HydrophobicContact CB-CE2 4.03Å; N372-F429 HydrophobicContact CB-CG 4.17Å; N372-F429 HydrophobicContact CB-CZ 3.74Å; N372-F438 HydrophobicContact CB-CE1 3.92Å; N372-F438 HydrophobicContact CB-CZ 4.05Å; N372-F438 VanDerWaalsContact O-CZ 3.3Å; N372-F438 WeakPolarHBondContact O-CZ 3.04Å
373	E	97.8	Very high	97.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.9	-39.5	176.8	-176.1	62.3	-177.1	0	0	112.1	S369 F370 I371 R376 F377 F424 S425 L426 N428 F429	S369-E373 WeakPolarHBondContact O-CB 3.46Å; S369-E373 PolarHBondContact O-N 3.46Å; F370-E373 PolarHBondContact O-N 3.18Å; I371-E373 PolarHBondContact O-N 2.77Å; E373-R376 PolarHBondContact O-N 3.23Å; E373-R376 IonicContact OE1-CZ 2.73Å; E373-R376 IonicContact OE1-NE 3.85Å; E373-R376 PolarHBondContact OE1-NE 2.88Å; E373-R376 IonicContact OE1-NH2 2.88Å; E373-R376 PolarHBondContact OE1-NH2 3Å; E373-R376 WeakPolarHBondContact OE2-CD 3.32Å; E373-R376 IonicContact OE2-CZ 3.99Å; E373-R376 IonicContact OE2-NE 2.73Å; E373-R376 PolarHBondContact OE2-NE 2.89Å; E373-R376 IonicContact OE2-NH2 2.76Å; E373-F377 WeakPolarHBondContact O-CB 3.31Å; E373-F377 PolarHBondContact O-N 3.33Å; E373-F424 HydrophobicContact CB-CE2 4.2Å; E373-F424 HydrophobicContact CB-CZ 4.39Å; E373-F424 HydrophobicContact CG-CD1 4.49Å; E373-F424 HydrophobicContact CG-CD2 3.8Å; E373-F424 HydrophobicContact CG-CE1 4.41Å; E373-F424 HydrophobicContact CG-CE2 3.66Å; E373-F424 HydrophobicContact CG-CG 4.23Å; E373-F424 HydrophobicContact CG-CZ 3.99Å; E373-S425 PolarHBondContact OE1-N 2.82Å; E373-L426 HydrophobicContact CB-CD2 3.94Å; E373-L426 HydrophobicContact CG-CD2 4.3Å; E373-N428 PolarHBondContact OE1-ND2 3.15Å; E373-N428 WeakPolarHBondContact OE2-CB 3.41Å; E373-F429 HydrophobicContact CB-CD2 4.01Å; E373-F429 HydrophobicContact CB-CE2 4.14Å; E373-F429 WeakPolarHBondContact OE2-CD2 3.45Å; E373-F429 WeakPolarHBondContact OE2-CE2 3.34Å
374	C	98.1	Very high	97.4	Very high	4 Å²	4	24 Å²	24	3%	0.027	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-48.1	171.7	-71.7	0	0	0	0	111.7	M329 L332 F370 I371 R376 F377 H378 F424	M329-C374 HydrophobicContact CE-CB 3.99Å; M329-C374 HydrophobicContact CG-CB 3.59Å; L332-C374 HydrophobicContact CD1-CB 4.25Å; F370-C374 VanDerWaalsContact CE2-SG 3.52Å; F370-C374 VanDerWaalsContact CZ-SG 3.56Å; F370-C374 WeakPolarHBondContact O-CB 3.41Å; F370-C374 PolarHBondContact O-N 2.84Å; F370-C374 PolarHBondContact O-SG 3.34Å; I371-C374 PolarHBondContact O-N 3.09Å; C374-R376 PolarHBondContact O-N 2.72Å; C374-F377 PolarHBondContact O-N 3.04Å; C374-H378 CarbonylContact O-C 3.58Å; C374-H378 PolarHBondContact O-N 2.95Å; C374-F424 HydrophobicContact CB-CE2 4.44Å; C374-F424 VanDerWaalsContact SG-CE2 3.51Å
375	L	97.7	Very high	97.5	Very high	14 Å²	14	24 Å²	24	7%	0.073	13%	0.127	C	C	.	.	H	α-helix	trans	-67.3	-22	177.9	-66.5	176	0	0	0	113.4	M329 I371 N372 P379 F438 P440 F441 M458	M329-L375 HydrophobicContact CE-CD2 4.12Å; M329-L375 HydrophobicContact CE-CG 4.11Å; I371-L375 HydrophobicContact CG2-CD1 4.01Å; I371-L375 HydrophobicContact CG2-CG 4.45Å; I371-L375 VanDerWaalsContact O-CG 3.31Å; I371-L375 WeakPolarHBondContact O-CG 3.37Å; I371-L375 PolarHBondContact O-N 2.77Å; N372-L375 PolarHBondContact O-N 3.39Å; L375-P379 WeakPolarHBondContact O-CB 3.17Å; L375-F438 HydrophobicContact CB-CZ 4.37Å; L375-P440 HydrophobicContact CB-CB 3.99Å; L375-P440 HydrophobicContact CD1-CB 4.15Å; L375-P440 HydrophobicContact CD1-CG 4.48Å; L375-F441 HydrophobicContact CD1-CE2 4.02Å; L375-F441 HydrophobicContact CD1-CZ 3.86Å; L375-M458 HydrophobicContact CD1-CE 4.22Å
376	R	97.2	Very high	97.6	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-81.6	-50.1	174.3	-173	-156.3	66.8	79.8	-4.1	111.2	N372 E373 C374 H413 F418 A421 E423 N428 F429 F438	N372-R376 WeakPolarHBondContact O-CB 3.22Å; N372-R376 PolarHBondContact O-N 2.95Å; E373-R376 PolarHBondContact O-N 3.23Å; E373-R376 IonicContact OE1-CZ 2.73Å; E373-R376 IonicContact OE1-NE 3.85Å; E373-R376 PolarHBondContact OE1-NE 2.88Å; E373-R376 IonicContact OE1-NH2 2.88Å; E373-R376 PolarHBondContact OE1-NH2 3Å; E373-R376 WeakPolarHBondContact OE2-CD 3.32Å; E373-R376 IonicContact OE2-CZ 3.99Å; E373-R376 IonicContact OE2-NE 2.73Å; E373-R376 PolarHBondContact OE2-NE 2.89Å; E373-R376 IonicContact OE2-NH2 2.76Å; C374-R376 PolarHBondContact O-N 2.72Å; R376-H413 HydrophobicContact CG-CB 3.72Å; R376-H413 PolarHBondContact NH1-O 3.5Å; R376-F418 VanDerWaalsContact CD-CE2 3.41Å; R376-F418 HydrophobicContact CG-CD2 4.17Å; R376-F418 HydrophobicContact CG-CE1 4.48Å; R376-F418 HydrophobicContact CG-CE2 3.75Å; R376-F418 HydrophobicContact CG-CZ 3.89Å; R376-A421 PolarHBondContact NH1-O 3.13Å; R376-A421 PolarHBondContact NH2-O 3.46Å; R376-E423 PolarHBondContact NH2-O 3.02Å; R376-N428 PolarHBondContact NH2-ND2 3.14Å; R376-F429 HydrophobicContact CB-CE2 4.07Å; R376-F429 HydrophobicContact CB-CZ 4.19Å; R376-F429 HydrophobicContact CG-CE2 4.47Å; R376-F438 HydrophobicContact CB-CD2 4.26Å; R376-F438 HydrophobicContact CB-CE2 3.66Å; R376-F438 HydrophobicContact CB-CZ 4.43Å; R376-F438 HydrophobicContact CG-CD2 4.3Å; R376-F438 HydrophobicContact CG-CE2 4.2Å
377	F	96.6	Very high	97.6	Very high	32 Å²	32	19.3 Å²	19.3	14%	0.14	10%	0.099	C	C	.	.	H	α-helix	trans	-75.6	-45.8	-172.3	-174.3	-103.3	0	0	0	111	L332 E373 C374 R414 D422 F424 L479	L332-F377 HydrophobicContact CD2-CD1 4.03Å; L332-F377 HydrophobicContact CD2-CE1 4.11Å; E373-F377 WeakPolarHBondContact O-CB 3.31Å; E373-F377 PolarHBondContact O-N 3.33Å; C374-F377 PolarHBondContact O-N 3.04Å; F377-R414 PolarHBondContact O-NH2 3.15Å; F377-D422 WeakPolarHBondContact CE2-O 3.2Å; F377-F424 HydrophobicContact CB-CD2 3.88Å; F377-F424 HydrophobicContact CD1-CB 4.09Å; F377-F424 AromaticContact CD1-CD2 3.89Å; F377-F424 HydrophobicContact CD1-CD2 3.89Å; F377-F424 HydrophobicContact CD1-CG 4.48Å; F377-F424 HydrophobicContact CD2-CB 4.18Å; F377-F424 HydrophobicContact CE1-CB 4.15Å; F377-F424 HydrophobicContact CE2-CB 4.24Å; F377-F424 HydrophobicContact CG-CB 4.11Å; F377-F424 AromaticContact CG-CD2 3.93Å; F377-F424 HydrophobicContact CG-CD2 3.93Å; F377-F424 HydrophobicContact CZ-CB 4.23Å; F377-L479 HydrophobicContact CD1-CD2 4.24Å; F377-L479 HydrophobicContact CE1-CD2 3.8Å
378	H	96.5	Very high	97.6	Very high	19 Å²	19	19.4 Å²	19.4	9%	0.088	10%	0.1	C	C	.	.	S	Bend	trans	-135.7	70.6	-176.7	-160.1	89.6	0	0	0	111.8	F328 L332 C374 L479 Q484 Q490	F328-H378 AromaticContact CD1-CD2 3.89Å; F328-H378 AromaticContact CD1-NE2 3.85Å; F328-H378 AromaticContact CD2-CD2 3.49Å; F328-H378 VanDerWaalsContact CD2-CD2 3.49Å; F328-H378 WeakPolarHBondContact CD2-CD2 3.45Å; F328-H378 AromaticContact CD2-NE2 3.91Å; F328-H378 AromaticContact CE1-NE2 3.58Å; F328-H378 AromaticContact CE2-CD2 3.66Å; F328-H378 AromaticContact CE2-NE2 3.61Å; F328-H378 AromaticContact CG-CD2 3.61Å; F328-H378 AromaticContact CZ-CD2 3.95Å; F328-H378 AromaticContact CZ-NE2 3.44Å; F328-H378 WeakPolarHBondContact CZ-NE2 3.37Å; L332-H378 HydrophobicContact CD1-CB 4.24Å; C374-H378 CarbonylContact O-C 3.58Å; C374-H378 PolarHBondContact O-N 2.95Å; H378-L479 HydrophobicContact CB-CD2 4.11Å; H378-L479 WeakPolarHBondContact ND1-CD2 3.47Å; H378-Q484 PolarHBondContact CE1-OE1 3.21Å; H378-Q484 PolarHBondContact NE2-OE1 2.92Å; H378-Q490 PolarHBondContact CE1-NE2 2.94Å; H378-Q490 PolarHBondContact NE2-NE2 3.3Å
379	P	96.8	Very high	97.7	Very high	10 Å²	10	18.4 Å²	18.4	7%	0.065	10%	0.097	C	C	.	.			trans	-69.6	132.3	-178.9	24.9	-31.2	0	0	0	112.3	L375 D382 Q490	L375-P379 WeakPolarHBondContact O-CB 3.17Å; P379-D382 HydrophobicContact CB-CB 4.33Å; P379-D382 HydrophobicContact CG-CB 3.8Å; P379-Q490 PolarHBondContact O-OE1 3.39Å
380	V	97.6	Very high	97.7	Very high	3 Å²	3	18.9 Å²	18.9	2%	0.018	10%	0.101	C	C	.	.	S	Bend	trans	-64.9	-44.1	165.7	175.1	0	0	0	0	110.7	I324 S325 F328 S489 Q490	I324-V380 HydrophobicContact CB-CG1 4.38Å; I324-V380 HydrophobicContact CB-CG2 4.01Å; I324-V380 HydrophobicContact CG2-CG1 4.35Å; I324-V380 HydrophobicContact CG2-CG2 3.69Å; S325-V380 VanDerWaalsContact OG-CG2 3.27Å; S325-V380 WeakPolarHBondContact OG-CG2 3.24Å; F328-V380 HydrophobicContact CD2-CG2 3.76Å; F328-V380 HydrophobicContact CE2-CG2 3.92Å; V380-S489 CarbonylContact O-C 3.56Å; V380-S489 VanDerWaalsContact O-CA 3.25Å; V380-S489 WeakPolarHBondContact O-CA 3.39Å; V380-S489 WeakPolarHBondContact O-CB 3.31Å; V380-Q490 PolarHBondContact O-N 2.83Å
381	V	97.1	Very high	97.7	Very high	68 Å²	68	24 Å²	24	41%	0.412	13%	0.128	S	C	.	.	S	Bend	trans	-103.7	90.4	175.8	-176.2	0	0	0	0	108.6	T321	T321-V381 HydrophobicContact CG2-CG2 4.17Å
382	D	96.4	Very high	97.7	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.027	14%	0.135	C	C	.	.			trans	-89.4	-11	-174.2	71.4	-28.1	0	0	0	113.5	P379 T409 G410 N486	P379-D382 HydrophobicContact CB-CB 4.33Å; P379-D382 HydrophobicContact CG-CB 3.8Å; D382-T409 CarbonylContact O-C 3.48Å; D382-T409 PolarHBondContact O-N 3.48Å; D382-T409 PolarHBondContact O-OG1 2.71Å; D382-G410 PolarHBondContact O-N 3.16Å; D382-N486 PolarHBondContact OD2-ND2 2.82Å; D382-N486 PolarHBondContact OD2-OD1 2.87Å
383	F	97.9	Very high	97.6	Very high	10 Å²	10	27.1 Å²	27.1	4%	0.044	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	165.2	172.1	68.9	-93	0	0	0	115	I87 M385 I406 L407 N487 L488	I87-F383 HydrophobicContact CB-CE1 4.09Å; I87-F383 HydrophobicContact CB-CE2 4.41Å; I87-F383 HydrophobicContact CB-CZ 3.69Å; I87-F383 HydrophobicContact CD1-CZ 4.45Å; I87-F383 HydrophobicContact CG2-CD2 4.37Å; I87-F383 HydrophobicContact CG2-CE1 3.89Å; I87-F383 HydrophobicContact CG2-CE2 3.65Å; I87-F383 HydrophobicContact CG2-CZ 3.39Å; F383-M385 HydrophobicContact CD2-CG 4.12Å; F383-M385 HydrophobicContact CE2-CG 3.84Å; F383-M385 HydrophobicContact CE2-SD 4.17Å; F383-I406 HydrophobicContact CB-CG2 3.87Å; F383-I406 HydrophobicContact CD2-CG2 3.87Å; F383-I406 HydrophobicContact CG-CG2 3.97Å; F383-L407 CarbonylContact C-O 3.55Å; F383-L407 WeakPolarHBondContact CA-O 3.39Å; F383-L407 VanDerWaalsContact CB-O 3.25Å; F383-L407 WeakPolarHBondContact CB-O 3.41Å; F383-N487 VanDerWaalsContact CE1-O 3.26Å; F383-N487 WeakPolarHBondContact CE1-O 3.12Å; F383-L488 HydrophobicContact CE2-CD1 4.46Å; F383-L488 HydrophobicContact CZ-CD1 4.17Å; F383-L488 WeakPolarHBondContact CZ-O 3.21Å
384	S	97.6	Very high	97.6	Very high	21 Å²	21	27.2 Å²	27.2	15%	0.147	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.8	170.1	164.5	0	0	0	0	111.9	R132 R386 L407	R132-S384 PolarHBondContact NH1-OG 3.39Å; R132-S384 VanDerWaalsContact NH1-OG 3.1Å; S384-R386 PolarHBondContact OG-NE 3.4Å; S384-L407 PolarHBondContact N-O 2.96Å; S384-L407 WeakPolarHBondContact O-CB 3.46Å; S384-L407 PolarHBondContact O-N 3.39Å
385	M	98.4	Very high	97.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138	174.3	-61.7	170.2	79.8	0	0	112.2	R132 F133 F151 L241 I242 F383 I405 I406	R132-M385 WeakPolarHBondContact CG-O 3.28Å; R132-M385 PolarHBondContact NH1-O 3.41Å; F133-M385 HydrophobicContact CD1-CB 4.04Å; F133-M385 HydrophobicContact CD1-CE 3.96Å; F133-M385 HydrophobicContact CD2-CE 3.81Å; F133-M385 HydrophobicContact CE1-CB 3.73Å; F133-M385 HydrophobicContact CE1-CE 3.55Å; F133-M385 HydrophobicContact CE1-CG 4Å; F133-M385 HydrophobicContact CE2-CE 3.38Å; F133-M385 HydrophobicContact CG-CE 4.09Å; F133-M385 HydrophobicContact CZ-CE 3.24Å; F133-M385 HydrophobicContact CZ-CG 4.34Å; F133-M385 WeakPolarHBondContact O-CE 3.2Å; F151-M385 HydrophobicContact CE1-SD 4.06Å; F151-M385 HydrophobicContact CZ-SD 3.85Å; L241-M385 HydrophobicContact CD2-CE 4.35Å; L241-M385 HydrophobicContact CD2-SD 3.86Å; I242-M385 HydrophobicContact CG2-CE 4.38Å; F383-M385 HydrophobicContact CD2-CG 4.12Å; F383-M385 HydrophobicContact CE2-CG 3.84Å; F383-M385 HydrophobicContact CE2-SD 4.17Å; M385-I405 CarbonylContact C-O 3.55Å; M385-I405 WeakPolarHBondContact CA-O 3.29Å; M385-I406 HydrophobicContact CG-CG1 4.49Å
386	R	98.4	Very high	97.2	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.015	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	159.9	-179.4	-59.1	-63.3	179.2	139.7	-7.8	111.1	V123 Y129 S131 F133 S384 I405 L407 R446	V123-R386 HydrophobicContact CG1-CB 4.18Å; V123-R386 HydrophobicContact CG1-CG 3.94Å; Y129-R386 WeakPolarHBondContact O-CD 3.39Å; Y129-R386 PolarHBondContact O-NH1 3.04Å; S131-R386 CarbonylContact O-C 3.53Å; S131-R386 WeakPolarHBondContact O-CA 3.47Å; F133-R386 VanDerWaalsContact CD1-O 3.26Å; F133-R386 WeakPolarHBondContact CD1-O 3.25Å; S384-R386 PolarHBondContact OG-NE 3.4Å; R386-I405 HydrophobicContact CB-CB 4.1Å; R386-I405 PolarHBondContact N-O 2.98Å; R386-I405 PolarHBondContact O-N 2.61Å; R386-L407 HydrophobicContact CG-CD1 3.91Å; R386-L407 HydrophobicContact CG-CG 4.28Å; R386-R446 PolarHBondContact NH2-O 3.08Å
387	R	98.3	Very high	97.1	Very high	72 Å²	72	35.1 Å²	35.1	27%	0.272	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.3	171.5	-169.5	171.8	-176.5	128	-2.6	110.1	E109 S131 F133 L389 G402 N404	E109-R387 IonicContact OE1-CZ 3.55Å; E109-R387 IonicContact OE1-NH1 3.77Å; E109-R387 PolarHBondContact OE1-NH1 3.39Å; E109-R387 IonicContact OE1-NH2 2.81Å; E109-R387 PolarHBondContact OE1-NH2 2.69Å; E109-R387 IonicContact OE2-NH1 2.8Å; E109-R387 PolarHBondContact OE2-NH1 3.1Å; E109-R387 VanDerWaalsContact OE2-NH1 3.1Å; S131-R387 PolarHBondContact O-N 3.03Å; F133-R387 HydrophobicContact CB-CB 4.42Å; R387-L389 PolarHBondContact O-N 2.85Å; R387-G402 PolarHBondContact NE-O 3.17Å; R387-N404 PolarHBondContact NH1-OD1 2.89Å
388	A	98.5	Very high	97	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.017	22%	0.224	C	C	.	.			trans	-71.7	123.8	177.9	0	0	0	0	0	110.7	Y129 V399 G402 T403	Y129-A388 HydrophobicContact CD1-CB 4.07Å; Y129-A388 HydrophobicContact CE1-CB 3.74Å; A388-V399 HydrophobicContact CB-CG1 4.23Å; A388-G402 PolarHBondContact O-N 2.9Å; A388-T403 PolarHBondContact N-O 3.36Å
389	L	98.3	Very high	97.1	Very high	64 Å²	64	39.3 Å²	39.3	34%	0.335	22%	0.221	S	C	.	.	S	Bend	trans	-89	-17.1	179.4	-64.7	172.3	0	0	0	113.1	K128 V155 R387 K401	K128-L389 VanDerWaalsContact O-CB 3.24Å; K128-L389 WeakPolarHBondContact O-CB 3.18Å; K128-L389 WeakPolarHBondContact O-CG 3.4Å; K128-L389 PolarHBondContact O-N 3.33Å; V155-L389 HydrophobicContact CG2-CD1 3.87Å; V155-L389 HydrophobicContact CG2-CD2 4.25Å; R387-L389 PolarHBondContact O-N 2.85Å; L389-K401 WeakPolarHBondContact O-CD 3.4Å; L389-K401 VanDerWaalsContact O-CE 3.31Å; L389-K401 WeakPolarHBondContact O-CE 3.44Å; L389-K401 WeakPolarHBondContact O-CG 3.43Å
390	S	98.1	Very high	97.1	Very high	40 Å²	40	42 Å²	42	28%	0.28	24%	0.238	S	C	.	.	S	Bend	trans	-152.6	163.9	176.8	65.6	0	0	0	0	109.7	K128	K128-S390 WeakPolarHBondContact CD-OG 3.21Å; K128-S390 WeakPolarHBondContact CE-OG 3.49Å; K128-S390 VanDerWaalsContact CG-OG 3.26Å; K128-S390 WeakPolarHBondContact CG-OG 3.26Å
391	D	98.1	Very high	97.1	Very high	106 Å²	106	48.9 Å²	48.9	57%	0.567	27%	0.268	S	S	*	.			trans	-60.1	146	173.9	-55.6	-14.7	0	0	0	111.4	K128 V399 K401	K128-D391 PolarHBondContact NZ-O 3.08Å; D391-V399 WeakPolarHBondContact CA-O 3.42Å; D391-K401 WeakPolarHBondContact OD1-CB 3.24Å; D391-K401 PolarHBondContact OD1-N 3.12Å
392	D	97.9	Very high	97.1	Very high	29 Å²	29	46.7 Å²	46.7	16%	0.155	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	172.3	177.1	-145.7	22.8	0	0	0	111.5	H122 N126 K128 Y129 V399	H122-D392 IonicContact CD2-OD2 2.77Å; H122-D392 IonicContact CE1-OD2 3.42Å; H122-D392 IonicContact NE2-OD2 3.8Å; H122-D392 PolarHBondContact NE2-OD2 3.42Å; N126-D392 PolarHBondContact ND2-OD2 3.34Å; K128-D392 HydrophobicContact CD-CB 4.31Å; K128-D392 IonicContact NZ-OD1 3.07Å; K128-D392 PolarHBondContact NZ-OD1 3.42Å; Y129-D392 WeakPolarHBondContact OH-CB 3.2Å; Y129-D392 PolarHBondContact OH-OD2 3.35Å; Y129-D392 VanDerWaalsContact OH-OD2 3.08Å; D392-V399 PolarHBondContact N-O 2.96Å; D392-V399 PolarHBondContact O-N 3.19Å
393	V	97.1	Very high	97.2	Very high	64 Å²	64	47 Å²	47	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.8	170.5	-178.6	0	0	0	0	109.1	Y397	V393-Y397 CarbonylContact C-O 3.41Å; V393-Y397 VanDerWaalsContact CA-O 3.31Å; V393-Y397 WeakPolarHBondContact CA-O 3.29Å
394	I	96.9	Very high	97.2	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.6	177.7	-59.7	178	0	0	0	108.5	L114 A119 V123 Y129 G396 Y397 V399 I405	L114-I394 HydrophobicContact CD1-CD1 4.48Å; A119-I394 HydrophobicContact CB-CG2 3.64Å; V123-I394 HydrophobicContact CG2-CD1 3.52Å; Y129-I394 HydrophobicContact CE1-CD1 4.32Å; Y129-I394 HydrophobicContact CE2-CD1 4.47Å; Y129-I394 VanDerWaalsContact OH-CD1 3.22Å; Y129-I394 WeakPolarHBondContact OH-CD1 3.34Å; I394-G396 PolarHBondContact O-N 3.48Å; I394-G396 VanDerWaalsContact O-N 3.09Å; I394-Y397 PolarHBondContact N-O 3.07Å; I394-Y397 WeakPolarHBondContact O-CB 3.41Å; I394-Y397 PolarHBondContact O-N 2.88Å; I394-V399 HydrophobicContact CB-CG2 4.14Å; I394-V399 HydrophobicContact CD1-CB 4.49Å; I394-V399 HydrophobicContact CD1-CG2 3.89Å; I394-V399 HydrophobicContact CG1-CG2 3.93Å; I394-I405 HydrophobicContact CD1-CD1 4.4Å
395	D	94	Very high	97.3	Very high	66 Å²	66	45.5 Å²	45.5	35%	0.353	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	37.4	178.7	-71.3	9.7	0	0	0	113.7	I101 R116 S118	I101-D395 HydrophobicContact CD1-CB 3.94Å; R116-D395 VanDerWaalsContact CD-OD2 3.24Å; R116-D395 WeakPolarHBondContact CD-OD2 3.3Å; R116-D395 IonicContact NH1-OD2 2.76Å; S118-D395 PolarHBondContact OG-OD2 2.79Å
396	G	93.2	Very high	97.3	Very high	63 Å²	63	45.4 Å²	45.4	65%	0.649	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	-9	-179.4	0	0	0	0	0	115.3	I394	I394-G396 PolarHBondContact O-N 3.48Å; I394-G396 VanDerWaalsContact O-N 3.09Å
397	Y	95.1	Very high	97.3	Very high	54 Å²	54	45.2 Å²	45.2	21%	0.212	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.4	177.8	-59.5	-76.8	0	0	0	111.9	V64 I101 V393 I394	V64-Y397 HydrophobicContact CB-CD1 4.26Å; V64-Y397 HydrophobicContact CG2-CD1 3.54Å; V64-Y397 HydrophobicContact CG2-CE1 4.31Å; V64-Y397 HydrophobicContact CG2-CG 3.79Å; I101-Y397 HydrophobicContact CB-CE2 4.46Å; I101-Y397 HydrophobicContact CD1-CD2 4.1Å; I101-Y397 HydrophobicContact CD1-CE2 3.98Å; I101-Y397 HydrophobicContact CG2-CD2 4.05Å; I101-Y397 HydrophobicContact CG2-CE2 4.16Å; V393-Y397 CarbonylContact C-O 3.41Å; V393-Y397 VanDerWaalsContact CA-O 3.31Å; V393-Y397 WeakPolarHBondContact CA-O 3.29Å; I394-Y397 PolarHBondContact N-O 3.07Å; I394-Y397 WeakPolarHBondContact O-CB 3.41Å; I394-Y397 PolarHBondContact O-N 2.88Å
398	Q	95.4	Very high	97.3	Very high	137 Å²	137	41.8 Å²	41.8	64%	0.64	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	131.4	174.2	-63.9	-66.4	-23.4	0	0	110.1
399	V	97.3	Very high	97.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	96.3	178.1	-175.5	0	0	0	0	108.7	L112 A388 D391 D392 I394 T403 I405	L112-V399 HydrophobicContact CD1-CG1 4.12Å; L112-V399 HydrophobicContact CD1-CG2 3.7Å; A388-V399 HydrophobicContact CB-CG1 4.23Å; D391-V399 WeakPolarHBondContact CA-O 3.42Å; D392-V399 PolarHBondContact N-O 2.96Å; D392-V399 PolarHBondContact O-N 3.19Å; I394-V399 HydrophobicContact CB-CG2 4.14Å; I394-V399 HydrophobicContact CD1-CB 4.49Å; I394-V399 HydrophobicContact CD1-CG2 3.89Å; I394-V399 HydrophobicContact CG1-CG2 3.93Å; V399-T403 HydrophobicContact CG1-CG2 4.13Å; V399-I405 HydrophobicContact CG1-CD1 4.36Å
400	P	97.1	Very high	97.1	Very high	66 Å²	66	39.6 Å²	39.6	43%	0.429	23%	0.229	S	C	.	.			trans	-62.8	155.9	177.6	-23.3	34.2	0	0	0	113	G402 T403	P400-G402 PolarHBondContact O-N 2.74Å; P400-T403 WeakPolarHBondContact O-CB 3.46Å; P400-T403 PolarHBondContact O-N 2.85Å; P400-T403 PolarHBondContact O-OG1 3.31Å
401	K	98	Very high	97	Very high	149 Å²	149	40.8 Å²	40.8	65%	0.648	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	136.2	167.9	177.3	176.5	178.3	-175.3	0	110.3	L389 D391 T403	L389-K401 WeakPolarHBondContact O-CD 3.4Å; L389-K401 VanDerWaalsContact O-CE 3.31Å; L389-K401 WeakPolarHBondContact O-CE 3.44Å; L389-K401 WeakPolarHBondContact O-CG 3.43Å; D391-K401 WeakPolarHBondContact OD1-CB 3.24Å; D391-K401 PolarHBondContact OD1-N 3.12Å; K401-T403 VanDerWaalsContact C-N 3.33Å
402	G	97.3	Very high	96.9	Very high	22 Å²	22	35.9 Å²	35.9	23%	0.227	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-12.4	178.5	0	0	0	0	0	114	R387 A388 P400 N404	R387-G402 PolarHBondContact NE-O 3.17Å; A388-G402 PolarHBondContact O-N 2.9Å; P400-G402 PolarHBondContact O-N 2.74Å; G402-N404 PolarHBondContact O-N 2.95Å
403	T	98.4	Very high	96.8	Very high	10 Å²	10	34.6 Å²	34.6	6%	0.061	19%	0.194	C	C	.	.			trans	-60.2	128.9	175	-61.6	0	0	0	0	111	L112 A388 V399 P400 K401	L112-T403 HydrophobicContact CD1-CG2 4.07Å; L112-T403 HydrophobicContact CG-CG2 3.78Å; A388-T403 PolarHBondContact N-O 3.36Å; V399-T403 HydrophobicContact CG1-CG2 4.13Å; P400-T403 WeakPolarHBondContact O-CB 3.46Å; P400-T403 PolarHBondContact O-N 2.85Å; P400-T403 PolarHBondContact O-OG1 3.31Å; K401-T403 VanDerWaalsContact C-N 3.33Å
404	N	98.7	Very high	96.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	149.6	174.8	-66.7	-30	0	0	0	109.4	E109 E110 T111 L112 F133 R387 G402	E109-N404 WeakPolarHBondContact CB-ND2 3.29Å; E109-N404 PolarHBondContact OE2-ND2 2.98Å; E110-N404 PolarHBondContact O-N 3.4Å; E110-N404 VanDerWaalsContact O-N 3.08Å; T111-N404 CarbonylContact C-O 3.54Å; T111-N404 VanDerWaalsContact CA-O 3.25Å; T111-N404 WeakPolarHBondContact CA-O 3.39Å; T111-N404 HydrophobicContact CG2-CB 3.87Å; T111-N404 WeakPolarHBondContact OG1-CB 3.37Å; L112-N404 PolarHBondContact N-O 3.46Å; F133-N404 HydrophobicContact CB-CB 4.5Å; F133-N404 WeakPolarHBondContact CB-OD1 3.21Å; F133-N404 HydrophobicContact CD1-CB 3.71Å; F133-N404 HydrophobicContact CD2-CB 3.91Å; F133-N404 VanDerWaalsContact CD2-CG 3.44Å; F133-N404 WeakPolarHBondContact CD2-ND2 3.4Å; F133-N404 HydrophobicContact CE1-CB 3.74Å; F133-N404 HydrophobicContact CE2-CB 3.94Å; F133-N404 HydrophobicContact CG-CB 3.79Å; F133-N404 VanDerWaalsContact CG-OD1 3.26Å; F133-N404 WeakPolarHBondContact CG-OD1 3.31Å; F133-N404 HydrophobicContact CZ-CB 3.85Å; R387-N404 PolarHBondContact NH1-OD1 2.89Å; G402-N404 PolarHBondContact O-N 2.95Å
405	I	98.8	Very high	95.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.7	-176.8	-58.4	175.3	0	0	0	109.4	L112 L114 V123 Y129 M385 R386 I394 V399 L407	L112-I405 HydrophobicContact CB-CG1 4.43Å; L112-I405 CarbonylContact O-C 3.52Å; L112-I405 VanDerWaalsContact O-CA 3.26Å; L112-I405 WeakPolarHBondContact O-CA 3.35Å; L114-I405 HydrophobicContact CD1-CG2 3.62Å; L114-I405 HydrophobicContact CG-CG2 4Å; V123-I405 HydrophobicContact CG1-CD1 4.47Å; V123-I405 HydrophobicContact CG2-CD1 4.17Å; Y129-I405 HydrophobicContact CD1-CD1 3.67Å; Y129-I405 HydrophobicContact CE1-CD1 3.53Å; M385-I405 CarbonylContact C-O 3.55Å; M385-I405 WeakPolarHBondContact CA-O 3.29Å; R386-I405 HydrophobicContact CB-CB 4.1Å; R386-I405 PolarHBondContact N-O 2.98Å; R386-I405 PolarHBondContact O-N 2.61Å; I394-I405 HydrophobicContact CD1-CD1 4.4Å; V399-I405 HydrophobicContact CG1-CD1 4.36Å; I405-L407 HydrophobicContact CG2-CD2 3.59Å; I405-L407 HydrophobicContact CG2-CG 4.22Å
406	I	98.8	Very high	94.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.2	169.2	-61.6	174	0	0	0	107.4	F82 I87 I106 T111 L112 I113 L114 F133 F383 M385	F82-I406 HydrophobicContact CE1-CD1 4Å; F82-I406 HydrophobicContact CZ-CD1 4.34Å; I87-I406 HydrophobicContact CG2-CD1 3.97Å; I106-I406 HydrophobicContact CD1-CD1 3.94Å; T111-I406 HydrophobicContact CG2-CD1 4.06Å; T111-I406 HydrophobicContact CG2-CG1 4Å; L112-I406 PolarHBondContact O-N 3.27Å; I113-I406 CarbonylContact C-O 3.42Å; I113-I406 WeakPolarHBondContact CA-O 3.32Å; I113-I406 HydrophobicContact CG2-CB 4.31Å; I113-I406 HydrophobicContact CG2-CG2 4.32Å; L114-I406 PolarHBondContact N-O 2.86Å; F133-I406 HydrophobicContact CE1-CG1 4.28Å; F133-I406 HydrophobicContact CZ-CD1 4.39Å; F133-I406 HydrophobicContact CZ-CG1 4.01Å; F383-I406 HydrophobicContact CB-CG2 3.87Å; F383-I406 HydrophobicContact CD2-CG2 3.87Å; F383-I406 HydrophobicContact CG-CG2 3.97Å; M385-I406 HydrophobicContact CG-CG1 4.49Å
407	L	98.6	Very high	94.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	98.7	175.4	-55.9	179.6	0	0	0	108.5	L114 V120 V123 L124 F383 S384 R386 I405 T409	L114-L407 HydrophobicContact CB-CD2 4.08Å; L114-L407 HydrophobicContact CD1-CD2 3.9Å; L114-L407 HydrophobicContact CG-CD2 4.37Å; L114-L407 CarbonylContact O-C 3.37Å; L114-L407 WeakPolarHBondContact O-CA 3.47Å; V120-L407 HydrophobicContact CG1-CB 4.38Å; V120-L407 HydrophobicContact CG1-CD1 4.45Å; V120-L407 HydrophobicContact CG2-CD2 4.29Å; V123-L407 HydrophobicContact CB-CD1 4.29Å; V123-L407 HydrophobicContact CB-CD2 3.95Å; V123-L407 HydrophobicContact CG1-CD1 3.89Å; V123-L407 HydrophobicContact CG1-CD2 3.95Å; V123-L407 HydrophobicContact CG1-CG 4.34Å; V123-L407 HydrophobicContact CG2-CD2 4.19Å; L124-L407 HydrophobicContact CD1-CD1 4.24Å; L124-L407 HydrophobicContact CD2-CD1 3.48Å; L124-L407 VanDerWaalsContact CD2-CD1 3.48Å; L124-L407 HydrophobicContact CG-CD1 3.6Å; F383-L407 CarbonylContact C-O 3.55Å; F383-L407 WeakPolarHBondContact CA-O 3.39Å; F383-L407 VanDerWaalsContact CB-O 3.25Å; F383-L407 WeakPolarHBondContact CB-O 3.41Å; S384-L407 PolarHBondContact N-O 2.96Å; S384-L407 WeakPolarHBondContact O-CB 3.46Å; S384-L407 PolarHBondContact O-N 3.39Å; R386-L407 HydrophobicContact CG-CD1 3.91Å; R386-L407 HydrophobicContact CG-CG 4.28Å; I405-L407 HydrophobicContact CG2-CD2 3.59Å; I405-L407 HydrophobicContact CG2-CG 4.22Å; L407-T409 VanDerWaalsContact C-N 3.33Å; L407-T409 PolarHBondContact O-N 3.25Å
408	N	98.1	Very high	94.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	80.4	-179.8	-175.3	-8.1	0	0	0	110.2	N92 N95 I113 L114 R411 M412	N92-N408 PolarHBondContact OD1-ND2 3.26Å; N95-N408 PolarHBondContact OD1-ND2 2.88Å; N95-N408 VanDerWaalsContact OD1-ND2 3.09Å; I113-N408 HydrophobicContact CG2-CB 4.25Å; L114-N408 PolarHBondContact O-N 3.5Å; N408-R411 HydrophobicContact CB-CB 4.49Å; N408-R411 WeakPolarHBondContact OD1-CB 3.26Å; N408-R411 PolarHBondContact OD1-N 3.27Å; N408-R411 VanDerWaalsContact OD1-N 3.13Å; N408-M412 PolarHBondContact O-N 3.45Å; N408-M412 VanDerWaalsContact O-N 3.11Å
409	T	96.9	Very high	94.1	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	19%	0.194	C	C	.	.	H	α-helix	trans	-71.5	-32	-176.9	40.7	0	0	0	0	113.1	V120 D382 L407 R411 M412 H413	V120-T409 HydrophobicContact CG1-CG2 4.1Å; D382-T409 CarbonylContact O-C 3.48Å; D382-T409 PolarHBondContact O-N 3.48Å; D382-T409 PolarHBondContact O-OG1 2.71Å; L407-T409 VanDerWaalsContact C-N 3.33Å; L407-T409 PolarHBondContact O-N 3.25Å; T409-R411 VanDerWaalsContact C-N 3.33Å; T409-R411 PolarHBondContact O-N 3.13Å; T409-M412 HydrophobicContact CG2-CE 4.08Å; T409-M412 WeakPolarHBondContact O-CB 3.29Å; T409-M412 PolarHBondContact O-N 3.45Å; T409-H413 PolarHBondContact O-CD2 2.92Å; T409-H413 VanDerWaalsContact O-CD2 3.27Å; T409-H413 PolarHBondContact O-N 2.95Å; T409-H413 PolarHBondContact O-ND1 3.49Å
410	G	96.1	Very high	93.7	Very high	10 Å²	10	42 Å²	42	10%	0.103	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-41.2	176.2	0	0	0	0	0	111.6	D382	D382-G410 PolarHBondContact O-N 3.16Å
411	R	95.8	Very high	93.4	Very high	65 Å²	65	39.5 Å²	39.5	25%	0.245	19%	0.19	C	C	.	.	H	α-helix	trans	-67.6	-43.4	170.3	-175.7	174.9	177.7	81.4	2.2	112.3	D100 N408 T409 H413 R414	D100-R411 IonicContact OD1-NE 3.7Å; N408-R411 HydrophobicContact CB-CB 4.49Å; N408-R411 WeakPolarHBondContact OD1-CB 3.26Å; N408-R411 PolarHBondContact OD1-N 3.27Å; N408-R411 VanDerWaalsContact OD1-N 3.13Å; T409-R411 VanDerWaalsContact C-N 3.33Å; T409-R411 PolarHBondContact O-N 3.13Å; R411-H413 PolarHBondContact O-N 3.21Å; R411-R414 PolarHBondContact O-N 2.87Å
412	M	95.9	Very high	93.1	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-55.8	-37.7	178.1	-176.6	-169.8	72.5	0	0	112.3	S115 A117 V120 N408 T409 R414 T415 Q439	S115-M412 VanDerWaalsContact O-CA 3.32Å; S115-M412 WeakPolarHBondContact O-CA 3.4Å; S115-M412 WeakPolarHBondContact O-CB 3.08Å; S115-M412 WeakPolarHBondContact O-CG 3.42Å; A117-M412 HydrophobicContact CB-CG 4Å; A117-M412 HydrophobicContact CB-SD 4.08Å; V120-M412 HydrophobicContact CB-SD 3.63Å; V120-M412 HydrophobicContact CG1-CE 4.35Å; V120-M412 HydrophobicContact CG1-SD 3.61Å; V120-M412 HydrophobicContact CG2-SD 3.9Å; N408-M412 PolarHBondContact O-N 3.45Å; N408-M412 VanDerWaalsContact O-N 3.11Å; T409-M412 HydrophobicContact CG2-CE 4.08Å; T409-M412 WeakPolarHBondContact O-CB 3.29Å; T409-M412 PolarHBondContact O-N 3.45Å; M412-R414 PolarHBondContact O-N 2.82Å; M412-R414 VanDerWaalsContact O-N 3.14Å; M412-T415 PolarHBondContact O-N 3.14Å; M412-T415 PolarHBondContact O-OG1 3.23Å; M412-Q439 HydrophobicContact CE-CB 4.22Å; M412-Q439 HydrophobicContact CE-CG 4.43Å
413	H	95.2	Very high	92.9	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-2.3	179.5	-66.4	167	0	0	0	114.1	R376 T409 R411 F418 Y437 F438 Q439	R376-H413 HydrophobicContact CG-CB 3.72Å; R376-H413 PolarHBondContact NH1-O 3.5Å; T409-H413 PolarHBondContact O-CD2 2.92Å; T409-H413 VanDerWaalsContact O-CD2 3.27Å; T409-H413 PolarHBondContact O-N 2.95Å; T409-H413 PolarHBondContact O-ND1 3.49Å; R411-H413 PolarHBondContact O-N 3.21Å; H413-F418 WeakPolarHBondContact O-CD2 3.4Å; H413-Y437 PolarHBondContact CD2-O 3.4Å; H413-F438 AromaticContact CE1-CD2 3.9Å; H413-F438 AromaticContact ND1-CD2 3.98Å; H413-F438 AromaticContact NE2-CD2 3.95Å; H413-Q439 PolarHBondContact NE2-N 3.07Å; H413-Q439 VanDerWaalsContact NE2-N 3.19Å
414	R	91.3	Very high	92.8	Very high	75 Å²	75	43.6 Å²	43.6	28%	0.283	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	8.2	-178.9	-65.5	179.4	171.2	-97.1	4.3	114.6	F377 R411 M412 A421 D422	F377-R414 PolarHBondContact O-NH2 3.15Å; R411-R414 PolarHBondContact O-N 2.87Å; M412-R414 PolarHBondContact O-N 2.82Å; M412-R414 VanDerWaalsContact O-N 3.14Å; R414-A421 WeakPolarHBondContact O-CB 3.39Å; R414-D422 IonicContact NH1-OD1 3.92Å
415	T	80.8	Confident	92.6	Very high	61 Å²	61	44.4 Å²	44.4	37%	0.374	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-59.6	-170.9	54.9	0	0	0	0	115.7	M412	M412-T415 PolarHBondContact O-N 3.14Å; M412-T415 PolarHBondContact O-OG1 3.23Å
416	E	76.6	Confident	92.5	Very high	82 Å²	82	45.4 Å²	45.4	38%	0.383	22%	0.219	S	C	.	.	S	Bend	trans	-102.7	-20.4	-158.1	-73.3	176.7	-144.2	0	0	116.4	R116 A117 Y437	R116-E416 WeakPolarHBondContact CA-OE1 3.3Å; R116-E416 WeakPolarHBondContact CG-OE1 3.29Å; A117-E416 VanDerWaalsContact CB-OE2 3.31Å; A117-E416 WeakPolarHBondContact CB-OE2 3.39Å; A117-E416 PolarHBondContact N-OE1 3.39Å; E416-Y437 HydrophobicContact CB-CD1 4.32Å; E416-Y437 HydrophobicContact CB-CE1 4.25Å
417	F	88.8	Confident	92.2	Very high	76 Å²	76	50.2 Å²	50.2	33%	0.333	24%	0.242	S	C	.	.	S	Bend	trans	-123.8	-40.5	-169.2	-178.7	-97.1	0	0	0	115.5	T433 P434 Y437	F417-T433 HydrophobicContact CD1-CG2 3.82Å; F417-T433 HydrophobicContact CE1-CG2 3.55Å; F417-T433 HydrophobicContact CZ-CG2 4.31Å; F417-P434 HydrophobicContact CE2-CG 3.9Å; F417-P434 HydrophobicContact CZ-CG 4.28Å; F417-Y437 HydrophobicContact CB-CD1 3.91Å; F417-Y437 HydrophobicContact CB-CD2 4.12Å; F417-Y437 HydrophobicContact CB-CG 3.6Å; F417-Y437 AromaticContact CD2-CD2 3.5Å; F417-Y437 HydrophobicContact CD2-CD2 3.5Å; F417-Y437 VanDerWaalsContact CD2-CD2 3.5Å; F417-Y437 HydrophobicContact CD2-CE2 4.04Å; F417-Y437 AromaticContact CD2-CG 3.91Å; F417-Y437 HydrophobicContact CD2-CG 3.91Å; F417-Y437 HydrophobicContact CE2-CD2 4.2Å; F417-Y437 AromaticContact CG-CD2 3.94Å; F417-Y437 HydrophobicContact CG-CD2 3.94Å; F417-Y437 AromaticContact CG-CG 3.87Å; F417-Y437 HydrophobicContact CG-CG 3.87Å
418	F	91.2	Very high	92	Very high	14 Å²	14	50.8 Å²	50.8	6%	0.061	25%	0.245	C	C	.	.			trans	-81.3	128.2	-171.7	-65.2	-76.8	0	0	0	110.9	R376 H413 A421 N428 F429 T433 F438	R376-F418 VanDerWaalsContact CD-CE2 3.41Å; R376-F418 HydrophobicContact CG-CD2 4.17Å; R376-F418 HydrophobicContact CG-CE1 4.48Å; R376-F418 HydrophobicContact CG-CE2 3.75Å; R376-F418 HydrophobicContact CG-CZ 3.89Å; H413-F418 WeakPolarHBondContact O-CD2 3.4Å; F418-A421 HydrophobicContact CB-CB 4.34Å; F418-N428 HydrophobicContact CD1-CB 3.65Å; F418-N428 HydrophobicContact CE1-CB 4.21Å; F418-N428 WeakPolarHBondContact CE1-O 3.31Å; F418-F429 HydrophobicContact CE1-CD2 4.42Å; F418-F429 HydrophobicContact CE1-CE1 4.07Å; F418-F429 AromaticContact CE1-CE2 3.83Å; F418-F429 HydrophobicContact CE1-CE2 3.83Å; F418-F429 AromaticContact CE1-CZ 3.65Å; F418-F429 HydrophobicContact CE1-CZ 3.65Å; F418-F429 HydrophobicContact CZ-CE1 4.21Å; F418-F429 HydrophobicContact CZ-CE2 4.23Å; F418-F429 AromaticContact CZ-CZ 3.69Å; F418-F429 HydrophobicContact CZ-CZ 3.69Å; F418-T433 HydrophobicContact CE1-CG2 4.13Å; F418-T433 HydrophobicContact CZ-CG2 3.9Å; F418-F438 HydrophobicContact CE2-CB 4.39Å; F418-F438 HydrophobicContact CE2-CD2 4.4Å; F418-F438 HydrophobicContact CZ-CB 3.93Å; F418-F438 HydrophobicContact CZ-CD2 4.03Å; F418-F438 HydrophobicContact CZ-CG 4.12Å
419	H	86.3	Confident	91.8	Very high	179 Å²	179	51.9 Å²	51.9	83%	0.829	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-44.9	-177.6	-179.2	-73.2	0	0	0	111.5
420	K	90.1	Very high	91.3	Very high	56 Å²	56	58.8 Å²	58.8	24%	0.243	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	60	176.8	-70.2	-179.8	172.6	170.7	0	109.1	D422 E423 E427 N428	K420-D422 VanDerWaalsContact C-N 3.3Å; K420-D422 PolarHBondContact O-N 3.33Å; K420-E423 HydrophobicContact CB-CB 4.25Å; K420-E423 PolarHBondContact O-N 2.86Å; K420-E427 WeakPolarHBondContact CE-OE2 3.22Å; K420-E427 VanDerWaalsContact NZ-CD 3.32Å; K420-E427 IonicContact NZ-OE1 2.65Å; K420-E427 PolarHBondContact NZ-OE1 3.44Å; K420-E427 IonicContact NZ-OE2 2.6Å; K420-E427 PolarHBondContact NZ-OE2 2.82Å; K420-N428 PolarHBondContact N-OD1 3.27Å; K420-N428 VanDerWaalsContact N-OD1 3.16Å; K420-N428 PolarHBondContact O-ND2 3.27Å
421	A	90.7	Very high	90.7	Very high	14 Å²	14	66.8 Å²	66.8	12%	0.116	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.9	-172.1	0	0	0	0	0	113.7	R376 R414 F418	R376-A421 PolarHBondContact NH1-O 3.13Å; R376-A421 PolarHBondContact NH2-O 3.46Å; R414-A421 WeakPolarHBondContact O-CB 3.39Å; F418-A421 HydrophobicContact CB-CB 4.34Å
422	D	91.4	Very high	90.2	Very high	121 Å²	121	71.6 Å²	71.6	65%	0.647	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	0.5	-177.4	-67.9	-43.4	0	0	0	114.2	F377 R414 K420	F377-D422 WeakPolarHBondContact CE2-O 3.2Å; R414-D422 IonicContact NH1-OD1 3.92Å; K420-D422 VanDerWaalsContact C-N 3.3Å; K420-D422 PolarHBondContact O-N 3.33Å
423	E	93.5	Very high	89.8	Confident	115 Å²	115	72.9 Å²	72.9	54%	0.537	35%	0.352	S	S	.	.	S	Bend	trans	-113.2	150.8	176.4	-59.5	171.3	-163.5	0	0	110	R376 K420 S425	R376-E423 PolarHBondContact NH2-O 3.02Å; K420-E423 HydrophobicContact CB-CB 4.25Å; K420-E423 PolarHBondContact O-N 2.86Å; E423-S425 PolarHBondContact O-N 2.8Å
424	F	95.8	Very high	89.6	Confident	32 Å²	32	75.4 Å²	75.4	14%	0.14	37%	0.369	C	S	.	.			trans	-82.3	109.9	168.6	-176.7	-85.6	0	0	0	109.1	L332 T336 F370 E373 C374 F377	L332-F424 HydrophobicContact CB-CE2 4.25Å; L332-F424 HydrophobicContact CB-CZ 4.38Å; L332-F424 HydrophobicContact CD1-CD2 4.11Å; L332-F424 HydrophobicContact CD1-CE2 3.86Å; L332-F424 HydrophobicContact CD2-CD2 3.89Å; L332-F424 HydrophobicContact CD2-CE2 4.27Å; L332-F424 HydrophobicContact CD2-CG 4.27Å; L332-F424 HydrophobicContact CG-CD2 4.46Å; L332-F424 HydrophobicContact CG-CE2 4.37Å; T336-F424 HydrophobicContact CG2-CD1 3.68Å; T336-F424 HydrophobicContact CG2-CE1 3.97Å; F370-F424 HydrophobicContact CD2-CE1 4.43Å; F370-F424 AromaticContact CD2-CZ 3.83Å; F370-F424 HydrophobicContact CD2-CZ 3.83Å; F370-F424 HydrophobicContact CE2-CE1 4.42Å; F370-F424 AromaticContact CE2-CZ 3.77Å; F370-F424 HydrophobicContact CE2-CZ 3.77Å; E373-F424 HydrophobicContact CB-CE2 4.2Å; E373-F424 HydrophobicContact CB-CZ 4.39Å; E373-F424 HydrophobicContact CG-CD1 4.49Å; E373-F424 HydrophobicContact CG-CD2 3.8Å; E373-F424 HydrophobicContact CG-CE1 4.41Å; E373-F424 HydrophobicContact CG-CE2 3.66Å; E373-F424 HydrophobicContact CG-CG 4.23Å; E373-F424 HydrophobicContact CG-CZ 3.99Å; C374-F424 HydrophobicContact CB-CE2 4.44Å; C374-F424 VanDerWaalsContact SG-CE2 3.51Å; F377-F424 HydrophobicContact CB-CD2 3.88Å; F377-F424 HydrophobicContact CD1-CB 4.09Å; F377-F424 AromaticContact CD1-CD2 3.89Å; F377-F424 HydrophobicContact CD1-CD2 3.89Å; F377-F424 HydrophobicContact CD1-CG 4.48Å; F377-F424 HydrophobicContact CD2-CB 4.18Å; F377-F424 HydrophobicContact CE1-CB 4.15Å; F377-F424 HydrophobicContact CE2-CB 4.24Å; F377-F424 HydrophobicContact CG-CB 4.11Å; F377-F424 AromaticContact CG-CD2 3.93Å; F377-F424 HydrophobicContact CG-CD2 3.93Å; F377-F424 HydrophobicContact CZ-CB 4.23Å
425	S	94.8	Very high	89.5	Confident	16 Å²	16	81.9 Å²	81.9	11%	0.112	39%	0.393	C	S	.	.			trans	-151.7	128.9	-178.7	-174.8	0	0	0	0	112.4	E373 E423 E427 N428	E373-S425 PolarHBondContact OE1-N 2.82Å; E423-S425 PolarHBondContact O-N 2.8Å; S425-E427 PolarHBondContact O-N 2.99Å; S425-E427 VanDerWaalsContact O-N 3.13Å; S425-E427 WeakPolarHBondContact OG-CB 3.23Å; S425-E427 PolarHBondContact OG-N 3.03Å; S425-N428 VanDerWaalsContact O-CB 3.3Å; S425-N428 WeakPolarHBondContact O-CB 3.28Å; S425-N428 PolarHBondContact O-N 2.82Å; S425-N428 VanDerWaalsContact O-N 3.14Å; S425-N428 PolarHBondContact O-ND2 3.32Å
426	L	95.7	Very high	90	Very high	21 Å²	21	83.7 Å²	83.7	11%	0.11	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-64.4	-16.5	175.2	-57.3	-165.2	0	0	0	113.2	V339 V366 F370 E373 N428 F429 Q430	V339-L426 HydrophobicContact CB-CD1 4.49Å; V339-L426 HydrophobicContact CG1-CD1 3.77Å; V339-L426 HydrophobicContact CG1-CD2 4.48Å; V339-L426 HydrophobicContact CG1-CG 4.28Å; V339-L426 HydrophobicContact CG2-CD1 4.04Å; V339-L426 HydrophobicContact CG2-CG 3.97Å; V366-L426 HydrophobicContact CG1-CD1 4.01Å; F370-L426 HydrophobicContact CB-CD2 4.11Å; E373-L426 HydrophobicContact CB-CD2 3.94Å; E373-L426 HydrophobicContact CG-CD2 4.3Å; L426-N428 PolarHBondContact O-N 2.92Å; L426-F429 PolarHBondContact O-N 2.77Å; L426-Q430 PolarHBondContact O-N 3.49Å
427	E	93.3	Very high	90.9	Very high	102 Å²	102	82.1 Å²	82.1	48%	0.477	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-57.5	-28.4	173.4	-68.3	176.6	-164.2	0	0	112.5	K420 S425 F429 Q430	K420-E427 WeakPolarHBondContact CE-OE2 3.22Å; K420-E427 VanDerWaalsContact NZ-CD 3.32Å; K420-E427 IonicContact NZ-OE1 2.65Å; K420-E427 PolarHBondContact NZ-OE1 3.44Å; K420-E427 IonicContact NZ-OE2 2.6Å; K420-E427 PolarHBondContact NZ-OE2 2.82Å; S425-E427 PolarHBondContact O-N 2.99Å; S425-E427 VanDerWaalsContact O-N 3.13Å; S425-E427 WeakPolarHBondContact OG-CB 3.23Å; S425-E427 PolarHBondContact OG-N 3.03Å; E427-F429 PolarHBondContact O-N 3.26Å; E427-F429 VanDerWaalsContact O-N 3.12Å; E427-Q430 PolarHBondContact O-N 3.05Å
428	N	94.1	Very high	91.2	Very high	11 Å²	11	79.6 Å²	79.6	6%	0.059	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-60	-20.4	175	-75.8	-37.7	0	0	0	113.1	E373 R376 F418 K420 S425 L426	E373-N428 PolarHBondContact OE1-ND2 3.15Å; E373-N428 WeakPolarHBondContact OE2-CB 3.41Å; R376-N428 PolarHBondContact NH2-ND2 3.14Å; F418-N428 HydrophobicContact CD1-CB 3.65Å; F418-N428 HydrophobicContact CE1-CB 4.21Å; F418-N428 WeakPolarHBondContact CE1-O 3.31Å; K420-N428 PolarHBondContact N-OD1 3.27Å; K420-N428 VanDerWaalsContact N-OD1 3.16Å; K420-N428 PolarHBondContact O-ND2 3.27Å; S425-N428 VanDerWaalsContact O-CB 3.3Å; S425-N428 WeakPolarHBondContact O-CB 3.28Å; S425-N428 PolarHBondContact O-N 2.82Å; S425-N428 VanDerWaalsContact O-N 3.14Å; S425-N428 PolarHBondContact O-ND2 3.32Å; L426-N428 PolarHBondContact O-N 2.92Å
429	F	94.1	Very high	91.4	Very high	24 Å²	24	79.2 Å²	79.2	11%	0.105	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-120	10.4	-179.2	-73.3	-83.7	0	0	0	114.3	N372 E373 R376 F418 L426 E427 K431 F438	N372-F429 HydrophobicContact CB-CD1 3.9Å; N372-F429 HydrophobicContact CB-CD2 4.24Å; N372-F429 HydrophobicContact CB-CE1 3.68Å; N372-F429 HydrophobicContact CB-CE2 4.03Å; N372-F429 HydrophobicContact CB-CG 4.17Å; N372-F429 HydrophobicContact CB-CZ 3.74Å; E373-F429 HydrophobicContact CB-CD2 4.01Å; E373-F429 HydrophobicContact CB-CE2 4.14Å; E373-F429 WeakPolarHBondContact OE2-CD2 3.45Å; E373-F429 WeakPolarHBondContact OE2-CE2 3.34Å; R376-F429 HydrophobicContact CB-CE2 4.07Å; R376-F429 HydrophobicContact CB-CZ 4.19Å; R376-F429 HydrophobicContact CG-CE2 4.47Å; F418-F429 HydrophobicContact CE1-CD2 4.42Å; F418-F429 HydrophobicContact CE1-CE1 4.07Å; F418-F429 AromaticContact CE1-CE2 3.83Å; F418-F429 HydrophobicContact CE1-CE2 3.83Å; F418-F429 AromaticContact CE1-CZ 3.65Å; F418-F429 HydrophobicContact CE1-CZ 3.65Å; F418-F429 HydrophobicContact CZ-CE1 4.21Å; F418-F429 HydrophobicContact CZ-CE2 4.23Å; F418-F429 AromaticContact CZ-CZ 3.69Å; F418-F429 HydrophobicContact CZ-CZ 3.69Å; L426-F429 PolarHBondContact O-N 2.77Å; E427-F429 PolarHBondContact O-N 3.26Å; E427-F429 VanDerWaalsContact O-N 3.12Å; F429-K431 PolarHBondContact O-N 3.49Å; F429-F438 AromaticContact CE1-CD1 3.64Å; F429-F438 HydrophobicContact CE1-CD1 3.64Å; F429-F438 AromaticContact CE1-CE1 3.67Å; F429-F438 HydrophobicContact CE1-CE1 3.67Å; F429-F438 HydrophobicContact CE1-CG 4.08Å; F429-F438 HydrophobicContact CE1-CZ 4.16Å; F429-F438 AromaticContact CZ-CD1 3.89Å; F429-F438 HydrophobicContact CZ-CD1 3.89Å; F429-F438 HydrophobicContact CZ-CD2 4.02Å; F429-F438 AromaticContact CZ-CE1 3.73Å; F429-F438 HydrophobicContact CZ-CE1 3.73Å; F429-F438 AromaticContact CZ-CE2 3.89Å; F429-F438 HydrophobicContact CZ-CE2 3.89Å; F429-F438 HydrophobicContact CZ-CG 4.02Å; F429-F438 AromaticContact CZ-CZ 3.72Å; F429-F438 HydrophobicContact CZ-CZ 3.72Å
430	Q	85.3	Confident	91.9	Very high	155 Å²	155	72.2 Å²	72.2	72%	0.724	34%	0.342	S	S	*	.	S	Bend	trans	-65.4	-28.6	173.2	-80.3	179.1	1	0	0	113.1	L426 E427	L426-Q430 PolarHBondContact O-N 3.49Å; E427-Q430 PolarHBondContact O-N 3.05Å
431	K	83.7	Confident	92.2	Very high	178 Å²	178	71.8 Å²	71.8	77%	0.774	34%	0.34	S	S	*	.	S	Bend	trans	-104.2	151.5	175.7	-65.6	179.5	-176.7	173.7	0	109.6	F429 T433	F429-K431 PolarHBondContact O-N 3.49Å; K431-T433 PolarHBondContact O-N 2.84Å
432	N	85.5	Confident	92.4	Very high	166 Å²	166	72.3 Å²	72.3	89%	0.888	35%	0.346	S	S	*	.			trans	-58.3	108	174.2	-84.6	-23.8	0	0	0	111.2	P434	N432-P434 WeakPolarHBondContact O-CD 3.46Å
433	T	88.4	Confident	92.6	Very high	31 Å²	31	67.6 Å²	67.6	19%	0.19	32%	0.323	C	S	.	.			trans	-75.7	119.7	177.7	-60.4	0	0	0	0	110.6	F417 F418 K431 R435 F438	F417-T433 HydrophobicContact CD1-CG2 3.82Å; F417-T433 HydrophobicContact CE1-CG2 3.55Å; F417-T433 HydrophobicContact CZ-CG2 4.31Å; F418-T433 HydrophobicContact CE1-CG2 4.13Å; F418-T433 HydrophobicContact CZ-CG2 3.9Å; K431-T433 PolarHBondContact O-N 2.84Å; T433-R435 PolarHBondContact O-N 2.9Å; T433-F438 HydrophobicContact CG2-CB 3.49Å; T433-F438 VanDerWaalsContact CG2-CB 3.49Å; T433-F438 HydrophobicContact CG2-CG 4.42Å
434	P	91.3	Very high	92.6	Very high	55 Å²	55	63.9 Å²	63.9	36%	0.357	32%	0.316	S	S	.	.			trans	-62.7	134.2	176.6	-20.3	31.9	0	0	0	111	F417 N432 R436 Y437	F417-P434 HydrophobicContact CE2-CG 3.9Å; F417-P434 HydrophobicContact CZ-CG 4.28Å; N432-P434 WeakPolarHBondContact O-CD 3.46Å; P434-R436 HydrophobicContact CB-CG 4.21Å; P434-R436 PolarHBondContact O-N 2.88Å; P434-Y437 HydrophobicContact CB-CD2 3.91Å; P434-Y437 HydrophobicContact CB-CE2 4.41Å; P434-Y437 HydrophobicContact CG-CD2 4Å; P434-Y437 HydrophobicContact CG-CE2 4.4Å; P434-Y437 PolarHBondContact O-N 3.32Å
435	R	87.8	Confident	92.6	Very high	211 Å²	211	65 Å²	65	80%	0.796	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-12.6	-179.3	-66.1	-174.2	178.7	-170.5	0.6	115.6	T433 Q439	T433-R435 PolarHBondContact O-N 2.9Å; R435-Q439 WeakPolarHBondContact O-CG 3.3Å; R435-Q439 PolarHBondContact O-NE2 2.91Å
436	R	92.5	Very high	92.7	Very high	99 Å²	99	64.5 Å²	64.5	37%	0.374	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-21.4	175.5	65.2	177	-72.9	-165.4	-3.4	112.8	N121 P434	N121-R436 HydrophobicContact CB-CB 4.2Å; P434-R436 HydrophobicContact CB-CG 4.21Å; P434-R436 PolarHBondContact O-N 2.88Å
437	Y	94.1	Very high	92.7	Very high	49 Å²	49	64.2 Å²	64.2	19%	0.192	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-19.3	-176.5	-63.2	-65.3	0	0	0	113.2	A117 H413 E416 F417 P434	A117-Y437 HydrophobicContact CB-CD1 3.63Å; A117-Y437 HydrophobicContact CB-CE1 3.89Å; H413-Y437 PolarHBondContact CD2-O 3.4Å; E416-Y437 HydrophobicContact CB-CD1 4.32Å; E416-Y437 HydrophobicContact CB-CE1 4.25Å; F417-Y437 HydrophobicContact CB-CD1 3.91Å; F417-Y437 HydrophobicContact CB-CD2 4.12Å; F417-Y437 HydrophobicContact CB-CG 3.6Å; F417-Y437 AromaticContact CD2-CD2 3.5Å; F417-Y437 HydrophobicContact CD2-CD2 3.5Å; F417-Y437 VanDerWaalsContact CD2-CD2 3.5Å; F417-Y437 HydrophobicContact CD2-CE2 4.04Å; F417-Y437 AromaticContact CD2-CG 3.91Å; F417-Y437 HydrophobicContact CD2-CG 3.91Å; F417-Y437 HydrophobicContact CE2-CD2 4.2Å; F417-Y437 AromaticContact CG-CD2 3.94Å; F417-Y437 HydrophobicContact CG-CD2 3.94Å; F417-Y437 AromaticContact CG-CG 3.87Å; F417-Y437 HydrophobicContact CG-CG 3.87Å; P434-Y437 HydrophobicContact CB-CD2 3.91Å; P434-Y437 HydrophobicContact CB-CE2 4.41Å; P434-Y437 HydrophobicContact CG-CD2 4Å; P434-Y437 HydrophobicContact CG-CE2 4.4Å; P434-Y437 PolarHBondContact O-N 3.32Å
438	F	95.9	Very high	92.9	Very high	23 Å²	23	62 Å²	62	10%	0.101	32%	0.316	C	S	.	.			trans	-132.1	117.7	175.1	-176	-120.7	0	0	0	110.8	N372 L375 R376 H413 F418 F429 T433 P440	N372-F438 HydrophobicContact CB-CE1 3.92Å; N372-F438 HydrophobicContact CB-CZ 4.05Å; N372-F438 VanDerWaalsContact O-CZ 3.3Å; N372-F438 WeakPolarHBondContact O-CZ 3.04Å; L375-F438 HydrophobicContact CB-CZ 4.37Å; R376-F438 HydrophobicContact CB-CD2 4.26Å; R376-F438 HydrophobicContact CB-CE2 3.66Å; R376-F438 HydrophobicContact CB-CZ 4.43Å; R376-F438 HydrophobicContact CG-CD2 4.3Å; R376-F438 HydrophobicContact CG-CE2 4.2Å; H413-F438 AromaticContact CE1-CD2 3.9Å; H413-F438 AromaticContact ND1-CD2 3.98Å; H413-F438 AromaticContact NE2-CD2 3.95Å; F418-F438 HydrophobicContact CE2-CB 4.39Å; F418-F438 HydrophobicContact CE2-CD2 4.4Å; F418-F438 HydrophobicContact CZ-CB 3.93Å; F418-F438 HydrophobicContact CZ-CD2 4.03Å; F418-F438 HydrophobicContact CZ-CG 4.12Å; F429-F438 AromaticContact CE1-CD1 3.64Å; F429-F438 HydrophobicContact CE1-CD1 3.64Å; F429-F438 AromaticContact CE1-CE1 3.67Å; F429-F438 HydrophobicContact CE1-CE1 3.67Å; F429-F438 HydrophobicContact CE1-CG 4.08Å; F429-F438 HydrophobicContact CE1-CZ 4.16Å; F429-F438 AromaticContact CZ-CD1 3.89Å; F429-F438 HydrophobicContact CZ-CD1 3.89Å; F429-F438 HydrophobicContact CZ-CD2 4.02Å; F429-F438 AromaticContact CZ-CE1 3.73Å; F429-F438 HydrophobicContact CZ-CE1 3.73Å; F429-F438 AromaticContact CZ-CE2 3.89Å; F429-F438 HydrophobicContact CZ-CE2 3.89Å; F429-F438 HydrophobicContact CZ-CG 4.02Å; F429-F438 AromaticContact CZ-CZ 3.72Å; F429-F438 HydrophobicContact CZ-CZ 3.72Å; T433-F438 HydrophobicContact CG2-CB 3.49Å; T433-F438 VanDerWaalsContact CG2-CB 3.49Å; T433-F438 HydrophobicContact CG2-CG 4.42Å; F438-P440 HydrophobicContact CD1-CG 4.25Å; F438-P440 HydrophobicContact CE1-CG 3.6Å; F438-P440 HydrophobicContact CE2-CB 4.15Å; F438-P440 HydrophobicContact CE2-CG 3.98Å; F438-P440 HydrophobicContact CZ-CB 3.95Å; F438-P440 HydrophobicContact CZ-CG 3.45Å; F438-P440 VanDerWaalsContact CZ-CG 3.45Å
439	Q	95.4	Very high	93.1	Very high	6 Å²	6	62.6 Å²	62.6	3%	0.028	32%	0.321	C	S	.	.			trans	-143.9	55	-170.5	-64.4	179.8	-28.6	0	0	111.8	M412 H413 R435 F441 G442 S443	M412-Q439 HydrophobicContact CE-CB 4.22Å; M412-Q439 HydrophobicContact CE-CG 4.43Å; H413-Q439 PolarHBondContact NE2-N 3.07Å; H413-Q439 VanDerWaalsContact NE2-N 3.19Å; R435-Q439 WeakPolarHBondContact O-CG 3.3Å; R435-Q439 PolarHBondContact O-NE2 2.91Å; Q439-F441 PolarHBondContact O-N 3.37Å; Q439-F441 VanDerWaalsContact O-N 3.14Å; Q439-G442 PolarHBondContact O-N 3.25Å; Q439-S443 PolarHBondContact NE2-OG 3.08Å
440	P	96.1	Very high	93.1	Very high	31 Å²	31	62.2 Å²	62.2	20%	0.201	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.1	-176	29	-38	0	0	0	112.6	L375 F438	L375-P440 HydrophobicContact CB-CB 3.99Å; L375-P440 HydrophobicContact CD1-CB 4.15Å; L375-P440 HydrophobicContact CD1-CG 4.48Å; F438-P440 HydrophobicContact CD1-CG 4.25Å; F438-P440 HydrophobicContact CE1-CG 3.6Å; F438-P440 HydrophobicContact CE2-CB 4.15Å; F438-P440 HydrophobicContact CE2-CG 3.98Å; F438-P440 HydrophobicContact CZ-CB 3.95Å; F438-P440 HydrophobicContact CZ-CG 3.45Å; F438-P440 VanDerWaalsContact CZ-CG 3.45Å
441	F	97.2	Very high	93.6	Very high	48 Å²	48	57.9 Å²	57.9	21%	0.211	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	11.2	178.3	-62.7	-66.6	0	0	0	113.1	L375 Q439 C448 K451 A454 M455 M458	L375-F441 HydrophobicContact CD1-CE2 4.02Å; L375-F441 HydrophobicContact CD1-CZ 3.86Å; Q439-F441 PolarHBondContact O-N 3.37Å; Q439-F441 VanDerWaalsContact O-N 3.14Å; F441-C448 HydrophobicContact CB-CB 3.92Å; F441-C448 HydrophobicContact CD1-CB 4.19Å; F441-C448 WeakPolarHBondContact O-CB 3.42Å; F441-C448 PolarHBondContact O-N 3.36Å; F441-K451 HydrophobicContact CB-CB 3.68Å; F441-K451 HydrophobicContact CD1-CB 4.07Å; F441-K451 HydrophobicContact CD2-CB 4.06Å; F441-K451 HydrophobicContact CG-CB 3.66Å; F441-A454 HydrophobicContact CE1-CB 4.08Å; F441-A454 HydrophobicContact CZ-CB 4.27Å; F441-M455 HydrophobicContact CE2-CG 4.1Å; F441-M455 HydrophobicContact CE2-SD 3.92Å; F441-M455 HydrophobicContact CZ-CG 4.44Å; F441-M455 HydrophobicContact CZ-SD 4.2Å; F441-M458 HydrophobicContact CZ-CE 3.98Å
442	G	95.4	Very high	94.1	Very high	24 Å²	24	54.2 Å²	54.2	25%	0.247	29%	0.287	C	S	.	.			trans	64.1	-170.8	-168.1	0	0	0	0	0	113.4	Q439	Q439-G442 PolarHBondContact O-N 3.25Å
443	S	94.6	Very high	94.5	Very high	23 Å²	23	46.6 Å²	46.6	16%	0.161	25%	0.246	C	C	.	.			trans	-146.3	173.4	177.2	68.6	0	0	0	0	112	L124 Q439	L124-S443 VanDerWaalsContact CB-OG 3.29Å; L124-S443 WeakPolarHBondContact CB-OG 3.3Å; Q439-S443 PolarHBondContact NE2-OG 3.08Å
444	G	94.9	Very high	94.8	Very high	37 Å²	37	45.9 Å²	45.9	38%	0.381	24%	0.244	S	C	.	.	S	Bend	trans	71.7	-160.8	176.1	0	0	0	0	0	115.2	L124 R446 S447	L124-G444 WeakPolarHBondContact O-CA 3.43Å; G444-R446 PolarHBondContact O-N 3.01Å; G444-R446 VanDerWaalsContact O-N 3.13Å; G444-S447 PolarHBondContact O-N 3.07Å
445	P	95.1	Very high	95.1	Very high	55 Å²	55	44.8 Å²	44.8	36%	0.357	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28	-166.2	19.3	-32.7	0	0	0	114.9	T130 W158 R162	T130-P445 HydrophobicContact CG2-CB 3.75Å; T130-P445 HydrophobicContact CG2-CG 3.37Å; W158-P445 WeakPolarHBondContact CH2-O 3.25Å; R162-P445 PolarHBondContact NE-O 2.81Å; R162-P445 PolarHBondContact NH2-O 3.38Å
446	R	96.6	Very high	95.4	Very high	6 Å²	6	35.4 Å²	35.4	2%	0.023	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120	38.2	-179	-173	162.9	-170	151.4	5.9	111.1	T130 I149 I150 N152 W158 R386 G444	T130-R446 WeakPolarHBondContact O-CD 3.42Å; T130-R446 PolarHBondContact O-NH1 2.87Å; I149-R446 PolarHBondContact O-NH2 3.34Å; I149-R446 VanDerWaalsContact O-NH2 3.11Å; I150-R446 PolarHBondContact O-NH2 2.85Å; N152-R446 PolarHBondContact O-NH1 3.43Å; N152-R446 PolarHBondContact O-NH2 3.15Å; W158-R446 HydrophobicContact CH2-CB 3.78Å; W158-R446 HydrophobicContact CH2-CG 4.2Å; W158-R446 HydrophobicContact CZ2-CB 3.47Å; W158-R446 VanDerWaalsContact CZ2-CB 3.47Å; W158-R446 HydrophobicContact CZ2-CG 3.44Å; W158-R446 VanDerWaalsContact CZ2-CG 3.44Å; R386-R446 PolarHBondContact NH2-O 3.08Å; G444-R446 PolarHBondContact O-N 3.01Å; G444-R446 VanDerWaalsContact O-N 3.13Å
447	S	96.5	Very high	95.7	Very high	14 Å²	14	31 Å²	31	10%	0.098	18%	0.184	C	C	.	.	S	Bend	trans	-64.4	166.5	167.3	70.9	0	0	0	0	111.2	R162 G444 V449	R162-S447 PolarHBondContact NH1-O 2.9Å; R162-S447 PolarHBondContact NH2-O 3.26Å; G444-S447 PolarHBondContact O-N 3.07Å; S447-V449 PolarHBondContact O-N 3.36Å
448	C	97.6	Very high	95.9	Very high	55 Å²	55	28.8 Å²	28.8	37%	0.372	18%	0.176	S	C	.	.			trans	-51.9	130.6	167.3	-179.8	0	0	0	0	109.6	F441 G450 K451	F441-C448 HydrophobicContact CB-CB 3.92Å; F441-C448 HydrophobicContact CD1-CB 4.19Å; F441-C448 WeakPolarHBondContact O-CB 3.42Å; F441-C448 PolarHBondContact O-N 3.36Å; C448-G450 PolarHBondContact SG-N 3.41Å; C448-K451 HydrophobicContact CB-CB 4.32Å
449	V	96.4	Very high	96	Very high	25 Å²	25	28 Å²	28	15%	0.152	17%	0.172	C	C	.	.	S	Bend	trans	-79.7	-32.6	179.8	63.2	0	0	0	0	111.2	I149 F165 V166 L169 S447 K451	I149-V449 HydrophobicContact CD1-CG1 3.83Å; F165-V449 HydrophobicContact CB-CG1 4.18Å; F165-V449 HydrophobicContact CB-CG2 3.82Å; F165-V449 HydrophobicContact CD1-CG1 4.33Å; V166-V449 HydrophobicContact CB-CG2 4.4Å; V166-V449 HydrophobicContact CG2-CG2 3.68Å; L169-V449 HydrophobicContact CD1-CB 4.24Å; L169-V449 HydrophobicContact CD1-CG1 3.64Å; L169-V449 HydrophobicContact CD1-CG2 3.93Å; S447-V449 PolarHBondContact O-N 3.36Å; V449-K451 VanDerWaalsContact C-N 3.33Å; V449-K451 PolarHBondContact O-N 3.07Å
450	G	95.5	Very high	96.1	Very high	15 Å²	15	27.8 Å²	27.8	16%	0.155	17%	0.171	C	C	.	.	S	Bend	trans	-85.1	9.6	178.3	0	0	0	0	0	115.3	C448 H452 V453 A454	C448-G450 PolarHBondContact SG-N 3.41Å; G450-H452 PolarHBondContact O-N 2.8Å; G450-H452 VanDerWaalsContact O-N 3.09Å; G450-V453 PolarHBondContact O-N 3.05Å; G450-A454 VanDerWaalsContact O-CB 3.31Å; G450-A454 WeakPolarHBondContact O-CB 3.42Å; G450-A454 PolarHBondContact O-N 3.25Å
451	K	94.9	Very high	96.2	Very high	65 Å²	65	26.4 Å²	26.4	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-54.9	-34.8	-171.5	71.8	-174.9	-175.6	-175.9	0	114.6	F441 C448 V449 M455	F441-K451 HydrophobicContact CB-CB 3.68Å; F441-K451 HydrophobicContact CD1-CB 4.07Å; F441-K451 HydrophobicContact CD2-CB 4.06Å; F441-K451 HydrophobicContact CG-CB 3.66Å; C448-K451 HydrophobicContact CB-CB 4.32Å; V449-K451 VanDerWaalsContact C-N 3.33Å; V449-K451 PolarHBondContact O-N 3.07Å; K451-M455 WeakPolarHBondContact O-CG 3.42Å; K451-M455 PolarHBondContact O-N 3.46Å
452	H	93.6	Very high	96.2	Very high	101 Å²	101	24.2 Å²	24.2	47%	0.468	15%	0.153	S	C	.	.	H	α-helix	trans	-79.7	-47.6	-179.7	-67.5	-64.9	0	0	0	111	L174 G450 A454 M455 V456	L174-H452 HydrophobicContact CD2-CB 4.36Å; G450-H452 PolarHBondContact O-N 2.8Å; G450-H452 VanDerWaalsContact O-N 3.09Å; H452-A454 VanDerWaalsContact C-N 3.3Å; H452-A454 PolarHBondContact O-N 3.4Å; H452-M455 PolarHBondContact O-N 2.87Å; H452-V456 WeakPolarHBondContact O-CG2 3.48Å; H452-V456 PolarHBondContact O-N 2.98Å; H452-V456 VanDerWaalsContact O-N 3.1Å
453	V	94.4	Very high	96.3	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.03	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-41.5	174.9	170.1	0	0	0	0	111.4	L169 L174 T177 G450 M455 V456 M457	L169-V453 HydrophobicContact CB-CG2 4.17Å; L169-V453 HydrophobicContact CD2-CB 4.2Å; L169-V453 HydrophobicContact CD2-CG1 4.29Å; L169-V453 HydrophobicContact CD2-CG2 3.86Å; L169-V453 WeakPolarHBondContact O-CG2 3.43Å; L174-V453 HydrophobicContact CD1-CB 4.17Å; L174-V453 HydrophobicContact CD1-CG2 3.42Å; L174-V453 VanDerWaalsContact CD1-CG2 3.42Å; T177-V453 HydrophobicContact CG2-CG1 4.25Å; G450-V453 PolarHBondContact O-N 3.05Å; V453-M455 PolarHBondContact O-N 3.1Å; V453-V456 WeakPolarHBondContact O-CB 3.42Å; V453-V456 PolarHBondContact O-N 2.81Å; V453-M457 HydrophobicContact CG1-CE 3.22Å; V453-M457 HydrophobicContact CG1-CG 4.2Å; V453-M457 HydrophobicContact CG1-SD 3.73Å; V453-M457 WeakPolarHBondContact O-CB 3.16Å; V453-M457 WeakPolarHBondContact O-CG 3.24Å; V453-M457 PolarHBondContact O-N 3.13Å
454	A	96.1	Very high	96.3	Very high	16 Å²	16	22.5 Å²	22.5	13%	0.132	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-44.4	177.7	0	0	0	0	0	112.2	L322 F441 G450 H452 V456 M457 M458	L322-A454 HydrophobicContact CD1-CB 4.14Å; F441-A454 HydrophobicContact CE1-CB 4.08Å; F441-A454 HydrophobicContact CZ-CB 4.27Å; G450-A454 VanDerWaalsContact O-CB 3.31Å; G450-A454 WeakPolarHBondContact O-CB 3.42Å; G450-A454 PolarHBondContact O-N 3.25Å; H452-A454 VanDerWaalsContact C-N 3.3Å; H452-A454 PolarHBondContact O-N 3.4Å; A454-V456 VanDerWaalsContact C-N 3.32Å; A454-V456 PolarHBondContact O-N 3.24Å; A454-M457 PolarHBondContact O-N 2.81Å; A454-M458 HydrophobicContact CB-CE 4.37Å; A454-M458 WeakPolarHBondContact O-CB 3.4Å; A454-M458 WeakPolarHBondContact O-CE 3.48Å; A454-M458 VanDerWaalsContact O-CG 3.3Å; A454-M458 WeakPolarHBondContact O-CG 3.48Å; A454-M458 PolarHBondContact O-N 3.03Å
455	M	96.3	Very high	96.4	Very high	32 Å²	32	20.9 Å²	20.9	16%	0.158	12%	0.119	C	C	.	.	H	α-helix	trans	-63.6	-39.3	175.5	-71.5	-60.2	-61.6	0	0	111.9	E368 I371 F441 K451 H452 V453 M458 K459	E368-M455 HydrophobicContact CG-CE 3.92Å; I371-M455 HydrophobicContact CB-CE 4.26Å; I371-M455 HydrophobicContact CD1-CE 4.47Å; I371-M455 HydrophobicContact CG2-CE 3.73Å; I371-M455 HydrophobicContact CG2-SD 3.76Å; F441-M455 HydrophobicContact CE2-CG 4.1Å; F441-M455 HydrophobicContact CE2-SD 3.92Å; F441-M455 HydrophobicContact CZ-CG 4.44Å; F441-M455 HydrophobicContact CZ-SD 4.2Å; K451-M455 WeakPolarHBondContact O-CG 3.42Å; K451-M455 PolarHBondContact O-N 3.46Å; H452-M455 PolarHBondContact O-N 2.87Å; V453-M455 PolarHBondContact O-N 3.1Å; M455-M458 HydrophobicContact CG-CE 4.39Å; M455-M458 HydrophobicContact SD-CE 3.52Å; M455-M458 VanDerWaalsContact SD-CE 3.52Å; M455-K459 WeakPolarHBondContact O-CB 3.36Å; M455-K459 WeakPolarHBondContact O-CG 3.4Å; M455-K459 PolarHBondContact O-N 3.3Å
456	V	95.6	Very high	96.4	Very high	14 Å²	14	18.3 Å²	18.3	9%	0.085	10%	0.102	C	C	.	.	H	α-helix	trans	-62.1	-51.2	174.6	170.4	0	0	0	0	110.7	L174 T177 V178 L361 H452 V453 A454 K459 S460	L174-V456 HydrophobicContact CD1-CB 4.39Å; L174-V456 HydrophobicContact CD1-CG2 3.83Å; L174-V456 HydrophobicContact CD2-CG2 4.45Å; L174-V456 HydrophobicContact CG-CG2 4.16Å; T177-V456 HydrophobicContact CG2-CB 4.31Å; T177-V456 HydrophobicContact CG2-CG1 3.62Å; V178-V456 HydrophobicContact CG2-CG1 3.7Å; L361-V456 HydrophobicContact CD1-CB 4.2Å; L361-V456 HydrophobicContact CD1-CG1 3.79Å; L361-V456 HydrophobicContact CD1-CG2 3.86Å; H452-V456 WeakPolarHBondContact O-CG2 3.48Å; H452-V456 PolarHBondContact O-N 2.98Å; H452-V456 VanDerWaalsContact O-N 3.1Å; V453-V456 WeakPolarHBondContact O-CB 3.42Å; V453-V456 PolarHBondContact O-N 2.81Å; A454-V456 VanDerWaalsContact C-N 3.32Å; A454-V456 PolarHBondContact O-N 3.24Å; V456-K459 PolarHBondContact O-N 2.82Å; V456-S460 VanDerWaalsContact O-CB 3.26Å; V456-S460 WeakPolarHBondContact O-CB 3.23Å; V456-S460 PolarHBondContact O-N 3.24Å; V456-S460 PolarHBondContact O-OG 3.46Å
457	M	97.1	Very high	96.2	Very high	6 Å²	6	18.4 Å²	18.4	3%	0.03	10%	0.104	C	C	.	.	H	α-helix	trans	-58.6	-50.3	178.7	-74.3	169	177.9	0	0	111.5	T177 C181 I211 L215 L322 V453 A454 K459 S460 I461	T177-M457 HydrophobicContact CG2-CG 4.29Å; C181-M457 VanDerWaalsContact SG-CG 3.59Å; I211-M457 HydrophobicContact CG2-CE 3.72Å; I211-M457 HydrophobicContact CG2-CG 4.41Å; L215-M457 HydrophobicContact CD1-CE 3.92Å; L322-M457 HydrophobicContact CD1-CB 3.69Å; L322-M457 HydrophobicContact CD1-CG 4.43Å; L322-M457 HydrophobicContact CD1-SD 3.84Å; L322-M457 HydrophobicContact CD2-CB 4.39Å; V453-M457 HydrophobicContact CG1-CE 3.22Å; V453-M457 HydrophobicContact CG1-CG 4.2Å; V453-M457 HydrophobicContact CG1-SD 3.73Å; V453-M457 WeakPolarHBondContact O-CB 3.16Å; V453-M457 WeakPolarHBondContact O-CG 3.24Å; V453-M457 PolarHBondContact O-N 3.13Å; A454-M457 PolarHBondContact O-N 2.81Å; M457-K459 PolarHBondContact O-N 3.48Å; M457-S460 PolarHBondContact O-N 3.38Å; M457-I461 HydrophobicContact CB-CD1 4.41Å; M457-I461 WeakPolarHBondContact O-CB 3.26Å; M457-I461 WeakPolarHBondContact O-CD1 3.37Å; M457-I461 VanDerWaalsContact O-CG1 3.26Å; M457-I461 WeakPolarHBondContact O-CG1 3.35Å; M457-I461 PolarHBondContact O-N 3.24Å
458	M	98.3	Very high	95.9	Very high	4 Å²	4	20 Å²	20	2%	0.02	11%	0.11	C	C	.	.	H	α-helix	trans	-60.8	-46.3	-179.3	-71.1	-179.2	-64.6	0	0	111.9	L322 L326 M329 I371 L375 F441 A454 M455 S460 L462	L322-M458 HydrophobicContact CD1-CG 3.99Å; L322-M458 HydrophobicContact CD2-CG 4.32Å; L322-M458 HydrophobicContact CG-CG 3.9Å; L326-M458 HydrophobicContact CD2-CB 4.23Å; L326-M458 HydrophobicContact CD2-CG 4.18Å; L326-M458 HydrophobicContact CG-CG 4.44Å; M329-M458 HydrophobicContact CE-SD 3.66Å; M329-M458 HydrophobicContact SD-SD 4.35Å; I371-M458 HydrophobicContact CD1-CB 3.95Å; I371-M458 HydrophobicContact CG2-CE 3.71Å; I371-M458 HydrophobicContact CG2-SD 4.06Å; L375-M458 HydrophobicContact CD1-CE 4.22Å; F441-M458 HydrophobicContact CZ-CE 3.98Å; A454-M458 HydrophobicContact CB-CE 4.37Å; A454-M458 WeakPolarHBondContact O-CB 3.4Å; A454-M458 WeakPolarHBondContact O-CE 3.48Å; A454-M458 VanDerWaalsContact O-CG 3.3Å; A454-M458 WeakPolarHBondContact O-CG 3.48Å; A454-M458 PolarHBondContact O-N 3.03Å; M455-M458 HydrophobicContact CG-CE 4.39Å; M455-M458 HydrophobicContact SD-CE 3.52Å; M455-M458 VanDerWaalsContact SD-CE 3.52Å; M458-S460 VanDerWaalsContact C-N 3.33Å; M458-S460 PolarHBondContact O-N 3.37Å; M458-L462 VanDerWaalsContact O-CB 3.28Å; M458-L462 WeakPolarHBondContact O-CB 3.31Å; M458-L462 WeakPolarHBondContact O-CD1 3.49Å; M458-L462 VanDerWaalsContact O-CG 3.23Å; M458-L462 WeakPolarHBondContact O-CG 3.48Å; M458-L462 PolarHBondContact O-N 2.8Å
459	K	97.8	Very high	95.7	Very high	7 Å²	7	18.8 Å²	18.8	3%	0.03	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-44.2	175.3	-75.2	-171.5	179.9	-160.6	0	111.6	L361 L364 L367 E368 I371 M455 V456 M457 A463	L361-K459 HydrophobicContact CD2-CB 3.77Å; L361-K459 HydrophobicContact CD2-CD 4.15Å; L361-K459 PolarHBondContact O-NZ 3.38Å; L364-K459 PolarHBondContact O-NZ 3.45Å; L367-K459 HydrophobicContact CD2-CB 3.99Å; L367-K459 HydrophobicContact CD2-CG 4.02Å; L367-K459 HydrophobicContact CG-CG 4.24Å; E368-K459 WeakPolarHBondContact OE2-CE 3.46Å; E368-K459 IonicContact OE2-NZ 2.76Å; E368-K459 PolarHBondContact OE2-NZ 3.32Å; I371-K459 HydrophobicContact CD1-CB 4.38Å; I371-K459 HydrophobicContact CD1-CG 3.53Å; M455-K459 WeakPolarHBondContact O-CB 3.36Å; M455-K459 WeakPolarHBondContact O-CG 3.4Å; M455-K459 PolarHBondContact O-N 3.3Å; V456-K459 PolarHBondContact O-N 2.82Å; M457-K459 PolarHBondContact O-N 3.48Å; K459-A463 WeakPolarHBondContact O-CB 3.13Å; K459-A463 PolarHBondContact O-N 3.17Å
460	S	97.5	Very high	95.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.5	-45.8	-174.6	-55.6	0	0	0	0	112.3	C181 M356 V456 M457 M458 T464	C181-S460 VanDerWaalsContact CB-CB 3.45Å; M356-S460 VanDerWaalsContact CE-CB 3.41Å; M356-S460 WeakPolarHBondContact CE-OG 3.46Å; V456-S460 VanDerWaalsContact O-CB 3.26Å; V456-S460 WeakPolarHBondContact O-CB 3.23Å; V456-S460 PolarHBondContact O-N 3.24Å; V456-S460 PolarHBondContact O-OG 3.46Å; M457-S460 PolarHBondContact O-N 3.38Å; M458-S460 VanDerWaalsContact C-N 3.33Å; M458-S460 PolarHBondContact O-N 3.37Å; S460-T464 VanDerWaalsContact O-CB 3.29Å; S460-T464 WeakPolarHBondContact O-CB 3.45Å; S460-T464 PolarHBondContact O-N 3.03Å; S460-T464 PolarHBondContact O-OG1 3.01Å
461	I	98.2	Very high	95.2	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-66.4	-48.4	179.4	-64.3	162.4	0	0	0	109.7	T185 L204 V208 I211 L322 L326 M457 T464 L465	T185-I461 HydrophobicContact CG2-CG2 4.27Å; T185-I461 WeakPolarHBondContact OG1-CG1 3.44Å; L204-I461 HydrophobicContact CD2-CG2 4.05Å; V208-I461 HydrophobicContact CG2-CD1 3.98Å; I211-I461 HydrophobicContact CD1-CD1 3.94Å; I211-I461 HydrophobicContact CD1-CG1 4.21Å; L322-I461 HydrophobicContact CD2-CD1 4Å; L326-I461 HydrophobicContact CD1-CB 4.03Å; L326-I461 HydrophobicContact CD1-CD1 3.68Å; L326-I461 HydrophobicContact CD1-CG1 4.46Å; L326-I461 HydrophobicContact CD1-CG2 3.76Å; M457-I461 HydrophobicContact CB-CD1 4.41Å; M457-I461 WeakPolarHBondContact O-CB 3.26Å; M457-I461 WeakPolarHBondContact O-CD1 3.37Å; M457-I461 VanDerWaalsContact O-CG1 3.26Å; M457-I461 WeakPolarHBondContact O-CG1 3.35Å; M457-I461 PolarHBondContact O-N 3.24Å; I461-T464 PolarHBondContact O-N 3.19Å; I461-L465 VanDerWaalsContact O-CB 3.26Å; I461-L465 WeakPolarHBondContact O-CB 3.32Å; I461-L465 PolarHBondContact O-N 2.82Å
462	L	98.1	Very high	94.9	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-61.6	-47.8	179	-71.8	171.2	0	0	0	112.2	L326 M329 L330 L367 F370 I371 M458 T464 L465 L466	L326-L462 HydrophobicContact CD2-CD1 3.98Å; L326-L462 HydrophobicContact CD2-CD2 3.83Å; L326-L462 HydrophobicContact CD2-CG 3.56Å; M329-L462 HydrophobicContact SD-CD1 3.93Å; L330-L462 HydrophobicContact CD2-CD2 3.98Å; L330-L462 HydrophobicContact CG-CD2 4.49Å; L367-L462 HydrophobicContact CD1-CB 4.12Å; L367-L462 HydrophobicContact CD1-CD1 3.99Å; F370-L462 HydrophobicContact CD1-CD1 4.46Å; F370-L462 HydrophobicContact CE1-CD1 4.16Å; I371-L462 HydrophobicContact CD1-CD1 4.16Å; I371-L462 HydrophobicContact CG1-CD1 3.92Å; M458-L462 VanDerWaalsContact O-CB 3.28Å; M458-L462 WeakPolarHBondContact O-CB 3.31Å; M458-L462 WeakPolarHBondContact O-CD1 3.49Å; M458-L462 VanDerWaalsContact O-CG 3.23Å; M458-L462 WeakPolarHBondContact O-CG 3.48Å; M458-L462 PolarHBondContact O-N 2.8Å; L462-T464 VanDerWaalsContact C-N 3.35Å; L462-T464 PolarHBondContact O-N 3.25Å; L462-L465 PolarHBondContact O-N 3.02Å; L462-L466 HydrophobicContact CB-CD1 4.39Å; L462-L466 VanDerWaalsContact O-CB 3.23Å; L462-L466 WeakPolarHBondContact O-CB 3.3Å; L462-L466 WeakPolarHBondContact O-CG 3.4Å; L462-L466 PolarHBondContact O-N 2.68Å
463	A	96.8	Very high	94.5	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-62.7	-42.8	-179.9	0	0	0	0	0	111.6	I347 I351 M356 L364 L367 K459 S467	I347-A463 HydrophobicContact CD1-CB 4.37Å; I347-A463 HydrophobicContact CG1-CB 4.41Å; I351-A463 HydrophobicContact CD1-CB 4.09Å; M356-A463 HydrophobicContact SD-CB 4.02Å; L364-A463 HydrophobicContact CD1-CB 4.47Å; L367-A463 HydrophobicContact CD2-CB 4.27Å; K459-A463 WeakPolarHBondContact O-CB 3.13Å; K459-A463 PolarHBondContact O-N 3.17Å; A463-S467 WeakPolarHBondContact O-CB 3.45Å; A463-S467 PolarHBondContact O-N 3.25Å; A463-S467 VanDerWaalsContact O-N 3.11Å; A463-S467 PolarHBondContact O-OG 3.48Å
464	T	96.1	Very high	93.8	Very high	9 Å²	9	18.2 Å²	18.2	6%	0.055	10%	0.095	C	C	.	.	H	α-helix	trans	-63.2	-49.3	178.9	-55.4	0	0	0	0	111	V182 T185 S460 I461 L462 S467 Q468	V182-T464 HydrophobicContact CG1-CG2 4.31Å; T185-T464 HydrophobicContact CG2-CG2 3.88Å; S460-T464 VanDerWaalsContact O-CB 3.29Å; S460-T464 WeakPolarHBondContact O-CB 3.45Å; S460-T464 PolarHBondContact O-N 3.03Å; S460-T464 PolarHBondContact O-OG1 3.01Å; I461-T464 PolarHBondContact O-N 3.19Å; L462-T464 VanDerWaalsContact C-N 3.35Å; L462-T464 PolarHBondContact O-N 3.25Å; T464-S467 PolarHBondContact O-OG 3.49Å; T464-Q468 PolarHBondContact O-NE2 3.11Å
465	L	96.1	Very high	92.8	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-51.2	-178.8	-177	152.2	0	0	0	112.2	L189 L330 I461 L462 S467 Q468 Y469 V471 F506	L189-L465 HydrophobicContact CD2-CD1 4.45Å; L330-L465 HydrophobicContact CD2-CD2 4.07Å; I461-L465 VanDerWaalsContact O-CB 3.26Å; I461-L465 WeakPolarHBondContact O-CB 3.32Å; I461-L465 PolarHBondContact O-N 2.82Å; L462-L465 PolarHBondContact O-N 3.02Å; L465-S467 VanDerWaalsContact C-N 3.27Å; L465-S467 PolarHBondContact O-N 3.37Å; L465-Q468 PolarHBondContact O-N 3.01Å; L465-Q468 VanDerWaalsContact O-N 3.15Å; L465-Y469 PolarHBondContact O-N 3.48Å; L465-V471 HydrophobicContact CD2-CG2 3.59Å; L465-F506 HydrophobicContact CD1-CE2 4.25Å; L465-F506 HydrophobicContact CD1-CZ 4.18Å
466	L	94.8	Very high	91.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-69.4	-24.9	-175.5	-64.7	174.2	0	0	0	113	L330 L333 L343 L344 I347 L462 Q468 R509	L330-L466 HydrophobicContact CD2-CD2 4.25Å; L333-L466 HydrophobicContact CD2-CD1 3.69Å; L333-L466 HydrophobicContact CD2-CD2 3.72Å; L333-L466 HydrophobicContact CD2-CG 4.38Å; L343-L466 HydrophobicContact CD1-CD1 4.48Å; L344-L466 HydrophobicContact CD2-CB 4.44Å; I347-L466 HydrophobicContact CD1-CB 4.29Å; L462-L466 HydrophobicContact CB-CD1 4.39Å; L462-L466 VanDerWaalsContact O-CB 3.23Å; L462-L466 WeakPolarHBondContact O-CB 3.3Å; L462-L466 WeakPolarHBondContact O-CG 3.4Å; L462-L466 PolarHBondContact O-N 2.68Å; L466-Q468 PolarHBondContact O-N 2.93Å; L466-R509 PolarHBondContact O-NE 3.5Å
467	S	92.3	Very high	91.3	Very high	8 Å²	8	27.9 Å²	27.9	6%	0.056	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.6	175.5	78.1	0	0	0	0	113.8	A463 T464 L465 R511	A463-S467 WeakPolarHBondContact O-CB 3.45Å; A463-S467 PolarHBondContact O-N 3.25Å; A463-S467 VanDerWaalsContact O-N 3.11Å; A463-S467 PolarHBondContact O-OG 3.48Å; T464-S467 PolarHBondContact O-OG 3.49Å; L465-S467 VanDerWaalsContact C-N 3.27Å; L465-S467 PolarHBondContact O-N 3.37Å; S467-R511 VanDerWaalsContact CB-NH2 3.34Å; S467-R511 PolarHBondContact OG-NH2 3.04Å
468	Q	91.3	Very high	90.9	Very high	47 Å²	47	29.9 Å²	29.9	22%	0.22	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-29.4	-176.7	-70.1	177.3	77.3	0	0	112.9	T464 L465 L466 R509	T464-Q468 PolarHBondContact O-NE2 3.11Å; L465-Q468 PolarHBondContact O-N 3.01Å; L465-Q468 VanDerWaalsContact O-N 3.15Å; L466-Q468 PolarHBondContact O-N 2.93Å; Q468-R509 PolarHBondContact O-N 3.15Å
469	Y	93.1	Very high	90.5	Very high	30 Å²	30	30.1 Å²	30.1	12%	0.118	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.5	-173.2	-60.6	-77.7	0	0	0	112.1	L189 L195 L465 F506 L507 P508	L189-Y469 HydrophobicContact CB-CE2 4.26Å; L189-Y469 HydrophobicContact CD1-CD2 4.41Å; L189-Y469 HydrophobicContact CD1-CE2 4.19Å; L189-Y469 HydrophobicContact CD2-CD2 4.22Å; L189-Y469 HydrophobicContact CD2-CE2 4.07Å; L189-Y469 HydrophobicContact CG-CE2 4.41Å; L195-Y469 HydrophobicContact CD1-CE1 3.91Å; L195-Y469 HydrophobicContact CD2-CE1 3.88Å; L465-Y469 PolarHBondContact O-N 3.48Å; Y469-F506 HydrophobicContact CD1-CB 3.92Å; Y469-F506 HydrophobicContact CD1-CD2 4.49Å; Y469-F506 HydrophobicContact CD2-CD2 4.4Å; Y469-F506 HydrophobicContact CG-CB 4.23Å; Y469-F506 HydrophobicContact CG-CD2 4.16Å; Y469-F506 HydrophobicContact CG-CG 4.49Å; Y469-L507 CarbonylContact C-O 3.24Å; Y469-L507 WeakPolarHBondContact CA-O 3.19Å; Y469-P508 HydrophobicContact CE1-CB 4.5Å; Y469-P508 HydrophobicContact CE1-CG 4.25Å
470	S	90.8	Very high	90	Very high	5 Å²	5	37 Å²	37	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.3	155.6	-177.3	0	0	0	0	108.1	K334 L507	K334-S470 PolarHBondContact NZ-OG 2.93Å; S470-L507 PolarHBondContact N-O 3.08Å; S470-L507 PolarHBondContact O-N 3.46Å
471	V	90.9	Very high	89.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.6	176.2	179.8	0	0	0	0	108.7	L330 K334 L465 M504 R505 F506	L330-V471 HydrophobicContact CD2-CG2 4.13Å; K334-V471 WeakPolarHBondContact CD-O 3.25Å; K334-V471 WeakPolarHBondContact CE-O 3.39Å; K334-V471 WeakPolarHBondContact CG-O 3.33Å; K334-V471 PolarHBondContact NZ-O 2.93Å; L465-V471 HydrophobicContact CD2-CG2 3.59Å; V471-M504 HydrophobicContact CG1-CB 3.93Å; V471-M504 HydrophobicContact CG1-CG 4.24Å; V471-M504 HydrophobicContact CG1-SD 3.34Å; V471-M504 WeakPolarHBondContact CG1-SD 3.4Å; V471-R505 CarbonylContact C-O 3.46Å; V471-F506 HydrophobicContact CB-CD1 4.41Å; V471-F506 HydrophobicContact CB-CE1 4.3Å; V471-F506 HydrophobicContact CG1-CD1 4.23Å; V471-F506 HydrophobicContact CG1-CE1 3.87Å; V471-F506 HydrophobicContact CG2-CD1 4.04Å; V471-F506 HydrophobicContact CG2-CE1 3.75Å; V471-F506 HydrophobicContact CG2-CZ 4.3Å
472	C	88.9	Confident	89.1	Confident	32 Å²	32	40.2 Å²	40.2	22%	0.216	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.9	-180	-67.7	0	0	0	0	108.9	M504 R505 L507	C472-M504 CarbonylContact O-C 3.54Å; C472-M504 WeakPolarHBondContact O-CA 3.41Å; C472-M504 WeakPolarHBondContact O-CB 3.29Å; C472-R505 HydrophobicContact CB-CB 4.12Å; C472-R505 WeakPolarHBondContact CB-O 3.18Å; C472-R505 PolarHBondContact N-O 3.45Å; C472-R505 PolarHBondContact O-N 3.08Å; C472-L507 VanDerWaalsContact SG-CD1 3.53Å
473	L	85	Confident	88.8	Confident	40 Å²	40	42.1 Å²	42.1	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	157.2	177.3	-54.9	172.7	0	0	0	110.4	L331 K334 L477 M504	L331-L473 HydrophobicContact CD1-CD1 3.55Å; L331-L473 HydrophobicContact CD1-CD2 3.65Å; L331-L473 HydrophobicContact CD1-CG 4.21Å; K334-L473 HydrophobicContact CB-CD1 3.64Å; K334-L473 HydrophobicContact CB-CG 3.94Å; K334-L473 HydrophobicContact CG-CD1 4.4Å; K334-L473 HydrophobicContact CG-CG 4.17Å; L473-L477 HydrophobicContact CB-CB 4.43Å; L473-L477 WeakPolarHBondContact CD1-O 3.33Å; L473-L477 HydrophobicContact CD2-CD2 4.33Å; L473-M504 HydrophobicContact CD2-CE 3.55Å; L473-M504 HydrophobicContact CD2-CG 4.07Å; L473-M504 HydrophobicContact CD2-SD 3.68Å
474	H	79.5	Confident	88.5	Confident	120 Å²	120	44.5 Å²	44.5	56%	0.556	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-60.4	148.6	164.2	-166.3	80.2	0	0	0	110.4	G476 L477	H474-G476 PolarHBondContact O-N 3.5Å; H474-L477 WeakPolarHBondContact O-CB 3.38Å; H474-L477 PolarHBondContact O-N 3.48Å; H474-L477 VanDerWaalsContact O-N 3.13Å
475	E	74.6	Confident	88.4	Confident	186 Å²	186	47 Å²	47	87%	0.869	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	128.3	-179.6	-74.4	-171.9	173.5	0	0	111	L477	E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 2.9Å
476	G	76.6	Confident	88.3	Confident	64 Å²	64	47.9 Å²	47.9	66%	0.66	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-4.5	178.7	0	0	0	0	0	116	H474 T478 S481	H474-G476 PolarHBondContact O-N 3.5Å; G476-T478 PolarHBondContact O-N 2.89Å; G476-S481 PolarHBondContact O-OG 2.9Å
477	L	83.7	Confident	88.4	Confident	16 Å²	16	49.6 Å²	49.6	8%	0.084	28%	0.279	C	S	.	.			trans	-74.2	117.5	172.7	-173.4	71.5	0	0	0	110.1	L331 L473 H474 E475 L482 Q501	L331-L477 HydrophobicContact CD1-CD2 4.07Å; L331-L477 HydrophobicContact CD1-CG 4.02Å; L473-L477 HydrophobicContact CB-CB 4.43Å; L473-L477 WeakPolarHBondContact CD1-O 3.33Å; L473-L477 HydrophobicContact CD2-CD2 4.33Å; H474-L477 WeakPolarHBondContact O-CB 3.38Å; H474-L477 PolarHBondContact O-N 3.48Å; H474-L477 VanDerWaalsContact O-N 3.13Å; E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 2.9Å; L477-L482 HydrophobicContact CD1-CB 4.37Å; L477-L482 HydrophobicContact CD1-CD1 4.16Å; L477-Q501 VanDerWaalsContact CD2-O 3.3Å; L477-Q501 WeakPolarHBondContact CD2-O 3.32Å
478	T	88.4	Confident	88.5	Confident	47 Å²	47	50.1 Å²	50.1	29%	0.288	28%	0.281	S	S	.	.			trans	-134.3	171.1	177.1	64.9	0	0	0	0	108.7	G476 D480 S481 L482	G476-T478 PolarHBondContact O-N 2.89Å; T478-D480 PolarHBondContact O-N 3.44Å; T478-D480 PolarHBondContact OG1-N 3.4Å; T478-S481 PolarHBondContact N-OG 3.27Å; T478-S481 PolarHBondContact O-N 3.16Å; T478-S481 PolarHBondContact O-OG 3.04Å; T478-S481 PolarHBondContact OG1-N 3.07Å; T478-S481 VanDerWaalsContact OG1-N 3.1Å; T478-S481 PolarHBondContact OG1-OG 3.38Å; T478-L482 VanDerWaalsContact O-CB 3.3Å; T478-L482 WeakPolarHBondContact O-CB 3.39Å; T478-L482 PolarHBondContact O-N 3.14Å; T478-L482 VanDerWaalsContact O-N 3.08Å
479	L	89.5	Confident	88.6	Confident	10 Å²	10	48.1 Å²	48.1	5%	0.052	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-34.2	174.7	-168.5	70.3	0	0	0	112.1	F328 L331 L332 F377 H378 Q484	F328-L479 HydrophobicContact CD1-CD1 3.89Å; F328-L479 HydrophobicContact CE1-CD1 4.31Å; L331-L479 HydrophobicContact CD2-CB 4.27Å; L331-L479 HydrophobicContact CD2-CD1 3.81Å; L332-L479 HydrophobicContact CD2-CD2 3.86Å; L332-L479 HydrophobicContact CG-CD2 4.41Å; F377-L479 HydrophobicContact CD1-CD2 4.24Å; F377-L479 HydrophobicContact CE1-CD2 3.8Å; H378-L479 HydrophobicContact CB-CD2 4.11Å; H378-L479 WeakPolarHBondContact ND1-CD2 3.47Å; L479-Q484 PolarHBondContact O-NE2 3.41Å
480	D	87.3	Confident	88.7	Confident	150 Å²	150	48.2 Å²	48.2	80%	0.802	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-29.8	-176.8	-67	-24.5	0	0	0	112.6	T478	T478-D480 PolarHBondContact O-N 3.44Å; T478-D480 PolarHBondContact OG1-N 3.4Å
481	S	88.1	Confident	88.8	Confident	63 Å²	63	48.3 Å²	48.3	44%	0.441	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-18.1	177.1	57.3	0	0	0	0	113.6	G476 T478 P483	G476-S481 PolarHBondContact O-OG 2.9Å; T478-S481 PolarHBondContact N-OG 3.27Å; T478-S481 PolarHBondContact O-N 3.16Å; T478-S481 PolarHBondContact O-OG 3.04Å; T478-S481 PolarHBondContact OG1-N 3.07Å; T478-S481 VanDerWaalsContact OG1-N 3.1Å; T478-S481 PolarHBondContact OG1-OG 3.38Å; S481-P483 VanDerWaalsContact O-CD 3.31Å; S481-P483 WeakPolarHBondContact O-CD 3.49Å
482	L	89.9	Confident	88.9	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.042	28%	0.275	C	S	.	.	S	Bend	trans	-69.3	120.1	-179.6	174.8	68.2	0	0	0	111.2	F327 F328 L331 L477 T478 Q484 P492 L502	F327-L482 HydrophobicContact CE1-CD2 3.88Å; F328-L482 HydrophobicContact CD1-CD2 4.28Å; F328-L482 HydrophobicContact CE1-CD2 3.67Å; L331-L482 HydrophobicContact CD2-CD2 3.82Å; L477-L482 HydrophobicContact CD1-CB 4.37Å; L477-L482 HydrophobicContact CD1-CD1 4.16Å; T478-L482 VanDerWaalsContact O-CB 3.3Å; T478-L482 WeakPolarHBondContact O-CB 3.39Å; T478-L482 PolarHBondContact O-N 3.14Å; T478-L482 VanDerWaalsContact O-N 3.08Å; L482-Q484 HydrophobicContact CD2-CG 4.13Å; L482-Q484 HydrophobicContact CG-CG 4.03Å; L482-Q484 WeakPolarHBondContact O-CG 3.47Å; L482-Q484 PolarHBondContact O-N 3.34Å; L482-Q484 PolarHBondContact O-NE2 2.89Å; L482-P492 HydrophobicContact CD1-CB 4.43Å; L482-P492 HydrophobicContact CD2-CB 4.41Å; L482-P492 HydrophobicContact CD2-CG 4.35Å; L482-L502 HydrophobicContact CD1-CD2 3.24Å
483	P	90.2	Very high	88.9	Confident	42 Å²	42	48.1 Å²	48.1	27%	0.273	27%	0.272	S	S	.	.			trans	-60.8	129.1	172.2	-23.6	35.6	0	0	0	111.1	S481 P492 V493	S481-P483 VanDerWaalsContact O-CD 3.31Å; S481-P483 WeakPolarHBondContact O-CD 3.49Å; P483-P492 WeakPolarHBondContact O-CA 3.23Å; P483-V493 HydrophobicContact CB-CB 4Å; P483-V493 HydrophobicContact CB-CG2 3.99Å; P483-V493 PolarHBondContact O-N 2.91Å
484	Q	91.9	Very high	88.8	Confident	52 Å²	52	49.1 Å²	49.1	24%	0.243	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.9	-175.9	-68.2	167.5	43.1	0	0	111.7	F328 H378 L479 L482 Q491	F328-Q484 HydrophobicContact CE1-CG 4.49Å; F328-Q484 HydrophobicContact CZ-CG 4.46Å; H378-Q484 PolarHBondContact CE1-OE1 3.21Å; H378-Q484 PolarHBondContact NE2-OE1 2.92Å; L479-Q484 PolarHBondContact O-NE2 3.41Å; L482-Q484 HydrophobicContact CD2-CG 4.13Å; L482-Q484 HydrophobicContact CG-CG 4.03Å; L482-Q484 WeakPolarHBondContact O-CG 3.47Å; L482-Q484 PolarHBondContact O-N 3.34Å; L482-Q484 PolarHBondContact O-NE2 2.89Å; Q484-Q491 CarbonylContact C-O 3.45Å; Q484-Q491 WeakPolarHBondContact CA-O 3.31Å; Q484-Q491 WeakPolarHBondContact CB-O 3.11Å
485	T	93.1	Very high	88.5	Confident	62 Å²	62	49.7 Å²	49.7	38%	0.38	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147	167	72.3	0	0	0	0	110	Q490 Q491 V493	T485-Q490 VanDerWaalsContact O-CA 3.31Å; T485-Q490 WeakPolarHBondContact O-CA 3.41Å; T485-Q491 PolarHBondContact N-O 3.31Å; T485-Q491 PolarHBondContact O-N 3.3Å; T485-V493 HydrophobicContact CG2-CG2 3.78Å
486	N	95.1	Very high	87.5	Confident	21 Å²	21	49.8 Å²	49.8	11%	0.112	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	81.6	170.2	-175.4	0.5	0	0	0	109.7	G88 T89 D382	G88-N486 WeakPolarHBondContact CA-OD1 3.39Å; T89-N486 PolarHBondContact N-O 3.37Å; T89-N486 PolarHBondContact OG1-O 3.4Å; D382-N486 PolarHBondContact OD2-ND2 2.82Å; D382-N486 PolarHBondContact OD2-OD1 2.87Å
487	N	95.2	Very high	86.3	Confident	37 Å²	37	55.5 Å²	55.5	20%	0.198	29%	0.288	C	S	.	.	S	Bend	trans	-103.4	-96.2	174.6	-175.4	13.4	0	0	0	111.2	G86 I87 G88 F383 S489	G86-N487 VanDerWaalsContact CA-OD1 3.22Å; G86-N487 WeakPolarHBondContact CA-OD1 3.14Å; I87-N487 WeakPolarHBondContact CB-O 3.47Å; I87-N487 PolarHBondContact N-O 3.06Å; I87-N487 PolarHBondContact N-OD1 3.37Å; G88-N487 PolarHBondContact N-O 3.32Å; F383-N487 VanDerWaalsContact CE1-O 3.26Å; F383-N487 WeakPolarHBondContact CE1-O 3.12Å; N487-S489 PolarHBondContact N-O 2.72Å
488	L	94.9	Very high	84.9	Confident	19 Å²	19	57.9 Å²	57.9	10%	0.099	30%	0.299	C	S	.	.	S	Bend	trans	-79.2	-28.7	176	-174.1	58.1	0	0	0	112.2	F234 W237 Q238 L241 F383	F234-L488 HydrophobicContact CE2-CD2 4.39Å; F234-L488 HydrophobicContact CZ-CD2 4.26Å; W237-L488 HydrophobicContact CD2-CD2 3.58Å; W237-L488 HydrophobicContact CE3-CD2 3.96Å; W237-L488 HydrophobicContact CG-CD2 4Å; W237-L488 HydrophobicContact CH2-CD2 4.32Å; W237-L488 HydrophobicContact CZ2-CD2 4Å; W237-L488 HydrophobicContact CZ3-CD2 4.3Å; Q238-L488 HydrophobicContact CB-CB 4.36Å; Q238-L488 HydrophobicContact CG-CB 3.65Å; Q238-L488 HydrophobicContact CG-CD2 4.09Å; L241-L488 HydrophobicContact CD2-CD1 3.53Å; L241-L488 HydrophobicContact CD2-CD2 4.41Å; F383-L488 HydrophobicContact CE2-CD1 4.46Å; F383-L488 HydrophobicContact CZ-CD1 4.17Å; F383-L488 WeakPolarHBondContact CZ-O 3.21Å
489	S	94.8	Very high	83.5	Confident	5 Å²	5	57.8 Å²	57.8	4%	0.035	30%	0.303	C	S	.	.	S	Bend	trans	-148.2	164.2	172.9	55.1	0	0	0	0	108.4	F234 V380 N487 Q491	F234-S489 WeakPolarHBondContact CZ-OG 3.32Å; V380-S489 CarbonylContact O-C 3.56Å; V380-S489 VanDerWaalsContact O-CA 3.25Å; V380-S489 WeakPolarHBondContact O-CA 3.39Å; V380-S489 WeakPolarHBondContact O-CB 3.31Å; N487-S489 PolarHBondContact N-O 2.72Å; S489-Q491 PolarHBondContact OG-NE2 3.39Å
490	Q	94.6	Very high	82.2	Confident	33 Å²	33	64.2 Å²	64.2	15%	0.154	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119.9	173.3	-175	156.4	5.8	0	0	110	H378 P379 V380 T485	H378-Q490 PolarHBondContact CE1-NE2 2.94Å; H378-Q490 PolarHBondContact NE2-NE2 3.3Å; P379-Q490 PolarHBondContact O-OE1 3.39Å; V380-Q490 PolarHBondContact O-N 2.83Å; T485-Q490 VanDerWaalsContact O-CA 3.31Å; T485-Q490 WeakPolarHBondContact O-CA 3.41Å
491	Q	93.1	Very high	81.2	Confident	6 Å²	6	61.6 Å²	61.6	3%	0.028	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	148.8	-175.1	-55.7	-162.5	20.4	0	0	112.1	F234 I324 Q484 T485 S489	F234-Q491 VanDerWaalsContact CZ-NE2 3.25Å; I324-Q491 HydrophobicContact CD1-CB 4.12Å; I324-Q491 VanDerWaalsContact CD1-CD 3.46Å; I324-Q491 HydrophobicContact CD1-CG 3.62Å; Q484-Q491 CarbonylContact C-O 3.45Å; Q484-Q491 WeakPolarHBondContact CA-O 3.31Å; Q484-Q491 WeakPolarHBondContact CB-O 3.11Å; T485-Q491 PolarHBondContact N-O 3.31Å; T485-Q491 PolarHBondContact O-N 3.3Å; S489-Q491 PolarHBondContact OG-NE2 3.39Å
492	P	92.5	Very high	80.7	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.032	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	149.3	163.8	-19.6	32.3	0	0	0	111.4	F327 F328 L482 P483 L502	F327-P492 HydrophobicContact CD1-CG 3.95Å; F327-P492 HydrophobicContact CE1-CG 3.83Å; F328-P492 HydrophobicContact CE1-CG 4.02Å; F328-P492 HydrophobicContact CZ-CG 4Å; L482-P492 HydrophobicContact CD1-CB 4.43Å; L482-P492 HydrophobicContact CD2-CB 4.41Å; L482-P492 HydrophobicContact CD2-CG 4.35Å; P483-P492 WeakPolarHBondContact O-CA 3.23Å; P492-L502 HydrophobicContact CB-CD1 4.34Å; P492-L502 HydrophobicContact CB-CD2 4.32Å
493	V	89.3	Confident	80.5	Confident	24 Å²	24	59.2 Å²	59.2	15%	0.145	30%	0.299	C	S	.	.			trans	-81.3	127.6	166.8	-179.4	0	0	0	0	108.3	P483 T485 H495 E498	P483-V493 HydrophobicContact CB-CB 4Å; P483-V493 HydrophobicContact CB-CG2 3.99Å; P483-V493 PolarHBondContact O-N 2.91Å; T485-V493 HydrophobicContact CG2-CG2 3.78Å; V493-H495 WeakPolarHBondContact CG1-CD2 3.24Å; V493-E498 VanDerWaalsContact CG1-OE2 3.25Å; V493-E498 WeakPolarHBondContact CG1-OE2 3.35Å
494	E	83.2	Confident	80.5	Confident	62 Å²	62	57.3 Å²	57.3	29%	0.29	29%	0.286	S	S	.	.			trans	-114	37.3	-172.5	-63.3	-179.2	-121.6	0	0	112.9	L201 R205 L502	L201-E494 VanDerWaalsContact CD2-CD 3.44Å; L201-E494 HydrophobicContact CD2-CG 4.14Å; L201-E494 WeakPolarHBondContact CD2-OE1 3.49Å; R205-E494 IonicContact CZ-OE1 2.7Å; R205-E494 IonicContact CZ-OE2 2.73Å; R205-E494 VanDerWaalsContact NH1-CD 3.31Å; R205-E494 IonicContact NH1-OE1 3.67Å; R205-E494 PolarHBondContact NH1-OE1 3.11Å; R205-E494 VanDerWaalsContact NH1-OE1 3.13Å; R205-E494 IonicContact NH1-OE2 3.54Å; R205-E494 PolarHBondContact NH1-OE2 3.23Å; R205-E494 IonicContact NH2-OE1 3.46Å; R205-E494 PolarHBondContact NH2-OE1 3.04Å; R205-E494 IonicContact NH2-OE2 3.33Å; E494-L502 HydrophobicContact CG-CD1 3.98Å
495	H	71.6	Confident	80.5	Confident	131 Å²	131	61.5 Å²	61.5	61%	0.606	30%	0.3	S	S	*	.			trans	-68.2	146.1	175.9	-69.3	-47.6	0	0	0	111.4	V493 E497 E498 A499	V493-H495 WeakPolarHBondContact CG1-CD2 3.24Å; H495-E497 PolarHBondContact O-N 2.85Å; H495-E498 CarbonylContact O-C 3.48Å; H495-E498 WeakPolarHBondContact O-CA 3.24Å; H495-E498 PolarHBondContact O-N 2.87Å; H495-A499 PolarHBondContact O-N 3.33Å
496	Q	54.5	Low	80.5	Confident	188 Å²	188	58.6 Å²	58.6	88%	0.879	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.3	-172.7	-80.8	179.6	-27.1	0	0	114.5
497	E	50.8	Low	80.4	Confident	185 Å²	185	59.8 Å²	59.8	86%	0.864	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-22.4	176.8	-65.2	179.2	177.2	0	0	113.2	H495	H495-E497 PolarHBondContact O-N 2.85Å
498	E	55.8	Low	80.2	Confident	65 Å²	65	62.4 Å²	62.4	30%	0.304	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-16.6	-178.7	-64.8	177.1	167.9	0	0	112.2	V493 H495 E500 Q501	V493-E498 VanDerWaalsContact CG1-OE2 3.25Å; V493-E498 WeakPolarHBondContact CG1-OE2 3.35Å; H495-E498 CarbonylContact O-C 3.48Å; H495-E498 WeakPolarHBondContact O-CA 3.24Å; H495-E498 PolarHBondContact O-N 2.87Å; E498-E500 VanDerWaalsContact C-N 3.27Å; E498-E500 PolarHBondContact O-N 3.43Å; E498-Q501 VanDerWaalsContact O-CB 3.26Å; E498-Q501 WeakPolarHBondContact O-CB 3.16Å; E498-Q501 PolarHBondContact O-N 3.37Å
499	A	58.3	Low	79.7	Confident	45 Å²	45	63 Å²	63	37%	0.372	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-61	-32.3	-178.8	0	0	0	0	0	113.2	H495 Q501 L502	H495-A499 PolarHBondContact O-N 3.33Å; A499-Q501 PolarHBondContact O-N 3.41Å; A499-L502 PolarHBondContact O-N 2.8Å; A499-L502 VanDerWaalsContact O-N 3.11Å
500	E	61.3	Low	78.5	Confident	145 Å²	145	70.2 Å²	70.2	68%	0.678	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-61.9	-29.5	173.5	-70.4	-170.8	171.9	0	0	112.1	E498 L502 S503	E498-E500 VanDerWaalsContact C-N 3.27Å; E498-E500 PolarHBondContact O-N 3.43Å; E500-L502 VanDerWaalsContact C-N 3.28Å; E500-L502 PolarHBondContact O-N 3.33Å; E500-S503 WeakPolarHBondContact O-CB 3.24Å; E500-S503 PolarHBondContact O-N 2.85Å; E500-S503 PolarHBondContact O-OG 2.94Å
501	Q	66.7	Low	76.9	Confident	96 Å²	96	72.7 Å²	72.7	45%	0.449	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-74.6	-17.4	178.3	-55.2	-179.2	0.9	0	0	112.8	L477 E498 A499 S503	L477-Q501 VanDerWaalsContact CD2-O 3.3Å; L477-Q501 WeakPolarHBondContact CD2-O 3.32Å; E498-Q501 VanDerWaalsContact O-CB 3.26Å; E498-Q501 WeakPolarHBondContact O-CB 3.16Å; E498-Q501 PolarHBondContact O-N 3.37Å; A499-Q501 PolarHBondContact O-N 3.41Å; Q501-S503 VanDerWaalsContact C-N 3.33Å
502	L	78.6	Confident	75.2	Confident	10 Å²	10	74.8 Å²	74.8	5%	0.052	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-85.3	-9.8	176.8	-54.9	-178	0	0	0	112.8	F327 L482 P492 E494 A499 E500	F327-L502 HydrophobicContact CE2-CB 4.45Å; F327-L502 HydrophobicContact CZ-CB 4.35Å; F327-L502 HydrophobicContact CZ-CD2 4.03Å; L482-L502 HydrophobicContact CD1-CD2 3.24Å; P492-L502 HydrophobicContact CB-CD1 4.34Å; P492-L502 HydrophobicContact CB-CD2 4.32Å; E494-L502 HydrophobicContact CG-CD1 3.98Å; A499-L502 PolarHBondContact O-N 2.8Å; A499-L502 VanDerWaalsContact O-N 3.11Å; E500-L502 VanDerWaalsContact C-N 3.28Å; E500-L502 PolarHBondContact O-N 3.33Å
503	S	85.1	Confident	73.6	Confident	11 Å²	11	77 Å²	77	8%	0.077	39%	0.388	C	S	.	.			trans	-68	147	177.9	70.9	0	0	0	0	112	H197 V198 E500 Q501	H197-S503 WeakPolarHBondContact CE1-CB 3.22Å; H197-S503 PolarHBondContact CE1-OG 2.91Å; H197-S503 WeakPolarHBondContact ND1-CB 3.45Å; H197-S503 PolarHBondContact ND1-OG 3.01Å; V198-S503 WeakPolarHBondContact O-CA 3.33Å; E500-S503 WeakPolarHBondContact O-CB 3.24Å; E500-S503 PolarHBondContact O-N 2.85Å; E500-S503 PolarHBondContact O-OG 2.94Å; Q501-S503 VanDerWaalsContact C-N 3.33Å
504	M	90.2	Very high	72.1	Confident	2 Å²	2	79.8 Å²	79.8	1%	0.01	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.9	175	-53.2	-178.3	-176.3	0	0	110.1	V198 V200 F327 L330 V471 C472 L473 F506	V198-M504 WeakPolarHBondContact CB-O 3.41Å; V198-M504 PolarHBondContact N-O 2.92Å; V198-M504 PolarHBondContact O-N 3.37Å; V200-M504 HydrophobicContact CB-CG 4.4Å; V200-M504 HydrophobicContact CB-SD 4.21Å; V200-M504 HydrophobicContact CG1-SD 4.27Å; V200-M504 HydrophobicContact CG2-CB 3.57Å; V200-M504 HydrophobicContact CG2-CG 3.65Å; V200-M504 HydrophobicContact CG2-SD 3.74Å; F327-M504 HydrophobicContact CD2-CE 3.89Å; F327-M504 HydrophobicContact CE2-CE 3.46Å; F327-M504 VanDerWaalsContact CE2-CE 3.46Å; F327-M504 HydrophobicContact CZ-CE 3.95Å; L330-M504 HydrophobicContact CB-SD 4.49Å; V471-M504 HydrophobicContact CG1-CB 3.93Å; V471-M504 HydrophobicContact CG1-CG 4.24Å; V471-M504 HydrophobicContact CG1-SD 3.34Å; V471-M504 WeakPolarHBondContact CG1-SD 3.4Å; C472-M504 CarbonylContact O-C 3.54Å; C472-M504 WeakPolarHBondContact O-CA 3.41Å; C472-M504 WeakPolarHBondContact O-CB 3.29Å; L473-M504 HydrophobicContact CD2-CE 3.55Å; L473-M504 HydrophobicContact CD2-CG 4.07Å; L473-M504 HydrophobicContact CD2-SD 3.68Å; M504-F506 HydrophobicContact CB-CE1 4.33Å
505	R	91.9	Very high	70.6	Confident	139 Å²	139	85 Å²	85	53%	0.525	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.6	172.7	174.8	171.8	-175.1	-176.2	-0.2	109.7	L195 V471 C472 L507	L195-R505 CarbonylContact O-C 3.56Å; L195-R505 WeakPolarHBondContact O-CA 3.22Å; V471-R505 CarbonylContact C-O 3.46Å; C472-R505 HydrophobicContact CB-CB 4.12Å; C472-R505 WeakPolarHBondContact CB-O 3.18Å; C472-R505 PolarHBondContact N-O 3.45Å; C472-R505 PolarHBondContact O-N 3.08Å; R505-L507 HydrophobicContact CG-CD2 4.2Å
506	F	94.1	Very high	69.6	Low	2 Å²	2	82.1 Å²	82.1	1%	0.009	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.2	173.5	-72.8	10	0	0	0	109.4	L189 L192 L195 V198 V200 L203 L465 Y469 V471 M504	L189-F506 HydrophobicContact CD2-CD2 4.42Å; L189-F506 HydrophobicContact CD2-CE2 3.96Å; L192-F506 HydrophobicContact CD1-CD2 4.02Å; L192-F506 HydrophobicContact CD1-CE2 4.18Å; L195-F506 HydrophobicContact CB-CB 4.36Å; L195-F506 WeakPolarHBondContact CB-O 3.48Å; L195-F506 HydrophobicContact CD2-CB 4.15Å; L195-F506 PolarHBondContact O-N 3.4Å; V198-F506 HydrophobicContact CB-CD1 4.44Å; V198-F506 HydrophobicContact CB-CE1 4.33Å; V198-F506 HydrophobicContact CB-CZ 4.44Å; V198-F506 HydrophobicContact CG1-CE1 4.37Å; V198-F506 HydrophobicContact CG1-CE2 4.15Å; V198-F506 HydrophobicContact CG1-CZ 4.01Å; V198-F506 HydrophobicContact CG2-CB 4.41Å; V198-F506 HydrophobicContact CG2-CD1 4.21Å; V198-F506 HydrophobicContact CG2-CD2 4.13Å; V198-F506 HydrophobicContact CG2-CE2 4.46Å; V198-F506 HydrophobicContact CG2-CG 4Å; V200-F506 HydrophobicContact CG2-CE1 3.6Å; V200-F506 HydrophobicContact CG2-CZ 3.81Å; L203-F506 HydrophobicContact CD2-CE2 3.83Å; L203-F506 HydrophobicContact CD2-CZ 4.04Å; L465-F506 HydrophobicContact CD1-CE2 4.25Å; L465-F506 HydrophobicContact CD1-CZ 4.18Å; Y469-F506 HydrophobicContact CD1-CB 3.92Å; Y469-F506 HydrophobicContact CD1-CD2 4.49Å; Y469-F506 HydrophobicContact CD2-CD2 4.4Å; Y469-F506 HydrophobicContact CG-CB 4.23Å; Y469-F506 HydrophobicContact CG-CD2 4.16Å; Y469-F506 HydrophobicContact CG-CG 4.49Å; V471-F506 HydrophobicContact CB-CD1 4.41Å; V471-F506 HydrophobicContact CB-CE1 4.3Å; V471-F506 HydrophobicContact CG1-CD1 4.23Å; V471-F506 HydrophobicContact CG1-CE1 3.87Å; V471-F506 HydrophobicContact CG2-CD1 4.04Å; V471-F506 HydrophobicContact CG2-CE1 3.75Å; V471-F506 HydrophobicContact CG2-CZ 4.3Å; M504-F506 HydrophobicContact CB-CE1 4.33Å
507	L	91.8	Very high	69.3	Low	45 Å²	45	80 Å²	80	24%	0.236	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.7	173.7	-61.1	179	0	0	0	108.5	Y469 S470 C472 R505 R509 P517	Y469-L507 CarbonylContact C-O 3.24Å; Y469-L507 WeakPolarHBondContact CA-O 3.19Å; S470-L507 PolarHBondContact N-O 3.08Å; S470-L507 PolarHBondContact O-N 3.46Å; C472-L507 VanDerWaalsContact SG-CD1 3.53Å; R505-L507 HydrophobicContact CG-CD2 4.2Å; L507-R509 PolarHBondContact O-N 3.23Å; L507-P517 HydrophobicContact CD1-CB 4.27Å; L507-P517 HydrophobicContact CD1-CG 3.9Å
508	P	91.2	Very high	70.2	Confident	93 Å²	93	74.7 Å²	74.7	60%	0.604	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.9	134.3	175.4	-24.8	33.6	0	0	0	111	L195 Y469	L195-P508 HydrophobicContact CD1-CG 3.77Å; Y469-P508 HydrophobicContact CE1-CB 4.5Å; Y469-P508 HydrophobicContact CE1-CG 4.25Å
509	R	83.9	Confident	71	Confident	31 Å²	31	75.2 Å²	75.2	12%	0.117	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-99.9	136.4	178.4	-170.7	-179.7	-66.6	-83.8	2.1	109.3	E340 L344 L466 Q468 L507	E340-R509 IonicContact OE1-NH2 2.7Å; E340-R509 PolarHBondContact OE1-NH2 3.28Å; L344-R509 VanDerWaalsContact CD1-CZ 3.41Å; L466-R509 PolarHBondContact O-NE 3.5Å; Q468-R509 PolarHBondContact O-N 3.15Å; L507-R509 PolarHBondContact O-N 3.23Å
510	Q	70	Confident	71.7	Confident	156 Å²	156	76.9 Å²	76.9	73%	0.729	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-90	119	159.7	-65.1	-159	-12.4	0	0	108.4	S513	Q510-S513 WeakPolarHBondContact O-CB 3.48Å; Q510-S513 PolarHBondContact O-N 3.37Å; Q510-S513 PolarHBondContact O-OG 3Å
511	R	61.8	Low	72.3	Confident	85 Å²	85	72.9 Å²	72.9	32%	0.321	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	141.8	177.2	-79.1	-175.7	-178.7	168.8	-7.2	110.8	G352 D353 S467 S513	G352-R511 VanDerWaalsContact O-CZ 3.3Å; G352-R511 PolarHBondContact O-NH1 3.47Å; D353-R511 PolarHBondContact O-NH1 2.89Å; D353-R511 IonicContact OD1-NH1 2.67Å; S467-R511 VanDerWaalsContact CB-NH2 3.34Å; S467-R511 PolarHBondContact OG-NH2 3.04Å; R511-S513 VanDerWaalsContact C-N 3.26Å; R511-S513 PolarHBondContact O-N 3.22Å
512	G	56.5	Low	72.7	Confident	51 Å²	51	71.4 Å²	71.4	53%	0.526	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-9.5	-171.4	0	0	0	0	0	116.3	D348	D348-G512 PolarHBondContact OD2-N 2.95Å
513	S	60	Low	72.3	Confident	52 Å²	52	75.5 Å²	75.5	36%	0.364	40%	0.399	S	S	.	.			trans	-94.6	100.7	168.6	74.3	0	0	0	0	110.2	Q510 R511 Q515	Q510-S513 WeakPolarHBondContact O-CB 3.48Å; Q510-S513 PolarHBondContact O-N 3.37Å; Q510-S513 PolarHBondContact O-OG 3Å; R511-S513 VanDerWaalsContact C-N 3.26Å; R511-S513 PolarHBondContact O-N 3.22Å; S513-Q515 PolarHBondContact O-N 3.15Å
514	W	57.7	Low	71.3	Confident	82 Å²	82	80.1 Å²	80.1	31%	0.311	42%	0.422	S	S	.	.			trans	-88.8	19.4	-177.5	-53.3	118	0	0	0	114	L341 L344 Q345 D348 T516	L341-W514 HydrophobicContact CD1-CB 3.84Å; L341-W514 HydrophobicContact CD1-CG 4.3Å; L344-W514 VanDerWaalsContact C-CZ3 3.49Å; L344-W514 HydrophobicContact CB-CE3 3.85Å; L344-W514 HydrophobicContact CB-CH2 4.18Å; L344-W514 HydrophobicContact CB-CZ3 3.41Å; L344-W514 VanDerWaalsContact CB-CZ3 3.41Å; L344-W514 HydrophobicContact CD1-CE3 4.4Å; L344-W514 HydrophobicContact CD2-CZ3 4.47Å; L344-W514 HydrophobicContact CG-CZ3 4.34Å; L344-W514 WeakPolarHBondContact O-CH2 3.33Å; Q345-W514 HydrophobicContact CG-CZ2 4.24Å; D348-W514 HydrophobicContact CB-CH2 3.48Å; D348-W514 VanDerWaalsContact CB-CH2 3.48Å; D348-W514 HydrophobicContact CB-CZ2 3.75Å; D348-W514 WeakPolarHBondContact OD2-CH2 3.28Å; D348-W514 WeakPolarHBondContact OD2-CZ2 3.4Å; W514-T516 PolarHBondContact O-N 2.86Å; W514-T516 VanDerWaalsContact O-N 3.12Å
515	Q	51.1	Low	69.9	Low	172 Å²	172	86.2 Å²	86.2	80%	0.804	45%	0.453	S	S	*	.			trans	-72.4	110.9	176.7	-69.1	-176.7	-14.1	0	0	108	S513 P517	S513-Q515 PolarHBondContact O-N 3.15Å; Q515-P517 WeakPolarHBondContact O-CD 3.46Å
516	T	50.7	Low	68.1	Low	70 Å²	70	81.8 Å²	81.8	43%	0.429	45%	0.448	S	S	.	.			trans	-68.6	118.4	162.8	23.3	0	0	0	0	107	W514	W514-T516 PolarHBondContact O-N 2.86Å; W514-T516 VanDerWaalsContact O-N 3.12Å
517	P	48.1	Very low	65.7	Low	142 Å²	142	89 Å²	89	92%	0.922	49%	0.487	S	S	*	.			trans	-67.5	0	177.3	26.5	-31.4	0	0	0	112.2	L507 Q515	L507-P517 HydrophobicContact CD1-CB 4.27Å; L507-P517 HydrophobicContact CD1-CG 3.9Å; Q515-P517 WeakPolarHBondContact O-CD 3.46Å

Retrieved 517 of 517 residues in 200 ms (Link to these results)

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