A0A087XM81_POEFO Loading...

dual-specificity kinase

AlphaFold DB , UniProt , Accession A0A087XM81, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 676 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	38.9	Very low	36.7	Very low	229 Å²	229	166.8 Å²	166.8	100%	1.128	84%	0.839	S	S	*	*				0	118.9	0	-71	150.9	177.2	0	0	105.7
2	E	34.7	Very low	36.4	Very low	185 Å²	185	167.3 Å²	167.3	86%	0.864	84%	0.836	S	S	*	*			cis	-140.8	-179.2	6	-101.3	144.8	128	0	0	112.5
3	T	39.2	Very low	36	Very low	128 Å²	128	160.1 Å²	160.1	79%	0.785	83%	0.83	S	S	*	*			trans	-66.2	147.6	-179	47.4	0	0	0	0	113.5
4	E	33.1	Very low	35.7	Very low	183 Å²	183	161.5 Å²	161.5	86%	0.855	84%	0.84	S	S	*	*				-167.8	-176.8	104.1	-105.8	-150.2	90.3	0	0	114
5	R	40.6	Very low	35.9	Very low	225 Å²	225	157.1 Å²	157.1	85%	0.849	84%	0.837	S	S	*	*			trans	-89	165.3	-172.8	-60.3	170.1	171.8	175.7	-3.3	112.5
6	V	34.2	Very low	36	Very low	144 Å²	144	158.7 Å²	158.7	87%	0.873	84%	0.838	S	S	*	*				172.3	143.4	110.9	153.2	0	0	0	0	110
7	G	31.9	Very low	36.1	Very low	70 Å²	70	156.2 Å²	156.2	72%	0.722	83%	0.833	S	S	*	*			trans	-178.4	108.8	173.8	0	0	0	0	0	113
8	P	46.8	Very low	36.5	Very low	112 Å²	112	154.2 Å²	154.2	73%	0.727	83%	0.83	S	S	*	*			trans	-85.9	-176.6	168.9	37.4	-32.9	0	0	0	110.5
9	E	36.2	Very low	36.9	Very low	176 Å²	176	155.2 Å²	155.2	82%	0.822	83%	0.831	S	S	*	*			cis	-137.5	147.3	21	-66.3	170	-179.4	0	0	114.3
10	E	34.5	Very low	36.9	Very low	174 Å²	174	156.9 Å²	156.9	81%	0.813	83%	0.833	S	S	*	*			trans	14.8	137.7	144	-53.5	-174	166.2	0	0	122.9
11	R	33.5	Very low	36.9	Very low	209 Å²	209	153.1 Å²	153.1	79%	0.789	82%	0.819	S	S	*	*				-171.6	141.4	97.2	-97.7	172.4	-164.9	-142.6	3.5	115.4
12	E	32.9	Very low	36.7	Very low	172 Å²	172	149.1 Å²	149.1	80%	0.804	81%	0.807	S	S	*	*			trans	39.4	133.2	142.4	-58.8	170	115.9	0	0	120.9
13	G	31.4	Very low	36.8	Very low	74 Å²	74	147.7 Å²	147.7	76%	0.763	80%	0.801	S	S	*	*			trans	171.9	-2.3	167.3	0	0	0	0	0	123.5
14	D	32.7	Very low	36.7	Very low	180 Å²	180	144.4 Å²	144.4	96%	0.963	79%	0.792	S	S	*	*			trans	55.7	170.1	174.7	-80	-32.8	0	0	0	119.5
15	A	37.3	Very low	37.3	Very low	96 Å²	96	142 Å²	142	79%	0.793	79%	0.79	S	S	*	*			trans	-106	167.6	-165	0	0	0	0	0	115.4
16	E	38.4	Very low	37.7	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-63.3	146.8	-179.5	-63.4	-170.3	135.2	0	0	115
17	P	38.3	Very low	38.4	Very low	116 Å²	116	143.2 Å²	143.2	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-90.4	137.8	146.6	34.4	-28.6	0	0	0	111
18	P	42.6	Very low	39.5	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.6	161.9	-172.4	32.2	-36.9	0	0	0	114.9	H20	P18-H20 PolarHBondContact O-N 3.46Å
19	M	44.6	Very low	39.6	Very low	173 Å²	173	149.3 Å²	149.3	85%	0.852	79%	0.785	S	S	*	*			trans	-25.1	121.1	165.4	-77.5	-90.7	-73.6	0	0	116.5
20	H	35.6	Very low	40.6	Very low	189 Å²	189	145.7 Å²	145.7	88%	0.875	78%	0.777	S	S	*	*			trans	-159	123	136.4	-102.4	-63.9	0	0	0	114.7	P18	P18-H20 PolarHBondContact O-N 3.46Å
21	S	37.2	Very low	42.4	Very low	78 Å²	78	141.2 Å²	141.2	55%	0.545	77%	0.765	S	S	.	*			trans	23.5	110.3	154.5	-163.2	0	0	0	0	121.1	H23	S21-H23 PolarHBondContact OG-ND1 3Å
22	V	35	Very low	44	Very low	145 Å²	145	133 Å²	133	88%	0.879	74%	0.739	S	S	*	*			trans	-124.7	87.3	137.1	-177.4	0	0	0	0	108.6	G24	V22-G24 VanDerWaalsContact C-N 3.32Å; V22-G24 PolarHBondContact O-N 2.93Å
23	H	37.7	Very low	45.7	Very low	156 Å²	156	130.1 Å²	130.1	72%	0.722	72%	0.722	S	S	*	*			trans	-74.5	81.1	177.3	-82.6	85.2	0	0	0	111.5	S21 T25	S21-H23 PolarHBondContact OG-ND1 3Å; H23-T25 PolarHBondContact O-N 2.95Å
24	G	36.7	Very low	47.5	Very low	58 Å²	58	135.9 Å²	135.9	60%	0.598	72%	0.721	S	S	*	*			trans	-66.9	95.4	172.3	0	0	0	0	0	112.1	V22 N26	V22-G24 VanDerWaalsContact C-N 3.32Å; V22-G24 PolarHBondContact O-N 2.93Å; G24-N26 PolarHBondContact O-N 3.03Å
25	T	46	Very low	48.9	Very low	133 Å²	133	130.1 Å²	130.1	82%	0.816	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	50.6	-174.6	44.6	0	0	0	0	114.6	H23	H23-T25 PolarHBondContact O-N 2.95Å
26	N	48.8	Very low	50.2	Low	156 Å²	156	131 Å²	131	83%	0.834	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.9	14	171.1	-109.7	-36.1	0	0	0	116.5	G24 I28	G24-N26 PolarHBondContact O-N 3.03Å; N26-I28 PolarHBondContact O-N 2.82Å; N26-I28 VanDerWaalsContact O-N 3.16Å
27	R	49	Very low	51.3	Low	239 Å²	239	130 Å²	130	90%	0.902	68%	0.677	S	S	*	*			trans	-76.6	101.3	169	-80.4	-172.9	173.2	177.2	-0.5	110.7	R29	R27-R29 PolarHBondContact O-N 3.41Å
28	I	53.4	Low	52.4	Low	124 Å²	124	127.8 Å²	127.8	64%	0.636	66%	0.664	S	S	*	*			trans	-49.1	125.3	167.9	-58.4	173.9	0	0	0	108.6	N26	N26-I28 PolarHBondContact O-N 2.82Å; N26-I28 VanDerWaalsContact O-N 3.16Å
29	R	50.9	Low	53.3	Low	185 Å²	185	124.5 Å²	124.5	70%	0.698	65%	0.647	S	S	*	*			trans	-59.6	132.5	-176.6	-82.6	-178.1	165.8	137.3	-4.4	110.4	R27 S31 S32 Y33	R27-R29 PolarHBondContact O-N 3.41Å; R29-S31 PolarHBondContact O-N 2.93Å; R29-S32 PolarHBondContact O-N 3.43Å; R29-S32 PolarHBondContact O-OG 3.37Å; R29-Y33 PolarHBondContact O-N 2.84Å
30	P	56.8	Low	54.2	Low	101 Å²	101	120.7 Å²	120.7	66%	0.656	63%	0.633	S	S	*	*	H	α-helix	trans	-56.4	-26.4	-178	-29.2	35.9	0	0	0	114.7	R34	P30-R34 WeakPolarHBondContact O-CB 3.35Å; P30-R34 PolarHBondContact O-N 3.21Å
31	S	71.6	Confident	55.4	Low	79 Å²	79	116.1 Å²	116.1	55%	0.552	62%	0.623	S	S	*	*	H	α-helix	trans	-66.1	-48.9	177.7	49.1	0	0	0	0	113.2	R29 R34 A35	R29-S31 PolarHBondContact O-N 2.93Å; S31-R34 PolarHBondContact O-N 3.44Å; S31-A35 VanDerWaalsContact O-CB 3.32Å; S31-A35 WeakPolarHBondContact O-CB 3.27Å; S31-A35 PolarHBondContact O-N 2.91Å
32	S	67.5	Low	56.8	Low	36 Å²	36	117.7 Å²	117.7	25%	0.252	63%	0.629	S	S	.	*	H	α-helix	trans	-71.5	-36.3	179.1	55	0	0	0	0	112	R29 A35 L36	R29-S32 PolarHBondContact O-N 3.43Å; R29-S32 PolarHBondContact O-OG 3.37Å; S32-A35 PolarHBondContact O-N 3.18Å; S32-L36 WeakPolarHBondContact O-CB 3.32Å; S32-L36 WeakPolarHBondContact O-CG 3.35Å; S32-L36 PolarHBondContact O-N 2.87Å
33	Y	68.2	Low	58.9	Low	113 Å²	113	113.5 Å²	113.5	44%	0.443	60%	0.602	S	S	.	*	H	α-helix	trans	-65.5	-40.8	172.9	-175.5	-106.2	0	0	0	112.5	R29 R37	R29-Y33 PolarHBondContact O-N 2.84Å; Y33-R37 HydrophobicContact CE1-CG 4.4Å; Y33-R37 WeakPolarHBondContact O-CB 3.1Å; Y33-R37 PolarHBondContact O-N 3.15Å; Y33-R37 PolarHBondContact OH-NE 3.4Å; Y33-R37 PolarHBondContact OH-NH2 3.33Å
34	R	68.4	Low	61.2	Low	195 Å²	195	107.2 Å²	107.2	74%	0.736	58%	0.576	S	S	*	*	H	α-helix	trans	-66.4	-41.7	174.2	-175.8	-178.9	-69.8	-176.4	-2.9	111.5	P30 S31 R37 S38	P30-R34 WeakPolarHBondContact O-CB 3.35Å; P30-R34 PolarHBondContact O-N 3.21Å; S31-R34 PolarHBondContact O-N 3.44Å; R34-R37 PolarHBondContact O-N 2.9Å; R34-S38 WeakPolarHBondContact O-CB 3.41Å; R34-S38 PolarHBondContact O-N 3.32Å
35	A	63.4	Low	63.7	Low	58 Å²	58	111.1 Å²	111.1	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-61.7	-45.8	175.6	0	0	0	0	0	111.6	S31 S32 S38 A39	S31-A35 VanDerWaalsContact O-CB 3.32Å; S31-A35 WeakPolarHBondContact O-CB 3.27Å; S31-A35 PolarHBondContact O-N 2.91Å; S32-A35 PolarHBondContact O-N 3.18Å; A35-S38 PolarHBondContact O-N 3.26Å; A35-A39 WeakPolarHBondContact O-CB 3.38Å; A35-A39 PolarHBondContact O-N 3.31Å
36	L	63.5	Low	65.7	Low	115 Å²	115	106.4 Å²	106.4	60%	0.602	54%	0.543	S	S	*	.	H	α-helix	trans	-62.7	-44.4	174.8	-75.4	169	0	0	0	112.2	S32 S38 A39 V40	S32-L36 WeakPolarHBondContact O-CB 3.32Å; S32-L36 WeakPolarHBondContact O-CG 3.35Å; S32-L36 PolarHBondContact O-N 2.87Å; L36-S38 VanDerWaalsContact C-N 3.34Å; L36-S38 PolarHBondContact O-N 3.16Å; L36-A39 PolarHBondContact O-N 3.07Å; L36-V40 WeakPolarHBondContact O-CB 3.35Å; L36-V40 VanDerWaalsContact O-CG2 3.27Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.05Å
37	R	63.1	Low	67.7	Low	162 Å²	162	103.1 Å²	103.1	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-61.5	-41.7	174.4	-94.9	-170.5	162.4	173.9	-2.3	112.3	Y33 R34 V40 S41	Y33-R37 HydrophobicContact CE1-CG 4.4Å; Y33-R37 WeakPolarHBondContact O-CB 3.1Å; Y33-R37 PolarHBondContact O-N 3.15Å; Y33-R37 PolarHBondContact OH-NE 3.4Å; Y33-R37 PolarHBondContact OH-NH2 3.33Å; R34-R37 PolarHBondContact O-N 2.9Å; R37-V40 PolarHBondContact O-N 2.75Å; R37-S41 WeakPolarHBondContact O-CB 3.48Å; R37-S41 PolarHBondContact O-N 3.18Å; R37-S41 PolarHBondContact O-OG 2.87Å; R37-S41 VanDerWaalsContact O-OG 3.07Å
38	S	59.7	Low	69.7	Low	68 Å²	68	94.4 Å²	94.4	48%	0.476	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-50.7	176.4	-162.9	0	0	0	0	110.9	R34 A35 L36 V40 S41 T42	R34-S38 WeakPolarHBondContact O-CB 3.41Å; R34-S38 PolarHBondContact O-N 3.32Å; A35-S38 PolarHBondContact O-N 3.26Å; L36-S38 VanDerWaalsContact C-N 3.34Å; L36-S38 PolarHBondContact O-N 3.16Å; S38-V40 VanDerWaalsContact C-N 3.33Å; S38-V40 PolarHBondContact O-N 3.23Å; S38-S41 WeakPolarHBondContact CA-OG 3.38Å; S38-S41 PolarHBondContact O-N 3.41Å; S38-S41 VanDerWaalsContact O-N 3.15Å; S38-S41 PolarHBondContact O-OG 2.86Å; S38-T42 PolarHBondContact O-N 2.9Å; S38-T42 PolarHBondContact O-OG1 3.48Å
39	A	61.9	Low	71.6	Confident	52 Å²	52	88.8 Å²	88.8	43%	0.43	47%	0.467	S	S	.	.	H	α-helix	trans	-61.1	-39.3	179.2	0	0	0	0	0	112.5	A35 L36 T42 L43	A35-A39 WeakPolarHBondContact O-CB 3.38Å; A35-A39 PolarHBondContact O-N 3.31Å; L36-A39 PolarHBondContact O-N 3.07Å; A39-T42 WeakPolarHBondContact CA-OG1 3.44Å; A39-T42 PolarHBondContact O-N 3.47Å; A39-T42 PolarHBondContact O-OG1 3.25Å; A39-L43 WeakPolarHBondContact O-CG 3.38Å
40	V	63.7	Low	73.7	Confident	92 Å²	92	82.3 Å²	82.3	56%	0.558	45%	0.451	S	S	*	.	H	α-helix	trans	-70.5	-36.6	174.7	171.5	0	0	0	0	111.9	L36 R37 S38 T42 L43	L36-V40 WeakPolarHBondContact O-CB 3.35Å; L36-V40 VanDerWaalsContact O-CG2 3.27Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.05Å; R37-V40 PolarHBondContact O-N 2.75Å; S38-V40 VanDerWaalsContact C-N 3.33Å; S38-V40 PolarHBondContact O-N 3.23Å; V40-T42 PolarHBondContact O-N 2.91Å; V40-L43 HydrophobicContact CG2-CD1 4.49Å; V40-L43 WeakPolarHBondContact O-CB 3.43Å; V40-L43 PolarHBondContact O-N 3.34Å; V40-L43 VanDerWaalsContact O-N 3.16Å
41	S	60.7	Low	75.4	Confident	94 Å²	94	80.4 Å²	80.4	66%	0.657	44%	0.439	S	S	*	.	H	α-helix	trans	-71.2	-14.7	174.7	61.7	0	0	0	0	114.3	R37 S38	R37-S41 WeakPolarHBondContact O-CB 3.48Å; R37-S41 PolarHBondContact O-N 3.18Å; R37-S41 PolarHBondContact O-OG 2.87Å; R37-S41 VanDerWaalsContact O-OG 3.07Å; S38-S41 WeakPolarHBondContact CA-OG 3.38Å; S38-S41 PolarHBondContact O-N 3.41Å; S38-S41 VanDerWaalsContact O-N 3.15Å; S38-S41 PolarHBondContact O-OG 2.86Å
42	T	67.6	Low	76.5	Confident	110 Å²	110	81.2 Å²	81.2	68%	0.675	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	1.9	170.7	48.9	0	0	0	0	113.6	S38 A39 V40	S38-T42 PolarHBondContact O-N 2.9Å; S38-T42 PolarHBondContact O-OG1 3.48Å; A39-T42 WeakPolarHBondContact CA-OG1 3.44Å; A39-T42 PolarHBondContact O-N 3.47Å; A39-T42 PolarHBondContact O-OG1 3.25Å; V40-T42 PolarHBondContact O-N 2.91Å
43	L	79.1	Confident	77.5	Confident	58 Å²	58	84.6 Å²	84.6	30%	0.304	44%	0.444	S	S	.	.	S	Bend	trans	-83.5	133.5	170.1	-56	176.7	0	0	0	109.4	A39 V40 V109 V111	A39-L43 WeakPolarHBondContact O-CG 3.38Å; V40-L43 HydrophobicContact CG2-CD1 4.49Å; V40-L43 WeakPolarHBondContact O-CB 3.43Å; V40-L43 PolarHBondContact O-N 3.34Å; V40-L43 VanDerWaalsContact O-N 3.16Å; L43-V109 HydrophobicContact CD2-CB 4.16Å; L43-V111 HydrophobicContact CB-CG2 3.72Å; L43-V111 HydrophobicContact CD1-CG2 3.58Å; L43-V111 HydrophobicContact CG-CG2 4.24Å
44	A	84.6	Confident	78.4	Confident	23 Å²	23	79.6 Å²	79.6	19%	0.19	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	148.8	176.3	0	0	0	0	0	111	F49 V109 C110 V111 L119	A44-F49 HydrophobicContact CB-CE2 3.69Å; A44-F49 HydrophobicContact CB-CZ 3.59Å; A44-V109 PolarHBondContact N-O 3.29Å; A44-C110 CarbonylContact O-C 3.49Å; A44-C110 VanDerWaalsContact O-CA 3.31Å; A44-C110 WeakPolarHBondContact O-CA 3.46Å; A44-V111 PolarHBondContact O-N 3.43Å; A44-L119 HydrophobicContact CB-CD1 4.22Å
45	R	89.2	Confident	79	Confident	140 Å²	140	71.2 Å²	71.2	53%	0.528	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	155.8	168.4	-61.1	178.3	57.4	73.8	4.5	109.9	D47 D48 F49	R45-D47 HydrophobicContact CB-CB 4.47Å; R45-D47 IonicContact CZ-OD2 3.15Å; R45-D47 IonicContact NE-OD2 2.82Å; R45-D47 PolarHBondContact NE-OD2 3.31Å; R45-D47 IonicContact NH2-OD2 2.66Å; R45-D47 PolarHBondContact NH2-OD2 3.12Å; R45-D47 PolarHBondContact O-N 3.24Å; R45-D48 PolarHBondContact N-OD2 3.36Å; R45-D48 WeakPolarHBondContact O-CB 3.44Å; R45-D48 PolarHBondContact O-N 2.8Å; R45-D48 VanDerWaalsContact O-N 3.13Å; R45-F49 WeakPolarHBondContact O-CD2 3.49Å; R45-F49 WeakPolarHBondContact O-CE2 3.46Å
46	L	88.9	Confident	79.7	Confident	34 Å²	34	71.1 Å²	71.1	18%	0.178	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-58.1	-35.1	171.7	-167.9	68.2	0	0	0	111.9	D48 F49 L76 M78 C110 H112	L46-D48 PolarHBondContact O-N 3.16Å; L46-F49 PolarHBondContact O-N 3.4Å; L46-F49 VanDerWaalsContact O-N 3.14Å; L46-L76 HydrophobicContact CD1-CD2 3.42Å; L46-L76 VanDerWaalsContact CD1-CD2 3.42Å; L46-M78 HydrophobicContact CD1-CE 4.43Å; L46-M78 HydrophobicContact CD1-SD 4.14Å; L46-M78 HydrophobicContact CD2-CE 4.17Å; L46-C110 PolarHBondContact N-SG 2.92Å; L46-C110 VanDerWaalsContact N-SG 3.45Å; L46-H112 HydrophobicContact CB-CB 4.27Å; L46-H112 VanDerWaalsContact CD2-CE1 3.41Å; L46-H112 WeakPolarHBondContact CD2-CE1 3.44Å; L46-H112 WeakPolarHBondContact CD2-ND1 3.47Å
47	D	90.6	Very high	79.9	Confident	87 Å²	87	67 Å²	67	47%	0.465	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-60.2	-26.6	179.3	-42.9	-31	0	0	0	113.2	R45 F49 R68	R45-D47 HydrophobicContact CB-CB 4.47Å; R45-D47 IonicContact CZ-OD2 3.15Å; R45-D47 IonicContact NE-OD2 2.82Å; R45-D47 PolarHBondContact NE-OD2 3.31Å; R45-D47 IonicContact NH2-OD2 2.66Å; R45-D47 PolarHBondContact NH2-OD2 3.12Å; R45-D47 PolarHBondContact O-N 3.24Å; D47-F49 PolarHBondContact O-N 3.27Å; D47-F49 VanDerWaalsContact O-N 3.13Å; D47-R68 WeakPolarHBondContact O-CD 3.38Å; D47-R68 PolarHBondContact O-NE 3.15Å
48	D	90.7	Very high	80.1	Confident	56 Å²	56	67 Å²	67	30%	0.299	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-70.3	-7.4	-179	-54.8	-28.1	0	0	0	112.1	R45 L46 H67 R68	R45-D48 PolarHBondContact N-OD2 3.36Å; R45-D48 WeakPolarHBondContact O-CB 3.44Å; R45-D48 PolarHBondContact O-N 2.8Å; R45-D48 VanDerWaalsContact O-N 3.13Å; L46-D48 PolarHBondContact O-N 3.16Å; D48-H67 PolarHBondContact O-CD2 2.65Å; D48-H67 VanDerWaalsContact O-CD2 3.31Å; D48-R68 WeakPolarHBondContact O-CB 3.43Å; D48-R68 VanDerWaalsContact O-CG 3.3Å; D48-R68 WeakPolarHBondContact O-CG 3.4Å; D48-R68 PolarHBondContact O-N 3.05Å
49	F	94.4	Very high	80.5	Confident	6 Å²	6	66 Å²	66	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.2	-176.3	-53.4	-73.6	0	0	0	113	A44 R45 L46 D47 V65 Q66 H67 R68 M74 C110 L119	A44-F49 HydrophobicContact CB-CE2 3.69Å; A44-F49 HydrophobicContact CB-CZ 3.59Å; R45-F49 WeakPolarHBondContact O-CD2 3.49Å; R45-F49 WeakPolarHBondContact O-CE2 3.46Å; L46-F49 PolarHBondContact O-N 3.4Å; L46-F49 VanDerWaalsContact O-N 3.14Å; D47-F49 PolarHBondContact O-N 3.27Å; D47-F49 VanDerWaalsContact O-N 3.13Å; F49-V65 HydrophobicContact CB-CB 4.03Å; F49-V65 HydrophobicContact CD1-CB 4.14Å; F49-V65 HydrophobicContact CD1-CG2 4.05Å; F49-V65 HydrophobicContact CE1-CG2 4.46Å; F49-V65 HydrophobicContact CG-CB 4.13Å; F49-V65 HydrophobicContact CG-CG2 4.36Å; F49-Q66 VanDerWaalsContact CA-O 3.3Å; F49-Q66 WeakPolarHBondContact CA-O 3.34Å; F49-H67 HydrophobicContact CD1-CB 3.99Å; F49-H67 HydrophobicContact CE1-CB 3.87Å; F49-H67 AromaticContact CE1-CD2 3.94Å; F49-R68 VanDerWaalsContact O-CZ 3.28Å; F49-R68 PolarHBondContact O-NE 3.46Å; F49-R68 VanDerWaalsContact O-NE 3.15Å; F49-R68 PolarHBondContact O-NH2 3.13Å; F49-M74 HydrophobicContact CD1-CE 4.35Å; F49-M74 HydrophobicContact CE1-CE 3.59Å; F49-M74 HydrophobicContact CZ-CE 4.45Å; F49-C110 HydrophobicContact CE2-CB 4.49Å; F49-L119 HydrophobicContact CE2-CD1 4.28Å; F49-L119 HydrophobicContact CZ-CD1 3.74Å; F49-L119 HydrophobicContact CZ-CD2 4.21Å
50	S	94.3	Very high	81.3	Confident	50 Å²	50	63.5 Å²	63.5	35%	0.35	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.5	146.9	49.8	0	0	0	0	108.8	V65 Q66	S50-V65 CarbonylContact O-C 3.49Å; S50-V65 VanDerWaalsContact O-CA 3.26Å; S50-V65 WeakPolarHBondContact O-CA 3.32Å; S50-Q66 PolarHBondContact N-O 3.44Å; S50-Q66 PolarHBondContact O-N 2.9Å; S50-Q66 PolarHBondContact OG-O 2.87Å
51	C	93.4	Very high	82.4	Confident	61 Å²	61	61.9 Å²	61.9	41%	0.412	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.4	-172.8	-59.9	0	0	0	0	111.2	F63 V65	C51-F63 HydrophobicContact CB-CB 4.49Å; C51-F63 HydrophobicContact CB-CD1 4.22Å; C51-V65 HydrophobicContact CB-CG1 4.23Å
52	E	92.8	Very high	83.7	Confident	95 Å²	95	57.6 Å²	57.6	44%	0.444	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.4	177.3	176.1	-172	150.5	0	0	107.4	I54 F63 K64	E52-I54 PolarHBondContact O-N 2.84Å; E52-F63 CarbonylContact O-C 3.51Å; E52-F63 WeakPolarHBondContact O-CA 3.4Å; E52-K64 HydrophobicContact CB-CB 4.3Å; E52-K64 PolarHBondContact N-O 3.27Å; E52-K64 PolarHBondContact O-N 3.44Å; E52-K64 IonicContact OE1-NZ 3.39Å; E52-K64 PolarHBondContact OE1-NZ 3.13Å; E52-K64 WeakPolarHBondContact OE2-CD 3.31Å; E52-K64 WeakPolarHBondContact OE2-CE 3.19Å; E52-K64 IonicContact OE2-NZ 3.99Å; E52-K64 PolarHBondContact OE2-NZ 2.99Å
53	K	90.3	Very high	84.9	Confident	107 Å²	107	53.9 Å²	53.9	47%	0.465	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	115.4	-177.4	-173.6	170.4	176.8	168.9	0	109.8	E61 F63	K53-E61 VanDerWaalsContact CE-OE2 3.28Å; K53-E61 WeakPolarHBondContact CE-OE2 3.4Å; K53-E61 IonicContact NZ-OE1 2.69Å; K53-E61 PolarHBondContact NZ-OE1 3.42Å; K53-E61 IonicContact NZ-OE2 3.34Å; K53-E61 PolarHBondContact NZ-OE2 3.44Å; K53-F63 HydrophobicContact CB-CD1 3.79Å; K53-F63 HydrophobicContact CB-CE1 3.66Å; K53-F63 HydrophobicContact CB-CZ 4.49Å; K53-F63 HydrophobicContact CD-CE1 4.21Å; K53-F63 HydrophobicContact CD-CZ 4.32Å; K53-F63 HydrophobicContact CG-CD1 4.3Å; K53-F63 HydrophobicContact CG-CE1 3.98Å; K53-F63 HydrophobicContact CG-CZ 4.34Å
54	I	86.6	Confident	85.6	Confident	9 Å²	9	53.8 Å²	53.8	5%	0.046	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-12.1	179.8	58.1	179.2	0	0	0	113.1	E52 V62 K64 Y122 F390 L392	E52-I54 PolarHBondContact O-N 2.84Å; I54-V62 HydrophobicContact CD1-CG1 4.04Å; I54-V62 HydrophobicContact CG1-CB 4.22Å; I54-V62 HydrophobicContact CG1-CG1 4.06Å; I54-V62 VanDerWaalsContact CG1-O 3.27Å; I54-V62 WeakPolarHBondContact CG1-O 3.47Å; I54-V62 PolarHBondContact N-O 2.77Å; I54-K64 HydrophobicContact CD1-CB 4.07Å; I54-K64 HydrophobicContact CG2-CB 3.51Å; I54-K64 HydrophobicContact CG2-CD 4.35Å; I54-Y122 HydrophobicContact CD1-CD2 4.38Å; I54-Y122 HydrophobicContact CD1-CE2 4.01Å; I54-F390 HydrophobicContact CB-CD2 4.02Å; I54-F390 HydrophobicContact CB-CE2 4.13Å; I54-F390 HydrophobicContact CD1-CD1 4.49Å; I54-F390 HydrophobicContact CD1-CD2 4.11Å; I54-F390 HydrophobicContact CD1-CE1 3.94Å; I54-F390 HydrophobicContact CD1-CE2 3.46Å; I54-F390 VanDerWaalsContact CD1-CE2 3.46Å; I54-F390 HydrophobicContact CD1-CZ 3.38Å; I54-F390 HydrophobicContact CG1-CD1 4.33Å; I54-F390 HydrophobicContact CG1-CD2 3.92Å; I54-F390 HydrophobicContact CG1-CE1 4.27Å; I54-F390 HydrophobicContact CG1-CE2 3.81Å; I54-F390 HydrophobicContact CG1-CG 4.2Å; I54-F390 HydrophobicContact CG1-CZ 4.01Å; I54-F390 WeakPolarHBondContact O-CB 3.34Å; I54-F390 WeakPolarHBondContact O-CD2 3.41Å; I54-L392 HydrophobicContact CB-CD2 3.78Å; I54-L392 HydrophobicContact CD1-CD2 4.49Å; I54-L392 HydrophobicContact CG2-CD2 3.94Å
55	G	80	Confident	86.2	Confident	18 Å²	18	52.8 Å²	52.8	19%	0.186	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.7	-165	157.6	0	0	0	0	0	114.2	V62	G55-V62 PolarHBondContact N-O 2.82Å; G55-V62 VanDerWaalsContact N-O 3.13Å; G55-V62 PolarHBondContact O-N 2.81Å
56	A	78.2	Confident	86.5	Confident	56 Å²	56	50.2 Å²	50.2	46%	0.463	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	143.8	177.8	0	0	0	0	0	111.5	E61	A56-E61 HydrophobicContact CB-CG 4.16Å
57	G	69.1	Low	86.8	Confident	28 Å²	28	50.7 Å²	50.7	29%	0.289	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	179.2	164.9	0	0	0	0	0	110.6	F59 S60	G57-F59 PolarHBondContact O-N 3.1Å; G57-F59 VanDerWaalsContact O-N 3.08Å; G57-S60 PolarHBondContact N-O 3.15Å; G57-S60 PolarHBondContact O-N 3.31Å
58	F	66.3	Low	86.9	Confident	162 Å²	162	54.5 Å²	54.5	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.3	-170.2	-166.9	-83.1	0	0	0	114.9
59	F	67.4	Low	87	Confident	47 Å²	47	58.1 Å²	58.1	21%	0.206	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-6.6	-176.4	-61.2	-73.1	0	0	0	114.2	G57 N79 I80 L81 S384	G57-F59 PolarHBondContact O-N 3.1Å; G57-F59 VanDerWaalsContact O-N 3.08Å; F59-N79 PolarHBondContact O-OD1 2.87Å; F59-I80 PolarHBondContact O-N 3.31Å; F59-L81 HydrophobicContact CD1-CD1 4Å; F59-L81 HydrophobicContact CE1-CD1 4.28Å; F59-S384 WeakPolarHBondContact CD2-O 3.26Å; F59-S384 WeakPolarHBondContact CE2-O 3.48Å
60	S	78.5	Confident	86.9	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	141.4	-169.7	38.8	0	0	0	0	113.2	G57 M78 I386 S387	G57-S60 PolarHBondContact N-O 3.15Å; G57-S60 PolarHBondContact O-N 3.31Å; S60-M78 CarbonylContact C-O 3.58Å; S60-M78 WeakPolarHBondContact CA-O 3.5Å; S60-M78 VanDerWaalsContact CB-O 3.26Å; S60-M78 WeakPolarHBondContact CB-O 3.48Å; S60-I386 WeakPolarHBondContact OG-CG2 3.45Å; S60-S387 PolarHBondContact OG-O 3.12Å; S60-S387 VanDerWaalsContact OG-O 3.1Å
61	E	87	Confident	86.9	Confident	58 Å²	58	61.4 Å²	61.4	27%	0.271	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145	166.4	-52.2	-151.7	145	0	0	109.2	K53 A56 F63 M78 I80	K53-E61 VanDerWaalsContact CE-OE2 3.28Å; K53-E61 WeakPolarHBondContact CE-OE2 3.4Å; K53-E61 IonicContact NZ-OE1 2.69Å; K53-E61 PolarHBondContact NZ-OE1 3.42Å; K53-E61 IonicContact NZ-OE2 3.34Å; K53-E61 PolarHBondContact NZ-OE2 3.44Å; A56-E61 HydrophobicContact CB-CG 4.16Å; E61-F63 HydrophobicContact CB-CD2 4.48Å; E61-F63 HydrophobicContact CB-CE2 3.67Å; E61-F63 HydrophobicContact CB-CZ 4.2Å; E61-M78 PolarHBondContact N-O 3.43Å; E61-M78 PolarHBondContact O-N 2.83Å; E61-I80 HydrophobicContact CG-CD1 3.88Å; E61-I80 HydrophobicContact CG-CG1 3.94Å
62	V	89	Confident	86.9	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.024	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.7	177	-166.4	0	0	0	0	110.3	I54 G55 A75 L76 L388 F390	I54-V62 HydrophobicContact CD1-CG1 4.04Å; I54-V62 HydrophobicContact CG1-CB 4.22Å; I54-V62 HydrophobicContact CG1-CG1 4.06Å; I54-V62 VanDerWaalsContact CG1-O 3.27Å; I54-V62 WeakPolarHBondContact CG1-O 3.47Å; I54-V62 PolarHBondContact N-O 2.77Å; G55-V62 PolarHBondContact N-O 2.82Å; G55-V62 VanDerWaalsContact N-O 3.13Å; G55-V62 PolarHBondContact O-N 2.81Å; V62-A75 HydrophobicContact CG1-CB 4.42Å; V62-L76 WeakPolarHBondContact CA-O 3.3Å; V62-L388 HydrophobicContact CG2-CD2 4.48Å; V62-F390 HydrophobicContact CB-CD1 3.58Å; V62-F390 HydrophobicContact CB-CE1 3.86Å; V62-F390 HydrophobicContact CB-CG 4.47Å; V62-F390 HydrophobicContact CG1-CD1 3.88Å; V62-F390 HydrophobicContact CG1-CE1 3.58Å; V62-F390 HydrophobicContact CG1-CZ 4.41Å; V62-F390 HydrophobicContact CG2-CD1 3.76Å; V62-F390 HydrophobicContact CG2-CE1 4.15Å
63	F	92.3	Very high	87.1	Confident	32 Å²	32	61.1 Å²	61.1	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135	179	-60.1	-99.4	0	0	0	109.8	C51 E52 K53 E61 V65 A75 L76 M78	C51-F63 HydrophobicContact CB-CB 4.49Å; C51-F63 HydrophobicContact CB-CD1 4.22Å; E52-F63 CarbonylContact O-C 3.51Å; E52-F63 WeakPolarHBondContact O-CA 3.4Å; K53-F63 HydrophobicContact CB-CD1 3.79Å; K53-F63 HydrophobicContact CB-CE1 3.66Å; K53-F63 HydrophobicContact CB-CZ 4.49Å; K53-F63 HydrophobicContact CD-CE1 4.21Å; K53-F63 HydrophobicContact CD-CZ 4.32Å; K53-F63 HydrophobicContact CG-CD1 4.3Å; K53-F63 HydrophobicContact CG-CE1 3.98Å; K53-F63 HydrophobicContact CG-CZ 4.34Å; E61-F63 HydrophobicContact CB-CD2 4.48Å; E61-F63 HydrophobicContact CB-CE2 3.67Å; E61-F63 HydrophobicContact CB-CZ 4.2Å; F63-V65 HydrophobicContact CB-CG1 3.82Å; F63-A75 CarbonylContact O-C 3.56Å; F63-A75 WeakPolarHBondContact O-CA 3.39Å; F63-L76 HydrophobicContact CB-CB 4.42Å; F63-L76 PolarHBondContact N-O 2.66Å; F63-L76 PolarHBondContact O-N 2.98Å; F63-M78 HydrophobicContact CD2-CG 3.94Å; F63-M78 HydrophobicContact CD2-SD 3.66Å; F63-M78 HydrophobicContact CE2-CB 4.24Å; F63-M78 HydrophobicContact CE2-CG 3.96Å; F63-M78 HydrophobicContact CE2-SD 3.43Å; F63-M78 WeakPolarHBondContact CE2-SD 3.22Å; F63-M78 HydrophobicContact CZ-SD 4.24Å
64	K	94.9	Very high	87.3	Confident	57 Å²	57	56.3 Å²	56.3	25%	0.248	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.4	157.6	168.7	178	157.6	-148.8	0	106.1	E52 I54 V73 Y122	E52-K64 HydrophobicContact CB-CB 4.3Å; E52-K64 PolarHBondContact N-O 3.27Å; E52-K64 PolarHBondContact O-N 3.44Å; E52-K64 IonicContact OE1-NZ 3.39Å; E52-K64 PolarHBondContact OE1-NZ 3.13Å; E52-K64 WeakPolarHBondContact OE2-CD 3.31Å; E52-K64 WeakPolarHBondContact OE2-CE 3.19Å; E52-K64 IonicContact OE2-NZ 3.99Å; E52-K64 PolarHBondContact OE2-NZ 2.99Å; I54-K64 HydrophobicContact CD1-CB 4.07Å; I54-K64 HydrophobicContact CG2-CB 3.51Å; I54-K64 HydrophobicContact CG2-CD 4.35Å; K64-V73 HydrophobicContact CG-CG1 4.17Å; K64-Y122 HydrophobicContact CB-CD2 4.24Å; K64-Y122 HydrophobicContact CB-CE2 3.99Å; K64-Y122 HydrophobicContact CD-CD2 4.47Å; K64-Y122 HydrophobicContact CD-CE2 3.84Å; K64-Y122 HydrophobicContact CG-CD2 4.14Å; K64-Y122 HydrophobicContact CG-CE2 3.95Å
65	V	95.6	Very high	87.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.6	-176.1	-59.2	0	0	0	0	110.5	F49 S50 C51 F63 V73 M74 L76 L119	F49-V65 HydrophobicContact CB-CB 4.03Å; F49-V65 HydrophobicContact CD1-CB 4.14Å; F49-V65 HydrophobicContact CD1-CG2 4.05Å; F49-V65 HydrophobicContact CE1-CG2 4.46Å; F49-V65 HydrophobicContact CG-CB 4.13Å; F49-V65 HydrophobicContact CG-CG2 4.36Å; S50-V65 CarbonylContact O-C 3.49Å; S50-V65 VanDerWaalsContact O-CA 3.26Å; S50-V65 WeakPolarHBondContact O-CA 3.32Å; C51-V65 HydrophobicContact CB-CG1 4.23Å; F63-V65 HydrophobicContact CB-CG1 3.82Å; V65-V73 CarbonylContact O-C 3.49Å; V65-V73 WeakPolarHBondContact O-CA 3.37Å; V65-M74 HydrophobicContact CG2-CB 3.88Å; V65-M74 PolarHBondContact N-O 3.11Å; V65-M74 PolarHBondContact O-N 2.95Å; V65-L76 HydrophobicContact CB-CB 4.48Å; V65-L76 HydrophobicContact CG1-CB 3.59Å; V65-L76 HydrophobicContact CG1-CD2 3.96Å; V65-L76 HydrophobicContact CG1-CG 4.43Å; V65-L76 HydrophobicContact CG2-CB 4.01Å; V65-L119 HydrophobicContact CG2-CD2 3.82Å
66	Q	96.6	Very high	88.3	Confident	87 Å²	87	55.4 Å²	55.4	41%	0.407	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.4	173.8	-169.6	179.5	27.7	0	0	109.6	F49 S50 R68 G71 Q72 V73	F49-Q66 VanDerWaalsContact CA-O 3.3Å; F49-Q66 WeakPolarHBondContact CA-O 3.34Å; S50-Q66 PolarHBondContact N-O 3.44Å; S50-Q66 PolarHBondContact O-N 2.9Å; S50-Q66 PolarHBondContact OG-O 2.87Å; Q66-R68 PolarHBondContact O-N 3.39Å; Q66-G71 WeakPolarHBondContact CG-O 3.34Å; Q66-G71 PolarHBondContact NE2-O 2.89Å; Q66-Q72 WeakPolarHBondContact CA-O 3.42Å; Q66-V73 HydrophobicContact CB-CG2 4.39Å; Q66-V73 HydrophobicContact CG-CG2 4.03Å
67	H	94.3	Very high	88.8	Confident	43 Å²	43	53.2 Å²	53.2	20%	0.199	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122	179.7	-178.3	-125.3	0	0	0	110.6	D48 F49 V69 T70 G71 Q72 M74	D48-H67 PolarHBondContact O-CD2 2.65Å; D48-H67 VanDerWaalsContact O-CD2 3.31Å; F49-H67 HydrophobicContact CD1-CB 3.99Å; F49-H67 HydrophobicContact CE1-CB 3.87Å; F49-H67 AromaticContact CE1-CD2 3.94Å; H67-V69 PolarHBondContact O-N 3.34Å; H67-V69 VanDerWaalsContact O-N 3.15Å; H67-T70 PolarHBondContact ND1-N 2.93Å; H67-T70 PolarHBondContact ND1-OG1 2.94Å; H67-T70 PolarHBondContact O-N 3.16Å; H67-G71 WeakPolarHBondContact O-CA 3.46Å; H67-G71 PolarHBondContact O-N 3.35Å; H67-Q72 PolarHBondContact N-O 2.99Å; H67-M74 HydrophobicContact CB-CE 3.93Å
68	R	93.8	Very high	89.6	Confident	168 Å²	168	53.1 Å²	53.1	63%	0.634	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-28.8	-168.3	-68.4	172.6	-171	-87.4	-2.3	114.2	D47 D48 F49 Q66	D47-R68 WeakPolarHBondContact O-CD 3.38Å; D47-R68 PolarHBondContact O-NE 3.15Å; D48-R68 WeakPolarHBondContact O-CB 3.43Å; D48-R68 VanDerWaalsContact O-CG 3.3Å; D48-R68 WeakPolarHBondContact O-CG 3.4Å; D48-R68 PolarHBondContact O-N 3.05Å; F49-R68 VanDerWaalsContact O-CZ 3.28Å; F49-R68 PolarHBondContact O-NE 3.46Å; F49-R68 VanDerWaalsContact O-NE 3.15Å; F49-R68 PolarHBondContact O-NH2 3.13Å; Q66-R68 PolarHBondContact O-N 3.39Å
69	V	91.9	Very high	90.1	Very high	131 Å²	131	45.9 Å²	45.9	79%	0.794	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-37.1	-175.8	-175.8	0	0	0	0	112.7	H67	H67-V69 PolarHBondContact O-N 3.34Å; H67-V69 VanDerWaalsContact O-N 3.15Å
70	T	93.3	Very high	90.3	Very high	89 Å²	89	47.6 Å²	47.6	55%	0.546	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-7.9	-176.8	62.2	0	0	0	0	114	H67 Q72	H67-T70 PolarHBondContact ND1-N 2.93Å; H67-T70 PolarHBondContact ND1-OG1 2.94Å; H67-T70 PolarHBondContact O-N 3.16Å; T70-Q72 PolarHBondContact O-N 2.97Å; T70-Q72 VanDerWaalsContact O-N 3.13Å; T70-Q72 WeakPolarHBondContact OG1-CB 3.4Å
71	G	93.6	Very high	89.8	Confident	36 Å²	36	51.1 Å²	51.1	37%	0.371	27%	0.265	S	S	.	.			trans	67.8	3.5	-174.5	0	0	0	0	0	114.6	Q66 H67 V73	Q66-G71 WeakPolarHBondContact CG-O 3.34Å; Q66-G71 PolarHBondContact NE2-O 2.89Å; H67-G71 WeakPolarHBondContact O-CA 3.46Å; H67-G71 PolarHBondContact O-N 3.35Å; G71-V73 PolarHBondContact O-N 3.43Å
72	Q	94.1	Very high	88.7	Confident	88 Å²	88	51.5 Å²	51.5	41%	0.411	28%	0.278	S	S	.	.			trans	-70.1	125.7	-173.6	-174.4	178	9.5	0	0	111.6	Q66 H67 T70 M74	Q66-Q72 WeakPolarHBondContact CA-O 3.42Å; H67-Q72 PolarHBondContact N-O 2.99Å; T70-Q72 PolarHBondContact O-N 2.97Å; T70-Q72 VanDerWaalsContact O-N 3.13Å; T70-Q72 WeakPolarHBondContact OG1-CB 3.4Å; Q72-M74 HydrophobicContact CB-CE 4.46Å; Q72-M74 HydrophobicContact CG-CE 4.37Å; Q72-M74 HydrophobicContact CG-CG 4.11Å; Q72-M74 HydrophobicContact CG-SD 4.34Å
73	V	95.5	Very high	87.6	Confident	62 Å²	62	56.4 Å²	56.4	38%	0.376	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.5	177	-176.2	0	0	0	0	110.7	K64 V65 Q66 G71 Y122	K64-V73 HydrophobicContact CG-CG1 4.17Å; V65-V73 CarbonylContact O-C 3.49Å; V65-V73 WeakPolarHBondContact O-CA 3.37Å; Q66-V73 HydrophobicContact CB-CG2 4.39Å; Q66-V73 HydrophobicContact CG-CG2 4.03Å; G71-V73 PolarHBondContact O-N 3.43Å; V73-Y122 HydrophobicContact CG1-CD1 4.07Å; V73-Y122 HydrophobicContact CG1-CG 3.98Å
74	M	95.8	Very high	86.3	Confident	7 Å²	7	55.6 Å²	55.6	3%	0.034	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	171.7	-173.2	-63.5	-179.7	-82.6	0	0	110.3	F49 V65 H67 Q72 I107 T120	F49-M74 HydrophobicContact CD1-CE 4.35Å; F49-M74 HydrophobicContact CE1-CE 3.59Å; F49-M74 HydrophobicContact CZ-CE 4.45Å; V65-M74 HydrophobicContact CG2-CB 3.88Å; V65-M74 PolarHBondContact N-O 3.11Å; V65-M74 PolarHBondContact O-N 2.95Å; H67-M74 HydrophobicContact CB-CE 3.93Å; Q72-M74 HydrophobicContact CB-CE 4.46Å; Q72-M74 HydrophobicContact CG-CE 4.37Å; Q72-M74 HydrophobicContact CG-CG 4.11Å; Q72-M74 HydrophobicContact CG-SD 4.34Å; M74-I107 HydrophobicContact CB-CD1 4.42Å; M74-I107 HydrophobicContact CG-CD1 3.64Å; M74-I107 HydrophobicContact SD-CB 4.3Å; M74-I107 HydrophobicContact SD-CD1 3.7Å; M74-I107 HydrophobicContact SD-CG2 3.73Å; M74-T120 WeakPolarHBondContact CB-O 3.16Å
75	A	94.8	Very high	85.1	Confident	7 Å²	7	60 Å²	60	6%	0.058	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.5	169.5	0	0	0	0	0	110.1	V62 F63 L119 T120	V62-A75 HydrophobicContact CG1-CB 4.42Å; F63-A75 CarbonylContact O-C 3.56Å; F63-A75 WeakPolarHBondContact O-CA 3.39Å; A75-L119 WeakPolarHBondContact O-CA 3.36Å; A75-T120 PolarHBondContact N-O 2.86Å; A75-T120 PolarHBondContact O-N 3.07Å
76	L	92.6	Very high	84	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113	-179.7	174.6	64.2	0	0	0	109.8	L46 V62 F63 V65 M78 C110 H117 A118 L119	L46-L76 HydrophobicContact CD1-CD2 3.42Å; L46-L76 VanDerWaalsContact CD1-CD2 3.42Å; V62-L76 WeakPolarHBondContact CA-O 3.3Å; F63-L76 HydrophobicContact CB-CB 4.42Å; F63-L76 PolarHBondContact N-O 2.66Å; F63-L76 PolarHBondContact O-N 2.98Å; V65-L76 HydrophobicContact CB-CB 4.48Å; V65-L76 HydrophobicContact CG1-CB 3.59Å; V65-L76 HydrophobicContact CG1-CD2 3.96Å; V65-L76 HydrophobicContact CG1-CG 4.43Å; V65-L76 HydrophobicContact CG2-CB 4.01Å; L76-M78 HydrophobicContact CD1-CG 4.44Å; L76-M78 HydrophobicContact CD2-CG 3.82Å; L76-M78 HydrophobicContact CD2-SD 3.92Å; L76-M78 HydrophobicContact CG-CG 3.76Å; L76-M78 HydrophobicContact CG-SD 4.5Å; L76-M78 PolarHBondContact O-N 3.19Å; L76-C110 HydrophobicContact CD1-CB 3.56Å; L76-H117 HydrophobicContact CD1-CB 3.67Å; L76-A118 WeakPolarHBondContact CA-O 3.37Å; L76-L119 HydrophobicContact CB-CD2 3.95Å; L76-L119 HydrophobicContact CD1-CD2 3.77Å; L76-L119 HydrophobicContact CD1-CG 4.05Å; L76-L119 HydrophobicContact CG-CD2 4.39Å
77	K	88.2	Confident	82.8	Confident	10 Å²	10	61.1 Å²	61.1	4%	0.043	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	95.1	174.9	-167.8	-170.9	-155.3	-171.5	0	109.1	E91 H117 A118 D187 I386 L388	K77-E91 IonicContact NZ-OE1 2.66Å; K77-E91 PolarHBondContact NZ-OE1 3.25Å; K77-E91 IonicContact NZ-OE2 2.66Å; K77-E91 PolarHBondContact NZ-OE2 3.03Å; K77-H117 WeakPolarHBondContact O-CB 3.42Å; K77-A118 HydrophobicContact CB-CB 4.29Å; K77-A118 PolarHBondContact N-O 2.89Å; K77-A118 PolarHBondContact O-N 3.25Å; K77-D187 IonicContact NZ-OD1 3.49Å; K77-D187 PolarHBondContact NZ-OD1 2.92Å; K77-I386 HydrophobicContact CD-CG2 4.14Å; K77-I386 VanDerWaalsContact CE-CG2 3.43Å; K77-I386 WeakPolarHBondContact CE-O 3.18Å; K77-I386 PolarHBondContact NZ-O 3.21Å; K77-L388 HydrophobicContact CB-CD2 4.09Å; K77-L388 HydrophobicContact CD-CD2 3.54Å; K77-L388 HydrophobicContact CD-CG 4.05Å; K77-L388 VanDerWaalsContact CE-CD2 3.5Å; K77-L388 HydrophobicContact CG-CD2 3.78Å
78	M	86.1	Confident	81.9	Confident	26 Å²	26	59.6 Å²	59.6	13%	0.128	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.7	175.4	-61.1	-172.3	69.2	0	0	109.8	L46 S60 E61 F63 L76 H112 H117	L46-M78 HydrophobicContact CD1-CE 4.43Å; L46-M78 HydrophobicContact CD1-SD 4.14Å; L46-M78 HydrophobicContact CD2-CE 4.17Å; S60-M78 CarbonylContact C-O 3.58Å; S60-M78 WeakPolarHBondContact CA-O 3.5Å; S60-M78 VanDerWaalsContact CB-O 3.26Å; S60-M78 WeakPolarHBondContact CB-O 3.48Å; E61-M78 PolarHBondContact N-O 3.43Å; E61-M78 PolarHBondContact O-N 2.83Å; F63-M78 HydrophobicContact CD2-CG 3.94Å; F63-M78 HydrophobicContact CD2-SD 3.66Å; F63-M78 HydrophobicContact CE2-CB 4.24Å; F63-M78 HydrophobicContact CE2-CG 3.96Å; F63-M78 HydrophobicContact CE2-SD 3.43Å; F63-M78 WeakPolarHBondContact CE2-SD 3.22Å; F63-M78 HydrophobicContact CZ-SD 4.24Å; L76-M78 HydrophobicContact CD1-CG 4.44Å; L76-M78 HydrophobicContact CD2-CG 3.82Å; L76-M78 HydrophobicContact CD2-SD 3.92Å; L76-M78 HydrophobicContact CG-CG 3.76Å; L76-M78 HydrophobicContact CG-SD 4.5Å; L76-M78 PolarHBondContact O-N 3.19Å; M78-H112 HydrophobicContact CE-CB 4.23Å; M78-H117 WeakPolarHBondContact CE-NE2 3.26Å; M78-H117 HydrophobicContact CG-CB 4.39Å
79	N	76.4	Confident	81.2	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.053	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.2	179.1	-154.6	-58.3	0	0	0	109.7	F59 L81 N84 M88 H117	F59-N79 PolarHBondContact O-OD1 2.87Å; N79-L81 PolarHBondContact OD1-N 3.13Å; N79-L81 PolarHBondContact OD1-O 2.77Å; N79-N84 PolarHBondContact ND2-ND2 3.14Å; N79-N84 PolarHBondContact OD1-ND2 3.02Å; N79-M88 HydrophobicContact CB-CE 4.37Å; N79-H117 PolarHBondContact N-ND1 3.38Å
80	I	73	Confident	80.8	Confident	83 Å²	83	53.8 Å²	53.8	43%	0.426	30%	0.304	S	S	.	.	S	Bend	trans	-77.7	-28.9	-177.2	-59.4	169.3	0	0	0	110.7	F59 E61	F59-I80 PolarHBondContact O-N 3.31Å; E61-I80 HydrophobicContact CG-CD1 3.88Å; E61-I80 HydrophobicContact CG-CG1 3.94Å
81	L	67.4	Low	80.3	Confident	74 Å²	74	49.9 Å²	49.9	39%	0.387	28%	0.28	S	S	.	.			trans	-115.1	113	-172	-60.3	-176.1	0	0	0	112.5	F59 N79 S83 N84	F59-L81 HydrophobicContact CD1-CD1 4Å; F59-L81 HydrophobicContact CE1-CD1 4.28Å; N79-L81 PolarHBondContact OD1-N 3.13Å; N79-L81 PolarHBondContact OD1-O 2.77Å; L81-S83 PolarHBondContact O-N 3.15Å; L81-N84 VanDerWaalsContact O-CB 3.23Å; L81-N84 WeakPolarHBondContact O-CB 3.4Å; L81-N84 PolarHBondContact O-N 2.83Å
82	A	63.3	Low	79.9	Confident	67 Å²	67	49.1 Å²	49.1	55%	0.554	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-58	-22.2	178	0	0	0	0	0	114.5	N84	A82-N84 PolarHBondContact O-N 3.2Å
83	S	65.4	Low	79.5	Confident	107 Å²	107	50.5 Å²	50.5	75%	0.748	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65.5	-21.9	173.5	52	0	0	0	0	113.6	L81 R85	L81-S83 PolarHBondContact O-N 3.15Å; S83-R85 PolarHBondContact O-N 2.84Å
84	N	65.7	Low	79.2	Confident	14 Å²	14	48.7 Å²	48.7	8%	0.075	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-82.6	4.7	-172.6	-150.8	-1.8	0	0	0	114	N79 L81 A82 A86 N87 M88 I386	N79-N84 PolarHBondContact ND2-ND2 3.14Å; N79-N84 PolarHBondContact OD1-ND2 3.02Å; L81-N84 VanDerWaalsContact O-CB 3.23Å; L81-N84 WeakPolarHBondContact O-CB 3.4Å; L81-N84 PolarHBondContact O-N 2.83Å; A82-N84 PolarHBondContact O-N 3.2Å; N84-A86 VanDerWaalsContact C-N 3.27Å; N84-A86 PolarHBondContact O-N 3.43Å; N84-A86 VanDerWaalsContact O-N 3.17Å; N84-N87 PolarHBondContact O-N 3.3Å; N84-N87 PolarHBondContact OD1-ND2 2.87Å; N84-M88 PolarHBondContact O-N 2.86Å; N84-I386 VanDerWaalsContact ND2-CG1 3.29Å; N84-I386 WeakPolarHBondContact ND2-CG1 3.47Å
85	R	69.6	Low	78.9	Confident	149 Å²	149	48.5 Å²	48.5	56%	0.562	26%	0.261	S	S	*	.	H	α-helix	trans	-52.4	-37.4	-175.6	-177.2	176.1	178.1	163.4	1.6	114.2	S83 L89	S83-R85 PolarHBondContact O-N 2.84Å; R85-L89 HydrophobicContact CG-CD1 4.09Å; R85-L89 WeakPolarHBondContact O-CB 3.21Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.3Å; R85-L89 PolarHBondContact O-N 3.45Å
86	A	72.3	Confident	78.7	Confident	68 Å²	68	53.6 Å²	53.6	56%	0.562	29%	0.288	S	S	*	.	H	α-helix	trans	-67.6	-42.5	-178.3	0	0	0	0	0	112.5	N84 R90	N84-A86 VanDerWaalsContact C-N 3.27Å; N84-A86 PolarHBondContact O-N 3.43Å; N84-A86 VanDerWaalsContact O-N 3.17Å; A86-R90 PolarHBondContact O-N 3.13Å
87	N	72.1	Confident	78.7	Confident	45 Å²	45	62.7 Å²	62.7	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-45.4	178.6	-63.8	-41.4	0	0	0	111.4	N84 L89 R90 E91 V385 I386	N84-N87 PolarHBondContact O-N 3.3Å; N84-N87 PolarHBondContact OD1-ND2 2.87Å; N87-L89 VanDerWaalsContact C-N 3.27Å; N87-L89 PolarHBondContact O-N 3.2Å; N87-R90 CarbonylContact O-C 3.45Å; N87-R90 WeakPolarHBondContact O-CA 3.45Å; N87-R90 WeakPolarHBondContact O-CB 3.35Å; N87-R90 PolarHBondContact O-N 3.25Å; N87-R90 PolarHBondContact OD1-NH2 2.6Å; N87-R90 VanDerWaalsContact OD1-NH2 3.08Å; N87-E91 PolarHBondContact O-N 3.32Å; N87-V385 HydrophobicContact CB-CG1 3.54Å; N87-I386 HydrophobicContact CB-CD1 4.28Å
88	M	75.4	Confident	78.9	Confident	11 Å²	11	62.8 Å²	62.8	5%	0.054	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-34.7	176.8	170.9	-114.9	-69	0	0	112.2	N79 N84 E91 V92 L116 I386	N79-M88 HydrophobicContact CB-CE 4.37Å; N84-M88 PolarHBondContact O-N 2.86Å; M88-E91 PolarHBondContact O-N 2.88Å; M88-V92 WeakPolarHBondContact O-CB 3.44Å; M88-V92 VanDerWaalsContact O-CG2 3.31Å; M88-V92 WeakPolarHBondContact O-CG2 3.28Å; M88-V92 PolarHBondContact O-N 2.99Å; M88-L116 HydrophobicContact CE-CB 4.33Å; M88-L116 WeakPolarHBondContact CE-O 3.36Å; M88-L116 HydrophobicContact SD-CB 3.73Å; M88-L116 VanDerWaalsContact SD-O 3.33Å; M88-I386 HydrophobicContact CB-CD1 4.18Å
89	L	79.4	Confident	79.4	Confident	61 Å²	61	65.8 Å²	65.8	32%	0.319	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-38.8	170.8	-77.5	170.9	0	0	0	112.7	R85 N87 Q93 L116	R85-L89 HydrophobicContact CG-CD1 4.09Å; R85-L89 WeakPolarHBondContact O-CB 3.21Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.3Å; R85-L89 PolarHBondContact O-N 3.45Å; N87-L89 VanDerWaalsContact C-N 3.27Å; N87-L89 PolarHBondContact O-N 3.2Å; L89-Q93 WeakPolarHBondContact O-CB 3.1Å; L89-Q93 WeakPolarHBondContact O-CG 3.13Å; L89-Q93 PolarHBondContact O-N 2.93Å; L89-L116 HydrophobicContact CD2-CD1 4.06Å
90	R	81.9	Confident	80.4	Confident	116 Å²	116	67.7 Å²	67.7	44%	0.438	36%	0.355	S	S	.	.	H	α-helix	trans	-64.8	-46.7	172.5	-67.5	-166.6	-63.7	141.4	-0.7	111.4	A86 N87 V92 Q93 L94 E192	A86-R90 PolarHBondContact O-N 3.13Å; N87-R90 CarbonylContact O-C 3.45Å; N87-R90 WeakPolarHBondContact O-CA 3.45Å; N87-R90 WeakPolarHBondContact O-CB 3.35Å; N87-R90 PolarHBondContact O-N 3.25Å; N87-R90 PolarHBondContact OD1-NH2 2.6Å; N87-R90 VanDerWaalsContact OD1-NH2 3.08Å; R90-V92 PolarHBondContact O-N 3.45Å; R90-Q93 PolarHBondContact O-N 3Å; R90-L94 WeakPolarHBondContact O-CB 3.39Å; R90-L94 PolarHBondContact O-N 3.21Å; R90-E192 IonicContact NH1-OE1 2.75Å; R90-E192 IonicContact NH1-OE2 3.23Å; R90-E192 PolarHBondContact NH1-OE2 3.33Å
91	E	83.9	Confident	81.5	Confident	6 Å²	6	68.3 Å²	68.3	3%	0.028	37%	0.365	C	S	.	.	H	α-helix	trans	-56.8	-49.6	177.7	-162.4	-166.1	161.6	0	0	110.8	K77 N87 M88 L94 M95 F188 I386	K77-E91 IonicContact NZ-OE1 2.66Å; K77-E91 PolarHBondContact NZ-OE1 3.25Å; K77-E91 IonicContact NZ-OE2 2.66Å; K77-E91 PolarHBondContact NZ-OE2 3.03Å; N87-E91 PolarHBondContact O-N 3.32Å; M88-E91 PolarHBondContact O-N 2.88Å; E91-L94 PolarHBondContact O-N 3.32Å; E91-M95 HydrophobicContact CG-CE 3.96Å; E91-M95 HydrophobicContact CG-CG 4.47Å; E91-M95 HydrophobicContact CG-SD 4.34Å; E91-M95 WeakPolarHBondContact O-CB 3.2Å; E91-M95 VanDerWaalsContact O-CG 3.28Å; E91-M95 WeakPolarHBondContact O-CG 3.42Å; E91-M95 PolarHBondContact O-N 2.85Å; E91-F188 HydrophobicContact CG-CB 4.45Å; E91-I386 WeakPolarHBondContact OE2-CD1 3.34Å
92	V	84.1	Confident	83	Confident	21 Å²	21	65.4 Å²	65.4	13%	0.127	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-43.4	177	165.3	0	0	0	0	112.2	M88 R90 L94 M95 N96 F106 V109 A118	M88-V92 WeakPolarHBondContact O-CB 3.44Å; M88-V92 VanDerWaalsContact O-CG2 3.31Å; M88-V92 WeakPolarHBondContact O-CG2 3.28Å; M88-V92 PolarHBondContact O-N 2.99Å; R90-V92 PolarHBondContact O-N 3.45Å; V92-L94 VanDerWaalsContact C-N 3.3Å; V92-L94 PolarHBondContact O-N 3.03Å; V92-M95 HydrophobicContact CG2-CE 4.36Å; V92-N96 WeakPolarHBondContact O-CB 3.3Å; V92-N96 PolarHBondContact O-N 3.26Å; V92-F106 HydrophobicContact CB-CZ 4.5Å; V92-F106 HydrophobicContact CG1-CE1 4.33Å; V92-F106 HydrophobicContact CG1-CE2 4.2Å; V92-F106 HydrophobicContact CG1-CZ 3.66Å; V92-F106 HydrophobicContact CG2-CE2 4.15Å; V92-F106 HydrophobicContact CG2-CZ 4.38Å; V92-V109 HydrophobicContact CG1-CG2 4Å; V92-A118 HydrophobicContact CG2-CB 4.19Å
93	Q	86.9	Confident	84.7	Confident	117 Å²	117	62.3 Å²	62.3	55%	0.547	32%	0.323	S	S	.	.	H	α-helix	trans	-65	-33.1	177.4	-76.7	175.1	5.8	0	0	113	L89 R90 R97	L89-Q93 WeakPolarHBondContact O-CB 3.1Å; L89-Q93 WeakPolarHBondContact O-CG 3.13Å; L89-Q93 PolarHBondContact O-N 2.93Å; R90-Q93 PolarHBondContact O-N 3Å; Q93-R97 WeakPolarHBondContact O-CD 3.49Å; Q93-R97 WeakPolarHBondContact O-CG 3.37Å
94	L	89.6	Confident	86.1	Confident	24 Å²	24	57.4 Å²	57.4	13%	0.126	29%	0.289	C	S	.	.	H	α-helix	trans	-70.9	-58	173.5	169	54.2	0	0	0	110.7	R90 E91 V92 N96 R97 L98 I162 F188 A191	R90-L94 WeakPolarHBondContact O-CB 3.39Å; R90-L94 PolarHBondContact O-N 3.21Å; E91-L94 PolarHBondContact O-N 3.32Å; V92-L94 VanDerWaalsContact C-N 3.3Å; V92-L94 PolarHBondContact O-N 3.03Å; L94-N96 VanDerWaalsContact C-N 3.25Å; L94-N96 PolarHBondContact O-N 3.49Å; L94-R97 WeakPolarHBondContact O-CA 3.45Å; L94-R97 WeakPolarHBondContact O-CB 3.31Å; L94-R97 PolarHBondContact O-N 2.89Å; L94-L98 HydrophobicContact CD1-CD1 4.13Å; L94-L98 HydrophobicContact CD1-CD2 4.18Å; L94-L98 HydrophobicContact CD1-CG 4.2Å; L94-L98 HydrophobicContact CG-CD1 4.3Å; L94-I162 HydrophobicContact CD1-CD1 3.53Å; L94-I162 HydrophobicContact CD1-CG1 4.26Å; L94-I162 HydrophobicContact CD1-CG2 4.16Å; L94-I162 HydrophobicContact CD2-CG2 4.31Å; L94-F188 HydrophobicContact CD2-CB 3.88Å; L94-F188 HydrophobicContact CG-CB 4.44Å; L94-A191 HydrophobicContact CD2-CB 3.69Å
95	M	89.6	Confident	87.5	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-57.2	-36.7	-177.4	-68.8	-169.1	-65.6	0	0	112.7	E91 V92 R97 L98 F106 A118 T120 F188	E91-M95 HydrophobicContact CG-CE 3.96Å; E91-M95 HydrophobicContact CG-CG 4.47Å; E91-M95 HydrophobicContact CG-SD 4.34Å; E91-M95 WeakPolarHBondContact O-CB 3.2Å; E91-M95 VanDerWaalsContact O-CG 3.28Å; E91-M95 WeakPolarHBondContact O-CG 3.42Å; E91-M95 PolarHBondContact O-N 2.85Å; V92-M95 HydrophobicContact CG2-CE 4.36Å; M95-R97 PolarHBondContact O-N 3.32Å; M95-R97 VanDerWaalsContact O-N 3.1Å; M95-L98 PolarHBondContact O-N 2.8Å; M95-F106 HydrophobicContact CB-CB 3.99Å; M95-F106 HydrophobicContact CB-CD2 4.17Å; M95-F106 HydrophobicContact CB-CG 4.2Å; M95-F106 HydrophobicContact CE-CD2 3.92Å; M95-F106 HydrophobicContact CE-CE2 4.2Å; M95-A118 HydrophobicContact CE-CB 3.99Å; M95-T120 HydrophobicContact SD-CG2 4.36Å; M95-F188 HydrophobicContact CG-CB 4.33Å; M95-F188 HydrophobicContact CG-CD2 3.71Å; M95-F188 HydrophobicContact CG-CG 4.38Å; M95-F188 HydrophobicContact SD-CD2 4.1Å
96	N	89.6	Confident	88.6	Confident	114 Å²	114	55.8 Å²	55.8	61%	0.61	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.5	175.8	-168.5	84.4	0	0	0	114.1	V92 L94 F106	V92-N96 WeakPolarHBondContact O-CB 3.3Å; V92-N96 PolarHBondContact O-N 3.26Å; L94-N96 VanDerWaalsContact C-N 3.25Å; L94-N96 PolarHBondContact O-N 3.49Å; N96-F106 HydrophobicContact CB-CD1 3.8Å; N96-F106 HydrophobicContact CB-CE1 4.01Å; N96-F106 WeakPolarHBondContact OD1-CD1 3.43Å
97	R	91.9	Very high	89.5	Confident	190 Å²	190	55.2 Å²	55.2	72%	0.717	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-5.4	172.9	-61.6	172.2	-177.5	-160.7	0	113	Q93 L94 M95	Q93-R97 WeakPolarHBondContact O-CD 3.49Å; Q93-R97 WeakPolarHBondContact O-CG 3.37Å; L94-R97 WeakPolarHBondContact O-CA 3.45Å; L94-R97 WeakPolarHBondContact O-CB 3.31Å; L94-R97 PolarHBondContact O-N 2.89Å; M95-R97 PolarHBondContact O-N 3.32Å; M95-R97 VanDerWaalsContact O-N 3.1Å
98	L	94.2	Very high	90.4	Very high	12 Å²	12	54 Å²	54	6%	0.063	27%	0.267	C	S	.	.			trans	-99.7	133.1	-178.8	-54.9	179.4	0	0	0	110.4	L94 M95 I103 Y156 L157 K160 F188	L94-L98 HydrophobicContact CD1-CD1 4.13Å; L94-L98 HydrophobicContact CD1-CD2 4.18Å; L94-L98 HydrophobicContact CD1-CG 4.2Å; L94-L98 HydrophobicContact CG-CD1 4.3Å; M95-L98 PolarHBondContact O-N 2.8Å; L98-I103 HydrophobicContact CB-CG2 3.9Å; L98-I103 HydrophobicContact CD1-CG2 4.08Å; L98-Y156 HydrophobicContact CB-CE1 4.27Å; L98-Y156 HydrophobicContact CD2-CE1 3.96Å; L98-L157 HydrophobicContact CD1-CD1 3.84Å; L98-L157 HydrophobicContact CD2-CD1 3.92Å; L98-K160 HydrophobicContact CD2-CG 4.49Å; L98-F188 HydrophobicContact CD1-CD1 4.21Å; L98-F188 HydrophobicContact CD1-CD2 4.33Å; L98-F188 HydrophobicContact CD1-CE1 4.19Å; L98-F188 HydrophobicContact CD1-CE2 4.3Å; L98-F188 HydrophobicContact CD1-CG 4.29Å; L98-F188 HydrophobicContact CD1-CZ 4.25Å
99	S	95.5	Very high	91	Very high	90 Å²	90	54.6 Å²	54.6	63%	0.629	27%	0.272	S	S	*	.			trans	-153.9	104.1	176.2	-175	0	0	0	0	109.3	Y156	S99-Y156 PolarHBondContact N-OH 2.93Å; S99-Y156 WeakPolarHBondContact O-CE2 3.29Å; S99-Y156 VanDerWaalsContact O-CZ 3.28Å; S99-Y156 PolarHBondContact O-OH 2.82Å
100	H	97.7	Very high	91.5	Very high	49 Å²	49	51.7 Å²	51.7	23%	0.227	26%	0.257	C	S	.	.			trans	-162.7	140.4	-178.1	-179.1	-94.4	0	0	0	108.7	N102 I103 Y156	H100-N102 PolarHBondContact CE1-OD1 3.19Å; H100-N102 VanDerWaalsContact CE1-OD1 3.29Å; H100-N102 PolarHBondContact ND1-N 2.85Å; H100-N102 PolarHBondContact O-N 2.95Å; H100-N102 VanDerWaalsContact O-N 3.13Å; H100-I103 HydrophobicContact CB-CB 4.11Å; H100-I103 HydrophobicContact CB-CG1 3.99Å; H100-I103 PolarHBondContact O-N 3.14Å; H100-I103 VanDerWaalsContact O-O 3.11Å; H100-Y156 HydrophobicContact CB-CD1 3.74Å; H100-Y156 HydrophobicContact CB-CD2 3.76Å; H100-Y156 HydrophobicContact CB-CE1 4Å; H100-Y156 HydrophobicContact CB-CE2 3.99Å; H100-Y156 HydrophobicContact CB-CG 3.61Å; H100-Y156 AromaticContact CD2-CD2 3.74Å; H100-Y156 AromaticContact CD2-CG 3.86Å; H100-Y156 AromaticContact CG-CD2 3.93Å; H100-Y156 AromaticContact CG-CG 3.71Å
101	P	96.7	Very high	91.7	Very high	97 Å²	97	48.3 Å²	48.3	63%	0.63	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.1	-173.4	22.2	-35.1	0	0	0	115
102	N	98.3	Very high	91.9	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.064	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	19	177	-48.4	107.1	0	0	0	113.6	H100 D149 A183 V185	H100-N102 PolarHBondContact CE1-OD1 3.19Å; H100-N102 VanDerWaalsContact CE1-OD1 3.29Å; H100-N102 PolarHBondContact ND1-N 2.85Å; H100-N102 PolarHBondContact O-N 2.95Å; H100-N102 VanDerWaalsContact O-N 3.13Å; N102-D149 WeakPolarHBondContact CB-O 3.42Å; N102-D149 VanDerWaalsContact ND2-CB 3.25Å; N102-D149 WeakPolarHBondContact ND2-CB 3.44Å; N102-A183 WeakPolarHBondContact CB-O 3.29Å; N102-A183 PolarHBondContact ND2-O 2.94Å; N102-V185 PolarHBondContact O-N 2.72Å
103	I	97.9	Very high	91.9	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-123.1	132.8	172.9	-69.1	-68.6	0	0	0	108.3	L98 H100 R105 Y156 V185 F188	L98-I103 HydrophobicContact CB-CG2 3.9Å; L98-I103 HydrophobicContact CD1-CG2 4.08Å; H100-I103 HydrophobicContact CB-CB 4.11Å; H100-I103 HydrophobicContact CB-CG1 3.99Å; H100-I103 PolarHBondContact O-N 3.14Å; H100-I103 VanDerWaalsContact O-O 3.11Å; I103-R105 PolarHBondContact O-N 3.18Å; I103-Y156 HydrophobicContact CG1-CD1 4.03Å; I103-V185 WeakPolarHBondContact CA-O 3.46Å; I103-V185 HydrophobicContact CD1-CB 4.25Å; I103-F188 HydrophobicContact CD1-CE1 4.24Å; I103-F188 HydrophobicContact CD1-CZ 3.95Å; I103-F188 HydrophobicContact CG2-CE2 4.13Å; I103-F188 HydrophobicContact CG2-CZ 3.79Å
104	L	96	Very high	91.5	Very high	4 Å²	4	55 Å²	55	2%	0.021	30%	0.296	C	S	.	.			trans	-59.9	113.8	-176.8	-178	65.1	0	0	0	111	F106 T120 E121 I123 L173 V184 V185 F188 L388	L104-F106 PolarHBondContact O-N 3.46Å; L104-T120 HydrophobicContact CD2-CG2 4.06Å; L104-T120 HydrophobicContact CG-CG2 4.25Å; L104-E121 HydrophobicContact CD1-CG 3.73Å; L104-I123 HydrophobicContact CD1-CD1 4.33Å; L104-I123 HydrophobicContact CD1-CG1 3.87Å; L104-L173 HydrophobicContact CD1-CD1 4.14Å; L104-L173 HydrophobicContact CD2-CD1 4.24Å; L104-V184 HydrophobicContact CB-CG1 4.07Å; L104-V184 HydrophobicContact CD1-CG1 4.42Å; L104-V185 PolarHBondContact N-O 3.12Å; L104-F188 HydrophobicContact CB-CE2 4.47Å; L104-L388 HydrophobicContact CD2-CD1 3.42Å; L104-L388 VanDerWaalsContact CD2-CD1 3.42Å
105	R	94.5	Very high	91	Very high	103 Å²	103	56 Å²	56	39%	0.389	30%	0.3	S	S	.	.			trans	-75.4	124.9	-173.2	-174	175.6	52.9	77.8	6	112.1	I103 T120 E121	I103-R105 PolarHBondContact O-N 3.18Å; R105-T120 WeakPolarHBondContact O-CA 3.27Å; R105-E121 HydrophobicContact CB-CG 4.14Å; R105-E121 WeakPolarHBondContact CB-OE1 3.23Å; R105-E121 IonicContact CZ-OE2 2.66Å; R105-E121 PolarHBondContact N-OE1 3.03Å; R105-E121 VanDerWaalsContact N-OE1 3.07Å; R105-E121 IonicContact NE-OE2 3.69Å; R105-E121 IonicContact NH2-OE2 3.01Å; R105-E121 PolarHBondContact NH2-OE2 2.87Å; R105-E121 PolarHBondContact O-N 2.99Å
106	F	92.9	Very high	90.7	Very high	26 Å²	26	57.9 Å²	57.9	11%	0.114	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	145.5	167.8	-169.5	-115.7	0	0	0	111.6	V92 M95 N96 L104 G108 V109 A118	V92-F106 HydrophobicContact CB-CZ 4.5Å; V92-F106 HydrophobicContact CG1-CE1 4.33Å; V92-F106 HydrophobicContact CG1-CE2 4.2Å; V92-F106 HydrophobicContact CG1-CZ 3.66Å; V92-F106 HydrophobicContact CG2-CE2 4.15Å; V92-F106 HydrophobicContact CG2-CZ 4.38Å; M95-F106 HydrophobicContact CB-CB 3.99Å; M95-F106 HydrophobicContact CB-CD2 4.17Å; M95-F106 HydrophobicContact CB-CG 4.2Å; M95-F106 HydrophobicContact CE-CD2 3.92Å; M95-F106 HydrophobicContact CE-CE2 4.2Å; N96-F106 HydrophobicContact CB-CD1 3.8Å; N96-F106 HydrophobicContact CB-CE1 4.01Å; N96-F106 WeakPolarHBondContact OD1-CD1 3.43Å; L104-F106 PolarHBondContact O-N 3.46Å; F106-G108 WeakPolarHBondContact CE2-O 3.25Å; F106-G108 VanDerWaalsContact CZ-C 3.41Å; F106-G108 WeakPolarHBondContact CZ-O 3.12Å; F106-V109 HydrophobicContact CZ-CG2 3.88Å; F106-A118 HydrophobicContact CE2-CB 4.25Å
107	I	92	Very high	90.6	Very high	56 Å²	56	52.8 Å²	52.8	29%	0.287	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	-39.1	176.5	-57.4	-175.9	0	0	0	111.4	M74 L119 E121	M74-I107 HydrophobicContact CB-CD1 4.42Å; M74-I107 HydrophobicContact CG-CD1 3.64Å; M74-I107 HydrophobicContact SD-CB 4.3Å; M74-I107 HydrophobicContact SD-CD1 3.7Å; M74-I107 HydrophobicContact SD-CG2 3.73Å; I107-L119 HydrophobicContact CB-CB 4.41Å; I107-L119 PolarHBondContact N-O 2.92Å; I107-E121 HydrophobicContact CD1-CB 4.14Å
108	G	90.1	Very high	90.4	Very high	19 Å²	19	43.9 Å²	43.9	20%	0.196	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.5	-160.4	179.3	0	0	0	0	0	113.9	F106 L119	F106-G108 WeakPolarHBondContact CE2-O 3.25Å; F106-G108 VanDerWaalsContact CZ-C 3.41Å; F106-G108 WeakPolarHBondContact CZ-O 3.12Å; G108-L119 PolarHBondContact N-O 3.07Å; G108-L119 WeakPolarHBondContact O-CB 3.38Å; G108-L119 PolarHBondContact O-N 3.44Å
109	V	88.4	Confident	90.4	Very high	25 Å²	25	43.6 Å²	43.6	15%	0.152	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.2	-178.8	-179.8	0	0	0	0	109.8	L43 A44 V92 F106 L116 H117	L43-V109 HydrophobicContact CD2-CB 4.16Å; A44-V109 PolarHBondContact N-O 3.29Å; V92-V109 HydrophobicContact CG1-CG2 4Å; F106-V109 HydrophobicContact CZ-CG2 3.88Å; V109-L116 HydrophobicContact CG1-CB 3.77Å; V109-L116 HydrophobicContact CG1-CD1 4.45Å; V109-L116 HydrophobicContact CG1-CD2 3.93Å; V109-L116 HydrophobicContact CG1-CG 4.24Å; V109-H117 WeakPolarHBondContact CA-O 3.4Å
110	C	89.3	Confident	90.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	144.7	167	-178.2	0	0	0	0	109.8	A44 L46 F49 L76 H117 L119	A44-C110 CarbonylContact O-C 3.49Å; A44-C110 VanDerWaalsContact O-CA 3.31Å; A44-C110 WeakPolarHBondContact O-CA 3.46Å; L46-C110 PolarHBondContact N-SG 2.92Å; L46-C110 VanDerWaalsContact N-SG 3.45Å; F49-C110 HydrophobicContact CE2-CB 4.49Å; L76-C110 HydrophobicContact CD1-CB 3.56Å; C110-H117 HydrophobicContact CB-CB 4.33Å; C110-H117 PolarHBondContact N-O 2.95Å; C110-H117 PolarHBondContact O-N 3.19Å; C110-L119 HydrophobicContact CB-CD1 4.04Å; C110-L119 HydrophobicContact CB-CG 4.14Å
111	V	87.1	Confident	90.1	Very high	45 Å²	45	38.1 Å²	38.1	27%	0.273	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.4	174.7	-173.9	0	0	0	0	109.6	L43 A44 Q115 L116	L43-V111 HydrophobicContact CB-CG2 3.72Å; L43-V111 HydrophobicContact CD1-CG2 3.58Å; L43-V111 HydrophobicContact CG-CG2 4.24Å; A44-V111 PolarHBondContact O-N 3.43Å; V111-Q115 WeakPolarHBondContact CA-O 3.45Å; V111-L116 HydrophobicContact CG2-CD2 3.89Å
112	H	86.5	Confident	90.1	Very high	55 Å²	55	35.9 Å²	35.9	26%	0.255	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.3	174.1	-170.3	65.8	0	0	0	109.2	L46 M78 G114 Q115	L46-H112 HydrophobicContact CB-CB 4.27Å; L46-H112 VanDerWaalsContact CD2-CE1 3.41Å; L46-H112 WeakPolarHBondContact CD2-CE1 3.44Å; L46-H112 WeakPolarHBondContact CD2-ND1 3.47Å; M78-H112 HydrophobicContact CE-CB 4.23Å; H112-G114 PolarHBondContact O-N 2.86Å; H112-Q115 PolarHBondContact N-O 3.23Å; H112-Q115 WeakPolarHBondContact O-CA 3.4Å; H112-Q115 WeakPolarHBondContact O-CB 3.45Å; H112-Q115 PolarHBondContact O-N 3.42Å
113	E	84.8	Confident	89.9	Confident	165 Å²	165	35.7 Å²	35.7	77%	0.771	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.9	31	-179.8	-61.3	-169.4	148.6	0	0	116	Q115	E113-Q115 PolarHBondContact O-N 3.39Å
114	G	78.2	Confident	89.6	Confident	65 Å²	65	39.2 Å²	39.2	67%	0.67	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	0.6	-176.9	0	0	0	0	0	115	H112	H112-G114 PolarHBondContact O-N 2.86Å
115	Q	80.4	Confident	89.4	Confident	44 Å²	44	40 Å²	40	21%	0.206	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	163.6	169.7	-55.8	-160.3	55.6	0	0	111.4	V111 H112 E113	V111-Q115 WeakPolarHBondContact CA-O 3.45Å; H112-Q115 PolarHBondContact N-O 3.23Å; H112-Q115 WeakPolarHBondContact O-CA 3.4Å; H112-Q115 WeakPolarHBondContact O-CB 3.45Å; H112-Q115 PolarHBondContact O-N 3.42Å; E113-Q115 PolarHBondContact O-N 3.39Å
116	L	83.3	Confident	89.3	Confident	43 Å²	43	35.2 Å²	35.2	23%	0.225	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	143.9	172.4	-57.3	-176.9	0	0	0	108.9	M88 L89 V109 V111	M88-L116 HydrophobicContact CE-CB 4.33Å; M88-L116 WeakPolarHBondContact CE-O 3.36Å; M88-L116 HydrophobicContact SD-CB 3.73Å; M88-L116 VanDerWaalsContact SD-O 3.33Å; L89-L116 HydrophobicContact CD2-CD1 4.06Å; V109-L116 HydrophobicContact CG1-CB 3.77Å; V109-L116 HydrophobicContact CG1-CD1 4.45Å; V109-L116 HydrophobicContact CG1-CD2 3.93Å; V109-L116 HydrophobicContact CG1-CG 4.24Å; V111-L116 HydrophobicContact CG2-CD2 3.89Å
117	H	86.6	Confident	89.4	Confident	6 Å²	6	34 Å²	34	3%	0.028	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140	-178.2	-60	-30.5	0	0	0	109.5	L76 K77 M78 N79 V109 C110	L76-H117 HydrophobicContact CD1-CB 3.67Å; K77-H117 WeakPolarHBondContact O-CB 3.42Å; M78-H117 WeakPolarHBondContact CE-NE2 3.26Å; M78-H117 HydrophobicContact CG-CB 4.39Å; N79-H117 PolarHBondContact N-ND1 3.38Å; V109-H117 WeakPolarHBondContact CA-O 3.4Å; C110-H117 HydrophobicContact CB-CB 4.33Å; C110-H117 PolarHBondContact N-O 2.95Å; C110-H117 PolarHBondContact O-N 3.19Å
118	A	88.7	Confident	89.6	Confident	3 Å²	3	31.4 Å²	31.4	3%	0.025	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	130	-174.4	0	0	0	0	0	111.2	L76 K77 V92 M95 F106	L76-A118 WeakPolarHBondContact CA-O 3.37Å; K77-A118 HydrophobicContact CB-CB 4.29Å; K77-A118 PolarHBondContact N-O 2.89Å; K77-A118 PolarHBondContact O-N 3.25Å; V92-A118 HydrophobicContact CG2-CB 4.19Å; M95-A118 HydrophobicContact CE-CB 3.99Å; F106-A118 HydrophobicContact CE2-CB 4.25Å
119	L	92.3	Very high	89.9	Confident	7 Å²	7	32.5 Å²	32.5	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121	167.5	-72.3	164	0	0	0	108.9	A44 F49 V65 A75 L76 I107 G108 C110	A44-L119 HydrophobicContact CB-CD1 4.22Å; F49-L119 HydrophobicContact CE2-CD1 4.28Å; F49-L119 HydrophobicContact CZ-CD1 3.74Å; F49-L119 HydrophobicContact CZ-CD2 4.21Å; V65-L119 HydrophobicContact CG2-CD2 3.82Å; A75-L119 WeakPolarHBondContact O-CA 3.36Å; L76-L119 HydrophobicContact CB-CD2 3.95Å; L76-L119 HydrophobicContact CD1-CD2 3.77Å; L76-L119 HydrophobicContact CD1-CG 4.05Å; L76-L119 HydrophobicContact CG-CD2 4.39Å; I107-L119 HydrophobicContact CB-CB 4.41Å; I107-L119 PolarHBondContact N-O 2.92Å; G108-L119 PolarHBondContact N-O 3.07Å; G108-L119 WeakPolarHBondContact O-CB 3.38Å; G108-L119 PolarHBondContact O-N 3.44Å; C110-L119 HydrophobicContact CB-CD1 4.04Å; C110-L119 HydrophobicContact CB-CG 4.14Å
120	T	93.9	Very high	90.1	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.025	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	171	172.6	60.3	0	0	0	0	110	M74 A75 M95 L104 R105	M74-T120 WeakPolarHBondContact CB-O 3.16Å; A75-T120 PolarHBondContact N-O 2.86Å; A75-T120 PolarHBondContact O-N 3.07Å; M95-T120 HydrophobicContact SD-CG2 4.36Å; L104-T120 HydrophobicContact CD2-CG2 4.06Å; L104-T120 HydrophobicContact CG-CG2 4.25Å; R105-T120 WeakPolarHBondContact O-CA 3.27Å
121	E	94.6	Very high	90.4	Very high	19 Å²	19	34.3 Å²	34.3	9%	0.089	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	151.9	168.9	69.6	-177	143.7	0	0	112.5	L104 R105 I107 I123 R175	L104-E121 HydrophobicContact CD1-CG 3.73Å; R105-E121 HydrophobicContact CB-CG 4.14Å; R105-E121 WeakPolarHBondContact CB-OE1 3.23Å; R105-E121 IonicContact CZ-OE2 2.66Å; R105-E121 PolarHBondContact N-OE1 3.03Å; R105-E121 VanDerWaalsContact N-OE1 3.07Å; R105-E121 IonicContact NE-OE2 3.69Å; R105-E121 IonicContact NH2-OE2 3.01Å; R105-E121 PolarHBondContact NH2-OE2 2.87Å; R105-E121 PolarHBondContact O-N 2.99Å; I107-E121 HydrophobicContact CD1-CB 4.14Å; E121-I123 HydrophobicContact CG-CD1 3.94Å; E121-R175 VanDerWaalsContact CD-NH2 3.26Å; E121-R175 IonicContact OE1-NH2 3.19Å; E121-R175 PolarHBondContact OE1-NH2 3.23Å; E121-R175 IonicContact OE2-CZ 2.72Å; E121-R175 IonicContact OE2-NH1 3.77Å; E121-R175 IonicContact OE2-NH2 2.94Å; E121-R175 PolarHBondContact OE2-NH2 2.92Å
122	Y	95.2	Very high	90.8	Very high	51 Å²	51	32.5 Å²	32.5	20%	0.2	18%	0.179	C	C	.	.			trans	-84.1	134.4	171.7	-178.6	-104.6	0	0	0	110.2	I54 K64 V73 N124	I54-Y122 HydrophobicContact CD1-CD2 4.38Å; I54-Y122 HydrophobicContact CD1-CE2 4.01Å; K64-Y122 HydrophobicContact CB-CD2 4.24Å; K64-Y122 HydrophobicContact CB-CE2 3.99Å; K64-Y122 HydrophobicContact CD-CD2 4.47Å; K64-Y122 HydrophobicContact CD-CE2 3.84Å; K64-Y122 HydrophobicContact CG-CD2 4.14Å; K64-Y122 HydrophobicContact CG-CE2 3.95Å; V73-Y122 HydrophobicContact CG1-CD1 4.07Å; V73-Y122 HydrophobicContact CG1-CG 3.98Å; Y122-N124 HydrophobicContact CD1-CB 4.37Å; Y122-N124 HydrophobicContact CE1-CB 3.84Å
123	I	95	Very high	91.2	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.041	20%	0.202	C	C	.	.			trans	-114.8	129.4	175.2	-54.8	-61	0	0	0	107.7	L104 E121 L173 V174 R175 V184	L104-I123 HydrophobicContact CD1-CD1 4.33Å; L104-I123 HydrophobicContact CD1-CG1 3.87Å; E121-I123 HydrophobicContact CG-CD1 3.94Å; I123-L173 HydrophobicContact CB-CB 4.03Å; I123-L173 HydrophobicContact CB-CD1 4.17Å; I123-L173 HydrophobicContact CG1-CB 4.13Å; I123-L173 HydrophobicContact CG1-CD1 3.91Å; I123-L173 HydrophobicContact CG2-CB 3.72Å; I123-V174 WeakPolarHBondContact CG2-O 3.47Å; I123-R175 HydrophobicContact CG2-CB 4.19Å; I123-V184 HydrophobicContact CD1-CB 4.41Å; I123-V184 HydrophobicContact CD1-CG1 4.38Å; I123-V184 HydrophobicContact CD1-CG2 4.11Å
124	N	92.5	Very high	91.6	Very high	76 Å²	76	27.2 Å²	27.2	41%	0.406	18%	0.177	S	C	.	.	S	Bend	trans	-99.1	-8.6	-158.4	65.2	-38.4	0	0	0	116.3	Y122 L176	Y122-N124 HydrophobicContact CD1-CB 4.37Å; Y122-N124 HydrophobicContact CE1-CB 3.84Å; N124-L176 PolarHBondContact ND2-O 2.85Å; N124-L176 PolarHBondContact OD1-N 3.46Å
125	G	91	Very high	92.3	Very high	19 Å²	19	32.3 Å²	32.3	20%	0.196	19%	0.189	C	C	.	.	S	Bend	trans	-107.5	15.3	-179.3	0	0	0	0	0	115.1	V174	G125-V174 CarbonylContact C-O 3.59Å; G125-V174 WeakPolarHBondContact CA-O 3.43Å; G125-V174 PolarHBondContact N-O 2.71Å
126	G	92.3	Very high	92.8	Very high	3 Å²	3	34.1 Å²	34.1	3%	0.031	20%	0.203	C	C	.	.			trans	73.7	-145	-179.8	0	0	0	0	0	112.3	L173 V174	G126-L173 WeakPolarHBondContact O-CA 3.49Å; G126-V174 PolarHBondContact O-N 3.47Å
127	N	94.3	Very high	93.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-111.9	166.5	177.2	71.6	63.4	0	0	0	113.3	E129 Q130 L131 K170 C172 L173 T389 F390	N127-E129 PolarHBondContact O-N 2.89Å; N127-E129 VanDerWaalsContact OD1-CB 3.32Å; N127-E129 WeakPolarHBondContact OD1-CB 3.44Å; N127-E129 PolarHBondContact OD1-N 2.88Å; N127-Q130 PolarHBondContact ND2-OE1 2.83Å; N127-Q130 WeakPolarHBondContact O-CB 2.97Å; N127-Q130 PolarHBondContact O-N 2.8Å; N127-Q130 PolarHBondContact OD1-N 2.77Å; N127-L131 PolarHBondContact O-N 3.39Å; N127-L131 VanDerWaalsContact O-N 3.09Å; N127-K170 WeakPolarHBondContact CB-O 3.2Å; N127-C172 CarbonylContact C-O 3.23Å; N127-C172 WeakPolarHBondContact CA-O 3.3Å; N127-L173 HydrophobicContact CB-CD2 4.07Å; N127-T389 HydrophobicContact CB-CG2 4.03Å; N127-T389 WeakPolarHBondContact ND2-CG2 3.46Å; N127-F390 PolarHBondContact ND2-O 2.96Å; N127-F390 VanDerWaalsContact ND2-O 3.1Å
128	L	96.9	Very high	93.4	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-33.2	-174.9	178.4	68.1	0	0	0	112.7	Q130 L131 L132 L146 I150 S169 C172 V174 I237 I241	L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 3.34Å; L128-L131 HydrophobicContact CD1-CD2 4.34Å; L128-L131 PolarHBondContact O-N 3.38Å; L128-L132 HydrophobicContact CD1-CD1 4.07Å; L128-L132 HydrophobicContact CD1-CD2 4.32Å; L128-L132 HydrophobicContact CD1-CG 3.88Å; L128-L132 HydrophobicContact CD2-CD1 4.3Å; L128-L132 HydrophobicContact CG-CD1 3.78Å; L128-L132 HydrophobicContact CG-CG 4.05Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 VanDerWaalsContact O-CG 3.23Å; L128-L132 WeakPolarHBondContact O-CG 3.42Å; L128-L132 PolarHBondContact O-N 3.42Å; L128-L146 HydrophobicContact CD1-CD1 4.09Å; L128-I150 HydrophobicContact CD2-CD1 3.87Å; L128-S169 WeakPolarHBondContact CB-O 3.35Å; L128-S169 PolarHBondContact N-O 3.32Å; L128-C172 HydrophobicContact CB-CB 4.02Å; L128-C172 HydrophobicContact CD2-CB 4.32Å; L128-C172 PolarHBondContact N-O 3.38Å; L128-V174 HydrophobicContact CB-CG2 4.33Å; L128-I237 HydrophobicContact CD2-CG2 3.64Å; L128-I241 HydrophobicContact CD1-CG1 4.48Å; L128-I241 HydrophobicContact CD2-CD1 4Å; L128-I241 HydrophobicContact CD2-CG1 4.05Å
129	E	95.5	Very high	93.7	Very high	41 Å²	41	42.4 Å²	42.4	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-45.8	173.2	-175	-174	-123.7	0	0	110.6	N127 L132 G133 S169 K170	N127-E129 PolarHBondContact O-N 2.89Å; N127-E129 VanDerWaalsContact OD1-CB 3.32Å; N127-E129 WeakPolarHBondContact OD1-CB 3.44Å; N127-E129 PolarHBondContact OD1-N 2.88Å; E129-L132 PolarHBondContact O-N 3.09Å; E129-G133 PolarHBondContact O-N 3.09Å; E129-S169 PolarHBondContact N-O 2.95Å; E129-K170 HydrophobicContact CB-CG 4.26Å; E129-K170 IonicContact OE1-NZ 2.66Å; E129-K170 PolarHBondContact OE1-NZ 2.98Å; E129-K170 WeakPolarHBondContact OE2-CE 3.33Å; E129-K170 WeakPolarHBondContact OE2-CG 3.45Å; E129-K170 IonicContact OE2-NZ 2.68Å; E129-K170 PolarHBondContact OE2-NZ 3.13Å
130	Q	94.5	Very high	93.8	Very high	47 Å²	47	44 Å²	44	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-45.8	175.6	-62.9	-173.1	-93.9	0	0	112.4	N127 L128 G133 S134 T391 L392	N127-Q130 PolarHBondContact ND2-OE1 2.83Å; N127-Q130 WeakPolarHBondContact O-CB 2.97Å; N127-Q130 PolarHBondContact O-N 2.8Å; N127-Q130 PolarHBondContact OD1-N 2.77Å; L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 3.34Å; Q130-G133 PolarHBondContact O-N 3.19Å; Q130-S134 PolarHBondContact O-N 2.66Å; Q130-S134 VanDerWaalsContact O-N 3.11Å; Q130-T391 HydrophobicContact CG-CG2 4.32Å; Q130-T391 VanDerWaalsContact NE2-CG2 3.29Å; Q130-L392 PolarHBondContact NE2-O 3.06Å
131	L	95.6	Very high	93.7	Very high	17 Å²	17	45.9 Å²	45.9	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-46.9	178.6	-178.9	68.3	0	0	0	110.7	N127 L128 G133 S134 L138 L146 V174 R244	N127-L131 PolarHBondContact O-N 3.39Å; N127-L131 VanDerWaalsContact O-N 3.09Å; L128-L131 HydrophobicContact CD1-CD2 4.34Å; L128-L131 PolarHBondContact O-N 3.38Å; L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 3.25Å; L131-S134 PolarHBondContact O-N 2.86Å; L131-S134 PolarHBondContact O-OG 3.24Å; L131-L138 HydrophobicContact CD1-CD2 4.32Å; L131-L138 HydrophobicContact CD2-CD1 4.38Å; L131-L138 HydrophobicContact CD2-CD2 4.18Å; L131-L138 HydrophobicContact CG-CD1 4.22Å; L131-L138 HydrophobicContact CG-CD2 4.3Å; L131-L146 HydrophobicContact CD2-CD1 3.78Å; L131-V174 HydrophobicContact CB-CG2 4.34Å; L131-V174 HydrophobicContact CD2-CG1 4.15Å; L131-V174 HydrophobicContact CD2-CG2 4.03Å; L131-R244 PolarHBondContact O-NH2 3.36Å
132	L	95.7	Very high	93.7	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-35.5	-179.3	-69.3	174.9	0	0	0	112.3	L128 E129 L138 E240 I241 R244	L128-L132 HydrophobicContact CD1-CD1 4.07Å; L128-L132 HydrophobicContact CD1-CD2 4.32Å; L128-L132 HydrophobicContact CD1-CG 3.88Å; L128-L132 HydrophobicContact CD2-CD1 4.3Å; L128-L132 HydrophobicContact CG-CD1 3.78Å; L128-L132 HydrophobicContact CG-CG 4.05Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 VanDerWaalsContact O-CG 3.23Å; L128-L132 WeakPolarHBondContact O-CG 3.42Å; L128-L132 PolarHBondContact O-N 3.42Å; E129-L132 PolarHBondContact O-N 3.09Å; L132-L138 HydrophobicContact CD2-CD1 3.88Å; L132-E240 HydrophobicContact CD1-CB 3.79Å; L132-I241 HydrophobicContact CD1-CG1 4.09Å; L132-I241 HydrophobicContact CD2-CG1 4.3Å; L132-R244 HydrophobicContact CD2-CG 4.38Å; L132-R244 VanDerWaalsContact O-CZ 3.31Å; L132-R244 PolarHBondContact O-NE 2.61Å; L132-R244 PolarHBondContact O-NH2 2.99Å
133	G	93.9	Very high	93.8	Very high	72 Å²	72	44.8 Å²	44.8	74%	0.742	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-3.2	174.3	0	0	0	0	0	116.4	E129 Q130 L131	E129-G133 PolarHBondContact O-N 3.09Å; Q130-G133 PolarHBondContact O-N 3.19Å; L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 3.25Å
134	S	93.6	Very high	93.8	Very high	36 Å²	36	44.5 Å²	44.5	25%	0.252	26%	0.259	S	S	.	.	S	Bend	trans	-86.9	159	179.5	74.1	0	0	0	0	113.6	Q130 L131 V136 R244	Q130-S134 PolarHBondContact O-N 2.66Å; Q130-S134 VanDerWaalsContact O-N 3.11Å; L131-S134 PolarHBondContact O-N 2.86Å; L131-S134 PolarHBondContact O-OG 3.24Å; S134-V136 PolarHBondContact O-N 2.84Å; S134-V136 VanDerWaalsContact O-N 3.17Å; S134-R244 PolarHBondContact O-NH2 3.29Å
135	D	91.5	Very high	94	Very high	173 Å²	173	41.9 Å²	41.9	93%	0.925	25%	0.247	S	C	*	.	S	Bend	trans	-71.8	-3.8	175.9	-62.1	-68.3	0	0	0	114.2	Y137	D135-Y137 PolarHBondContact O-N 2.82Å
136	V	91	Very high	94.3	Very high	82 Å²	82	41 Å²	41	50%	0.497	24%	0.238	S	C	.	.			trans	-59.5	126.9	178.7	179.7	0	0	0	0	110.7	S134 L138 R244	S134-V136 PolarHBondContact O-N 2.84Å; S134-V136 VanDerWaalsContact O-N 3.17Å; V136-L138 PolarHBondContact O-N 3.39Å; V136-R244 PolarHBondContact O-NH1 3.36Å; V136-R244 PolarHBondContact O-NH2 2.81Å
137	Y	91.1	Very high	94.6	Very high	178 Å²	178	40.9 Å²	40.9	70%	0.698	24%	0.237	S	C	*	.			trans	-70.1	125.1	177.7	176.1	-100.5	0	0	0	112.1	D135	D135-Y137 PolarHBondContact O-N 2.82Å
138	L	93	Very high	94.8	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	24%	0.237	C	C	.	.			trans	-111.4	105.6	176.7	-60.5	178	0	0	0	110.4	L131 L132 V136 R143	L131-L138 HydrophobicContact CD1-CD2 4.32Å; L131-L138 HydrophobicContact CD2-CD1 4.38Å; L131-L138 HydrophobicContact CD2-CD2 4.18Å; L131-L138 HydrophobicContact CG-CD1 4.22Å; L131-L138 HydrophobicContact CG-CD2 4.3Å; L132-L138 HydrophobicContact CD2-CD1 3.88Å; V136-L138 PolarHBondContact O-N 3.39Å; L138-R143 HydrophobicContact CB-CG 4.06Å; L138-R143 PolarHBondContact O-NE 3.04Å; L138-R143 PolarHBondContact O-NH2 2.85Å; L138-R143 VanDerWaalsContact O-NH2 3.07Å
139	S	93.9	Very high	94.9	Very high	44 Å²	44	41.5 Å²	41.5	31%	0.308	24%	0.24	S	C	.	.			trans	-67.1	158.5	171.9	69.7	0	0	0	0	111.8	A141 A142 R143	S139-A141 VanDerWaalsContact C-N 3.26Å; S139-A141 PolarHBondContact O-N 3.26Å; S139-A142 WeakPolarHBondContact O-CB 3.44Å; S139-A142 PolarHBondContact O-N 3.35Å; S139-A142 PolarHBondContact OG-N 3.5Å; S139-R143 WeakPolarHBondContact O-CG 3.41Å; S139-R143 PolarHBondContact O-N 3.08Å
140	W	94.1	Very high	95.1	Very high	39 Å²	39	39.5 Å²	39.5	15%	0.148	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-37	176.9	-71.6	108.3	0	0	0	113	A142 R143 L144 I242 D271 C272 P273 F276	W140-A142 VanDerWaalsContact C-N 3.3Å; W140-A142 PolarHBondContact O-N 3Å; W140-R143 HydrophobicContact CE3-CB 4.31Å; W140-R143 VanDerWaalsContact CH2-NH1 3.3Å; W140-R143 PolarHBondContact O-N 3.18Å; W140-L144 WeakPolarHBondContact O-CB 3.48Å; W140-L144 PolarHBondContact O-N 3.19Å; W140-I242 HydrophobicContact CH2-CG2 4.28Å; W140-I242 HydrophobicContact CZ3-CG1 4.26Å; W140-D271 PolarHBondContact NE1-O 2.98Å; W140-D271 PolarHBondContact NE1-OD2 3.17Å; W140-C272 HydrophobicContact CH2-CB 3.67Å; W140-C272 HydrophobicContact CZ2-CB 4Å; W140-C272 HydrophobicContact CZ3-CB 4.31Å; W140-P273 HydrophobicContact CB-CG 4.44Å; W140-P273 VanDerWaalsContact CD2-CD 3.47Å; W140-P273 HydrophobicContact CD2-CG 4.14Å; W140-P273 HydrophobicContact CE3-CG 4.34Å; W140-P273 HydrophobicContact CG-CG 4.15Å; W140-F276 HydrophobicContact CE3-CD1 4.01Å; W140-F276 HydrophobicContact CE3-CE1 4.2Å; W140-F276 AromaticContact CZ3-CD1 3.74Å; W140-F276 HydrophobicContact CZ3-CD1 3.74Å; W140-F276 AromaticContact CZ3-CE1 3.9Å; W140-F276 HydrophobicContact CZ3-CE1 3.9Å
141	A	93.3	Very high	95.3	Very high	45 Å²	45	37.3 Å²	37.3	37%	0.372	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-32.3	174.1	0	0	0	0	0	113.3	S139 S145	S139-A141 VanDerWaalsContact C-N 3.26Å; S139-A141 PolarHBondContact O-N 3.26Å; A141-S145 WeakPolarHBondContact O-CB 3.44Å; A141-S145 PolarHBondContact O-N 3.36Å; A141-S145 VanDerWaalsContact O-N 3.15Å; A141-S145 PolarHBondContact O-OG 2.69Å
142	A	94.5	Very high	95.4	Very high	26 Å²	26	40 Å²	40	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-73.9	-47	173.7	0	0	0	0	0	111.4	S139 W140 L144 S145 L146	S139-A142 WeakPolarHBondContact O-CB 3.44Å; S139-A142 PolarHBondContact O-N 3.35Å; S139-A142 PolarHBondContact OG-N 3.5Å; W140-A142 VanDerWaalsContact C-N 3.3Å; W140-A142 PolarHBondContact O-N 3Å; A142-L144 PolarHBondContact O-N 3.39Å; A142-S145 WeakPolarHBondContact O-CB 3.45Å; A142-S145 PolarHBondContact O-N 2.98Å; A142-L146 PolarHBondContact O-N 3.21Å
143	R	96.3	Very high	95.6	Very high	20 Å²	20	39.7 Å²	39.7	8%	0.075	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-47.1	175.4	-66.1	-178.5	-154.8	-169.7	22.5	111.9	L138 S139 W140 S145 L146 A147 I241 I242 F276	L138-R143 HydrophobicContact CB-CG 4.06Å; L138-R143 PolarHBondContact O-NE 3.04Å; L138-R143 PolarHBondContact O-NH2 2.85Å; L138-R143 VanDerWaalsContact O-NH2 3.07Å; S139-R143 WeakPolarHBondContact O-CG 3.41Å; S139-R143 PolarHBondContact O-N 3.08Å; W140-R143 HydrophobicContact CE3-CB 4.31Å; W140-R143 VanDerWaalsContact CH2-NH1 3.3Å; W140-R143 PolarHBondContact O-N 3.18Å; R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 3.12Å; R143-L146 PolarHBondContact O-N 3.14Å; R143-A147 WeakPolarHBondContact O-CB 3.45Å; R143-A147 PolarHBondContact O-N 3.25Å; R143-I241 HydrophobicContact CB-CG2 3.58Å; R143-I241 WeakPolarHBondContact CD-O 3.42Å; R143-I241 HydrophobicContact CG-CG2 3.93Å; R143-I242 PolarHBondContact NH1-O 3.46Å; R143-F276 HydrophobicContact CB-CE1 4.42Å
144	L	96.1	Very high	95.8	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-59.9	-37.4	174.3	-176.7	69.8	0	0	0	112.1	W140 A142 L148 Y275 F276 L301 K305 E308	W140-L144 WeakPolarHBondContact O-CB 3.48Å; W140-L144 PolarHBondContact O-N 3.19Å; A142-L144 PolarHBondContact O-N 3.39Å; L144-L148 WeakPolarHBondContact O-CB 3.48Å; L144-L148 PolarHBondContact O-N 2.92Å; L144-Y275 HydrophobicContact CD1-CE2 4.11Å; L144-F276 HydrophobicContact CD1-CD2 4.47Å; L144-L301 HydrophobicContact CD1-CD2 3.62Å; L144-K305 HydrophobicContact CD2-CB 3.9Å; L144-K305 HydrophobicContact CD2-CG 4.23Å; L144-E308 WeakPolarHBondContact CD2-OE2 3.32Å
145	S	96.3	Very high	96.1	Very high	22 Å²	22	38.3 Å²	38.3	15%	0.154	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-47.2	178.1	-63.8	0	0	0	0	112.2	A141 A142 R143 L148 D149 K305	A141-S145 WeakPolarHBondContact O-CB 3.44Å; A141-S145 PolarHBondContact O-N 3.36Å; A141-S145 VanDerWaalsContact O-N 3.15Å; A141-S145 PolarHBondContact O-OG 2.69Å; A142-S145 WeakPolarHBondContact O-CB 3.45Å; A142-S145 PolarHBondContact O-N 2.98Å; R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 3.12Å; S145-L148 PolarHBondContact O-N 3.34Å; S145-D149 WeakPolarHBondContact O-CB 3.43Å; S145-D149 PolarHBondContact O-N 3.3Å; S145-K305 WeakPolarHBondContact OG-CE 3.32Å; S145-K305 PolarHBondContact OG-NZ 3.03Å
146	L	97.9	Very high	96.4	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-59.9	-47.1	175.2	-67.7	167.3	0	0	0	111.2	L128 L131 A142 R143 L148 D149 I150 C181 A183	L128-L146 HydrophobicContact CD1-CD1 4.09Å; L131-L146 HydrophobicContact CD2-CD1 3.78Å; A142-L146 PolarHBondContact O-N 3.21Å; R143-L146 PolarHBondContact O-N 3.14Å; L146-L148 PolarHBondContact O-N 3.18Å; L146-D149 PolarHBondContact O-N 2.86Å; L146-I150 WeakPolarHBondContact O-CG1 3.43Å; L146-I150 PolarHBondContact O-N 3.19Å; L146-C181 HydrophobicContact CD2-CB 3.97Å; L146-C181 HydrophobicContact CG-CB 4.49Å; L146-A183 HydrophobicContact CD2-CB 4Å
147	A	98.5	Very high	96.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-43	177.5	0	0	0	0	0	113.1	R143 A151 Y234 L238 I241 F276	R143-A147 WeakPolarHBondContact O-CB 3.45Å; R143-A147 PolarHBondContact O-N 3.25Å; A147-A151 WeakPolarHBondContact O-CB 3.31Å; A147-A151 PolarHBondContact O-N 3.08Å; A147-A151 VanDerWaalsContact O-N 3.1Å; A147-Y234 WeakPolarHBondContact O-CE2 3.37Å; A147-Y234 PolarHBondContact O-OH 3.49Å; A147-L238 HydrophobicContact CB-CD2 3.59Å; A147-I241 HydrophobicContact CB-CD1 4.28Å; A147-F276 HydrophobicContact CB-CE2 3.71Å; A147-F276 HydrophobicContact CB-CZ 3.72Å
148	L	98.5	Very high	97.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.2	-41.6	176.8	171	59.6	0	0	0	112.1	L144 S145 L146 A151 R152 V298 L301 E302 K305	L144-L148 WeakPolarHBondContact O-CB 3.48Å; L144-L148 PolarHBondContact O-N 2.92Å; S145-L148 PolarHBondContact O-N 3.34Å; L146-L148 PolarHBondContact O-N 3.18Å; L148-A151 PolarHBondContact O-N 2.93Å; L148-R152 HydrophobicContact CD1-CG 4.05Å; L148-R152 HydrophobicContact CG-CG 4.49Å; L148-R152 VanDerWaalsContact O-CG 3.27Å; L148-R152 WeakPolarHBondContact O-CG 3.23Å; L148-R152 PolarHBondContact O-N 2.89Å; L148-V298 HydrophobicContact CD1-CB 4.45Å; L148-V298 HydrophobicContact CD1-CG1 4.07Å; L148-V298 HydrophobicContact CD1-CG2 4.4Å; L148-L301 HydrophobicContact CB-CB 4.32Å; L148-L301 HydrophobicContact CB-CD1 4.19Å; L148-L301 HydrophobicContact CD1-CB 3.86Å; L148-L301 HydrophobicContact CD1-CD1 4.48Å; L148-E302 HydrophobicContact CD1-CG 3.7Å; L148-E302 HydrophobicContact CD2-CG 3.93Å; L148-E302 HydrophobicContact CG-CG 4.47Å; L148-K305 HydrophobicContact CD2-CD 3.58Å
149	D	98.7	Very high	97.3	Very high	15 Å²	15	24.9 Å²	24.9	8%	0.08	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-43.6	-179.9	-81.7	-5.4	0	0	0	111.7	N102 S145 L146 A151 R152 G153 S182 A183	N102-D149 WeakPolarHBondContact CB-O 3.42Å; N102-D149 VanDerWaalsContact ND2-CB 3.25Å; N102-D149 WeakPolarHBondContact ND2-CB 3.44Å; S145-D149 WeakPolarHBondContact O-CB 3.43Å; S145-D149 PolarHBondContact O-N 3.3Å; L146-D149 PolarHBondContact O-N 2.86Å; D149-A151 PolarHBondContact O-N 3.49Å; D149-R152 PolarHBondContact O-N 3.15Å; D149-R152 IonicContact OD1-NH1 3.27Å; D149-R152 PolarHBondContact OD1-NH1 3.48Å; D149-G153 PolarHBondContact O-N 2.98Å; D149-S182 WeakPolarHBondContact OD2-CA 3.45Å; D149-S182 WeakPolarHBondContact OD2-CB 3.28Å; D149-A183 HydrophobicContact CB-CB 3.85Å; D149-A183 PolarHBondContact OD2-N 2.66Å
150	I	98.8	Very high	97.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.4	-47.2	172	-65	165	0	0	0	110.5	L128 L146 R152 G153 L154 C172 A183 V185 Y234 I237	L128-I150 HydrophobicContact CD2-CD1 3.87Å; L146-I150 WeakPolarHBondContact O-CG1 3.43Å; L146-I150 PolarHBondContact O-N 3.19Å; I150-R152 VanDerWaalsContact C-N 3.29Å; I150-R152 PolarHBondContact O-N 3.07Å; I150-G153 PolarHBondContact O-N 3.37Å; I150-L154 HydrophobicContact CG2-CD1 3.73Å; I150-L154 WeakPolarHBondContact O-CG 3.43Å; I150-L154 PolarHBondContact O-N 3.2Å; I150-C172 HydrophobicContact CD1-CB 4.11Å; I150-C172 HydrophobicContact CG1-CB 4.44Å; I150-A183 HydrophobicContact CD1-CB 4.21Å; I150-A183 HydrophobicContact CG1-CB 3.62Å; I150-V185 HydrophobicContact CB-CG2 4.34Å; I150-V185 HydrophobicContact CG1-CG2 4.41Å; I150-V185 HydrophobicContact CG2-CG2 3.96Å; I150-Y234 HydrophobicContact CB-CD2 4.43Å; I150-Y234 HydrophobicContact CB-CE2 4.07Å; I150-Y234 HydrophobicContact CG2-CD2 3.66Å; I150-Y234 HydrophobicContact CG2-CE2 3.8Å; I150-I237 HydrophobicContact CD1-CG2 4.15Å
151	A	98.9	Very high	97.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-34	178.7	0	0	0	0	0	113.1	A147 L148 D149 K155 Y234 F294 I297 V298 L301	A147-A151 WeakPolarHBondContact O-CB 3.31Å; A147-A151 PolarHBondContact O-N 3.08Å; A147-A151 VanDerWaalsContact O-N 3.1Å; L148-A151 PolarHBondContact O-N 2.93Å; D149-A151 PolarHBondContact O-N 3.49Å; A151-K155 VanDerWaalsContact O-CB 3.23Å; A151-K155 WeakPolarHBondContact O-CB 3.43Å; A151-K155 PolarHBondContact O-N 2.75Å; A151-Y234 HydrophobicContact CB-CE2 4.14Å; A151-F294 HydrophobicContact CB-CD1 3.96Å; A151-F294 HydrophobicContact CB-CE1 4.43Å; A151-I297 HydrophobicContact CB-CG2 3.76Å; A151-V298 HydrophobicContact CB-CG2 3.72Å; A151-V298 WeakPolarHBondContact O-CG2 3.46Å; A151-L301 HydrophobicContact CB-CD1 4.41Å
152	R	98.8	Very high	97.7	Very high	75 Å²	75	26.7 Å²	26.7	28%	0.283	14%	0.142	S	C	.	.	H	α-helix	trans	-68.3	-42.4	173.8	-73.7	162.3	164.9	-179.5	-12.5	111.9	L148 D149 I150 K155 Y156 V298 E302	L148-R152 HydrophobicContact CD1-CG 4.05Å; L148-R152 HydrophobicContact CG-CG 4.49Å; L148-R152 VanDerWaalsContact O-CG 3.27Å; L148-R152 WeakPolarHBondContact O-CG 3.23Å; L148-R152 PolarHBondContact O-N 2.89Å; D149-R152 PolarHBondContact O-N 3.15Å; D149-R152 IonicContact OD1-NH1 3.27Å; D149-R152 PolarHBondContact OD1-NH1 3.48Å; I150-R152 VanDerWaalsContact C-N 3.29Å; I150-R152 PolarHBondContact O-N 3.07Å; R152-K155 PolarHBondContact O-N 3.42Å; R152-Y156 PolarHBondContact O-N 2.89Å; R152-V298 HydrophobicContact CG-CG1 4.02Å; R152-V298 HydrophobicContact CG-CG2 3.95Å; R152-E302 IonicContact CZ-OE1 3.47Å; R152-E302 VanDerWaalsContact CZ-OE1 3.27Å; R152-E302 IonicContact NE-OE1 3.15Å; R152-E302 PolarHBondContact NE-OE1 3.17Å; R152-E302 IonicContact NH2-OE1 2.92Å; R152-E302 PolarHBondContact NH2-OE1 2.71Å
153	G	98.7	Very high	97.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-57.1	-48.7	173	0	0	0	0	0	111.9	D149 I150 Y156 L157	D149-G153 PolarHBondContact O-N 2.98Å; I150-G153 PolarHBondContact O-N 3.37Å; G153-Y156 WeakPolarHBondContact O-CB 3.28Å; G153-Y156 PolarHBondContact O-N 2.95Å; G153-L157 PolarHBondContact O-N 2.96Å
154	L	98.8	Very high	97.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.8	-37.3	-179.4	-65.3	163	0	0	0	112.6	I150 Y156 L157 H158 H164 L167 Y234 F294	I150-L154 HydrophobicContact CG2-CD1 3.73Å; I150-L154 WeakPolarHBondContact O-CG 3.43Å; I150-L154 PolarHBondContact O-N 3.2Å; L154-Y156 VanDerWaalsContact C-N 3.29Å; L154-Y156 PolarHBondContact O-N 3.32Å; L154-L157 HydrophobicContact CD2-CD2 4.47Å; L154-L157 PolarHBondContact O-N 3.48Å; L154-H158 WeakPolarHBondContact O-CB 3.38Å; L154-H158 PolarHBondContact O-CD2 3.39Å; L154-H158 PolarHBondContact O-N 3.31Å; L154-H164 HydrophobicContact CD2-CB 4.26Å; L154-L167 HydrophobicContact CD1-CD1 4.15Å; L154-L167 HydrophobicContact CD1-CD2 3.38Å; L154-L167 HydrophobicContact CD1-CG 4.42Å; L154-L167 HydrophobicContact CD2-CD1 4.31Å; L154-L167 HydrophobicContact CD2-CD2 4.15Å; L154-L167 HydrophobicContact CG-CD2 4.41Å; L154-Y234 HydrophobicContact CD1-CD2 4.31Å; L154-F294 HydrophobicContact CB-CD1 3.87Å; L154-F294 HydrophobicContact CB-CD2 3.75Å; L154-F294 HydrophobicContact CB-CE1 3.85Å; L154-F294 HydrophobicContact CB-CE2 3.72Å; L154-F294 HydrophobicContact CB-CG 3.83Å; L154-F294 HydrophobicContact CB-CZ 3.78Å; L154-F294 HydrophobicContact CD1-CD1 4.42Å; L154-F294 HydrophobicContact CD1-CE1 3.6Å; L154-F294 HydrophobicContact CD1-CE2 4.11Å; L154-F294 HydrophobicContact CD1-CZ 3.42Å; L154-F294 VanDerWaalsContact CD1-CZ 3.42Å; L154-F294 HydrophobicContact CG-CE1 4.38Å; L154-F294 HydrophobicContact CG-CE2 4.43Å; L154-F294 HydrophobicContact CG-CZ 4.18Å
155	K	98.8	Very high	97.8	Very high	78 Å²	78	25.6 Å²	25.6	34%	0.339	13%	0.132	S	C	.	.	H	α-helix	trans	-55	-44.9	168.9	-177.9	179.9	177.2	178.2	0	111.6	A151 R152 S159 F294 V298	A151-K155 VanDerWaalsContact O-CB 3.23Å; A151-K155 WeakPolarHBondContact O-CB 3.43Å; A151-K155 PolarHBondContact O-N 2.75Å; R152-K155 PolarHBondContact O-N 3.42Å; K155-S159 WeakPolarHBondContact O-CB 3.21Å; K155-S159 PolarHBondContact O-N 2.88Å; K155-F294 HydrophobicContact CB-CB 3.84Å; K155-V298 HydrophobicContact CB-CG2 4.26Å; K155-V298 HydrophobicContact CD-CB 4.04Å; K155-V298 HydrophobicContact CD-CG1 4.23Å; K155-V298 HydrophobicContact CD-CG2 3.96Å
156	Y	98.7	Very high	97.7	Very high	39 Å²	39	24.9 Å²	24.9	15%	0.153	13%	0.126	C	C	.	.	H	α-helix	trans	-63.5	-47.9	175.6	173.2	-88.5	0	0	0	111.5	L98 S99 H100 I103 R152 G153 L154 H158 S159 K160	L98-Y156 HydrophobicContact CB-CE1 4.27Å; L98-Y156 HydrophobicContact CD2-CE1 3.96Å; S99-Y156 PolarHBondContact N-OH 2.93Å; S99-Y156 WeakPolarHBondContact O-CE2 3.29Å; S99-Y156 VanDerWaalsContact O-CZ 3.28Å; S99-Y156 PolarHBondContact O-OH 2.82Å; H100-Y156 HydrophobicContact CB-CD1 3.74Å; H100-Y156 HydrophobicContact CB-CD2 3.76Å; H100-Y156 HydrophobicContact CB-CE1 4Å; H100-Y156 HydrophobicContact CB-CE2 3.99Å; H100-Y156 HydrophobicContact CB-CG 3.61Å; H100-Y156 AromaticContact CD2-CD2 3.74Å; H100-Y156 AromaticContact CD2-CG 3.86Å; H100-Y156 AromaticContact CG-CD2 3.93Å; H100-Y156 AromaticContact CG-CG 3.71Å; I103-Y156 HydrophobicContact CG1-CD1 4.03Å; R152-Y156 PolarHBondContact O-N 2.89Å; G153-Y156 WeakPolarHBondContact O-CB 3.28Å; G153-Y156 PolarHBondContact O-N 2.95Å; L154-Y156 VanDerWaalsContact C-N 3.29Å; L154-Y156 PolarHBondContact O-N 3.32Å; Y156-H158 PolarHBondContact O-N 2.94Å; Y156-S159 WeakPolarHBondContact O-CB 3.36Å; Y156-S159 PolarHBondContact O-N 3.34Å; Y156-S159 VanDerWaalsContact O-N 3.15Å; Y156-S159 PolarHBondContact O-OG 2.87Å; Y156-K160 HydrophobicContact CE1-CG 4.18Å; Y156-K160 PolarHBondContact O-N 2.97Å; Y156-K160 WeakPolarHBondContact OH-CE 3.49Å
157	L	98.3	Very high	97.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.6	-47.4	-178.6	-168.6	68.7	0	0	0	111.3	L98 G153 L154 S159 K160 I162 H164 F188	L98-L157 HydrophobicContact CD1-CD1 3.84Å; L98-L157 HydrophobicContact CD2-CD1 3.92Å; G153-L157 PolarHBondContact O-N 2.96Å; L154-L157 HydrophobicContact CD2-CD2 4.47Å; L154-L157 PolarHBondContact O-N 3.48Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.27Å; L157-K160 WeakPolarHBondContact O-CA 3.5Å; L157-K160 WeakPolarHBondContact O-CB 3.48Å; L157-K160 PolarHBondContact O-N 3.3Å; L157-I162 CarbonylContact C-O 3.58Å; L157-I162 VanDerWaalsContact C-O 3.23Å; L157-I162 HydrophobicContact CD1-CB 4.19Å; L157-I162 HydrophobicContact CD1-CG2 3.73Å; L157-I162 HydrophobicContact CD2-CG2 4.44Å; L157-I162 HydrophobicContact CG-CB 4.28Å; L157-I162 HydrophobicContact CG-CG2 3.96Å; L157-I162 PolarHBondContact O-N 2.89Å; L157-I162 VanDerWaalsContact O-O 3.06Å; L157-H164 HydrophobicContact CD2-CB 3.96Å; L157-F188 HydrophobicContact CD1-CD1 4.38Å; L157-F188 HydrophobicContact CD1-CE1 4.2Å; L157-F188 HydrophobicContact CD2-CD1 4.46Å; L157-F188 HydrophobicContact CD2-CE1 4.19Å
158	H	97.9	Very high	97.6	Very high	30 Å²	30	25.1 Å²	25.1	14%	0.139	13%	0.128	C	C	.	.	H	α-helix	trans	-63.2	-36.5	176.9	-68.6	-166.8	0	0	0	111.6	L154 Y156 K160 G161 I162 I194 E227 D230 F294	L154-H158 WeakPolarHBondContact O-CB 3.38Å; L154-H158 PolarHBondContact O-CD2 3.39Å; L154-H158 PolarHBondContact O-N 3.31Å; Y156-H158 PolarHBondContact O-N 2.94Å; H158-K160 PolarHBondContact O-N 3.1Å; H158-K160 VanDerWaalsContact O-N 3.11Å; H158-G161 PolarHBondContact O-N 3.49Å; H158-I162 WeakPolarHBondContact CA-O 3.41Å; H158-I162 PolarHBondContact CD2-O 3.4Å; H158-I162 PolarHBondContact N-O 2.85Å; H158-I194 HydrophobicContact CB-CD1 4.47Å; H158-E227 VanDerWaalsContact CE1-CB 3.49Å; H158-E227 WeakPolarHBondContact CE1-CB 3.37Å; H158-E227 PolarHBondContact CE1-O 3.31Å; H158-E227 VanDerWaalsContact CE1-O 3.31Å; H158-D230 IonicContact CD2-OD2 2.86Å; H158-D230 IonicContact CE1-OD2 3.73Å; H158-D230 IonicContact NE2-OD2 3.74Å; H158-D230 PolarHBondContact NE2-OD2 2.96Å; H158-F294 AromaticContact CE1-CD2 3.41Å; H158-F294 VanDerWaalsContact CE1-CD2 3.41Å; H158-F294 WeakPolarHBondContact CE1-CD2 3.28Å; H158-F294 AromaticContact CE1-CE2 3.51Å; H158-F294 AromaticContact ND1-CD2 3.52Å
159	S	97.6	Very high	97.5	Very high	86 Å²	86	25.1 Å²	25.1	60%	0.601	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-12.1	173.3	83.3	0	0	0	0	114.6	K155 Y156 L157	K155-S159 WeakPolarHBondContact O-CB 3.21Å; K155-S159 PolarHBondContact O-N 2.88Å; Y156-S159 WeakPolarHBondContact O-CB 3.36Å; Y156-S159 PolarHBondContact O-N 3.34Å; Y156-S159 VanDerWaalsContact O-N 3.15Å; Y156-S159 PolarHBondContact O-OG 2.87Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.27Å
160	K	96.8	Very high	97.3	Very high	109 Å²	109	28 Å²	28	47%	0.474	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	6.9	172.2	-59.7	-56.7	-173.5	-175.6	0	113.4	L98 Y156 L157 H158 I162	L98-K160 HydrophobicContact CD2-CG 4.49Å; Y156-K160 HydrophobicContact CE1-CG 4.18Å; Y156-K160 PolarHBondContact O-N 2.97Å; Y156-K160 WeakPolarHBondContact OH-CE 3.49Å; L157-K160 WeakPolarHBondContact O-CA 3.5Å; L157-K160 WeakPolarHBondContact O-CB 3.48Å; L157-K160 PolarHBondContact O-N 3.3Å; H158-K160 PolarHBondContact O-N 3.1Å; H158-K160 VanDerWaalsContact O-N 3.11Å; K160-I162 VanDerWaalsContact C-N 3.31Å; K160-I162 HydrophobicContact CB-CD1 3.89Å
161	G	96	Very high	97.1	Very high	30 Å²	30	28.2 Å²	28.2	31%	0.309	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	26.8	-176.6	0	0	0	0	0	112.9	H158 K193 I194	H158-G161 PolarHBondContact O-N 3.49Å; G161-K193 CarbonylContact O-C 3.58Å; G161-K193 WeakPolarHBondContact O-CA 3.5Å; G161-I194 PolarHBondContact O-N 3.06Å
162	I	96	Very high	97	Very high	28 Å²	28	28.2 Å²	28.2	14%	0.144	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.8	-175.8	-67.4	143.8	0	0	0	109.3	L94 L157 H158 K160 A191 E192	L94-I162 HydrophobicContact CD1-CD1 3.53Å; L94-I162 HydrophobicContact CD1-CG1 4.26Å; L94-I162 HydrophobicContact CD1-CG2 4.16Å; L94-I162 HydrophobicContact CD2-CG2 4.31Å; L157-I162 CarbonylContact C-O 3.58Å; L157-I162 VanDerWaalsContact C-O 3.23Å; L157-I162 HydrophobicContact CD1-CB 4.19Å; L157-I162 HydrophobicContact CD1-CG2 3.73Å; L157-I162 HydrophobicContact CD2-CG2 4.44Å; L157-I162 HydrophobicContact CG-CB 4.28Å; L157-I162 HydrophobicContact CG-CG2 3.96Å; L157-I162 PolarHBondContact O-N 2.89Å; L157-I162 VanDerWaalsContact O-O 3.06Å; H158-I162 WeakPolarHBondContact CA-O 3.41Å; H158-I162 PolarHBondContact CD2-O 3.4Å; H158-I162 PolarHBondContact N-O 2.85Å; K160-I162 VanDerWaalsContact C-N 3.31Å; K160-I162 HydrophobicContact CB-CD1 3.89Å; I162-A191 HydrophobicContact CG2-CB 4.22Å; I162-E192 WeakPolarHBondContact CA-O 3.34Å
163	F	96.2	Very high	97	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	155.2	175.7	73.8	-57.6	0	0	0	111.2	R165 A191 E192 K193 I194 L206 Y225 N226 E227 V229 D230	F163-R165 HydrophobicContact CD1-CG 4.48Å; F163-R165 HydrophobicContact CD2-CG 3.61Å; F163-R165 HydrophobicContact CE1-CG 4.3Å; F163-R165 HydrophobicContact CE2-CG 3.44Å; F163-R165 VanDerWaalsContact CE2-CG 3.44Å; F163-R165 HydrophobicContact CG-CG 4.17Å; F163-R165 HydrophobicContact CZ-CG 3.82Å; F163-A191 WeakPolarHBondContact O-CA 3.36Å; F163-A191 WeakPolarHBondContact O-CB 3.49Å; F163-E192 WeakPolarHBondContact CD1-O 3.46Å; F163-E192 HydrophobicContact CE1-CB 4.29Å; F163-E192 PolarHBondContact N-O 3.21Å; F163-E192 VanDerWaalsContact N-O 3.09Å; F163-E192 PolarHBondContact O-N 2.93Å; F163-E192 VanDerWaalsContact O-N 3.09Å; F163-K193 WeakPolarHBondContact CE1-O 3.48Å; F163-I194 HydrophobicContact CB-CD1 4.35Å; F163-I194 HydrophobicContact CB-CG1 3.83Å; F163-I194 HydrophobicContact CD1-CB 4.29Å; F163-I194 HydrophobicContact CD1-CG1 3.63Å; F163-I194 HydrophobicContact CE1-CG1 4.49Å; F163-I194 HydrophobicContact CG-CG1 3.98Å; F163-L206 HydrophobicContact CE1-CD1 4.1Å; F163-L206 HydrophobicContact CZ-CD1 3.61Å; F163-Y225 AromaticContact CE2-CD2 3.78Å; F163-Y225 HydrophobicContact CE2-CD2 3.78Å; F163-Y225 AromaticContact CE2-CE2 3.68Å; F163-Y225 HydrophobicContact CE2-CE2 3.68Å; F163-Y225 HydrophobicContact CZ-CD2 4.11Å; F163-Y225 AromaticContact CZ-CE2 3.83Å; F163-Y225 HydrophobicContact CZ-CE2 3.83Å; F163-N226 WeakPolarHBondContact CD2-O 3.35Å; F163-N226 VanDerWaalsContact CE2-O 3.27Å; F163-N226 WeakPolarHBondContact CE2-O 3.4Å; F163-E227 HydrophobicContact CB-CB 3.95Å; F163-E227 HydrophobicContact CG-CB 4.44Å; F163-V229 HydrophobicContact CD2-CG2 3.85Å; F163-V229 HydrophobicContact CE2-CG2 3.82Å; F163-D230 WeakPolarHBondContact CA-OD2 3.49Å; F163-D230 WeakPolarHBondContact CB-OD2 3.46Å
164	H	97.2	Very high	96.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.			trans	-84.3	-45	-157.8	-165.1	-64.5	0	0	0	113.5	L154 L157 D166 L167 V185 G186 D187 F188 A191 D230	L154-H164 HydrophobicContact CD2-CB 4.26Å; L157-H164 HydrophobicContact CD2-CB 3.96Å; H164-D166 PolarHBondContact CE1-O 2.85Å; H164-D166 VanDerWaalsContact ND1-C 3.26Å; H164-D166 PolarHBondContact ND1-N 2.74Å; H164-D166 PolarHBondContact O-N 2.85Å; H164-L167 HydrophobicContact CB-CB 4.36Å; H164-L167 PolarHBondContact ND1-N 3Å; H164-V185 VanDerWaalsContact NE2-CG1 3.35Å; H164-V185 WeakPolarHBondContact NE2-CG1 3.45Å; H164-G186 PolarHBondContact CE1-O 2.9Å; H164-G186 VanDerWaalsContact CE1-O 3.32Å; H164-G186 CovalentContact NE2-O 1.8Å; H164-G186 PolarHBondContact NE2-O 2.98Å; H164-D187 PolarHBondContact CE1-O 2.68Å; H164-D187 PolarHBondContact NE2-O 3.39Å; H164-F188 AromaticContact CD2-CE1 3.83Å; H164-F188 AromaticContact NE2-CE1 3.77Å; H164-A191 WeakPolarHBondContact O-CA 3.43Å; H164-A191 PolarHBondContact O-N 3.04Å; H164-D230 WeakPolarHBondContact CB-OD2 3.45Å; H164-D230 PolarHBondContact N-OD1 3.19Å; H164-D230 VanDerWaalsContact N-OD1 3.17Å; H164-D230 PolarHBondContact N-OD2 3.37Å
165	R	95.6	Very high	96.7	Very high	25 Å²	25	28 Å²	28	9%	0.094	14%	0.141	C	C	.	.	S	Bend	trans	64.9	-17.1	176.2	-57	165.4	67	-148.4	14.5	116.8	F163 L190 A207 V209 G210 Y225 D230	F163-R165 HydrophobicContact CD1-CG 4.48Å; F163-R165 HydrophobicContact CD2-CG 3.61Å; F163-R165 HydrophobicContact CE1-CG 4.3Å; F163-R165 HydrophobicContact CE2-CG 3.44Å; F163-R165 VanDerWaalsContact CE2-CG 3.44Å; F163-R165 HydrophobicContact CG-CG 4.17Å; F163-R165 HydrophobicContact CZ-CG 3.82Å; R165-L190 WeakPolarHBondContact CD-O 3.25Å; R165-L190 PolarHBondContact NH1-O 3.31Å; R165-A207 PolarHBondContact NH2-O 3.22Å; R165-V209 HydrophobicContact CB-CG2 4.28Å; R165-G210 WeakPolarHBondContact O-CA 3.41Å; R165-Y225 HydrophobicContact CG-CE2 4.38Å; R165-Y225 PolarHBondContact NE-OH 3.02Å; R165-Y225 VanDerWaalsContact NE-OH 3.16Å; R165-Y225 PolarHBondContact NH2-OH 3.19Å; R165-D230 PolarHBondContact N-OD1 3.26Å
166	D	94.9	Very high	96.4	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.032	14%	0.142	C	C	.	.	S	Bend	trans	-129.3	44.8	170.6	-155.7	5.1	0	0	0	111.3	H164 T168 N171 L190 G210 S211 S384	H164-D166 PolarHBondContact CE1-O 2.85Å; H164-D166 VanDerWaalsContact ND1-C 3.26Å; H164-D166 PolarHBondContact ND1-N 2.74Å; H164-D166 PolarHBondContact O-N 2.85Å; D166-T168 PolarHBondContact O-N 3.36Å; D166-N171 PolarHBondContact O-ND2 2.78Å; D166-L190 HydrophobicContact CB-CB 4.14Å; D166-L190 HydrophobicContact CB-CD1 3.76Å; D166-G210 WeakPolarHBondContact OD1-CA 3.49Å; D166-S211 VanDerWaalsContact OD1-CB 3.28Å; D166-S211 WeakPolarHBondContact OD1-CB 3.35Å; D166-S211 PolarHBondContact OD1-N 2.79Å; D166-S211 PolarHBondContact OD1-OG 2.91Å; D166-S384 WeakPolarHBondContact OD2-CB 3.42Å; D166-S384 PolarHBondContact OD2-OG 3.17Å
167	L	97.9	Very high	95.9	Very high	4 Å²	4	32 Å²	32	2%	0.021	16%	0.164	C	C	.	.			trans	-74.7	124.6	177.3	177.5	66.7	0	0	0	109.9	L154 H164 V185 W214 D230 A233 I237	L154-L167 HydrophobicContact CD1-CD1 4.15Å; L154-L167 HydrophobicContact CD1-CD2 3.38Å; L154-L167 HydrophobicContact CD1-CG 4.42Å; L154-L167 HydrophobicContact CD2-CD1 4.31Å; L154-L167 HydrophobicContact CD2-CD2 4.15Å; L154-L167 HydrophobicContact CG-CD2 4.41Å; H164-L167 HydrophobicContact CB-CB 4.36Å; H164-L167 PolarHBondContact ND1-N 3Å; L167-V185 HydrophobicContact CD1-CG1 4.08Å; L167-W214 WeakPolarHBondContact O-CB 3.13Å; L167-D230 HydrophobicContact CD2-CB 4.43Å; L167-D230 WeakPolarHBondContact CD2-O 3.46Å; L167-A233 HydrophobicContact CB-CB 3.94Å; L167-A233 HydrophobicContact CD2-CB 4.08Å; L167-A233 HydrophobicContact CG-CB 4.23Å; L167-I237 HydrophobicContact CD1-CD1 4.05Å; L167-I237 HydrophobicContact CD2-CD1 4.26Å; L167-I237 HydrophobicContact CG-CD1 3.76Å
168	T	97	Very high	95.1	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.206	C	C	.	.			trans	-146.9	163.5	-178.2	59	0	0	0	0	110.7	D166 K170 N171 C172 S211 W214 I237	D166-T168 PolarHBondContact O-N 3.36Å; T168-K170 PolarHBondContact O-N 1.8Å; T168-K170 WeakPolarHBondContact OG1-CB 3.41Å; T168-N171 PolarHBondContact O-N 3.24Å; T168-N171 VanDerWaalsContact O-N 3.16Å; T168-N171 WeakPolarHBondContact OG1-CB 3.36Å; T168-N171 VanDerWaalsContact OG1-CG 3.24Å; T168-N171 PolarHBondContact OG1-N 2.91Å; T168-N171 PolarHBondContact OG1-ND2 3.42Å; T168-C172 PolarHBondContact O-N 2.8Å; T168-C172 PolarHBondContact O-SG 3.31Å; T168-S211 VanDerWaalsContact CG2-CB 3.5Å; T168-W214 HydrophobicContact CG2-CB 4.29Å; T168-W214 HydrophobicContact CG2-CD2 3.59Å; T168-W214 HydrophobicContact CG2-CE3 3.6Å; T168-W214 HydrophobicContact CG2-CG 3.9Å; T168-W214 HydrophobicContact CG2-CZ3 4.19Å; T168-I237 VanDerWaalsContact C-CD1 3.43Å
169	S	96.7	Very high	94.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-61	-31.3	168.8	51.7	0	0	0	0	111.9	L128 E129 C172 W214 E240	L128-S169 WeakPolarHBondContact CB-O 3.35Å; L128-S169 PolarHBondContact N-O 3.32Å; E129-S169 PolarHBondContact N-O 2.95Å; S169-C172 PolarHBondContact O-N 2.7Å; S169-W214 WeakPolarHBondContact OG-CZ2 3.45Å; S169-E240 WeakPolarHBondContact CB-OE1 3.49Å; S169-E240 VanDerWaalsContact CB-OE2 3.3Å; S169-E240 WeakPolarHBondContact CB-OE2 3.44Å; S169-E240 VanDerWaalsContact OG-CD 3.3Å; S169-E240 PolarHBondContact OG-OE1 2.85Å; S169-E240 PolarHBondContact OG-OE2 2.86Å
170	K	93.2	Very high	93.5	Very high	77 Å²	77	41 Å²	41	34%	0.335	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-53.2	167.9	-80.8	178.2	169.4	90.4	0	112	N127 E129 T168 C172 T389	N127-K170 WeakPolarHBondContact CB-O 3.2Å; E129-K170 HydrophobicContact CB-CG 4.26Å; E129-K170 IonicContact OE1-NZ 2.66Å; E129-K170 PolarHBondContact OE1-NZ 2.98Å; E129-K170 WeakPolarHBondContact OE2-CE 3.33Å; E129-K170 WeakPolarHBondContact OE2-CG 3.45Å; E129-K170 IonicContact OE2-NZ 2.68Å; E129-K170 PolarHBondContact OE2-NZ 3.13Å; T168-K170 PolarHBondContact O-N 1.8Å; T168-K170 WeakPolarHBondContact OG1-CB 3.41Å; K170-C172 PolarHBondContact O-N 2.94Å; K170-C172 VanDerWaalsContact O-N 3.09Å; K170-T389 HydrophobicContact CB-CG2 3.67Å; K170-T389 HydrophobicContact CG-CG2 4.06Å; K170-T389 VanDerWaalsContact O-CG2 3.29Å; K170-T389 WeakPolarHBondContact O-CG2 3.18Å; K170-T389 PolarHBondContact O-OG1 2.79Å
171	N	95.3	Very high	93.3	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.8	-175.4	-63.2	-12.6	0	0	0	114	D166 T168 G186 D187 T389	D166-N171 PolarHBondContact O-ND2 2.78Å; T168-N171 PolarHBondContact O-N 3.24Å; T168-N171 VanDerWaalsContact O-N 3.16Å; T168-N171 WeakPolarHBondContact OG1-CB 3.36Å; T168-N171 VanDerWaalsContact OG1-CG 3.24Å; T168-N171 PolarHBondContact OG1-N 2.91Å; T168-N171 PolarHBondContact OG1-ND2 3.42Å; N171-G186 PolarHBondContact O-N 3.33Å; N171-D187 HydrophobicContact CB-CB 3.95Å; N171-D187 PolarHBondContact ND2-OD2 3.39Å; N171-D187 PolarHBondContact OD1-OD2 3.23Å; N171-T389 PolarHBondContact N-OG1 3.24Å; N171-T389 PolarHBondContact OD1-OG1 3.44Å
172	C	97.7	Very high	93.3	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	105.8	170	-65	0	0	0	0	110.1	N127 L128 I150 T168 S169 K170	N127-C172 CarbonylContact C-O 3.23Å; N127-C172 WeakPolarHBondContact CA-O 3.3Å; L128-C172 HydrophobicContact CB-CB 4.02Å; L128-C172 HydrophobicContact CD2-CB 4.32Å; L128-C172 PolarHBondContact N-O 3.38Å; I150-C172 HydrophobicContact CD1-CB 4.11Å; I150-C172 HydrophobicContact CG1-CB 4.44Å; T168-C172 PolarHBondContact O-N 2.8Å; T168-C172 PolarHBondContact O-SG 3.31Å; S169-C172 PolarHBondContact O-N 2.7Å; K170-C172 PolarHBondContact O-N 2.94Å; K170-C172 VanDerWaalsContact O-N 3.09Å
173	L	97	Very high	93.4	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.073	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	146.3	178.8	-56.9	178.5	0	0	0	111.4	L104 I123 G126 N127 V184	L104-L173 HydrophobicContact CD1-CD1 4.14Å; L104-L173 HydrophobicContact CD2-CD1 4.24Å; I123-L173 HydrophobicContact CB-CB 4.03Å; I123-L173 HydrophobicContact CB-CD1 4.17Å; I123-L173 HydrophobicContact CG1-CB 4.13Å; I123-L173 HydrophobicContact CG1-CD1 3.91Å; I123-L173 HydrophobicContact CG2-CB 3.72Å; G126-L173 WeakPolarHBondContact O-CA 3.49Å; N127-L173 HydrophobicContact CB-CD2 4.07Å; L173-V184 PolarHBondContact N-O 2.98Å; L173-V184 PolarHBondContact O-N 3.16Å
174	V	96.9	Very high	93.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.5	-178.3	179.6	0	0	0	0	110.4	I123 G125 G126 L128 L131 L176 C181	I123-V174 WeakPolarHBondContact CG2-O 3.47Å; G125-V174 CarbonylContact C-O 3.59Å; G125-V174 WeakPolarHBondContact CA-O 3.43Å; G125-V174 PolarHBondContact N-O 2.71Å; G126-V174 PolarHBondContact O-N 3.47Å; L128-V174 HydrophobicContact CB-CG2 4.33Å; L131-V174 HydrophobicContact CB-CG2 4.34Å; L131-V174 HydrophobicContact CD2-CG1 4.15Å; L131-V174 HydrophobicContact CD2-CG2 4.03Å; V174-L176 HydrophobicContact CG1-CD2 4.21Å; V174-L176 HydrophobicContact CG1-CG 4.43Å; V174-C181 HydrophobicContact CG1-CB 4.07Å
175	R	95	Very high	93.5	Very high	56 Å²	56	36.3 Å²	36.3	21%	0.211	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.8	169.7	-171.4	-170.7	-55.9	-85.3	9	109.3	E121 I123 C181 S182	E121-R175 VanDerWaalsContact CD-NH2 3.26Å; E121-R175 IonicContact OE1-NH2 3.19Å; E121-R175 PolarHBondContact OE1-NH2 3.23Å; E121-R175 IonicContact OE2-CZ 2.72Å; E121-R175 IonicContact OE2-NH1 3.77Å; E121-R175 IonicContact OE2-NH2 2.94Å; E121-R175 PolarHBondContact OE2-NH2 2.92Å; I123-R175 HydrophobicContact CG2-CB 4.19Å; R175-C181 WeakPolarHBondContact O-CA 3.49Å; R175-S182 PolarHBondContact N-O 2.86Å; R175-S182 PolarHBondContact O-N 2.95Å
176	L	91.8	Very high	93.5	Very high	67 Å²	67	35.2 Å²	35.2	35%	0.351	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.5	177.4	-66.8	172	0	0	0	109.6	N124 V174 M180 C181	N124-L176 PolarHBondContact ND2-O 2.85Å; N124-L176 PolarHBondContact OD1-N 3.46Å; V174-L176 HydrophobicContact CG1-CD2 4.21Å; V174-L176 HydrophobicContact CG1-CG 4.43Å; L176-M180 WeakPolarHBondContact CA-O 3.42Å; L176-C181 HydrophobicContact CD2-CB 4.32Å; L176-C181 WeakPolarHBondContact CD2-SG 3.27Å
177	E	88.3	Confident	93.1	Very high	132 Å²	132	35.1 Å²	35.1	62%	0.617	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	123.2	-177.3	-171.7	169.8	-176.9	0	0	110.7	G179 M180	E177-G179 PolarHBondContact O-N 3.21Å; E177-G179 VanDerWaalsContact O-N 3.15Å; E177-M180 PolarHBondContact N-O 2.94Å; E177-M180 WeakPolarHBondContact O-CB 3.21Å; E177-M180 PolarHBondContact O-N 3.2Å
178	G	81.6	Confident	92.8	Very high	86 Å²	86	35.1 Å²	35.1	89%	0.887	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	25.6	179.1	0	0	0	0	0	115.2	M180	G178-M180 VanDerWaalsContact C-N 3.3Å
179	G	78.2	Confident	92.3	Very high	82 Å²	82	35.4 Å²	35.4	85%	0.845	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	2.3	-172.9	0	0	0	0	0	114.8	E177	E177-G179 PolarHBondContact O-N 3.21Å; E177-G179 VanDerWaalsContact O-N 3.15Å
180	M	85.2	Confident	91.9	Very high	138 Å²	138	36 Å²	36	68%	0.68	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	143	173.7	-59.5	-173.7	-66.2	0	0	111.3	L176 E177 G178	L176-M180 WeakPolarHBondContact CA-O 3.42Å; E177-M180 PolarHBondContact N-O 2.94Å; E177-M180 WeakPolarHBondContact O-CB 3.21Å; E177-M180 PolarHBondContact O-N 3.2Å; G178-M180 VanDerWaalsContact C-N 3.3Å
181	C	91.4	Very high	91.9	Very high	31 Å²	31	32.8 Å²	32.8	21%	0.209	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.5	169.5	-49.9	0	0	0	0	109.9	L146 V174 R175 L176	L146-C181 HydrophobicContact CD2-CB 3.97Å; L146-C181 HydrophobicContact CG-CB 4.49Å; V174-C181 HydrophobicContact CG1-CB 4.07Å; R175-C181 WeakPolarHBondContact O-CA 3.49Å; L176-C181 HydrophobicContact CD2-CB 4.32Å; L176-C181 WeakPolarHBondContact CD2-SG 3.27Å
182	S	95.9	Very high	91.7	Very high	35 Å²	35	35.7 Å²	35.7	25%	0.245	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.3	169.3	55.2	0	0	0	0	110.4	D149 R175	D149-S182 WeakPolarHBondContact OD2-CA 3.45Å; D149-S182 WeakPolarHBondContact OD2-CB 3.28Å; R175-S182 PolarHBondContact N-O 2.86Å; R175-S182 PolarHBondContact O-N 2.95Å
183	A	98.1	Very high	91.5	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.5	-173.4	0	0	0	0	0	112.9	N102 L146 D149 I150	N102-A183 WeakPolarHBondContact CB-O 3.29Å; N102-A183 PolarHBondContact ND2-O 2.94Å; L146-A183 HydrophobicContact CD2-CB 4Å; D149-A183 HydrophobicContact CB-CB 3.85Å; D149-A183 PolarHBondContact OD2-N 2.66Å; I150-A183 HydrophobicContact CD1-CB 4.21Å; I150-A183 HydrophobicContact CG1-CB 3.62Å
184	V	98.3	Very high	91.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	111.9	-179.9	-177.1	0	0	0	0	108.6	L104 I123 L173	L104-V184 HydrophobicContact CB-CG1 4.07Å; L104-V184 HydrophobicContact CD1-CG1 4.42Å; I123-V184 HydrophobicContact CD1-CB 4.41Å; I123-V184 HydrophobicContact CD1-CG1 4.38Å; I123-V184 HydrophobicContact CD1-CG2 4.11Å; L173-V184 PolarHBondContact N-O 2.98Å; L173-V184 PolarHBondContact O-N 3.16Å
185	V	98.1	Very high	91	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.7	177.1	-176.4	0	0	0	0	109.2	N102 I103 L104 I150 H164 L167 F188	N102-V185 PolarHBondContact O-N 2.72Å; I103-V185 WeakPolarHBondContact CA-O 3.46Å; I103-V185 HydrophobicContact CD1-CB 4.25Å; L104-V185 PolarHBondContact N-O 3.12Å; I150-V185 HydrophobicContact CB-CG2 4.34Å; I150-V185 HydrophobicContact CG1-CG2 4.41Å; I150-V185 HydrophobicContact CG2-CG2 3.96Å; H164-V185 VanDerWaalsContact NE2-CG1 3.35Å; H164-V185 WeakPolarHBondContact NE2-CG1 3.45Å; L167-V185 HydrophobicContact CD1-CG1 4.08Å; V185-F188 WeakPolarHBondContact O-CZ 3.27Å
186	G	94.3	Very high	90.3	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.021	28%	0.284	C	S	.	.			trans	-125.3	-172.3	174.3	0	0	0	0	0	112.2	H164 N171	H164-G186 PolarHBondContact CE1-O 2.9Å; H164-G186 VanDerWaalsContact CE1-O 3.32Å; H164-G186 CovalentContact NE2-O 1.8Å; H164-G186 PolarHBondContact NE2-O 2.98Å; N171-G186 PolarHBondContact O-N 3.33Å
187	D	88	Confident	89.5	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.021	28%	0.282	C	S	.	.			trans	74.5	68.9	169.9	-149.1	5.7	0	0	0	116.2	K77 H164 N171 G189 I386 S387 L388	K77-D187 IonicContact NZ-OD1 3.49Å; K77-D187 PolarHBondContact NZ-OD1 2.92Å; H164-D187 PolarHBondContact CE1-O 2.68Å; H164-D187 PolarHBondContact NE2-O 3.39Å; N171-D187 HydrophobicContact CB-CB 3.95Å; N171-D187 PolarHBondContact ND2-OD2 3.39Å; N171-D187 PolarHBondContact OD1-OD2 3.23Å; D187-G189 VanDerWaalsContact C-N 3.28Å; D187-G189 PolarHBondContact O-N 3.3Å; D187-I386 VanDerWaalsContact OD1-O 3.12Å; D187-S387 WeakPolarHBondContact OD2-CA 3.45Å; D187-S387 PolarHBondContact OD2-OG 3.47Å; D187-L388 HydrophobicContact CB-CB 3.95Å; D187-L388 HydrophobicContact CB-CD1 4.24Å; D187-L388 HydrophobicContact CB-CG 4.37Å; D187-L388 PolarHBondContact OD1-N 3.17Å; D187-L388 PolarHBondContact OD2-N 3.27Å
188	F	90.4	Very high	88.4	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.013	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-90.5	16.3	-174.8	-53.1	-74.4	0	0	0	113.4	E91 L94 M95 L98 I103 L104 L157 H164 V185 L190 A191	E91-F188 HydrophobicContact CG-CB 4.45Å; L94-F188 HydrophobicContact CD2-CB 3.88Å; L94-F188 HydrophobicContact CG-CB 4.44Å; M95-F188 HydrophobicContact CG-CB 4.33Å; M95-F188 HydrophobicContact CG-CD2 3.71Å; M95-F188 HydrophobicContact CG-CG 4.38Å; M95-F188 HydrophobicContact SD-CD2 4.1Å; L98-F188 HydrophobicContact CD1-CD1 4.21Å; L98-F188 HydrophobicContact CD1-CD2 4.33Å; L98-F188 HydrophobicContact CD1-CE1 4.19Å; L98-F188 HydrophobicContact CD1-CE2 4.3Å; L98-F188 HydrophobicContact CD1-CG 4.29Å; L98-F188 HydrophobicContact CD1-CZ 4.25Å; I103-F188 HydrophobicContact CD1-CE1 4.24Å; I103-F188 HydrophobicContact CD1-CZ 3.95Å; I103-F188 HydrophobicContact CG2-CE2 4.13Å; I103-F188 HydrophobicContact CG2-CZ 3.79Å; L104-F188 HydrophobicContact CB-CE2 4.47Å; L157-F188 HydrophobicContact CD1-CD1 4.38Å; L157-F188 HydrophobicContact CD1-CE1 4.2Å; L157-F188 HydrophobicContact CD2-CD1 4.46Å; L157-F188 HydrophobicContact CD2-CE1 4.19Å; H164-F188 AromaticContact CD2-CE1 3.83Å; H164-F188 AromaticContact NE2-CE1 3.77Å; V185-F188 WeakPolarHBondContact O-CZ 3.27Å; F188-L190 PolarHBondContact O-N 3.04Å; F188-A191 HydrophobicContact CB-CB 4.04Å; F188-A191 HydrophobicContact CD1-CB 4.3Å; F188-A191 PolarHBondContact O-N 3.49Å
189	G	86.2	Confident	87	Confident	9 Å²	9	49.4 Å²	49.4	9%	0.093	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-66.5	-19	-176.4	0	0	0	0	0	114.9	D187 V385	D187-G189 VanDerWaalsContact C-N 3.28Å; D187-G189 PolarHBondContact O-N 3.3Å; G189-V385 WeakPolarHBondContact CA-O 3.24Å; G189-V385 WeakPolarHBondContact O-CG1 3.49Å
190	L	89.3	Confident	86	Confident	13 Å²	13	55.4 Å²	55.4	7%	0.068	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-111.9	-4	172.4	-84	-178.6	0	0	0	114.9	R165 D166 F188 V209 K383 V385	R165-L190 WeakPolarHBondContact CD-O 3.25Å; R165-L190 PolarHBondContact NH1-O 3.31Å; D166-L190 HydrophobicContact CB-CB 4.14Å; D166-L190 HydrophobicContact CB-CD1 3.76Å; F188-L190 PolarHBondContact O-N 3.04Å; L190-V209 HydrophobicContact CD1-CB 3.79Å; L190-V209 HydrophobicContact CD1-CG2 4.02Å; L190-V209 HydrophobicContact CD2-CB 3.89Å; L190-V209 HydrophobicContact CD2-CG1 4.02Å; L190-V209 HydrophobicContact CD2-CG2 3.96Å; L190-V209 HydrophobicContact CG-CB 4.46Å; L190-V209 HydrophobicContact CG-CG2 4.44Å; L190-K383 WeakPolarHBondContact CD1-O 3.24Å; L190-K383 WeakPolarHBondContact CD2-O 3.05Å; L190-V385 HydrophobicContact CD2-CB 4.09Å; L190-V385 HydrophobicContact CD2-CG2 4.08Å; L190-V385 HydrophobicContact CG-CB 4.27Å
191	A	92.9	Very high	84.8	Confident	9 Å²	9	57.2 Å²	57.2	7%	0.074	29%	0.292	C	S	.	.			trans	-66.4	143.4	-179.1	0	0	0	0	0	111.1	L94 I162 F163 H164 F188	L94-A191 HydrophobicContact CD2-CB 3.69Å; I162-A191 HydrophobicContact CG2-CB 4.22Å; F163-A191 WeakPolarHBondContact O-CA 3.36Å; F163-A191 WeakPolarHBondContact O-CB 3.49Å; H164-A191 WeakPolarHBondContact O-CA 3.43Å; H164-A191 PolarHBondContact O-N 3.04Å; F188-A191 HydrophobicContact CB-CB 4.04Å; F188-A191 HydrophobicContact CD1-CB 4.3Å; F188-A191 PolarHBondContact O-N 3.49Å
192	E	92.3	Very high	83.4	Confident	64 Å²	64	62.3 Å²	62.3	30%	0.299	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	163.2	-170	-159.9	57.3	-91.8	0	0	110.7	R90 I162 F163 I194	R90-E192 IonicContact NH1-OE1 2.75Å; R90-E192 IonicContact NH1-OE2 3.23Å; R90-E192 PolarHBondContact NH1-OE2 3.33Å; I162-E192 WeakPolarHBondContact CA-O 3.34Å; F163-E192 WeakPolarHBondContact CD1-O 3.46Å; F163-E192 HydrophobicContact CE1-CB 4.29Å; F163-E192 PolarHBondContact N-O 3.21Å; F163-E192 VanDerWaalsContact N-O 3.09Å; F163-E192 PolarHBondContact O-N 2.93Å; F163-E192 VanDerWaalsContact O-N 3.09Å; E192-I194 PolarHBondContact O-N 3.14Å
193	K	93.4	Very high	82.2	Confident	135 Å²	135	64.7 Å²	64.7	59%	0.587	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	132.5	169.6	-169	-151.9	166.9	-164.7	0	108.8	G161 F163 P195	G161-K193 CarbonylContact O-C 3.58Å; G161-K193 WeakPolarHBondContact O-CA 3.5Å; F163-K193 WeakPolarHBondContact CE1-O 3.48Å; K193-P195 WeakPolarHBondContact O-CD 3.45Å
194	I	93.1	Very high	80.9	Confident	28 Å²	28	72.5 Å²	72.5	14%	0.144	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-57.5	124.4	167.9	-63.2	168.9	0	0	0	107.4	H158 G161 F163 E192 E227	H158-I194 HydrophobicContact CB-CD1 4.47Å; G161-I194 PolarHBondContact O-N 3.06Å; F163-I194 HydrophobicContact CB-CD1 4.35Å; F163-I194 HydrophobicContact CB-CG1 3.83Å; F163-I194 HydrophobicContact CD1-CB 4.29Å; F163-I194 HydrophobicContact CD1-CG1 3.63Å; F163-I194 HydrophobicContact CE1-CG1 4.49Å; F163-I194 HydrophobicContact CG-CG1 3.98Å; E192-I194 PolarHBondContact O-N 3.14Å; I194-E227 HydrophobicContact CD1-CB 3.7Å; I194-E227 HydrophobicContact CD1-CG 4.33Å; I194-E227 HydrophobicContact CG1-CB 4.04Å
195	P	88.6	Confident	80	Confident	29 Å²	29	81.3 Å²	81.3	19%	0.188	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-59.5	141.9	176.4	-26	36.3	0	0	0	111.1	K193 Y197 L206	K193-P195 WeakPolarHBondContact O-CD 3.45Å; P195-Y197 HydrophobicContact CB-CD1 3.83Å; P195-Y197 HydrophobicContact CB-CD2 4.37Å; P195-Y197 HydrophobicContact CB-CE1 3.26Å; P195-Y197 HydrophobicContact CB-CE2 3.89Å; P195-Y197 HydrophobicContact CB-CG 4.37Å; P195-Y197 HydrophobicContact CG-CE1 4.14Å; P195-Y197 HydrophobicContact CG-CE2 4.38Å; P195-L206 HydrophobicContact CG-CD1 3.58Å; P195-L206 HydrophobicContact CG-CG 4.16Å
196	D	81.6	Confident	79.5	Confident	113 Å²	113	83.4 Å²	83.4	60%	0.604	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-91.3	134.6	164	-148.8	-38.9	0	0	0	107.7	S198	D196-S198 VanDerWaalsContact OD1-CB 3.3Å; D196-S198 WeakPolarHBondContact OD1-CB 3.37Å; D196-S198 PolarHBondContact OD1-N 3.22Å; D196-S198 PolarHBondContact OD1-OG 2.92Å
197	Y	73.6	Confident	79.2	Confident	79 Å²	79	85.9 Å²	85.9	31%	0.31	43%	0.429	S	S	.	.			trans	-132.1	27.6	-174.2	-62.6	-36.9	0	0	0	110.3	P195 Q203 Y225 N226	P195-Y197 HydrophobicContact CB-CD1 3.83Å; P195-Y197 HydrophobicContact CB-CD2 4.37Å; P195-Y197 HydrophobicContact CB-CE1 3.26Å; P195-Y197 HydrophobicContact CB-CE2 3.89Å; P195-Y197 HydrophobicContact CB-CG 4.37Å; P195-Y197 HydrophobicContact CG-CE1 4.14Å; P195-Y197 HydrophobicContact CG-CE2 4.38Å; Y197-Q203 HydrophobicContact CD1-CG 3.46Å; Y197-Q203 VanDerWaalsContact CD1-CG 3.46Å; Y197-Q203 HydrophobicContact CE1-CG 3.3Å; Y197-Q203 VanDerWaalsContact CE1-NE2 3.25Å; Y197-Q203 HydrophobicContact CG-CG 4.26Å; Y197-Y225 PolarHBondContact OH-O 2.84Å; Y197-N226 HydrophobicContact CE2-CB 4.4Å
198	S	66	Low	79.3	Confident	94 Å²	94	89.3 Å²	89.3	66%	0.657	45%	0.45	S	S	*	.	S	Bend	trans	-90.2	-17.1	-170	50	0	0	0	0	115.5	D196	D196-S198 VanDerWaalsContact OD1-CB 3.3Å; D196-S198 WeakPolarHBondContact OD1-CB 3.37Å; D196-S198 PolarHBondContact OD1-N 3.22Å; D196-S198 PolarHBondContact OD1-OG 2.92Å
199	E	52.8	Low	79.3	Confident	166 Å²	166	89.8 Å²	89.8	78%	0.776	45%	0.453	S	S	*	.	S	Bend	trans	-132.2	174.9	-179.8	-66	-167.2	-178.9	0	0	112.3	E201	E199-E201 PolarHBondContact O-N 3.34Å
200	E	57.6	Low	79.4	Confident	209 Å²	209	89.4 Å²	89.4	98%	0.977	45%	0.45	S	S	*	.	S	Bend	trans	-74.1	21	-160.9	-53.9	-178.2	144.6	0	0	115.5
201	E	59.3	Low	79.5	Confident	176 Å²	176	90 Å²	90	82%	0.822	46%	0.455	S	S	*	.	S	Bend	trans	-72.3	156.4	178.8	-65.1	-165.6	146.6	0	0	113	E199 Q203	E199-E201 PolarHBondContact O-N 3.34Å; E201-Q203 PolarHBondContact O-N 3.49Å
202	V	62.2	Low	79.4	Confident	137 Å²	137	91 Å²	91	83%	0.83	46%	0.461	S	S	*	.			trans	-67.5	108.4	177.4	178.7	0	0	0	0	109.5	E204	V202-E204 PolarHBondContact O-N 2.66Å
203	Q	70.6	Confident	79.5	Confident	86 Å²	86	89.6 Å²	89.6	40%	0.402	45%	0.453	S	S	.	.			trans	-67.2	92.9	-173.4	-159.9	172.2	-3.7	0	0	112.4	Y197 E201 R205 V224	Y197-Q203 HydrophobicContact CD1-CG 3.46Å; Y197-Q203 VanDerWaalsContact CD1-CG 3.46Å; Y197-Q203 HydrophobicContact CE1-CG 3.3Å; Y197-Q203 VanDerWaalsContact CE1-NE2 3.25Å; Y197-Q203 HydrophobicContact CG-CG 4.26Å; E201-Q203 PolarHBondContact O-N 3.49Å; Q203-R205 PolarHBondContact O-N 3.01Å; Q203-V224 HydrophobicContact CG-CB 4.48Å; Q203-V224 HydrophobicContact CG-CG1 3.99Å
204	E	71.4	Confident	79.7	Confident	165 Å²	165	84 Å²	84	77%	0.771	43%	0.428	S	S	*	.			trans	-61.8	130	-179.5	-68.1	-155.4	143.2	0	0	111.8	V202 L206	V202-E204 PolarHBondContact O-N 2.66Å; E204-L206 PolarHBondContact O-N 3.01Å
205	R	79.7	Confident	79.8	Confident	187 Å²	187	83.6 Å²	83.6	71%	0.706	43%	0.426	S	S	*	.			trans	-77.1	109.1	174.5	-69.3	-179.6	-177	78.8	-0.3	109.3	Q203 V224	Q203-R205 PolarHBondContact O-N 3.01Å; R205-V224 HydrophobicContact CG-CG1 4.03Å
206	L	87	Confident	80.3	Confident	44 Å²	44	82.2 Å²	82.2	23%	0.23	42%	0.417	C	S	.	.			trans	-55.9	143.4	168.6	-69.6	-178.3	0	0	0	110.8	F163 P195 E204 V208 Y225	F163-L206 HydrophobicContact CE1-CD1 4.1Å; F163-L206 HydrophobicContact CZ-CD1 3.61Å; P195-L206 HydrophobicContact CG-CD1 3.58Å; P195-L206 HydrophobicContact CG-CG 4.16Å; E204-L206 PolarHBondContact O-N 3.01Å; L206-V208 PolarHBondContact O-N 2.92Å; L206-Y225 HydrophobicContact CB-CE1 3.86Å; L206-Y225 HydrophobicContact CB-CE2 4.33Å; L206-Y225 HydrophobicContact CD1-CE2 4.06Å
207	A	87.7	Confident	80.9	Confident	54 Å²	54	76.9 Å²	76.9	45%	0.446	39%	0.388	S	S	.	.			trans	-56.2	138.5	179.8	0	0	0	0	0	112.2	R165 V209 Y225	R165-A207 PolarHBondContact NH2-O 3.22Å; A207-V209 HydrophobicContact CB-CG1 4.11Å; A207-V209 PolarHBondContact O-N 3.42Å; A207-Y225 PolarHBondContact O-OH 3.47Å
208	V	90.9	Very high	82	Confident	76 Å²	76	73.5 Å²	73.5	46%	0.461	38%	0.376	S	S	.	.			trans	-66.4	113.2	169.8	177.1	0	0	0	0	108.5	L206 M215 V219	L206-V208 PolarHBondContact O-N 2.92Å; V208-M215 HydrophobicContact CG1-CE 3.7Å; V208-V219 HydrophobicContact CG1-CG1 4.29Å; V208-V219 WeakPolarHBondContact CG2-O 3.49Å
209	V	89.1	Confident	83.3	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.073	35%	0.346	C	S	.	.			trans	-148.7	166.6	-176	-59.2	0	0	0	0	110	R165 L190 A207 M215 K383	R165-V209 HydrophobicContact CB-CG2 4.28Å; L190-V209 HydrophobicContact CD1-CB 3.79Å; L190-V209 HydrophobicContact CD1-CG2 4.02Å; L190-V209 HydrophobicContact CD2-CB 3.89Å; L190-V209 HydrophobicContact CD2-CG1 4.02Å; L190-V209 HydrophobicContact CD2-CG2 3.96Å; L190-V209 HydrophobicContact CG-CB 4.46Å; L190-V209 HydrophobicContact CG-CG2 4.44Å; A207-V209 HydrophobicContact CB-CG1 4.11Å; A207-V209 PolarHBondContact O-N 3.42Å; V209-M215 WeakPolarHBondContact O-CE 3.35Å; V209-K383 HydrophobicContact CG1-CB 4.22Å
210	G	89.3	Confident	85.1	Confident	2 Å²	2	61.8 Å²	61.8	2%	0.021	31%	0.311	C	S	.	.	S	Bend	trans	112.1	175.5	-178.5	0	0	0	0	0	112.9	R165 D166	R165-G210 WeakPolarHBondContact O-CA 3.41Å; D166-G210 WeakPolarHBondContact OD1-CA 3.49Å
211	S	90.9	Very high	86.7	Confident	25 Å²	25	56.9 Å²	56.9	18%	0.175	28%	0.283	C	S	.	.			trans	-86.3	117.1	179.2	-64	0	0	0	0	111.3	D166 T168 Y213 W214 M215	D166-S211 VanDerWaalsContact OD1-CB 3.28Å; D166-S211 WeakPolarHBondContact OD1-CB 3.35Å; D166-S211 PolarHBondContact OD1-N 2.79Å; D166-S211 PolarHBondContact OD1-OG 2.91Å; T168-S211 VanDerWaalsContact CG2-CB 3.5Å; S211-Y213 VanDerWaalsContact C-N 3.34Å; S211-Y213 PolarHBondContact O-N 2.67Å; S211-W214 PolarHBondContact O-N 3.15Å; S211-M215 WeakPolarHBondContact O-CG 3.26Å; S211-M215 PolarHBondContact O-N 3.46Å
212	P	90	Very high	88.1	Confident	30 Å²	30	49.9 Å²	49.9	20%	0.195	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.1	-44.4	-164.7	-37.8	38.2	0	0	0	118	W214 M215 F364 L377	P212-W214 VanDerWaalsContact C-N 3.3Å; P212-W214 PolarHBondContact O-N 2.97Å; P212-M215 PolarHBondContact O-N 3.36Å; P212-F364 HydrophobicContact CB-CD1 4.37Å; P212-F364 VanDerWaalsContact O-CE1 3.32Å; P212-F364 WeakPolarHBondContact O-CE1 3.42Å; P212-L377 HydrophobicContact CB-CD2 3.93Å; P212-L377 HydrophobicContact CG-CD2 3.84Å
213	Y	94.6	Very high	89.5	Confident	34 Å²	34	47.1 Å²	47.1	13%	0.133	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.8	-173.3	-54.9	-22.5	0	0	0	114.2	S211 D248 P249 F364 F378	S211-Y213 VanDerWaalsContact C-N 3.34Å; S211-Y213 PolarHBondContact O-N 2.67Å; Y213-D248 HydrophobicContact CD2-CB 4.24Å; Y213-D248 HydrophobicContact CE2-CB 3.73Å; Y213-D248 WeakPolarHBondContact CE2-OD2 3.46Å; Y213-D248 PolarHBondContact OH-OD2 3.38Å; Y213-P249 HydrophobicContact CD1-CG 4.26Å; Y213-P249 HydrophobicContact CE1-CG 3.86Å; Y213-P249 VanDerWaalsContact CZ-CD 3.46Å; Y213-F364 HydrophobicContact CD1-CD1 4.39Å; Y213-F364 HydrophobicContact CD1-CG 4.41Å; Y213-F364 HydrophobicContact CE1-CB 4.49Å; Y213-F364 HydrophobicContact CE1-CG 4.45Å; Y213-F378 WeakPolarHBondContact OH-CZ 3.29Å
214	W	97.6	Very high	90.4	Very high	18 Å²	18	45.8 Å²	45.8	7%	0.068	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-11.9	176.4	-61.9	-97.2	0	0	0	112.7	L167 T168 S169 S211 P212 A233 I236 E240 A247	L167-W214 WeakPolarHBondContact O-CB 3.13Å; T168-W214 HydrophobicContact CG2-CB 4.29Å; T168-W214 HydrophobicContact CG2-CD2 3.59Å; T168-W214 HydrophobicContact CG2-CE3 3.6Å; T168-W214 HydrophobicContact CG2-CG 3.9Å; T168-W214 HydrophobicContact CG2-CZ3 4.19Å; S169-W214 WeakPolarHBondContact OG-CZ2 3.45Å; S211-W214 PolarHBondContact O-N 3.15Å; P212-W214 VanDerWaalsContact C-N 3.3Å; P212-W214 PolarHBondContact O-N 2.97Å; W214-A233 HydrophobicContact CB-CB 4.07Å; W214-A233 WeakPolarHBondContact O-CA 3.21Å; W214-A233 WeakPolarHBondContact O-CB 3.36Å; W214-I236 HydrophobicContact CG-CB 4.47Å; W214-I236 HydrophobicContact CG-CG2 4.14Å; W214-E240 PolarHBondContact NE1-OE2 2.76Å; W214-A247 HydrophobicContact CD2-CB 4.14Å; W214-A247 HydrophobicContact CH2-CB 4.03Å; W214-A247 HydrophobicContact CZ2-CB 3.45Å; W214-A247 VanDerWaalsContact CZ2-CB 3.45Å
215	M	96.5	Very high	91.5	Very high	19 Å²	19	38.2 Å²	38.2	9%	0.094	20%	0.198	C	C	.	.	S	Bend	trans	-65.5	136.4	-177.6	-72.9	172.2	68	0	0	111.9	V208 V209 S211 P212 V219 L220	V208-M215 HydrophobicContact CG1-CE 3.7Å; V209-M215 WeakPolarHBondContact O-CE 3.35Å; S211-M215 WeakPolarHBondContact O-CG 3.26Å; S211-M215 PolarHBondContact O-N 3.46Å; P212-M215 PolarHBondContact O-N 3.36Å; M215-V219 HydrophobicContact CE-CB 4.14Å; M215-V219 HydrophobicContact CE-CG1 3.59Å; M215-L220 HydrophobicContact CB-CD1 4.26Å; M215-L220 HydrophobicContact CB-CD2 3.99Å; M215-L220 HydrophobicContact CB-CG 3.93Å; M215-L220 HydrophobicContact CE-CD2 3.78Å; M215-L220 HydrophobicContact CE-CG 4.37Å; M215-L220 HydrophobicContact SD-CD2 4Å
216	A	97.1	Very high	92.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	18%	0.175	C	C	.	.			trans	-69.5	147.8	176.5	0	0	0	0	0	111.7	E218 V219 L220 V229 F232	A216-E218 VanDerWaalsContact C-N 3.26Å; A216-E218 VanDerWaalsContact CB-CD 3.48Å; A216-E218 HydrophobicContact CB-CG 4.37Å; A216-E218 WeakPolarHBondContact CB-OE1 3.24Å; A216-E218 WeakPolarHBondContact CB-OE2 3.37Å; A216-E218 PolarHBondContact O-N 2.98Å; A216-V219 HydrophobicContact CB-CG2 4.22Å; A216-V219 WeakPolarHBondContact O-CB 3.12Å; A216-V219 PolarHBondContact O-N 2.98Å; A216-L220 PolarHBondContact O-N 3.39Å; A216-V229 HydrophobicContact CB-CB 4.01Å; A216-V229 HydrophobicContact CB-CG1 4.02Å; A216-F232 HydrophobicContact CB-CB 3.73Å; A216-F232 HydrophobicContact CB-CD1 4.02Å; A216-F232 HydrophobicContact CB-CG 3.88Å
217	P	95.6	Very high	92.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-35.2	-174.5	-27.6	37.1	0	0	0	113.7	V219 L220 R221 F232 F258 M286	P217-V219 VanDerWaalsContact C-N 3.29Å; P217-V219 PolarHBondContact O-N 3.07Å; P217-L220 PolarHBondContact O-N 3.4Å; P217-R221 WeakPolarHBondContact O-CG 3.23Å; P217-R221 PolarHBondContact O-N 3.45Å; P217-F232 VanDerWaalsContact CD-CZ 3.48Å; P217-F232 HydrophobicContact CG-CE1 4.47Å; P217-F232 HydrophobicContact CG-CE2 3.97Å; P217-F232 HydrophobicContact CG-CZ 3.78Å; P217-F258 HydrophobicContact CG-CB 4.5Å; P217-M286 HydrophobicContact CB-CE 3.62Å; P217-M286 HydrophobicContact CG-CE 3.56Å; P217-M286 HydrophobicContact CG-SD 3.81Å
218	E	95.3	Very high	93.2	Very high	9 Å²	9	29.9 Å²	29.9	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-35.8	174.8	63.2	-89.1	-155	0	0	112.8	A216 R221 G222 E223 V229 R291	A216-E218 VanDerWaalsContact C-N 3.26Å; A216-E218 VanDerWaalsContact CB-CD 3.48Å; A216-E218 HydrophobicContact CB-CG 4.37Å; A216-E218 WeakPolarHBondContact CB-OE1 3.24Å; A216-E218 WeakPolarHBondContact CB-OE2 3.37Å; A216-E218 PolarHBondContact O-N 2.98Å; E218-R221 PolarHBondContact O-N 2.74Å; E218-G222 PolarHBondContact O-N 2.86Å; E218-G222 VanDerWaalsContact O-N 3.08Å; E218-E223 VanDerWaalsContact CA-OE2 3.28Å; E218-E223 WeakPolarHBondContact CA-OE2 3.27Å; E218-E223 HydrophobicContact CB-CB 4.05Å; E218-E223 WeakPolarHBondContact CB-OE2 3.14Å; E218-E223 WeakPolarHBondContact O-CB 3.19Å; E218-E223 PolarHBondContact O-N 2.88Å; E218-V229 HydrophobicContact CG-CG1 4.35Å; E218-R291 IonicContact OE1-CZ 3.87Å; E218-R291 IonicContact OE1-NH1 3.77Å; E218-R291 PolarHBondContact OE1-NH1 3.39Å; E218-R291 IonicContact OE1-NH2 3.52Å; E218-R291 PolarHBondContact OE1-NH2 3.33Å; E218-R291 IonicContact OE2-CZ 3.98Å; E218-R291 IonicContact OE2-NH1 2.84Å; E218-R291 IonicContact OE2-NH2 2.86Å; E218-R291 PolarHBondContact OE2-NH2 3.14Å
219	V	94.3	Very high	93.5	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-72.2	-40.3	176.7	-166.1	0	0	0	0	110.2	V208 M215 A216 P217 R221 G222 Y225 V229	V208-V219 HydrophobicContact CG1-CG1 4.29Å; V208-V219 WeakPolarHBondContact CG2-O 3.49Å; M215-V219 HydrophobicContact CE-CB 4.14Å; M215-V219 HydrophobicContact CE-CG1 3.59Å; A216-V219 HydrophobicContact CB-CG2 4.22Å; A216-V219 WeakPolarHBondContact O-CB 3.12Å; A216-V219 PolarHBondContact O-N 2.98Å; P217-V219 VanDerWaalsContact C-N 3.29Å; P217-V219 PolarHBondContact O-N 3.07Å; V219-R221 PolarHBondContact O-N 2.93Å; V219-G222 PolarHBondContact O-N 2.76Å; V219-G222 VanDerWaalsContact O-N 3.14Å; V219-Y225 HydrophobicContact CG1-CD1 4.38Å; V219-Y225 HydrophobicContact CG1-CE1 3.99Å; V219-Y225 HydrophobicContact CG2-CD1 4.01Å; V219-Y225 HydrophobicContact CG2-CD2 4.21Å; V219-Y225 HydrophobicContact CG2-CE1 4.32Å; V219-Y225 HydrophobicContact CG2-CG 3.95Å; V219-V229 HydrophobicContact CG2-CB 4.1Å; V219-V229 HydrophobicContact CG2-CG1 3.46Å; V219-V229 VanDerWaalsContact CG2-CG1 3.46Å
220	L	91.3	Very high	94	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-67.9	-22	176.1	-66	168.8	0	0	0	113.1	M215 A216 P217 F258 F364 R367 L377	M215-L220 HydrophobicContact CB-CD1 4.26Å; M215-L220 HydrophobicContact CB-CD2 3.99Å; M215-L220 HydrophobicContact CB-CG 3.93Å; M215-L220 HydrophobicContact CE-CD2 3.78Å; M215-L220 HydrophobicContact CE-CG 4.37Å; M215-L220 HydrophobicContact SD-CD2 4Å; A216-L220 PolarHBondContact O-N 3.39Å; P217-L220 PolarHBondContact O-N 3.4Å; L220-F258 HydrophobicContact CB-CD2 4.36Å; L220-F258 HydrophobicContact CD1-CB 3.73Å; L220-F258 HydrophobicContact CD1-CD1 4.05Å; L220-F258 HydrophobicContact CD1-CD2 4.34Å; L220-F258 HydrophobicContact CD1-CG 3.78Å; L220-F364 HydrophobicContact CD1-CE1 3.77Å; L220-F364 HydrophobicContact CD1-CZ 4.11Å; L220-F364 HydrophobicContact CD2-CE1 4.43Å; L220-R367 PolarHBondContact O-NH1 3.18Å; L220-R367 PolarHBondContact O-NH2 3Å; L220-L377 HydrophobicContact CD2-CD2 4.46Å
221	R	90.8	Very high	94.5	Very high	107 Å²	107	26 Å²	26	40%	0.404	13%	0.134	S	C	.	.	H	α-helix	trans	-92.1	-8.6	172	-67.2	-171.1	-54.3	-100.5	-6.5	114.1	P217 E218 V219 E223	P217-R221 WeakPolarHBondContact O-CG 3.23Å; P217-R221 PolarHBondContact O-N 3.45Å; E218-R221 PolarHBondContact O-N 2.74Å; V219-R221 PolarHBondContact O-N 2.93Å; R221-E223 HydrophobicContact CB-CG 4.08Å; R221-E223 IonicContact CZ-OE1 3.43Å; R221-E223 IonicContact CZ-OE2 3.33Å; R221-E223 VanDerWaalsContact NE-CD 3.34Å; R221-E223 IonicContact NE-OE1 2.65Å; R221-E223 PolarHBondContact NE-OE1 3.46Å; R221-E223 IonicContact NE-OE2 2.85Å; R221-E223 PolarHBondContact NE-OE2 3.32Å; R221-E223 IonicContact NH2-OE1 2.96Å; R221-E223 PolarHBondContact NH2-OE1 2.85Å; R221-E223 IonicContact NH2-OE2 3.1Å; R221-E223 PolarHBondContact NH2-OE2 3.24Å
222	G	88.8	Confident	94.8	Very high	28 Å²	28	24.9 Å²	24.9	29%	0.289	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	27.6	-179.1	0	0	0	0	0	114	E218 V219	E218-G222 PolarHBondContact O-N 2.86Å; E218-G222 VanDerWaalsContact O-N 3.08Å; V219-G222 PolarHBondContact O-N 2.76Å; V219-G222 VanDerWaalsContact O-N 3.14Å
223	E	90.4	Very high	95.3	Very high	80 Å²	80	23.7 Å²	23.7	37%	0.374	12%	0.119	S	C	.	.			trans	-77.8	171.9	175.9	-66.7	166.1	-179.8	0	0	111	E218 R221	E218-E223 VanDerWaalsContact CA-OE2 3.28Å; E218-E223 WeakPolarHBondContact CA-OE2 3.27Å; E218-E223 HydrophobicContact CB-CB 4.05Å; E218-E223 WeakPolarHBondContact CB-OE2 3.14Å; E218-E223 WeakPolarHBondContact O-CB 3.19Å; E218-E223 PolarHBondContact O-N 2.88Å; R221-E223 HydrophobicContact CB-CG 4.08Å; R221-E223 IonicContact CZ-OE1 3.43Å; R221-E223 IonicContact CZ-OE2 3.33Å; R221-E223 VanDerWaalsContact NE-CD 3.34Å; R221-E223 IonicContact NE-OE1 2.65Å; R221-E223 PolarHBondContact NE-OE1 3.46Å; R221-E223 IonicContact NE-OE2 2.85Å; R221-E223 PolarHBondContact NE-OE2 3.32Å; R221-E223 IonicContact NH2-OE1 2.96Å; R221-E223 PolarHBondContact NH2-OE1 2.85Å; R221-E223 IonicContact NH2-OE2 3.1Å; R221-E223 PolarHBondContact NH2-OE2 3.24Å
224	V	91.1	Very high	95.5	Very high	57 Å²	57	22.1 Å²	22.1	35%	0.345	11%	0.112	S	C	.	.			trans	-73.5	139.6	169.7	-67.1	0	0	0	0	109.6	Q203 R205	Q203-V224 HydrophobicContact CG-CB 4.48Å; Q203-V224 HydrophobicContact CG-CG1 3.99Å; R205-V224 HydrophobicContact CG-CG1 4.03Å
225	Y	93.4	Very high	95.5	Very high	7 Å²	7	21.2 Å²	21.2	3%	0.027	11%	0.109	C	C	.	.			trans	-149.6	154.9	-171.4	70.4	-99.2	0	0	0	112.9	F163 R165 Y197 L206 A207 V219 V229	F163-Y225 AromaticContact CE2-CD2 3.78Å; F163-Y225 HydrophobicContact CE2-CD2 3.78Å; F163-Y225 AromaticContact CE2-CE2 3.68Å; F163-Y225 HydrophobicContact CE2-CE2 3.68Å; F163-Y225 HydrophobicContact CZ-CD2 4.11Å; F163-Y225 AromaticContact CZ-CE2 3.83Å; F163-Y225 HydrophobicContact CZ-CE2 3.83Å; R165-Y225 HydrophobicContact CG-CE2 4.38Å; R165-Y225 PolarHBondContact NE-OH 3.02Å; R165-Y225 VanDerWaalsContact NE-OH 3.16Å; R165-Y225 PolarHBondContact NH2-OH 3.19Å; Y197-Y225 PolarHBondContact OH-O 2.84Å; L206-Y225 HydrophobicContact CB-CE1 3.86Å; L206-Y225 HydrophobicContact CB-CE2 4.33Å; L206-Y225 HydrophobicContact CD1-CE2 4.06Å; A207-Y225 PolarHBondContact O-OH 3.47Å; V219-Y225 HydrophobicContact CG1-CD1 4.38Å; V219-Y225 HydrophobicContact CG1-CE1 3.99Å; V219-Y225 HydrophobicContact CG2-CD1 4.01Å; V219-Y225 HydrophobicContact CG2-CD2 4.21Å; V219-Y225 HydrophobicContact CG2-CE1 4.32Å; V219-Y225 HydrophobicContact CG2-CG 3.95Å; Y225-V229 HydrophobicContact CD2-CG1 3.62Å; Y225-V229 HydrophobicContact CD2-CG2 4.17Å; Y225-V229 HydrophobicContact CE2-CG2 4.45Å; Y225-V229 HydrophobicContact CG-CG1 3.94Å
226	N	95.1	Very high	95.6	Very high	41 Å²	41	20.3 Å²	20.3	22%	0.219	11%	0.105	C	C	.	.			trans	-133.5	-157.8	-175.1	70.1	-23.8	0	0	0	111.2	F163 Y197 K228 V229	F163-N226 WeakPolarHBondContact CD2-O 3.35Å; F163-N226 VanDerWaalsContact CE2-O 3.27Å; F163-N226 WeakPolarHBondContact CE2-O 3.4Å; Y197-N226 HydrophobicContact CE2-CB 4.4Å; N226-K228 PolarHBondContact O-N 3.06Å; N226-K228 WeakPolarHBondContact OD1-CB 3.47Å; N226-K228 VanDerWaalsContact OD1-CG 3.3Å; N226-K228 WeakPolarHBondContact OD1-CG 3.42Å; N226-K228 PolarHBondContact OD1-N 2.66Å; N226-V229 WeakPolarHBondContact O-CG2 3.45Å; N226-V229 PolarHBondContact O-N 3.09Å
227	E	97.1	Very high	95.7	Very high	41 Å²	41	20.3 Å²	20.3	19%	0.192	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.4	-176.9	84.8	-60.9	143.8	0	0	114.7	H158 F163 I194 V229 D230	H158-E227 VanDerWaalsContact CE1-CB 3.49Å; H158-E227 WeakPolarHBondContact CE1-CB 3.37Å; H158-E227 PolarHBondContact CE1-O 3.31Å; H158-E227 VanDerWaalsContact CE1-O 3.31Å; F163-E227 HydrophobicContact CB-CB 3.95Å; F163-E227 HydrophobicContact CG-CB 4.44Å; I194-E227 HydrophobicContact CD1-CB 3.7Å; I194-E227 HydrophobicContact CD1-CG 4.33Å; I194-E227 HydrophobicContact CG1-CB 4.04Å; E227-V229 PolarHBondContact O-N 2.88Å; E227-D230 PolarHBondContact O-N 3.35Å
228	K	98.1	Very high	95.9	Very high	27 Å²	27	20.3 Å²	20.3	12%	0.117	10%	0.104	C	C	.	.	H	α-helix	trans	-63.9	-16.2	175.6	-61.3	-61.6	-172.9	166.1	0	114.2	N226 V231 F232 A288 R291	N226-K228 PolarHBondContact O-N 3.06Å; N226-K228 WeakPolarHBondContact OD1-CB 3.47Å; N226-K228 VanDerWaalsContact OD1-CG 3.3Å; N226-K228 WeakPolarHBondContact OD1-CG 3.42Å; N226-K228 PolarHBondContact OD1-N 2.66Å; K228-V231 HydrophobicContact CD-CG2 4.49Å; K228-V231 PolarHBondContact O-N 3.33Å; K228-F232 PolarHBondContact O-N 3.5Å; K228-A288 HydrophobicContact CB-CB 3.81Å; K228-A288 WeakPolarHBondContact CD-O 3.08Å; K228-A288 HydrophobicContact CG-CB 4.24Å; K228-A288 WeakPolarHBondContact CG-O 3.34Å; K228-R291 HydrophobicContact CD-CB 4.49Å; K228-R291 PolarHBondContact NZ-O 2.95Å; K228-R291 PolarHBondContact O-NH1 3.36Å
229	V	98.1	Very high	96	Very high	8 Å²	8	19.9 Å²	19.9	5%	0.048	10%	0.102	C	C	.	.	H	α-helix	trans	-69.3	-37.2	175	-53.6	0	0	0	0	111.5	F163 A216 E218 V219 Y225 N226 E227 V231 F232 A233	F163-V229 HydrophobicContact CD2-CG2 3.85Å; F163-V229 HydrophobicContact CE2-CG2 3.82Å; A216-V229 HydrophobicContact CB-CB 4.01Å; A216-V229 HydrophobicContact CB-CG1 4.02Å; E218-V229 HydrophobicContact CG-CG1 4.35Å; V219-V229 HydrophobicContact CG2-CB 4.1Å; V219-V229 HydrophobicContact CG2-CG1 3.46Å; V219-V229 VanDerWaalsContact CG2-CG1 3.46Å; Y225-V229 HydrophobicContact CD2-CG1 3.62Å; Y225-V229 HydrophobicContact CD2-CG2 4.17Å; Y225-V229 HydrophobicContact CE2-CG2 4.45Å; Y225-V229 HydrophobicContact CG-CG1 3.94Å; N226-V229 WeakPolarHBondContact O-CG2 3.45Å; N226-V229 PolarHBondContact O-N 3.09Å; E227-V229 PolarHBondContact O-N 2.88Å; V229-V231 PolarHBondContact O-N 3.03Å; V229-F232 PolarHBondContact O-N 3.16Å; V229-A233 PolarHBondContact O-N 2.85Å
230	D	98.7	Very high	96.2	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-64.1	-32.9	174	-65.8	-3.8	0	0	0	110.9	H158 F163 H164 R165 L167 E227 Y234 F294	H158-D230 IonicContact CD2-OD2 2.86Å; H158-D230 IonicContact CE1-OD2 3.73Å; H158-D230 IonicContact NE2-OD2 3.74Å; H158-D230 PolarHBondContact NE2-OD2 2.96Å; F163-D230 WeakPolarHBondContact CA-OD2 3.49Å; F163-D230 WeakPolarHBondContact CB-OD2 3.46Å; H164-D230 WeakPolarHBondContact CB-OD2 3.45Å; H164-D230 PolarHBondContact N-OD1 3.19Å; H164-D230 VanDerWaalsContact N-OD1 3.17Å; H164-D230 PolarHBondContact N-OD2 3.37Å; R165-D230 PolarHBondContact N-OD1 3.26Å; L167-D230 HydrophobicContact CD2-CB 4.43Å; L167-D230 WeakPolarHBondContact CD2-O 3.46Å; E227-D230 PolarHBondContact O-N 3.35Å; D230-Y234 VanDerWaalsContact O-CB 3.23Å; D230-Y234 WeakPolarHBondContact O-CB 3.38Å; D230-Y234 PolarHBondContact O-N 2.68Å; D230-F294 HydrophobicContact CB-CE2 4.01Å; D230-F294 HydrophobicContact CB-CZ 4.47Å
231	V	98.9	Very high	96.5	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-67.5	-38.6	176.7	-175.5	0	0	0	0	111.1	K228 V229 Y234 G235 C283 R291 P292 F294 I297	K228-V231 HydrophobicContact CD-CG2 4.49Å; K228-V231 PolarHBondContact O-N 3.33Å; V229-V231 PolarHBondContact O-N 3.03Å; V231-Y234 PolarHBondContact O-N 3.38Å; V231-G235 PolarHBondContact O-N 3.16Å; V231-C283 HydrophobicContact CG1-CB 4.04Å; V231-C283 WeakPolarHBondContact O-CB 3.23Å; V231-R291 HydrophobicContact CB-CB 4.32Å; V231-R291 HydrophobicContact CG1-CB 3.83Å; V231-P292 WeakPolarHBondContact CG1-O 3.4Å; V231-P292 WeakPolarHBondContact CG2-O 3.42Å; V231-F294 HydrophobicContact CB-CE2 4.37Å; V231-F294 HydrophobicContact CB-CZ 4.47Å; V231-F294 HydrophobicContact CG2-CD2 3.98Å; V231-F294 HydrophobicContact CG2-CE2 3.54Å; V231-F294 HydrophobicContact CG2-CZ 4.07Å; V231-I297 HydrophobicContact CG1-CD1 4.05Å
232	F	98.8	Very high	96.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-66.4	-48.7	174.9	-170.1	-89.4	0	0	0	111.2	A216 P217 K228 V229 Y234 G235 I236 R254 C283 C284	A216-F232 HydrophobicContact CB-CB 3.73Å; A216-F232 HydrophobicContact CB-CD1 4.02Å; A216-F232 HydrophobicContact CB-CG 3.88Å; P217-F232 VanDerWaalsContact CD-CZ 3.48Å; P217-F232 HydrophobicContact CG-CE1 4.47Å; P217-F232 HydrophobicContact CG-CE2 3.97Å; P217-F232 HydrophobicContact CG-CZ 3.78Å; K228-F232 PolarHBondContact O-N 3.5Å; V229-F232 PolarHBondContact O-N 3.16Å; F232-Y234 VanDerWaalsContact C-N 3.26Å; F232-Y234 PolarHBondContact O-N 2.94Å; F232-G235 CarbonylContact O-C 3.58Å; F232-G235 WeakPolarHBondContact O-CA 3.39Å; F232-G235 PolarHBondContact O-N 2.95Å; F232-I236 HydrophobicContact CD1-CD1 4.41Å; F232-I236 HydrophobicContact CD1-CG1 4.17Å; F232-I236 HydrophobicContact CE1-CD1 3.96Å; F232-I236 HydrophobicContact CE1-CG1 4.13Å; F232-I236 HydrophobicContact CZ-CD1 4.47Å; F232-I236 WeakPolarHBondContact O-CG1 3.4Å; F232-I236 PolarHBondContact O-N 3.26Å; F232-R254 VanDerWaalsContact CZ-NH2 3.28Å; F232-C283 WeakPolarHBondContact CA-O 3.49Å; F232-C284 HydrophobicContact CE2-CB 4.42Å; F232-C284 WeakPolarHBondContact CE2-O 3.42Å
233	A	98.8	Very high	97.2	Very high	6 Å²	6	14.4 Å²	14.4	5%	0.05	8%	0.079	C	C	.	.	H	α-helix	trans	-57	-39.6	175.3	0	0	0	0	0	112.3	L167 W214 V229 I236 I237	L167-A233 HydrophobicContact CB-CB 3.94Å; L167-A233 HydrophobicContact CD2-CB 4.08Å; L167-A233 HydrophobicContact CG-CB 4.23Å; W214-A233 HydrophobicContact CB-CB 4.07Å; W214-A233 WeakPolarHBondContact O-CA 3.21Å; W214-A233 WeakPolarHBondContact O-CB 3.36Å; V229-A233 PolarHBondContact O-N 2.85Å; A233-I236 WeakPolarHBondContact O-CB 3.39Å; A233-I236 PolarHBondContact O-N 3.23Å; A233-I237 WeakPolarHBondContact O-CG1 3.46Å; A233-I237 PolarHBondContact O-N 2.64Å
234	Y	98.9	Very high	97.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.3	-38.1	171.3	175.8	-102.9	0	0	0	112.6	A147 I150 A151 L154 D230 V231 F232 I236 I237 L238 F294 I297 L301	A147-Y234 WeakPolarHBondContact O-CE2 3.37Å; A147-Y234 PolarHBondContact O-OH 3.49Å; I150-Y234 HydrophobicContact CB-CD2 4.43Å; I150-Y234 HydrophobicContact CB-CE2 4.07Å; I150-Y234 HydrophobicContact CG2-CD2 3.66Å; I150-Y234 HydrophobicContact CG2-CE2 3.8Å; A151-Y234 HydrophobicContact CB-CE2 4.14Å; L154-Y234 HydrophobicContact CD1-CD2 4.31Å; D230-Y234 VanDerWaalsContact O-CB 3.23Å; D230-Y234 WeakPolarHBondContact O-CB 3.38Å; D230-Y234 PolarHBondContact O-N 2.68Å; V231-Y234 PolarHBondContact O-N 3.38Å; F232-Y234 VanDerWaalsContact C-N 3.26Å; F232-Y234 PolarHBondContact O-N 2.94Å; Y234-I236 VanDerWaalsContact C-N 3.31Å; Y234-I236 PolarHBondContact O-N 2.69Å; Y234-I237 CarbonylContact O-C 3.56Å; Y234-I237 PolarHBondContact O-N 2.81Å; Y234-L238 HydrophobicContact CD1-CD1 4.09Å; Y234-L238 HydrophobicContact CD1-CG 4.19Å; Y234-L238 HydrophobicContact CE1-CD1 3.56Å; Y234-L238 HydrophobicContact CE1-CD2 4.13Å; Y234-L238 HydrophobicContact CE1-CG 3.8Å; Y234-L238 HydrophobicContact CE2-CD2 4.31Å; Y234-L238 HydrophobicContact CE2-CG 4.5Å; Y234-L238 WeakPolarHBondContact O-CG 3.09Å; Y234-L238 PolarHBondContact O-N 3.34Å; Y234-F294 AromaticContact CD1-CE1 3.75Å; Y234-F294 HydrophobicContact CD1-CE1 3.75Å; Y234-F294 HydrophobicContact CD1-CZ 4.34Å; Y234-F294 AromaticContact CD2-CE1 3.99Å; Y234-F294 HydrophobicContact CD2-CE1 3.99Å; Y234-F294 HydrophobicContact CE1-CE1 4.25Å; Y234-F294 HydrophobicContact CE2-CE1 4.46Å; Y234-F294 AromaticContact CG-CE1 3.6Å; Y234-F294 HydrophobicContact CG-CE1 3.6Å; Y234-F294 AromaticContact CG-CZ 3.98Å; Y234-F294 HydrophobicContact CG-CZ 3.98Å; Y234-I297 HydrophobicContact CD1-CD1 4.13Å; Y234-I297 HydrophobicContact CE1-CD1 4.13Å; Y234-I297 HydrophobicContact CE1-CG2 3.74Å; Y234-L301 WeakPolarHBondContact OH-CD1 3.25Å
235	G	98.8	Very high	97.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.9	-38.4	171.3	0	0	0	0	0	113.1	V231 F232 L238 C239	V231-G235 PolarHBondContact O-N 3.16Å; F232-G235 CarbonylContact O-C 3.58Å; F232-G235 WeakPolarHBondContact O-CA 3.39Å; F232-G235 PolarHBondContact O-N 2.95Å; G235-L238 WeakPolarHBondContact O-CB 3.41Å; G235-L238 PolarHBondContact O-N 3.3Å; G235-C239 PolarHBondContact O-N 2.83Å; G235-C239 PolarHBondContact O-SG 3.41Å
236	I	98.8	Very high	97.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.3	-46.6	171.6	-55	-54.7	0	0	0	110.6	W214 F232 A233 Y234 L238 C239 E240 A247 L252	W214-I236 HydrophobicContact CG-CB 4.47Å; W214-I236 HydrophobicContact CG-CG2 4.14Å; F232-I236 HydrophobicContact CD1-CD1 4.41Å; F232-I236 HydrophobicContact CD1-CG1 4.17Å; F232-I236 HydrophobicContact CE1-CD1 3.96Å; F232-I236 HydrophobicContact CE1-CG1 4.13Å; F232-I236 HydrophobicContact CZ-CD1 4.47Å; F232-I236 WeakPolarHBondContact O-CG1 3.4Å; F232-I236 PolarHBondContact O-N 3.26Å; A233-I236 WeakPolarHBondContact O-CB 3.39Å; A233-I236 PolarHBondContact O-N 3.23Å; Y234-I236 VanDerWaalsContact C-N 3.31Å; Y234-I236 PolarHBondContact O-N 2.69Å; I236-L238 VanDerWaalsContact C-N 3.28Å; I236-L238 PolarHBondContact O-N 2.83Å; I236-C239 WeakPolarHBondContact O-CA 3.41Å; I236-C239 VanDerWaalsContact O-CB 3.31Å; I236-C239 WeakPolarHBondContact O-CB 3.43Å; I236-C239 PolarHBondContact O-N 2.75Å; I236-E240 PolarHBondContact O-N 2.62Å; I236-A247 HydrophobicContact CG2-CB 3.57Å; I236-L252 HydrophobicContact CD1-CD2 4.34Å; I236-L252 HydrophobicContact CG2-CD2 3.86Å
237	I	98.8	Very high	97.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-35.6	175.8	-65.4	166.6	0	0	0	111.7	L128 I150 L167 T168 A233 Y234 C239 E240 I241	L128-I237 HydrophobicContact CD2-CG2 3.64Å; I150-I237 HydrophobicContact CD1-CG2 4.15Å; L167-I237 HydrophobicContact CD1-CD1 4.05Å; L167-I237 HydrophobicContact CD2-CD1 4.26Å; L167-I237 HydrophobicContact CG-CD1 3.76Å; T168-I237 VanDerWaalsContact C-CD1 3.43Å; A233-I237 WeakPolarHBondContact O-CG1 3.46Å; A233-I237 PolarHBondContact O-N 2.64Å; Y234-I237 CarbonylContact O-C 3.56Å; Y234-I237 PolarHBondContact O-N 2.81Å; I237-C239 VanDerWaalsContact C-N 3.33Å; I237-E240 WeakPolarHBondContact CA-OE2 3.29Å; I237-E240 PolarHBondContact O-N 2.79Å; I237-I241 HydrophobicContact CG2-CD1 3.86Å; I237-I241 HydrophobicContact CG2-CG1 4.35Å; I237-I241 WeakPolarHBondContact O-CB 3.42Å; I237-I241 VanDerWaalsContact O-CG1 3.23Å; I237-I241 WeakPolarHBondContact O-CG1 3.28Å; I237-I241 PolarHBondContact O-N 3.16Å
238	L	98.8	Very high	97.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.1	-39.7	171	-71.1	-174.7	0	0	0	111.5	A147 Y234 G235 I236 I241 I242 F276 L279 A280	A147-L238 HydrophobicContact CB-CD2 3.59Å; Y234-L238 HydrophobicContact CD1-CD1 4.09Å; Y234-L238 HydrophobicContact CD1-CG 4.19Å; Y234-L238 HydrophobicContact CE1-CD1 3.56Å; Y234-L238 HydrophobicContact CE1-CD2 4.13Å; Y234-L238 HydrophobicContact CE1-CG 3.8Å; Y234-L238 HydrophobicContact CE2-CD2 4.31Å; Y234-L238 HydrophobicContact CE2-CG 4.5Å; Y234-L238 WeakPolarHBondContact O-CG 3.09Å; Y234-L238 PolarHBondContact O-N 3.34Å; G235-L238 WeakPolarHBondContact O-CB 3.41Å; G235-L238 PolarHBondContact O-N 3.3Å; I236-L238 VanDerWaalsContact C-N 3.28Å; I236-L238 PolarHBondContact O-N 2.83Å; L238-I241 PolarHBondContact O-N 3.1Å; L238-I242 VanDerWaalsContact O-CB 3.25Å; L238-I242 WeakPolarHBondContact O-CB 3.48Å; L238-I242 WeakPolarHBondContact O-CD1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.13Å; L238-I242 PolarHBondContact O-N 3.08Å; L238-F276 HydrophobicContact CD2-CE2 3.63Å; L238-F276 HydrophobicContact CD2-CZ 3.82Å; L238-L279 HydrophobicContact CD1-CD2 4.04Å; L238-L279 HydrophobicContact CD1-CG 3.88Å; L238-A280 HydrophobicContact CB-CB 3.69Å; L238-A280 HydrophobicContact CD1-CB 4.13Å
239	C	98.6	Very high	96.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.1	-43.2	175.2	-59.9	0	0	0	0	111.8	G235 I236 I237 I242 A243 L252 F265	G235-C239 PolarHBondContact O-N 2.83Å; G235-C239 PolarHBondContact O-SG 3.41Å; I236-C239 WeakPolarHBondContact O-CA 3.41Å; I236-C239 VanDerWaalsContact O-CB 3.31Å; I236-C239 WeakPolarHBondContact O-CB 3.43Å; I236-C239 PolarHBondContact O-N 2.75Å; I237-C239 VanDerWaalsContact C-N 3.33Å; C239-I242 PolarHBondContact O-N 3.34Å; C239-A243 PolarHBondContact O-N 3.33Å; C239-L252 HydrophobicContact CB-CD1 3.68Å; C239-L252 HydrophobicContact CB-CD2 4.43Å; C239-F265 HydrophobicContact CB-CE1 4.08Å; C239-F265 HydrophobicContact CB-CE2 3.83Å; C239-F265 HydrophobicContact CB-CZ 3.55Å
240	E	98.3	Very high	96.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-58.6	-45.9	172.8	-64.1	177.5	96.3	0	0	111.4	L132 S169 W214 I236 I237 R244 I245 A247	L132-E240 HydrophobicContact CD1-CB 3.79Å; S169-E240 WeakPolarHBondContact CB-OE1 3.49Å; S169-E240 VanDerWaalsContact CB-OE2 3.3Å; S169-E240 WeakPolarHBondContact CB-OE2 3.44Å; S169-E240 VanDerWaalsContact OG-CD 3.3Å; S169-E240 PolarHBondContact OG-OE1 2.85Å; S169-E240 PolarHBondContact OG-OE2 2.86Å; W214-E240 PolarHBondContact NE1-OE2 2.76Å; I236-E240 PolarHBondContact O-N 2.62Å; I237-E240 WeakPolarHBondContact CA-OE2 3.29Å; I237-E240 PolarHBondContact O-N 2.79Å; E240-R244 WeakPolarHBondContact O-CA 3.44Å; E240-R244 PolarHBondContact O-N 3.07Å; E240-I245 WeakPolarHBondContact CA-O 3.37Å; E240-I245 WeakPolarHBondContact CB-O 3.47Å; E240-I245 WeakPolarHBondContact CG-O 3.33Å; E240-I245 PolarHBondContact O-N 2.72Å; E240-A247 HydrophobicContact CG-CB 4.11Å; E240-A247 PolarHBondContact OE1-N 3.24Å
241	I	98.1	Very high	96.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.6	-42.9	177.6	-71.1	168.2	0	0	0	112	L128 L132 R143 A147 I237 L238 F276	L128-I241 HydrophobicContact CD1-CG1 4.48Å; L128-I241 HydrophobicContact CD2-CD1 4Å; L128-I241 HydrophobicContact CD2-CG1 4.05Å; L132-I241 HydrophobicContact CD1-CG1 4.09Å; L132-I241 HydrophobicContact CD2-CG1 4.3Å; R143-I241 HydrophobicContact CB-CG2 3.58Å; R143-I241 WeakPolarHBondContact CD-O 3.42Å; R143-I241 HydrophobicContact CG-CG2 3.93Å; A147-I241 HydrophobicContact CB-CD1 4.28Å; I237-I241 HydrophobicContact CG2-CD1 3.86Å; I237-I241 HydrophobicContact CG2-CG1 4.35Å; I237-I241 WeakPolarHBondContact O-CB 3.42Å; I237-I241 VanDerWaalsContact O-CG1 3.23Å; I237-I241 WeakPolarHBondContact O-CG1 3.28Å; I237-I241 PolarHBondContact O-N 3.16Å; L238-I241 PolarHBondContact O-N 3.1Å; I241-F276 HydrophobicContact CG2-CE1 4.16Å; I241-F276 HydrophobicContact CG2-CZ 4.13Å
242	I	97.6	Very high	96.1	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-67.9	-52.1	-176.1	-75.9	166.4	0	0	0	110.8	W140 R143 L238 C239 F265 V269 C272 F276 A280	W140-I242 HydrophobicContact CH2-CG2 4.28Å; W140-I242 HydrophobicContact CZ3-CG1 4.26Å; R143-I242 PolarHBondContact NH1-O 3.46Å; L238-I242 VanDerWaalsContact O-CB 3.25Å; L238-I242 WeakPolarHBondContact O-CB 3.48Å; L238-I242 WeakPolarHBondContact O-CD1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.13Å; L238-I242 PolarHBondContact O-N 3.08Å; C239-I242 PolarHBondContact O-N 3.34Å; I242-F265 HydrophobicContact CB-CZ 4.28Å; I242-F265 HydrophobicContact CG2-CE1 4.35Å; I242-F265 HydrophobicContact CG2-CZ 4.03Å; I242-V269 HydrophobicContact CG2-CB 4.29Å; I242-V269 HydrophobicContact CG2-CG1 3.54Å; I242-V269 HydrophobicContact CG2-CG2 3.66Å; I242-C272 HydrophobicContact CG2-CB 4.04Å; I242-F276 HydrophobicContact CD1-CD1 3.98Å; I242-F276 HydrophobicContact CD1-CE1 4.23Å; I242-F276 HydrophobicContact CD1-CG 4.4Å; I242-F276 HydrophobicContact CG1-CD1 3.63Å; I242-F276 HydrophobicContact CG1-CE1 3.6Å; I242-F276 HydrophobicContact CG1-CZ 4.46Å; I242-A280 HydrophobicContact CD1-CB 3.8Å
243	A	95.9	Very high	96	Very high	29 Å²	29	22.8 Å²	22.8	24%	0.24	12%	0.119	C	C	.	.	H	α-helix	trans	-94.3	-9.8	-173.8	0	0	0	0	0	114.2	C239 I245 F265 V269	C239-A243 PolarHBondContact O-N 3.33Å; A243-I245 VanDerWaalsContact C-N 3.34Å; A243-I245 HydrophobicContact CB-CD1 3.84Å; A243-I245 HydrophobicContact CB-CG1 3.94Å; A243-I245 HydrophobicContact CB-CG2 4.11Å; A243-F265 HydrophobicContact CB-CE2 3.83Å; A243-F265 HydrophobicContact CB-CZ 4.2Å; A243-V269 HydrophobicContact CB-CG2 4.16Å
244	R	95.1	Very high	95.8	Very high	67 Å²	67	23.3 Å²	23.3	25%	0.253	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	47	-172.1	-60.8	-164.5	66	172.7	7.5	113.1	L131 L132 S134 V136 E240	L131-R244 PolarHBondContact O-NH2 3.36Å; L132-R244 HydrophobicContact CD2-CG 4.38Å; L132-R244 VanDerWaalsContact O-CZ 3.31Å; L132-R244 PolarHBondContact O-NE 2.61Å; L132-R244 PolarHBondContact O-NH2 2.99Å; S134-R244 PolarHBondContact O-NH2 3.29Å; V136-R244 PolarHBondContact O-NH1 3.36Å; V136-R244 PolarHBondContact O-NH2 2.81Å; E240-R244 WeakPolarHBondContact O-CA 3.44Å; E240-R244 PolarHBondContact O-N 3.07Å
245	I	94.6	Very high	95.6	Very high	31 Å²	31	25.5 Å²	25.5	16%	0.159	13%	0.134	C	C	.	.			trans	-117.7	161.7	177.7	63	-175.7	0	0	0	110.5	E240 A243 I251 L252 F265 M268	E240-I245 WeakPolarHBondContact CA-O 3.37Å; E240-I245 WeakPolarHBondContact CB-O 3.47Å; E240-I245 WeakPolarHBondContact CG-O 3.33Å; E240-I245 PolarHBondContact O-N 2.72Å; A243-I245 VanDerWaalsContact C-N 3.34Å; A243-I245 HydrophobicContact CB-CD1 3.84Å; A243-I245 HydrophobicContact CB-CG1 3.94Å; A243-I245 HydrophobicContact CB-CG2 4.11Å; I245-I251 HydrophobicContact CB-CG2 3.83Å; I245-I251 HydrophobicContact CG2-CG2 4.02Å; I245-L252 HydrophobicContact CD1-CB 4.04Å; I245-L252 HydrophobicContact CD1-CD1 3.88Å; I245-F265 HydrophobicContact CD1-CE2 4.21Å; I245-M268 HydrophobicContact CD1-SD 3.8Å
246	Q	94.2	Very high	95.1	Very high	88 Å²	88	33.7 Å²	33.7	41%	0.411	17%	0.172	S	C	.	.			trans	-75.8	152.6	167.2	-60.5	171.6	28.6	0	0	109.5	D248 I251	Q246-D248 PolarHBondContact O-N 3.32Å; Q246-D248 VanDerWaalsContact O-N 3.07Å; Q246-I251 HydrophobicContact CB-CD1 4.4Å
247	A	94.9	Very high	94.7	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.191	C	C	.	.	S	Bend	trans	-66.6	-1	174.8	0	0	0	0	0	115.4	W214 I236 E240 L252	W214-A247 HydrophobicContact CD2-CB 4.14Å; W214-A247 HydrophobicContact CH2-CB 4.03Å; W214-A247 HydrophobicContact CZ2-CB 3.45Å; W214-A247 VanDerWaalsContact CZ2-CB 3.45Å; I236-A247 HydrophobicContact CG2-CB 3.57Å; E240-A247 HydrophobicContact CG-CB 4.11Å; E240-A247 PolarHBondContact OE1-N 3.24Å; A247-L252 HydrophobicContact CB-CD2 4.42Å
248	D	92.9	Very high	94.4	Very high	35 Å²	35	38.3 Å²	38.3	19%	0.187	20%	0.195	C	C	.	.			trans	-59.8	130.1	-177.5	-168.5	-66.3	0	0	0	111.5	Y213 Q246 D250 I251 L252	Y213-D248 HydrophobicContact CD2-CB 4.24Å; Y213-D248 HydrophobicContact CE2-CB 3.73Å; Y213-D248 WeakPolarHBondContact CE2-OD2 3.46Å; Y213-D248 PolarHBondContact OH-OD2 3.38Å; Q246-D248 PolarHBondContact O-N 3.32Å; Q246-D248 VanDerWaalsContact O-N 3.07Å; D248-D250 PolarHBondContact O-N 2.96Å; D248-D250 VanDerWaalsContact O-N 3.15Å; D248-D250 WeakPolarHBondContact OD1-CB 3.44Å; D248-D250 PolarHBondContact OD1-N 3.48Å; D248-I251 HydrophobicContact CB-CD1 4.44Å; D248-I251 HydrophobicContact CB-CG1 4.49Å; D248-I251 CarbonylContact O-C 3.54Å; D248-I251 WeakPolarHBondContact O-CA 3.34Å; D248-I251 PolarHBondContact O-N 3.03Å; D248-L252 PolarHBondContact O-N 2.89Å
249	P	88.4	Confident	94.2	Very high	14 Å²	14	38.3 Å²	38.3	9%	0.091	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.2	-177.9	26.3	-38.1	0	0	0	115.5	Y213 I251 R254 N362 F364	Y213-P249 HydrophobicContact CD1-CG 4.26Å; Y213-P249 HydrophobicContact CE1-CG 3.86Å; Y213-P249 VanDerWaalsContact CZ-CD 3.46Å; P249-I251 PolarHBondContact O-N 3.11Å; P249-R254 HydrophobicContact CB-CG 3.71Å; P249-N362 WeakPolarHBondContact CG-ND2 3.43Å; P249-N362 VanDerWaalsContact CG-OD1 3.26Å; P249-N362 WeakPolarHBondContact CG-OD1 3.44Å; P249-F364 HydrophobicContact CB-CD2 3.78Å; P249-F364 HydrophobicContact CB-CE2 4.21Å; P249-F364 HydrophobicContact CG-CB 4.33Å; P249-F364 HydrophobicContact CG-CD2 3.67Å; P249-F364 HydrophobicContact CG-CE2 4.39Å; P249-F364 HydrophobicContact CG-CG 4.29Å
250	D	89.8	Confident	94.1	Very high	118 Å²	118	38.9 Å²	38.9	63%	0.631	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-8.9	170.8	-69.7	-6.5	0	0	0	112.1	D248 N362	D248-D250 PolarHBondContact O-N 2.96Å; D248-D250 VanDerWaalsContact O-N 3.15Å; D248-D250 WeakPolarHBondContact OD1-CB 3.44Å; D248-D250 PolarHBondContact OD1-N 3.48Å; D250-N362 WeakPolarHBondContact OD1-CB 3.45Å; D250-N362 PolarHBondContact OD1-ND2 3.37Å
251	I	93.4	Very high	94.1	Very high	74 Å²	74	40.2 Å²	40.2	38%	0.379	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-55.6	-177.5	-51.4	178.2	0	0	0	111.3	I245 Q246 D248 P249 P253 M268	I245-I251 HydrophobicContact CB-CG2 3.83Å; I245-I251 HydrophobicContact CG2-CG2 4.02Å; Q246-I251 HydrophobicContact CB-CD1 4.4Å; D248-I251 HydrophobicContact CB-CD1 4.44Å; D248-I251 HydrophobicContact CB-CG1 4.49Å; D248-I251 CarbonylContact O-C 3.54Å; D248-I251 WeakPolarHBondContact O-CA 3.34Å; D248-I251 PolarHBondContact O-N 3.03Å; P249-I251 PolarHBondContact O-N 3.11Å; I251-P253 WeakPolarHBondContact O-CD 3.43Å; I251-M268 WeakPolarHBondContact O-CE 3.43Å
252	L	95.9	Very high	94	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-81.9	115.3	175.1	173.9	64.6	0	0	0	109.7	I236 C239 I245 A247 D248 R254 L260 F265	I236-L252 HydrophobicContact CD1-CD2 4.34Å; I236-L252 HydrophobicContact CG2-CD2 3.86Å; C239-L252 HydrophobicContact CB-CD1 3.68Å; C239-L252 HydrophobicContact CB-CD2 4.43Å; I245-L252 HydrophobicContact CD1-CB 4.04Å; I245-L252 HydrophobicContact CD1-CD1 3.88Å; A247-L252 HydrophobicContact CB-CD2 4.42Å; D248-L252 PolarHBondContact O-N 2.89Å; L252-R254 WeakPolarHBondContact O-CD 3.29Å; L252-R254 WeakPolarHBondContact O-CG 3.36Å; L252-R254 PolarHBondContact O-N 3.02Å; L252-L260 HydrophobicContact CD1-CD1 3.94Å; L252-L260 HydrophobicContact CG-CD1 4.48Å; L252-F265 HydrophobicContact CD1-CD2 3.83Å; L252-F265 HydrophobicContact CD1-CE2 3.94Å
253	P	95.6	Very high	93.9	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.058	25%	0.25	C	S	.	.			trans	-60.9	125.2	-174.5	-26.6	37.2	0	0	0	113.7	I251 D261 A264 M268	I251-P253 WeakPolarHBondContact O-CD 3.43Å; P253-D261 HydrophobicContact CB-CB 3.73Å; P253-D261 PolarHBondContact O-N 3.46Å; P253-A264 HydrophobicContact CB-CB 3.63Å; P253-A264 HydrophobicContact CG-CB 3.88Å; P253-M268 HydrophobicContact CG-CE 3.67Å
254	R	94.9	Very high	93.9	Very high	17 Å²	17	48.1 Å²	48.1	6%	0.064	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-120.3	148.5	178.4	-49.4	-53.4	-62.9	171.3	-6.4	111.8	F232 P249 L252 F258 G259 P363 F364	F232-R254 VanDerWaalsContact CZ-NH2 3.28Å; P249-R254 HydrophobicContact CB-CG 3.71Å; L252-R254 WeakPolarHBondContact O-CD 3.29Å; L252-R254 WeakPolarHBondContact O-CG 3.36Å; L252-R254 PolarHBondContact O-N 3.02Å; R254-F258 PolarHBondContact NH2-O 3.45Å; R254-G259 VanDerWaalsContact CA-O 3.23Å; R254-G259 WeakPolarHBondContact CA-O 3.23Å; R254-G259 PolarHBondContact NE-O 3.37Å; R254-G259 PolarHBondContact NH2-O 2.87Å; R254-P363 HydrophobicContact CB-CG 3.97Å; R254-F364 HydrophobicContact CG-CE2 4.24Å
255	T	94.3	Very high	94	Very high	47 Å²	47	44.9 Å²	44.9	29%	0.288	23%	0.23	S	C	.	.			trans	-85.8	161.4	168.5	51.2	0	0	0	0	111.4	D257 F258 G259 D261	T255-D257 VanDerWaalsContact CB-OD1 3.25Å; T255-D257 WeakPolarHBondContact CB-OD1 3.43Å; T255-D257 PolarHBondContact O-N 3.45Å; T255-D257 PolarHBondContact OG1-OD1 3.49Å; T255-F258 PolarHBondContact O-N 3.13Å; T255-G259 PolarHBondContact N-O 2.86Å; T255-G259 VanDerWaalsContact OG1-C 3.27Å; T255-G259 WeakPolarHBondContact OG1-CA 3.43Å; T255-G259 PolarHBondContact OG1-N 3.4Å; T255-G259 VanDerWaalsContact OG1-N 3.08Å; T255-G259 PolarHBondContact OG1-O 3.33Å; T255-D261 HydrophobicContact CG2-CB 4.08Å
256	E	89.5	Confident	94	Very high	172 Å²	172	47.7 Å²	47.7	80%	0.804	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.9	-177.3	-63.1	-174	164.9	0	0	113.6	F258	E256-F258 PolarHBondContact O-N 2.95Å
257	D	89.8	Confident	93.9	Very high	76 Å²	76	51.2 Å²	51.2	41%	0.406	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	18.6	175.9	68.4	-18.3	0	0	0	114	T255 G259 M286	T255-D257 VanDerWaalsContact CB-OD1 3.25Å; T255-D257 WeakPolarHBondContact CB-OD1 3.43Å; T255-D257 PolarHBondContact O-N 3.45Å; T255-D257 PolarHBondContact OG1-OD1 3.49Å; D257-G259 PolarHBondContact O-N 3.13Å; D257-G259 PolarHBondContact OD1-N 2.88Å; D257-M286 HydrophobicContact CB-CE 4.3Å; D257-M286 VanDerWaalsContact OD2-CE 3.22Å; D257-M286 WeakPolarHBondContact OD2-CE 3.43Å
258	F	92.3	Very high	93.8	Very high	20 Å²	20	54.9 Å²	54.9	9%	0.088	28%	0.276	C	S	.	.	S	Bend	trans	68.8	8.5	-178.3	-44.5	-81.7	0	0	0	115.5	P217 L220 R254 T255 E256 P363 F364	P217-F258 HydrophobicContact CG-CB 4.5Å; L220-F258 HydrophobicContact CB-CD2 4.36Å; L220-F258 HydrophobicContact CD1-CB 3.73Å; L220-F258 HydrophobicContact CD1-CD1 4.05Å; L220-F258 HydrophobicContact CD1-CD2 4.34Å; L220-F258 HydrophobicContact CD1-CG 3.78Å; R254-F258 PolarHBondContact NH2-O 3.45Å; T255-F258 PolarHBondContact O-N 3.13Å; E256-F258 PolarHBondContact O-N 2.95Å; F258-P363 HydrophobicContact CD1-CB 4.06Å; F258-P363 HydrophobicContact CD1-CG 4.4Å; F258-P363 HydrophobicContact CE1-CB 4.05Å; F258-F364 HydrophobicContact CB-CZ 4.24Å; F258-F364 HydrophobicContact CD1-CD1 4.22Å; F258-F364 HydrophobicContact CD1-CD2 4.35Å; F258-F364 AromaticContact CD1-CE1 3.88Å; F258-F364 HydrophobicContact CD1-CE1 3.88Å; F258-F364 HydrophobicContact CD1-CE2 4.01Å; F258-F364 HydrophobicContact CD1-CG 4.45Å; F258-F364 AromaticContact CD1-CZ 3.77Å; F258-F364 HydrophobicContact CD1-CZ 3.77Å; F258-F364 HydrophobicContact CE1-CD1 4.45Å; F258-F364 HydrophobicContact CG-CZ 4.45Å
259	G	94.1	Very high	93.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.			trans	-71.2	178.1	173.5	0	0	0	0	0	114.6	R254 T255 D257 M286	R254-G259 VanDerWaalsContact CA-O 3.23Å; R254-G259 WeakPolarHBondContact CA-O 3.23Å; R254-G259 PolarHBondContact NE-O 3.37Å; R254-G259 PolarHBondContact NH2-O 2.87Å; T255-G259 PolarHBondContact N-O 2.86Å; T255-G259 VanDerWaalsContact OG1-C 3.27Å; T255-G259 WeakPolarHBondContact OG1-CA 3.43Å; T255-G259 PolarHBondContact OG1-N 3.4Å; T255-G259 VanDerWaalsContact OG1-N 3.08Å; T255-G259 PolarHBondContact OG1-O 3.33Å; D257-G259 PolarHBondContact O-N 3.13Å; D257-G259 PolarHBondContact OD1-N 2.88Å; G259-M286 WeakPolarHBondContact CA-SD 3.49Å
260	L	97	Very high	93.4	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.063	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-83.2	127	170.3	179.3	70.1	0	0	0	109.1	L252 V262 F265 I281 C284	L252-L260 HydrophobicContact CD1-CD1 3.94Å; L252-L260 HydrophobicContact CG-CD1 4.48Å; L260-V262 VanDerWaalsContact C-N 3.32Å; L260-V262 HydrophobicContact CD2-CG2 4.26Å; L260-V262 HydrophobicContact CG-CG2 4.36Å; L260-V262 PolarHBondContact O-N 3.27Å; L260-F265 HydrophobicContact CD1-CB 4.18Å; L260-F265 HydrophobicContact CD1-CG 4.22Å; L260-F265 HydrophobicContact CD2-CD1 4.37Å; L260-I281 HydrophobicContact CD2-CG1 4.47Å; L260-C284 HydrophobicContact CB-CB 3.95Å; L260-C284 HydrophobicContact CD2-CB 3.89Å
261	D	97.1	Very high	93.4	Very high	30 Å²	30	55.7 Å²	55.7	16%	0.16	29%	0.293	C	S	.	.			trans	-75.2	89.6	167.9	174.6	-6	0	0	0	107.7	P253 T255 E263 A264 F265 R360	P253-D261 HydrophobicContact CB-CB 3.73Å; P253-D261 PolarHBondContact O-N 3.46Å; T255-D261 HydrophobicContact CG2-CB 4.08Å; D261-E263 PolarHBondContact O-N 3.26Å; D261-A264 HydrophobicContact CB-CB 4.19Å; D261-A264 PolarHBondContact O-N 3.29Å; D261-A264 VanDerWaalsContact OD1-CB 3.24Å; D261-A264 WeakPolarHBondContact OD1-CB 3.43Å; D261-A264 PolarHBondContact OD1-N 3.23Å; D261-A264 WeakPolarHBondContact OD2-CB 3.37Å; D261-F265 WeakPolarHBondContact O-CB 3.22Å; D261-F265 PolarHBondContact O-N 3.09Å; D261-R360 IonicContact OD2-CZ 2.78Å; D261-R360 IonicContact OD2-NE 2.98Å; D261-R360 PolarHBondContact OD2-NE 2.79Å; D261-R360 VanDerWaalsContact OD2-NE 3.1Å; D261-R360 IonicContact OD2-NH2 3.75Å; D261-R360 PolarHBondContact OD2-NH2 3.07Å
262	V	96.3	Very high	93.4	Very high	47 Å²	47	52.8 Å²	52.8	29%	0.285	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-42.5	-171.9	175.2	0	0	0	0	111.5	L260 F265 Q266 I281	L260-V262 VanDerWaalsContact C-N 3.32Å; L260-V262 HydrophobicContact CD2-CG2 4.26Å; L260-V262 HydrophobicContact CG-CG2 4.36Å; L260-V262 PolarHBondContact O-N 3.27Å; V262-F265 PolarHBondContact O-N 3.46Å; V262-Q266 HydrophobicContact CG1-CG 4.26Å; V262-Q266 WeakPolarHBondContact O-CB 3.4Å; V262-Q266 VanDerWaalsContact O-CG 3.25Å; V262-Q266 WeakPolarHBondContact O-CG 3.33Å; V262-Q266 PolarHBondContact O-N 3.25Å; V262-I281 HydrophobicContact CG1-CD1 3.72Å; V262-I281 HydrophobicContact CG1-CG1 3.98Å; V262-I281 HydrophobicContact CG1-CG2 4.19Å; V262-I281 HydrophobicContact CG2-CG1 4.42Å; V262-I281 HydrophobicContact CG2-CG2 4.03Å
263	E	95.6	Very high	93.4	Very high	144 Å²	144	54.1 Å²	54.1	67%	0.673	29%	0.288	S	S	*	.	H	α-helix	trans	-64.7	-44.2	-178.9	-64.9	-177.3	-167.5	0	0	110.9	D261 Q266 Q267	D261-E263 PolarHBondContact O-N 3.26Å; E263-Q266 PolarHBondContact O-N 3.33Å; E263-Q267 VanDerWaalsContact O-CG 3.26Å; E263-Q267 WeakPolarHBondContact O-CG 3.23Å; E263-Q267 PolarHBondContact O-N 2.9Å
264	A	95.9	Very high	93.3	Very high	7 Å²	7	58.1 Å²	58.1	6%	0.058	31%	0.314	C	S	.	.	H	α-helix	trans	-70.6	-34.4	177.3	0	0	0	0	0	113.5	P253 D261 Q267 M268	P253-A264 HydrophobicContact CB-CB 3.63Å; P253-A264 HydrophobicContact CG-CB 3.88Å; D261-A264 HydrophobicContact CB-CB 4.19Å; D261-A264 PolarHBondContact O-N 3.29Å; D261-A264 VanDerWaalsContact OD1-CB 3.24Å; D261-A264 WeakPolarHBondContact OD1-CB 3.43Å; D261-A264 PolarHBondContact OD1-N 3.23Å; D261-A264 WeakPolarHBondContact OD2-CB 3.37Å; A264-Q267 PolarHBondContact O-N 3.19Å; A264-M268 WeakPolarHBondContact O-CB 3.44Å; A264-M268 PolarHBondContact O-N 3.02Å; A264-M268 VanDerWaalsContact O-N 3.12Å
265	F	96.8	Very high	93.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.6	-40.4	174.9	-172.8	-111.1	0	0	0	111.3	C239 I242 A243 I245 L252 L260 D261 V262 Q267 M268 V269 L277	C239-F265 HydrophobicContact CB-CE1 4.08Å; C239-F265 HydrophobicContact CB-CE2 3.83Å; C239-F265 HydrophobicContact CB-CZ 3.55Å; I242-F265 HydrophobicContact CB-CZ 4.28Å; I242-F265 HydrophobicContact CG2-CE1 4.35Å; I242-F265 HydrophobicContact CG2-CZ 4.03Å; A243-F265 HydrophobicContact CB-CE2 3.83Å; A243-F265 HydrophobicContact CB-CZ 4.2Å; I245-F265 HydrophobicContact CD1-CE2 4.21Å; L252-F265 HydrophobicContact CD1-CD2 3.83Å; L252-F265 HydrophobicContact CD1-CE2 3.94Å; L260-F265 HydrophobicContact CD1-CB 4.18Å; L260-F265 HydrophobicContact CD1-CG 4.22Å; L260-F265 HydrophobicContact CD2-CD1 4.37Å; D261-F265 WeakPolarHBondContact O-CB 3.22Å; D261-F265 PolarHBondContact O-N 3.09Å; V262-F265 PolarHBondContact O-N 3.46Å; F265-Q267 VanDerWaalsContact C-N 3.34Å; F265-Q267 PolarHBondContact O-N 3.46Å; F265-M268 WeakPolarHBondContact O-CB 3.4Å; F265-M268 PolarHBondContact O-N 2.93Å; F265-M268 VanDerWaalsContact O-N 3.11Å; F265-V269 HydrophobicContact CD1-CG2 4.31Å; F265-V269 HydrophobicContact CD2-CG2 4.32Å; F265-V269 HydrophobicContact CE1-CG2 3.87Å; F265-V269 HydrophobicContact CE2-CG2 3.87Å; F265-V269 HydrophobicContact CZ-CG2 3.61Å; F265-V269 VanDerWaalsContact O-CG2 3.28Å; F265-V269 WeakPolarHBondContact O-CG2 3.48Å; F265-V269 PolarHBondContact O-N 3.45Å; F265-L277 HydrophobicContact CD1-CD1 3.82Å; F265-L277 HydrophobicContact CE1-CD1 3.6Å
266	Q	95.3	Very high	93.4	Very high	89 Å²	89	57.6 Å²	57.6	42%	0.416	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-42.3	171.8	-76.1	176.2	-21.5	0	0	111.8	V262 E263 M268 V269 L277 I281	V262-Q266 HydrophobicContact CG1-CG 4.26Å; V262-Q266 WeakPolarHBondContact O-CB 3.4Å; V262-Q266 VanDerWaalsContact O-CG 3.25Å; V262-Q266 WeakPolarHBondContact O-CG 3.33Å; V262-Q266 PolarHBondContact O-N 3.25Å; E263-Q266 PolarHBondContact O-N 3.33Å; Q266-M268 PolarHBondContact O-N 2.8Å; Q266-V269 PolarHBondContact O-N 3.35Å; Q266-L277 HydrophobicContact CG-CD2 4.18Å; Q266-I281 HydrophobicContact CG-CD1 4.37Å
267	Q	93.3	Very high	93.8	Very high	162 Å²	162	50.4 Å²	50.4	76%	0.757	27%	0.274	S	S	*	.	H	α-helix	trans	-66.1	-21.6	174.9	-71	168.4	21.3	0	0	114	E263 A264 F265	E263-Q267 VanDerWaalsContact O-CG 3.26Å; E263-Q267 WeakPolarHBondContact O-CG 3.23Å; E263-Q267 PolarHBondContact O-N 2.9Å; A264-Q267 PolarHBondContact O-N 3.19Å; F265-Q267 VanDerWaalsContact C-N 3.34Å; F265-Q267 PolarHBondContact O-N 3.46Å
268	M	92.3	Very high	94.2	Very high	80 Å²	80	51.2 Å²	51.2	39%	0.394	28%	0.279	S	S	.	.	H	α-helix	trans	-84.7	-21.8	177.4	-173.5	176.9	-65.1	0	0	112.9	I245 I251 P253 A264 F265 Q266	I245-M268 HydrophobicContact CD1-SD 3.8Å; I251-M268 WeakPolarHBondContact O-CE 3.43Å; P253-M268 HydrophobicContact CG-CE 3.67Å; A264-M268 WeakPolarHBondContact O-CB 3.44Å; A264-M268 PolarHBondContact O-N 3.02Å; A264-M268 VanDerWaalsContact O-N 3.12Å; F265-M268 WeakPolarHBondContact O-CB 3.4Å; F265-M268 PolarHBondContact O-N 2.93Å; F265-M268 VanDerWaalsContact O-N 3.11Å; Q266-M268 PolarHBondContact O-N 2.8Å
269	V	90.7	Very high	94.5	Very high	21 Å²	21	51.4 Å²	51.4	13%	0.127	28%	0.28	C	S	.	.			trans	-104	114.2	-168.7	171.8	0	0	0	0	110.8	I242 A243 F265 Q266 C272 L277	I242-V269 HydrophobicContact CG2-CB 4.29Å; I242-V269 HydrophobicContact CG2-CG1 3.54Å; I242-V269 HydrophobicContact CG2-CG2 3.66Å; A243-V269 HydrophobicContact CB-CG2 4.16Å; F265-V269 HydrophobicContact CD1-CG2 4.31Å; F265-V269 HydrophobicContact CD2-CG2 4.32Å; F265-V269 HydrophobicContact CE1-CG2 3.87Å; F265-V269 HydrophobicContact CE2-CG2 3.87Å; F265-V269 HydrophobicContact CZ-CG2 3.61Å; F265-V269 VanDerWaalsContact O-CG2 3.28Å; F265-V269 WeakPolarHBondContact O-CG2 3.48Å; F265-V269 PolarHBondContact O-N 3.45Å; Q266-V269 PolarHBondContact O-N 3.35Å; V269-C272 HydrophobicContact CG1-CB 3.23Å; V269-L277 HydrophobicContact CG1-CD2 4.33Å
270	G	82.7	Confident	94.7	Very high	55 Å²	55	51.4 Å²	51.4	57%	0.567	28%	0.28	S	S	*	.			trans	-85.4	-81.1	-178.3	0	0	0	0	0	114.4	C272	G270-C272 VanDerWaalsContact C-N 3.3Å; G270-C272 PolarHBondContact O-N 3.25Å
271	D	89	Confident	94.7	Very high	107 Å²	107	52.6 Å²	52.6	57%	0.572	29%	0.286	S	S	*	.	S	Bend	trans	-87.4	17.2	-165.2	68.7	-48.4	0	0	0	115	W140	W140-D271 PolarHBondContact NE1-O 2.98Å; W140-D271 PolarHBondContact NE1-OD2 3.17Å
272	C	94.3	Very high	94.8	Very high	13 Å²	13	52.9 Å²	52.9	9%	0.088	29%	0.293	C	S	.	.			trans	-73.7	131.3	-174.2	-171.6	0	0	0	0	112.5	W140 I242 V269 G270 P274	W140-C272 HydrophobicContact CH2-CB 3.67Å; W140-C272 HydrophobicContact CZ2-CB 4Å; W140-C272 HydrophobicContact CZ3-CB 4.31Å; I242-C272 HydrophobicContact CG2-CB 4.04Å; V269-C272 HydrophobicContact CG1-CB 3.23Å; G270-C272 VanDerWaalsContact C-N 3.3Å; G270-C272 PolarHBondContact O-N 3.25Å; C272-P274 WeakPolarHBondContact O-CD 3.3Å
273	P	94.6	Very high	94.9	Very high	28 Å²	28	50.7 Å²	50.7	18%	0.182	28%	0.28	C	S	.	.			trans	-55.3	122.9	168.5	-24.8	34.1	0	0	0	110.6	W140 Y275 F276 L277	W140-P273 HydrophobicContact CB-CG 4.44Å; W140-P273 VanDerWaalsContact CD2-CD 3.47Å; W140-P273 HydrophobicContact CD2-CG 4.14Å; W140-P273 HydrophobicContact CE3-CG 4.34Å; W140-P273 HydrophobicContact CG-CG 4.15Å; P273-Y275 HydrophobicContact CB-CD1 3.71Å; P273-Y275 HydrophobicContact CB-CE1 3.49Å; P273-Y275 VanDerWaalsContact CB-CE1 3.49Å; P273-Y275 HydrophobicContact CG-CE1 4.36Å; P273-Y275 PolarHBondContact O-N 2.77Å; P273-Y275 VanDerWaalsContact O-N 3.07Å; P273-F276 WeakPolarHBondContact O-CB 3.33Å; P273-F276 PolarHBondContact O-N 3.41Å; P273-L277 PolarHBondContact O-N 3.05Å
274	P	94.7	Very high	95.1	Very high	93 Å²	93	44.1 Å²	44.1	60%	0.604	25%	0.25	S	C	*	.	H	α-helix	trans	-52.7	-40.5	-172.5	-31.7	36.2	0	0	0	113.5	C272 F276 L277 D278	C272-P274 WeakPolarHBondContact O-CD 3.3Å; P274-F276 PolarHBondContact O-N 3.29Å; P274-L277 PolarHBondContact O-N 3.16Å; P274-L277 VanDerWaalsContact O-N 3.1Å; P274-D278 WeakPolarHBondContact O-CB 3.44Å; P274-D278 PolarHBondContact O-N 3.28Å; P274-D278 VanDerWaalsContact O-OD2 3.13Å
275	Y	94.8	Very high	95.2	Very high	51 Å²	51	46.5 Å²	46.5	20%	0.2	26%	0.261	C	S	.	.	H	α-helix	trans	-56.8	-25.3	178.6	79.9	-103.4	0	0	0	114.7	L144 P273 L279 K304 E308	L144-Y275 HydrophobicContact CD1-CE2 4.11Å; P273-Y275 HydrophobicContact CB-CD1 3.71Å; P273-Y275 HydrophobicContact CB-CE1 3.49Å; P273-Y275 VanDerWaalsContact CB-CE1 3.49Å; P273-Y275 HydrophobicContact CG-CE1 4.36Å; P273-Y275 PolarHBondContact O-N 2.77Å; P273-Y275 VanDerWaalsContact O-N 3.07Å; Y275-L279 WeakPolarHBondContact O-CB 3.42Å; Y275-L279 PolarHBondContact O-N 3.24Å; Y275-K304 HydrophobicContact CD1-CD 3.91Å; Y275-K304 HydrophobicContact CD2-CB 4.29Å; Y275-K304 HydrophobicContact CD2-CD 3.78Å; Y275-K304 HydrophobicContact CD2-CG 3.64Å; Y275-K304 HydrophobicContact CE1-CB 4.46Å; Y275-K304 HydrophobicContact CE1-CD 4.12Å; Y275-K304 HydrophobicContact CE1-CG 4.46Å; Y275-K304 HydrophobicContact CE2-CB 3.72Å; Y275-K304 HydrophobicContact CE2-CD 4.03Å; Y275-K304 HydrophobicContact CE2-CG 3.6Å; Y275-K304 HydrophobicContact CG-CD 3.74Å; Y275-K304 HydrophobicContact CG-CG 4.15Å; Y275-E308 PolarHBondContact OH-OE1 2.64Å
276	F	96.3	Very high	95.2	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.009	28%	0.275	C	S	.	.	H	α-helix	trans	-91.5	-34	-177.6	-168.5	-133.8	0	0	0	111	W140 R143 L144 A147 L238 I241 I242 P273 P274 L279 A280 L301	W140-F276 HydrophobicContact CE3-CD1 4.01Å; W140-F276 HydrophobicContact CE3-CE1 4.2Å; W140-F276 AromaticContact CZ3-CD1 3.74Å; W140-F276 HydrophobicContact CZ3-CD1 3.74Å; W140-F276 AromaticContact CZ3-CE1 3.9Å; W140-F276 HydrophobicContact CZ3-CE1 3.9Å; R143-F276 HydrophobicContact CB-CE1 4.42Å; L144-F276 HydrophobicContact CD1-CD2 4.47Å; A147-F276 HydrophobicContact CB-CE2 3.71Å; A147-F276 HydrophobicContact CB-CZ 3.72Å; L238-F276 HydrophobicContact CD2-CE2 3.63Å; L238-F276 HydrophobicContact CD2-CZ 3.82Å; I241-F276 HydrophobicContact CG2-CE1 4.16Å; I241-F276 HydrophobicContact CG2-CZ 4.13Å; I242-F276 HydrophobicContact CD1-CD1 3.98Å; I242-F276 HydrophobicContact CD1-CE1 4.23Å; I242-F276 HydrophobicContact CD1-CG 4.4Å; I242-F276 HydrophobicContact CG1-CD1 3.63Å; I242-F276 HydrophobicContact CG1-CE1 3.6Å; I242-F276 HydrophobicContact CG1-CZ 4.46Å; P273-F276 WeakPolarHBondContact O-CB 3.33Å; P273-F276 PolarHBondContact O-N 3.41Å; P274-F276 PolarHBondContact O-N 3.29Å; F276-L279 HydrophobicContact CD2-CD2 4.4Å; F276-L279 PolarHBondContact O-N 3.07Å; F276-A280 PolarHBondContact O-N 3.48Å; F276-A280 VanDerWaalsContact O-N 3.11Å; F276-L301 HydrophobicContact CD2-CD2 4.29Å; F276-L301 HydrophobicContact CE2-CD2 4.41Å
277	L	97.2	Very high	95.2	Very high	22 Å²	22	46.5 Å²	46.5	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-46.4	168.4	-176.8	54.5	0	0	0	111.5	F265 Q266 V269 P273 P274 L279 A280 I281	F265-L277 HydrophobicContact CD1-CD1 3.82Å; F265-L277 HydrophobicContact CE1-CD1 3.6Å; Q266-L277 HydrophobicContact CG-CD2 4.18Å; V269-L277 HydrophobicContact CG1-CD2 4.33Å; P273-L277 PolarHBondContact O-N 3.05Å; P274-L277 PolarHBondContact O-N 3.16Å; P274-L277 VanDerWaalsContact O-N 3.1Å; L277-L279 VanDerWaalsContact C-N 3.26Å; L277-L279 PolarHBondContact O-N 3.26Å; L277-A280 WeakPolarHBondContact O-CB 3.32Å; L277-A280 PolarHBondContact O-N 3.48Å; L277-A280 VanDerWaalsContact O-N 3.13Å; L277-I281 HydrophobicContact CD1-CD1 4.2Å; L277-I281 HydrophobicContact CG-CD1 4.04Å; L277-I281 WeakPolarHBondContact O-CG1 3.24Å; L277-I281 PolarHBondContact O-N 3.17Å
278	D	97.8	Very high	95.4	Very high	93 Å²	93	39.9 Å²	39.9	50%	0.497	24%	0.239	S	C	.	.	H	α-helix	trans	-56.7	-40.6	173.9	-65.1	-30.9	0	0	0	111.6	P274 I281 A282	P274-D278 WeakPolarHBondContact O-CB 3.44Å; P274-D278 PolarHBondContact O-N 3.28Å; P274-D278 VanDerWaalsContact O-OD2 3.13Å; D278-I281 PolarHBondContact O-N 3.1Å; D278-A282 VanDerWaalsContact O-CB 3.29Å; D278-A282 WeakPolarHBondContact O-CB 3.32Å; D278-A282 PolarHBondContact O-N 3.41Å
279	L	98.4	Very high	95.6	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.12	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-42.6	176.6	-179.9	66.2	0	0	0	112	L238 Y275 F276 L277 A282 C283 I297 L301	L238-L279 HydrophobicContact CD1-CD2 4.04Å; L238-L279 HydrophobicContact CD1-CG 3.88Å; Y275-L279 WeakPolarHBondContact O-CB 3.42Å; Y275-L279 PolarHBondContact O-N 3.24Å; F276-L279 HydrophobicContact CD2-CD2 4.4Å; F276-L279 PolarHBondContact O-N 3.07Å; L277-L279 VanDerWaalsContact C-N 3.26Å; L277-L279 PolarHBondContact O-N 3.26Å; L279-A282 PolarHBondContact O-N 3.21Å; L279-C283 WeakPolarHBondContact O-CB 3.35Å; L279-C283 PolarHBondContact O-N 2.76Å; L279-C283 PolarHBondContact O-SG 3.18Å; L279-I297 HydrophobicContact CD1-CG1 4.24Å; L279-I297 HydrophobicContact CD1-CG2 4.41Å; L279-I297 HydrophobicContact CD2-CG2 4.31Å; L279-L301 HydrophobicContact CD2-CD1 4.15Å; L279-L301 HydrophobicContact CD2-CD2 3.49Å; L279-L301 VanDerWaalsContact CD2-CD2 3.49Å; L279-L301 HydrophobicContact CD2-CG 3.87Å
280	A	98.4	Very high	95.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-46.2	175.8	0	0	0	0	0	111.2	L238 I242 F276 L277 A282 C283 C284	L238-A280 HydrophobicContact CB-CB 3.69Å; L238-A280 HydrophobicContact CD1-CB 4.13Å; I242-A280 HydrophobicContact CD1-CB 3.8Å; F276-A280 PolarHBondContact O-N 3.48Å; F276-A280 VanDerWaalsContact O-N 3.11Å; L277-A280 WeakPolarHBondContact O-CB 3.32Å; L277-A280 PolarHBondContact O-N 3.48Å; L277-A280 VanDerWaalsContact O-N 3.13Å; A280-A282 PolarHBondContact O-N 2.8Å; A280-C283 PolarHBondContact O-N 3.19Å; A280-C284 WeakPolarHBondContact O-CB 3.46Å; A280-C284 PolarHBondContact O-N 3.19Å; A280-C284 PolarHBondContact O-SG 2.89Å
281	I	98.3	Very high	96.7	Very high	37 Å²	37	47 Å²	47	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-44	176.9	-65.5	162.1	0	0	0	111.1	L260 V262 Q266 L277 D278 C283 C284 N285	L260-I281 HydrophobicContact CD2-CG1 4.47Å; V262-I281 HydrophobicContact CG1-CD1 3.72Å; V262-I281 HydrophobicContact CG1-CG1 3.98Å; V262-I281 HydrophobicContact CG1-CG2 4.19Å; V262-I281 HydrophobicContact CG2-CG1 4.42Å; V262-I281 HydrophobicContact CG2-CG2 4.03Å; Q266-I281 HydrophobicContact CG-CD1 4.37Å; L277-I281 HydrophobicContact CD1-CD1 4.2Å; L277-I281 HydrophobicContact CG-CD1 4.04Å; L277-I281 WeakPolarHBondContact O-CG1 3.24Å; L277-I281 PolarHBondContact O-N 3.17Å; D278-I281 PolarHBondContact O-N 3.1Å; I281-C283 VanDerWaalsContact C-N 3.34Å; I281-C283 PolarHBondContact O-N 2.92Å; I281-C284 CarbonylContact O-C 3.56Å; I281-C284 PolarHBondContact O-N 2.79Å; I281-N285 PolarHBondContact O-N 3.34Å
282	A	98.6	Very high	97.1	Very high	37 Å²	37	42.9 Å²	42.9	31%	0.306	23%	0.228	S	C	.	.	H	α-helix	trans	-64.9	-35.1	177	0	0	0	0	0	112.9	D278 L279 A280 N285 P292	D278-A282 VanDerWaalsContact O-CB 3.29Å; D278-A282 WeakPolarHBondContact O-CB 3.32Å; D278-A282 PolarHBondContact O-N 3.41Å; L279-A282 PolarHBondContact O-N 3.21Å; A280-A282 PolarHBondContact O-N 2.8Å; A282-N285 WeakPolarHBondContact O-CB 3.02Å; A282-P292 WeakPolarHBondContact O-CD 3.49Å
283	C	98.8	Very high	97.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.7	-38.4	173.7	-67.2	0	0	0	0	111.8	V231 F232 L279 A280 I281 N285 R291	V231-C283 HydrophobicContact CG1-CB 4.04Å; V231-C283 WeakPolarHBondContact O-CB 3.23Å; F232-C283 WeakPolarHBondContact CA-O 3.49Å; L279-C283 WeakPolarHBondContact O-CB 3.35Å; L279-C283 PolarHBondContact O-N 2.76Å; L279-C283 PolarHBondContact O-SG 3.18Å; A280-C283 PolarHBondContact O-N 3.19Å; I281-C283 VanDerWaalsContact C-N 3.34Å; I281-C283 PolarHBondContact O-N 2.92Å; C283-N285 PolarHBondContact O-N 3.36Å; C283-R291 VanDerWaalsContact O-CD 3.22Å; C283-R291 WeakPolarHBondContact O-CD 3.37Å; C283-R291 WeakPolarHBondContact O-CG 3.42Å
284	C	98.5	Very high	97.6	Very high	7 Å²	7	43 Å²	43	5%	0.047	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	11.8	175.5	-72.2	0	0	0	0	114.8	F232 L260 A280 I281 M286	F232-C284 HydrophobicContact CE2-CB 4.42Å; F232-C284 WeakPolarHBondContact CE2-O 3.42Å; L260-C284 HydrophobicContact CB-CB 3.95Å; L260-C284 HydrophobicContact CD2-CB 3.89Å; A280-C284 WeakPolarHBondContact O-CB 3.46Å; A280-C284 PolarHBondContact O-N 3.19Å; A280-C284 PolarHBondContact O-SG 2.89Å; I281-C284 CarbonylContact O-C 3.56Å; I281-C284 PolarHBondContact O-N 2.79Å; C284-M286 PolarHBondContact O-N 3.03Å
285	N	98.2	Very high	97.7	Very high	56 Å²	56	41.6 Å²	41.6	30%	0.299	22%	0.222	S	C	.	.			trans	-62.3	133.9	-177.2	-166.2	-70.9	0	0	0	111.9	I281 A282 C283 S287 R291	I281-N285 PolarHBondContact O-N 3.34Å; A282-N285 WeakPolarHBondContact O-CB 3.02Å; C283-N285 PolarHBondContact O-N 3.36Å; N285-S287 PolarHBondContact O-N 3.01Å; N285-S287 VanDerWaalsContact O-N 3.17Å; N285-S287 PolarHBondContact OD1-N 2.73Å; N285-S287 PolarHBondContact OD1-O 3.39Å; N285-R291 HydrophobicContact CB-CG 4Å; N285-R291 PolarHBondContact O-NE 3.24Å; N285-R291 PolarHBondContact O-NH2 3.38Å
286	M	96.3	Very high	97.9	Very high	59 Å²	59	44.6 Å²	44.6	29%	0.291	24%	0.238	S	C	.	.	S	Bend	trans	-59.1	-27.5	179.5	-69.7	-55	-61.2	0	0	113.8	P217 D257 G259 C284	P217-M286 HydrophobicContact CB-CE 3.62Å; P217-M286 HydrophobicContact CG-CE 3.56Å; P217-M286 HydrophobicContact CG-SD 3.81Å; D257-M286 HydrophobicContact CB-CE 4.3Å; D257-M286 VanDerWaalsContact OD2-CE 3.22Å; D257-M286 WeakPolarHBondContact OD2-CE 3.43Å; G259-M286 WeakPolarHBondContact CA-SD 3.49Å; C284-M286 PolarHBondContact O-N 3.03Å
287	S	96.9	Very high	98	Very high	30 Å²	30	44.6 Å²	44.6	21%	0.21	24%	0.238	C	C	.	.	S	Bend	trans	-97.4	109.2	176.3	-157.8	0	0	0	0	110.8	N285 R289 L290	N285-S287 PolarHBondContact O-N 3.01Å; N285-S287 VanDerWaalsContact O-N 3.17Å; N285-S287 PolarHBondContact OD1-N 2.73Å; N285-S287 PolarHBondContact OD1-O 3.39Å; S287-R289 PolarHBondContact O-N 3.43Å; S287-R289 PolarHBondContact OG-NH1 2.76Å; S287-L290 PolarHBondContact O-N 2.92Å
288	A	96.8	Very high	98.1	Very high	24 Å²	24	43.6 Å²	43.6	20%	0.198	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-47.9	-38.3	-179.7	0	0	0	0	0	114.1	K228 L290 R291	K228-A288 HydrophobicContact CB-CB 3.81Å; K228-A288 WeakPolarHBondContact CD-O 3.08Å; K228-A288 HydrophobicContact CG-CB 4.24Å; K228-A288 WeakPolarHBondContact CG-O 3.34Å; A288-L290 VanDerWaalsContact C-N 3.29Å; A288-L290 PolarHBondContact O-N 3.08Å; A288-R291 PolarHBondContact O-N 3.39Å
289	R	96.4	Very high	98.1	Very high	199 Å²	199	41.5 Å²	41.5	75%	0.751	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-64.3	-27.4	177.9	74.5	-175.3	-174.1	-104.9	-4.5	114.3	S287	S287-R289 PolarHBondContact O-N 3.43Å; S287-R289 PolarHBondContact OG-NH1 2.76Å
290	L	97.9	Very high	98.1	Very high	103 Å²	103	44.3 Å²	44.3	54%	0.539	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-87.2	-17.2	-178.5	-61.4	-178.4	0	0	0	112.5	S287 A288	S287-L290 PolarHBondContact O-N 2.92Å; A288-L290 VanDerWaalsContact C-N 3.29Å; A288-L290 PolarHBondContact O-N 3.08Å
291	R	98.5	Very high	98	Very high	3 Å²	3	44.4 Å²	44.4	1%	0.011	24%	0.241	C	C	.	.	S	Bend	trans	-65.7	136.9	173.8	-55.9	177.3	-165.2	141.5	11.1	109.6	E218 K228 V231 C283 N285 A288	E218-R291 IonicContact OE1-CZ 3.87Å; E218-R291 IonicContact OE1-NH1 3.77Å; E218-R291 PolarHBondContact OE1-NH1 3.39Å; E218-R291 IonicContact OE1-NH2 3.52Å; E218-R291 PolarHBondContact OE1-NH2 3.33Å; E218-R291 IonicContact OE2-CZ 3.98Å; E218-R291 IonicContact OE2-NH1 2.84Å; E218-R291 IonicContact OE2-NH2 2.86Å; E218-R291 PolarHBondContact OE2-NH2 3.14Å; K228-R291 HydrophobicContact CD-CB 4.49Å; K228-R291 PolarHBondContact NZ-O 2.95Å; K228-R291 PolarHBondContact O-NH1 3.36Å; V231-R291 HydrophobicContact CB-CB 4.32Å; V231-R291 HydrophobicContact CG1-CB 3.83Å; C283-R291 VanDerWaalsContact O-CD 3.22Å; C283-R291 WeakPolarHBondContact O-CD 3.37Å; C283-R291 WeakPolarHBondContact O-CG 3.42Å; N285-R291 HydrophobicContact CB-CG 4Å; N285-R291 PolarHBondContact O-NE 3.24Å; N285-R291 PolarHBondContact O-NH2 3.38Å; A288-R291 PolarHBondContact O-N 3.39Å
292	P	98.6	Very high	97.9	Very high	21 Å²	21	45.4 Å²	45.4	14%	0.136	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-62.7	160.6	177.1	26.5	-33.8	0	0	0	111.8	V231 A282 Q296 I297	V231-P292 WeakPolarHBondContact CG1-O 3.4Å; V231-P292 WeakPolarHBondContact CG2-O 3.42Å; A282-P292 WeakPolarHBondContact O-CD 3.49Å; P292-Q296 HydrophobicContact CB-CB 4.28Å; P292-I297 HydrophobicContact CB-CG1 3.98Å; P292-I297 HydrophobicContact CG-CD1 4.06Å; P292-I297 HydrophobicContact CG-CG1 3.77Å
293	S	98.6	Very high	97.7	Very high	40 Å²	40	49 Å²	49	28%	0.28	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-82.5	154.6	166.3	63.3	0	0	0	0	110.7	S295 Q296 I297	S293-S295 PolarHBondContact O-N 2.93Å; S293-S295 VanDerWaalsContact O-N 3.12Å; S293-Q296 WeakPolarHBondContact O-CA 3.45Å; S293-Q296 WeakPolarHBondContact O-CB 3.36Å; S293-Q296 PolarHBondContact O-N 3.19Å; S293-Q296 WeakPolarHBondContact OG-CG 3.41Å; S293-Q296 PolarHBondContact OG-N 2.75Å; S293-Q296 PolarHBondContact OG-OE1 2.87Å; S293-I297 WeakPolarHBondContact O-CG1 3.21Å; S293-I297 PolarHBondContact O-N 3.41Å
294	F	98.7	Very high	97.4	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-24.2	174.6	-74.9	-73.9	0	0	0	113.6	A151 L154 K155 H158 D230 V231 Y234 I297 V298	A151-F294 HydrophobicContact CB-CD1 3.96Å; A151-F294 HydrophobicContact CB-CE1 4.43Å; L154-F294 HydrophobicContact CB-CD1 3.87Å; L154-F294 HydrophobicContact CB-CD2 3.75Å; L154-F294 HydrophobicContact CB-CE1 3.85Å; L154-F294 HydrophobicContact CB-CE2 3.72Å; L154-F294 HydrophobicContact CB-CG 3.83Å; L154-F294 HydrophobicContact CB-CZ 3.78Å; L154-F294 HydrophobicContact CD1-CD1 4.42Å; L154-F294 HydrophobicContact CD1-CE1 3.6Å; L154-F294 HydrophobicContact CD1-CE2 4.11Å; L154-F294 HydrophobicContact CD1-CZ 3.42Å; L154-F294 VanDerWaalsContact CD1-CZ 3.42Å; L154-F294 HydrophobicContact CG-CE1 4.38Å; L154-F294 HydrophobicContact CG-CE2 4.43Å; L154-F294 HydrophobicContact CG-CZ 4.18Å; K155-F294 HydrophobicContact CB-CB 3.84Å; H158-F294 AromaticContact CE1-CD2 3.41Å; H158-F294 VanDerWaalsContact CE1-CD2 3.41Å; H158-F294 WeakPolarHBondContact CE1-CD2 3.28Å; H158-F294 AromaticContact CE1-CE2 3.51Å; H158-F294 AromaticContact ND1-CD2 3.52Å; D230-F294 HydrophobicContact CB-CE2 4.01Å; D230-F294 HydrophobicContact CB-CZ 4.47Å; V231-F294 HydrophobicContact CB-CE2 4.37Å; V231-F294 HydrophobicContact CB-CZ 4.47Å; V231-F294 HydrophobicContact CG2-CD2 3.98Å; V231-F294 HydrophobicContact CG2-CE2 3.54Å; V231-F294 HydrophobicContact CG2-CZ 4.07Å; Y234-F294 AromaticContact CD1-CE1 3.75Å; Y234-F294 HydrophobicContact CD1-CE1 3.75Å; Y234-F294 HydrophobicContact CD1-CZ 4.34Å; Y234-F294 AromaticContact CD2-CE1 3.99Å; Y234-F294 HydrophobicContact CD2-CE1 3.99Å; Y234-F294 HydrophobicContact CE1-CE1 4.25Å; Y234-F294 HydrophobicContact CE2-CE1 4.46Å; Y234-F294 AromaticContact CG-CE1 3.6Å; Y234-F294 HydrophobicContact CG-CE1 3.6Å; Y234-F294 AromaticContact CG-CZ 3.98Å; Y234-F294 HydrophobicContact CG-CZ 3.98Å; F294-I297 HydrophobicContact CD1-CD1 3.7Å; F294-I297 HydrophobicContact CE1-CD1 3.88Å; F294-I297 HydrophobicContact CG-CD1 4.26Å; F294-V298 WeakPolarHBondContact O-CB 3.14Å; F294-V298 VanDerWaalsContact O-CG2 3.25Å; F294-V298 WeakPolarHBondContact O-CG2 3.33Å; F294-V298 PolarHBondContact O-N 3.34Å
295	S	98.6	Very high	97.1	Very high	65 Å²	65	54 Å²	54	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-39.8	169.2	-72.6	0	0	0	0	113.2	S293 A299	S293-S295 PolarHBondContact O-N 2.93Å; S293-S295 VanDerWaalsContact O-N 3.12Å; S295-A299 WeakPolarHBondContact O-CB 3.46Å; S295-A299 PolarHBondContact O-N 3.25Å
296	Q	98.6	Very high	96.7	Very high	113 Å²	113	57.9 Å²	57.9	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-74.5	-43.3	175.2	-69.1	159.3	-63.5	0	0	111.5	P292 S293 V298 A299 E300	P292-Q296 HydrophobicContact CB-CB 4.28Å; S293-Q296 WeakPolarHBondContact O-CA 3.45Å; S293-Q296 WeakPolarHBondContact O-CB 3.36Å; S293-Q296 PolarHBondContact O-N 3.19Å; S293-Q296 WeakPolarHBondContact OG-CG 3.41Å; S293-Q296 PolarHBondContact OG-N 2.75Å; S293-Q296 PolarHBondContact OG-OE1 2.87Å; Q296-V298 PolarHBondContact O-N 3.07Å; Q296-A299 PolarHBondContact O-N 2.82Å; Q296-E300 PolarHBondContact O-N 3.4Å
297	I	98.8	Very high	96.4	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-55.9	-53	177.3	-63.1	170.9	0	0	0	110.3	A151 V231 Y234 L279 P292 S293 F294 A299 E300 L301	A151-I297 HydrophobicContact CB-CG2 3.76Å; V231-I297 HydrophobicContact CG1-CD1 4.05Å; Y234-I297 HydrophobicContact CD1-CD1 4.13Å; Y234-I297 HydrophobicContact CE1-CD1 4.13Å; Y234-I297 HydrophobicContact CE1-CG2 3.74Å; L279-I297 HydrophobicContact CD1-CG1 4.24Å; L279-I297 HydrophobicContact CD1-CG2 4.41Å; L279-I297 HydrophobicContact CD2-CG2 4.31Å; P292-I297 HydrophobicContact CB-CG1 3.98Å; P292-I297 HydrophobicContact CG-CD1 4.06Å; P292-I297 HydrophobicContact CG-CG1 3.77Å; S293-I297 WeakPolarHBondContact O-CG1 3.21Å; S293-I297 PolarHBondContact O-N 3.41Å; F294-I297 HydrophobicContact CD1-CD1 3.7Å; F294-I297 HydrophobicContact CE1-CD1 3.88Å; F294-I297 HydrophobicContact CG-CD1 4.26Å; I297-A299 VanDerWaalsContact C-N 3.31Å; I297-A299 PolarHBondContact O-N 3.1Å; I297-E300 PolarHBondContact O-N 2.87Å; I297-L301 HydrophobicContact CG2-CD1 3.8Å; I297-L301 HydrophobicContact CG2-CG 4.34Å; I297-L301 WeakPolarHBondContact O-CB 3.48Å; I297-L301 VanDerWaalsContact O-CG 3.29Å; I297-L301 WeakPolarHBondContact O-CG 3.43Å; I297-L301 PolarHBondContact O-N 3.01Å
298	V	98.7	Very high	95.8	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-39.9	179	170.3	0	0	0	0	111.5	L148 A151 R152 K155 F294 Q296 L301 E302	L148-V298 HydrophobicContact CD1-CB 4.45Å; L148-V298 HydrophobicContact CD1-CG1 4.07Å; L148-V298 HydrophobicContact CD1-CG2 4.4Å; A151-V298 HydrophobicContact CB-CG2 3.72Å; A151-V298 WeakPolarHBondContact O-CG2 3.46Å; R152-V298 HydrophobicContact CG-CG1 4.02Å; R152-V298 HydrophobicContact CG-CG2 3.95Å; K155-V298 HydrophobicContact CB-CG2 4.26Å; K155-V298 HydrophobicContact CD-CB 4.04Å; K155-V298 HydrophobicContact CD-CG1 4.23Å; K155-V298 HydrophobicContact CD-CG2 3.96Å; F294-V298 WeakPolarHBondContact O-CB 3.14Å; F294-V298 VanDerWaalsContact O-CG2 3.25Å; F294-V298 WeakPolarHBondContact O-CG2 3.33Å; F294-V298 PolarHBondContact O-N 3.34Å; Q296-V298 PolarHBondContact O-N 3.07Å; V298-L301 PolarHBondContact O-N 3.42Å; V298-E302 HydrophobicContact CG1-CG 4.16Å; V298-E302 VanDerWaalsContact O-CB 3.31Å; V298-E302 WeakPolarHBondContact O-CB 3.41Å; V298-E302 VanDerWaalsContact O-CG 3.28Å; V298-E302 WeakPolarHBondContact O-CG 3.13Å; V298-E302 PolarHBondContact O-N 3.02Å
299	A	98.2	Very high	95.2	Very high	48 Å²	48	63.1 Å²	63.1	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-64.2	-45.4	-179.4	0	0	0	0	0	112.9	S295 Q296 I297 K303	S295-A299 WeakPolarHBondContact O-CB 3.46Å; S295-A299 PolarHBondContact O-N 3.25Å; Q296-A299 PolarHBondContact O-N 2.82Å; I297-A299 VanDerWaalsContact C-N 3.31Å; I297-A299 PolarHBondContact O-N 3.1Å; A299-K303 VanDerWaalsContact O-CB 3.28Å; A299-K303 WeakPolarHBondContact O-CB 3.31Å; A299-K303 PolarHBondContact O-N 2.98Å; A299-K303 VanDerWaalsContact O-N 3.08Å
300	E	97.1	Very high	94.7	Very high	83 Å²	83	60.3 Å²	60.3	39%	0.388	30%	0.297	S	S	.	.	H	α-helix	trans	-69.6	-42	175.9	-76.6	-59.7	130.7	0	0	111.9	Q296 I297 E302 K303 K304	Q296-E300 PolarHBondContact O-N 3.4Å; I297-E300 PolarHBondContact O-N 2.87Å; E300-E302 PolarHBondContact O-N 2.83Å; E300-K303 WeakPolarHBondContact O-CB 3.43Å; E300-K303 PolarHBondContact O-N 3.01Å; E300-K303 WeakPolarHBondContact OE1-CD 3.39Å; E300-K303 IonicContact OE1-NZ 3.75Å; E300-K303 PolarHBondContact OE1-NZ 3.38Å; E300-K303 WeakPolarHBondContact OE2-CD 3.43Å; E300-K303 IonicContact OE2-NZ 3.42Å; E300-K303 PolarHBondContact OE2-NZ 2.84Å; E300-K304 VanDerWaalsContact O-CG 3.27Å; E300-K304 WeakPolarHBondContact O-CG 3.11Å; E300-K304 PolarHBondContact O-N 2.96Å
301	L	97.1	Very high	93.8	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-40.4	176.7	-69.9	-177.7	0	0	0	112.4	L144 L148 A151 Y234 F276 L279 I297 V298 K303 K304 K305	L144-L301 HydrophobicContact CD1-CD2 3.62Å; L148-L301 HydrophobicContact CB-CB 4.32Å; L148-L301 HydrophobicContact CB-CD1 4.19Å; L148-L301 HydrophobicContact CD1-CB 3.86Å; L148-L301 HydrophobicContact CD1-CD1 4.48Å; A151-L301 HydrophobicContact CB-CD1 4.41Å; Y234-L301 WeakPolarHBondContact OH-CD1 3.25Å; F276-L301 HydrophobicContact CD2-CD2 4.29Å; F276-L301 HydrophobicContact CE2-CD2 4.41Å; L279-L301 HydrophobicContact CD2-CD1 4.15Å; L279-L301 HydrophobicContact CD2-CD2 3.49Å; L279-L301 VanDerWaalsContact CD2-CD2 3.49Å; L279-L301 HydrophobicContact CD2-CG 3.87Å; I297-L301 HydrophobicContact CG2-CD1 3.8Å; I297-L301 HydrophobicContact CG2-CG 4.34Å; I297-L301 WeakPolarHBondContact O-CB 3.48Å; I297-L301 VanDerWaalsContact O-CG 3.29Å; I297-L301 WeakPolarHBondContact O-CG 3.43Å; I297-L301 PolarHBondContact O-N 3.01Å; V298-L301 PolarHBondContact O-N 3.42Å; L301-K303 VanDerWaalsContact C-N 3.35Å; L301-K304 PolarHBondContact O-N 2.67Å; L301-K305 VanDerWaalsContact O-CB 3.23Å; L301-K305 WeakPolarHBondContact O-CB 3.4Å; L301-K305 PolarHBondContact O-N 2.73Å
302	E	96.4	Very high	92.7	Very high	58 Å²	58	70 Å²	70	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-71.3	-27.4	175.9	-73	-179.2	164.3	0	0	113.3	L148 R152 V298 E300 R306	L148-E302 HydrophobicContact CD1-CG 3.7Å; L148-E302 HydrophobicContact CD2-CG 3.93Å; L148-E302 HydrophobicContact CG-CG 4.47Å; R152-E302 IonicContact CZ-OE1 3.47Å; R152-E302 VanDerWaalsContact CZ-OE1 3.27Å; R152-E302 IonicContact NE-OE1 3.15Å; R152-E302 PolarHBondContact NE-OE1 3.17Å; R152-E302 IonicContact NH2-OE1 2.92Å; R152-E302 PolarHBondContact NH2-OE1 2.71Å; V298-E302 HydrophobicContact CG1-CG 4.16Å; V298-E302 VanDerWaalsContact O-CB 3.31Å; V298-E302 WeakPolarHBondContact O-CB 3.41Å; V298-E302 VanDerWaalsContact O-CG 3.28Å; V298-E302 WeakPolarHBondContact O-CG 3.13Å; V298-E302 PolarHBondContact O-N 3.02Å; E300-E302 PolarHBondContact O-N 2.83Å; E302-R306 WeakPolarHBondContact O-CG 3.22Å; E302-R306 PolarHBondContact O-N 3.34Å; E302-R306 PolarHBondContact O-NE 3.39Å
303	K	95.1	Very high	90.8	Very high	112 Å²	112	71.8 Å²	71.8	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-71.2	-46	172.9	174.2	-174	171	-157	0	110.8	A299 E300 L301 R306 A307	A299-K303 VanDerWaalsContact O-CB 3.28Å; A299-K303 WeakPolarHBondContact O-CB 3.31Å; A299-K303 PolarHBondContact O-N 2.98Å; A299-K303 VanDerWaalsContact O-N 3.08Å; E300-K303 WeakPolarHBondContact O-CB 3.43Å; E300-K303 PolarHBondContact O-N 3.01Å; E300-K303 WeakPolarHBondContact OE1-CD 3.39Å; E300-K303 IonicContact OE1-NZ 3.75Å; E300-K303 PolarHBondContact OE1-NZ 3.38Å; E300-K303 WeakPolarHBondContact OE2-CD 3.43Å; E300-K303 IonicContact OE2-NZ 3.42Å; E300-K303 PolarHBondContact OE2-NZ 2.84Å; L301-K303 VanDerWaalsContact C-N 3.35Å; K303-R306 PolarHBondContact O-N 2.87Å; K303-A307 PolarHBondContact O-N 3.4Å
304	K	92.3	Very high	88.7	Confident	70 Å²	70	74.9 Å²	74.9	30%	0.304	37%	0.366	S	S	.	.	H	α-helix	trans	-64.2	-46.4	175.6	-61.5	-73.5	-178.8	173.1	0	111.9	Y275 E300 L301 R306 A307 E308	Y275-K304 HydrophobicContact CD1-CD 3.91Å; Y275-K304 HydrophobicContact CD2-CB 4.29Å; Y275-K304 HydrophobicContact CD2-CD 3.78Å; Y275-K304 HydrophobicContact CD2-CG 3.64Å; Y275-K304 HydrophobicContact CE1-CB 4.46Å; Y275-K304 HydrophobicContact CE1-CD 4.12Å; Y275-K304 HydrophobicContact CE1-CG 4.46Å; Y275-K304 HydrophobicContact CE2-CB 3.72Å; Y275-K304 HydrophobicContact CE2-CD 4.03Å; Y275-K304 HydrophobicContact CE2-CG 3.6Å; Y275-K304 HydrophobicContact CG-CD 3.74Å; Y275-K304 HydrophobicContact CG-CG 4.15Å; E300-K304 VanDerWaalsContact O-CG 3.27Å; E300-K304 WeakPolarHBondContact O-CG 3.11Å; E300-K304 PolarHBondContact O-N 2.96Å; L301-K304 PolarHBondContact O-N 2.67Å; K304-R306 PolarHBondContact O-N 3.5Å; K304-A307 PolarHBondContact O-N 3.17Å; K304-A307 VanDerWaalsContact O-N 3.14Å; K304-E308 PolarHBondContact O-N 2.93Å
305	K	91.1	Very high	86.3	Confident	42 Å²	42	82.1 Å²	82.1	18%	0.183	40%	0.404	C	S	.	.	H	α-helix	trans	-63.3	-20.6	177.4	-168.6	170.8	-173.2	170.1	0	114.2	L144 S145 L148 L301 R309	L144-K305 HydrophobicContact CD2-CB 3.9Å; L144-K305 HydrophobicContact CD2-CG 4.23Å; S145-K305 WeakPolarHBondContact OG-CE 3.32Å; S145-K305 PolarHBondContact OG-NZ 3.03Å; L148-K305 HydrophobicContact CD2-CD 3.58Å; L301-K305 VanDerWaalsContact O-CB 3.23Å; L301-K305 WeakPolarHBondContact O-CB 3.4Å; L301-K305 PolarHBondContact O-N 2.73Å; K305-R309 WeakPolarHBondContact O-CG 3.43Å
306	R	91.1	Very high	83.9	Confident	139 Å²	139	84.6 Å²	84.6	53%	0.525	42%	0.418	S	S	.	.	H	α-helix	trans	-78.6	-50	169.8	-85.4	175.3	-76.5	-171.6	-2.1	111.6	E302 K303 K304 E308 R309 E310	E302-R306 WeakPolarHBondContact O-CG 3.22Å; E302-R306 PolarHBondContact O-N 3.34Å; E302-R306 PolarHBondContact O-NE 3.39Å; K303-R306 PolarHBondContact O-N 2.87Å; K304-R306 PolarHBondContact O-N 3.5Å; R306-E308 VanDerWaalsContact C-N 3.27Å; R306-E308 PolarHBondContact O-N 2.96Å; R306-R309 WeakPolarHBondContact O-CA 3.25Å; R306-R309 WeakPolarHBondContact O-CB 3.34Å; R306-R309 PolarHBondContact O-N 3.42Å; R306-E310 WeakPolarHBondContact O-CG 3.28Å; R306-E310 PolarHBondContact O-N 2.78Å
307	A	88.8	Confident	81.3	Confident	34 Å²	34	85.7 Å²	85.7	28%	0.281	43%	0.432	S	S	.	.	H	α-helix	trans	-55.4	-40.1	176.2	0	0	0	0	0	112.8	K303 K304 R309 E310 Q311	K303-A307 PolarHBondContact O-N 3.4Å; K304-A307 PolarHBondContact O-N 3.17Å; K304-A307 VanDerWaalsContact O-N 3.14Å; A307-R309 VanDerWaalsContact C-N 3.27Å; A307-R309 PolarHBondContact O-N 3.11Å; A307-E310 PolarHBondContact O-N 2.65Å; A307-Q311 WeakPolarHBondContact O-CB 3.34Å; A307-Q311 VanDerWaalsContact O-CG 3.24Å; A307-Q311 WeakPolarHBondContact O-CG 3.42Å; A307-Q311 PolarHBondContact O-N 3.46Å
308	E	85	Confident	78.3	Confident	49 Å²	49	94.8 Å²	94.8	23%	0.229	47%	0.472	C	S	.	.	H	α-helix	trans	-66.4	-22.4	175.6	-71.7	177.9	-174	0	0	114.4	L144 Y275 K304 R306 R312	L144-E308 WeakPolarHBondContact CD2-OE2 3.32Å; Y275-E308 PolarHBondContact OH-OE1 2.64Å; K304-E308 PolarHBondContact O-N 2.93Å; R306-E308 VanDerWaalsContact C-N 3.27Å; R306-E308 PolarHBondContact O-N 2.96Å; E308-R312 PolarHBondContact O-NH1 3.49Å
309	R	84.6	Confident	75.4	Confident	139 Å²	139	101.3 Å²	101.3	53%	0.525	51%	0.512	S	S	.	.	H	α-helix	trans	-85.2	-41.8	174	-73.9	174.9	167.7	-151.1	-8.4	111.6	K305 R306 A307 Q311 R312 G313 E314	K305-R309 WeakPolarHBondContact O-CG 3.43Å; R306-R309 WeakPolarHBondContact O-CA 3.25Å; R306-R309 WeakPolarHBondContact O-CB 3.34Å; R306-R309 PolarHBondContact O-N 3.42Å; A307-R309 VanDerWaalsContact C-N 3.27Å; A307-R309 PolarHBondContact O-N 3.11Å; R309-Q311 VanDerWaalsContact C-N 3.35Å; R309-R312 PolarHBondContact O-N 3.34Å; R309-R312 VanDerWaalsContact O-N 3.12Å; R309-G313 PolarHBondContact O-N 2.85Å; R309-E314 PolarHBondContact O-N 2.77Å
310	E	85.6	Confident	72.5	Confident	141 Å²	141	105.5 Å²	105.5	66%	0.659	53%	0.532	S	S	*	.	H	α-helix	trans	-59.8	-45.3	175	-70.2	155.4	-160.3	0	0	110.6	R306 A307 R312 G313	R306-E310 WeakPolarHBondContact O-CG 3.28Å; R306-E310 PolarHBondContact O-N 2.78Å; A307-E310 PolarHBondContact O-N 2.65Å; E310-R312 VanDerWaalsContact C-N 3.27Å; E310-R312 PolarHBondContact O-N 2.96Å; E310-G313 PolarHBondContact O-N 3.36Å; E310-G313 VanDerWaalsContact O-N 3.14Å
311	Q	77.8	Confident	69.4	Low	168 Å²	168	104.8 Å²	104.8	79%	0.785	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.2	174.5	-70.8	172.2	15.1	0	0	114	A307 R309	A307-Q311 WeakPolarHBondContact O-CB 3.34Å; A307-Q311 VanDerWaalsContact O-CG 3.24Å; A307-Q311 WeakPolarHBondContact O-CG 3.42Å; A307-Q311 PolarHBondContact O-N 3.46Å; R309-Q311 VanDerWaalsContact C-N 3.35Å
312	R	75.3	Confident	67.3	Low	141 Å²	141	110.8 Å²	110.8	53%	0.532	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	-1.7	175.3	-159.8	165.8	74.7	-103.3	11.9	113.3	E308 R309 E310 E314	E308-R312 PolarHBondContact O-NH1 3.49Å; R309-R312 PolarHBondContact O-N 3.34Å; R309-R312 VanDerWaalsContact O-N 3.12Å; E310-R312 VanDerWaalsContact C-N 3.27Å; E310-R312 PolarHBondContact O-N 2.96Å; R312-E314 VanDerWaalsContact C-N 3.3Å; R312-E314 IonicContact CZ-OE1 2.73Å; R312-E314 IonicContact CZ-OE2 2.62Å; R312-E314 IonicContact NE-OE1 2.76Å; R312-E314 PolarHBondContact NE-OE1 3.26Å; R312-E314 IonicContact NE-OE2 2.8Å; R312-E314 IonicContact NH1-OE2 3.38Å; R312-E314 IonicContact NH2-OE1 3.39Å; R312-E314 PolarHBondContact NH2-OE1 3.37Å; R312-E314 IonicContact NH2-OE2 3.7Å; R312-E314 PolarHBondContact NH2-OE2 2.84Å; R312-E314 PolarHBondContact O-N 2.98Å
313	G	59.3	Low	64.3	Low	59 Å²	59	116.4 Å²	116.4	61%	0.608	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	19.9	175	0	0	0	0	0	115.2	R309 E310 L315	R309-G313 PolarHBondContact O-N 2.85Å; E310-G313 PolarHBondContact O-N 3.36Å; E310-G313 VanDerWaalsContact O-N 3.14Å; G313-L315 PolarHBondContact O-N 3.03Å
314	E	55.2	Low	61.3	Low	104 Å²	104	122.3 Å²	122.3	49%	0.486	64%	0.636	S	S	.	*			trans	-76.2	90.8	-178	-74.4	-176.9	166.9	0	0	112.2	R309 R312	R309-E314 PolarHBondContact O-N 2.77Å; R312-E314 VanDerWaalsContact C-N 3.3Å; R312-E314 IonicContact CZ-OE1 2.73Å; R312-E314 IonicContact CZ-OE2 2.62Å; R312-E314 IonicContact NE-OE1 2.76Å; R312-E314 PolarHBondContact NE-OE1 3.26Å; R312-E314 IonicContact NE-OE2 2.8Å; R312-E314 IonicContact NH1-OE2 3.38Å; R312-E314 IonicContact NH2-OE1 3.39Å; R312-E314 PolarHBondContact NH2-OE1 3.37Å; R312-E314 IonicContact NH2-OE2 3.7Å; R312-E314 PolarHBondContact NH2-OE2 2.84Å; R312-E314 PolarHBondContact O-N 2.98Å
315	L	47.2	Very low	58.6	Low	154 Å²	154	130.2 Å²	130.2	81%	0.806	66%	0.664	S	S	*	*			trans	-61.3	140.7	167.3	-72.5	170.9	0	0	0	110.9	G313 V317	G313-L315 PolarHBondContact O-N 3.03Å; L315-V317 PolarHBondContact O-N 3.46Å; L315-V317 VanDerWaalsContact O-N 3.14Å
316	P	47.8	Very low	56	Low	118 Å²	118	133.6 Å²	133.6	77%	0.766	69%	0.691	S	S	*	*			trans	-69.1	113	-177.1	27.1	-34.1	0	0	0	111.5	K318	P316-K318 PolarHBondContact O-N 3.11Å
317	V	44.4	Very low	53.1	Low	135 Å²	135	131.5 Å²	131.5	82%	0.818	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-61.8	120.6	179.3	179.1	0	0	0	0	110.7	L315	L315-V317 PolarHBondContact O-N 3.46Å; L315-V317 VanDerWaalsContact O-N 3.14Å
318	K	36.6	Very low	50.2	Low	193 Å²	193	137.1 Å²	137.1	84%	0.839	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-89.8	123.5	166	-68.9	-177.5	179.9	178	0	109.2	P316	P316-K318 PolarHBondContact O-N 3.11Å
319	T	37	Very low	47.5	Very low	139 Å²	139	139.3 Å²	139.3	85%	0.853	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.2	129	-173.6	-39.5	0	0	0	0	112.6
320	V	38	Very low	44.7	Very low	137 Å²	137	139.5 Å²	139.5	83%	0.83	75%	0.753	S	S	*	*			trans	-132.5	143.9	166.5	-176.3	0	0	0	0	108.7
321	G	32.8	Very low	41.8	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	76%	0.755	S	S	*	*			trans	-77.1	169.7	-167.6	0	0	0	0	0	116.4
322	P	52.1	Low	39.3	Very low	127 Å²	127	135.2 Å²	135.2	83%	0.825	75%	0.752	S	S	*	*			trans	-97.1	153.6	-165.4	37.1	-35.7	0	0	0	114.9
323	L	32.3	Very low	37	Very low	175 Å²	175	135.8 Å²	135.8	92%	0.916	77%	0.766	S	S	*	*			trans	-144	147.7	164.7	-105.7	152.1	0	0	0	112.5
324	R	32.8	Very low	36.5	Very low	237 Å²	237	137 Å²	137	89%	0.894	76%	0.763	S	S	*	*			trans	-68.3	155.2	-154.9	-67.4	168.6	161.4	143.6	-5.8	117.9
325	R	36.8	Very low	35.2	Very low	236 Å²	236	143.6 Å²	143.6	89%	0.891	78%	0.783	S	S	*	*			trans	-68.9	161	155.9	-67.3	179.1	174.6	172.4	-3.4	112.3
326	P	36.5	Very low	34.4	Very low	113 Å²	113	144.1 Å²	144.1	73%	0.734	79%	0.786	S	S	*	*				-124.1	140.9	110.4	-2.8	24.8	0	0	0	112.4
327	S	28.9	Very low	33.5	Very low	95 Å²	95	144 Å²	144	66%	0.664	79%	0.789	S	S	*	*				65.6	133.9	86	81.7	0	0	0	0	114.4
328	L	29.2	Very low	32.8	Very low	152 Å²	152	149.1 Å²	149.1	80%	0.796	79%	0.793	S	S	*	*			cis	-156.1	154.2	43.8	-83.9	156.1	0	0	0	114.4
329	C	26.7	Very low	32.6	Very low	95 Å²	95	145 Å²	145	64%	0.642	79%	0.789	S	S	*	*			trans	32.3	144.9	137.1	-61	0	0	0	0	126.2
330	D	26.4	Very low	32.3	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	79%	0.789	S	S	*	*			trans	69.2	149	137.4	-63.9	-12.3	0	0	0	120.7
331	T	24.6	Very low	32	Very low	117 Å²	117	146 Å²	146	72%	0.718	78%	0.782	S	S	*	*			cis	-156.6	160.2	-1.7	6.1	0	0	0	0	112.3
332	S	25.5	Very low	32	Very low	103 Å²	103	150.9 Å²	150.9	72%	0.72	79%	0.793	S	S	*	*			trans	46	117.3	149.3	65.7	0	0	0	0	122.7
333	D	27.1	Very low	31.1	Very low	153 Å²	153	152.6 Å²	152.6	82%	0.818	79%	0.792	S	S	*	*				11.9	164.8	114.2	-104.7	-23.3	0	0	0	121.6
334	P	47.6	Very low	31	Very low	85 Å²	85	152.7 Å²	152.7	55%	0.552	79%	0.792	S	S	*	*			cis	-136.1	172.2	-19.2	39.7	-25.4	0	0	0	114.1
335	R	27.9	Very low	30.9	Very low	241 Å²	241	149.6 Å²	149.6	91%	0.909	79%	0.787	S	S	*	*				-173.2	146.5	127.5	-109.8	157.4	-76.6	-165.1	-3.3	117.2
336	L	31.4	Very low	30.8	Very low	165 Å²	165	143.7 Å²	143.7	86%	0.864	78%	0.78	S	S	*	*			trans	-78.9	147.5	-178.6	-63.3	147.2	0	0	0	114.2
337	S	29.5	Very low	30.7	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	78%	0.783	S	S	*	*			trans	-169.8	117.8	131.5	-79.6	0	0	0	0	109.5
338	R	29.8	Very low	30.7	Very low	242 Å²	242	147.7 Å²	147.7	91%	0.913	79%	0.794	S	S	*	*				80.9	136.2	64.3	-104.5	-170.1	169.3	-171.3	-2.4	115.1
339	S	31.1	Very low	30.8	Very low	106 Å²	106	149.4 Å²	149.4	74%	0.741	80%	0.798	S	S	*	*			trans	79.9	133.4	166.6	-157.2	0	0	0	0	115.5
340	K	30.6	Very low	30.9	Very low	196 Å²	196	153 Å²	153	85%	0.852	81%	0.81	S	S	*	*			cis	-155.6	162.9	-9.4	-122.8	176.4	-173.1	-177.1	0	110.5
341	S	33.4	Very low	31.3	Very low	100 Å²	100	152 Å²	152	70%	0.699	81%	0.811	S	S	*	*			trans	-83	161	171.5	3.2	0	0	0	0	112.8
342	D	32.1	Very low	31.4	Very low	172 Å²	172	152.1 Å²	152.1	92%	0.92	82%	0.816	S	S	*	*			trans	-144.5	159.1	143.7	-95.9	-42.8	0	0	0	109.7
343	M	33.2	Very low	31.8	Very low	163 Å²	163	153.6 Å²	153.6	80%	0.803	82%	0.82	S	S	*	*			trans	-126.6	142.2	-173.5	-54.8	178.9	-62	0	0	111.2
344	L	29.6	Very low	32.2	Very low	176 Å²	176	150.2 Å²	150.2	92%	0.921	81%	0.813	S	S	*	*			trans	-144.8	161.6	156.9	-78.6	-175.4	0	0	0	111.5
345	H	31.3	Very low	31.6	Very low	173 Å²	173	153.7 Å²	153.7	80%	0.801	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-97.6	162.8	-167.2	-79	-95.7	0	0	0	114
346	P	34	Very low	31.7	Very low	112 Å²	112	146.5 Å²	146.5	73%	0.727	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-80.8	159.1	177.1	34.5	-37	0	0	0	113.5
347	P	35.8	Very low	32.2	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-91.5	162.8	169.7	36.9	-33.8	0	0	0	113.4
348	D	29	Very low	32.9	Very low	166 Å²	166	144.2 Å²	144.2	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81.8	166.5	-166.1	-59.5	-78.9	0	0	0	117.5
349	E	31	Very low	33.9	Very low	188 Å²	188	137.2 Å²	137.2	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.1	156.8	176	-56.4	-178.6	141.1	0	0	113.7
350	L	27.1	Very low	35.2	Very low	170 Å²	170	140 Å²	140	89%	0.89	80%	0.802	S	S	*	*			trans	-133.7	138.8	156	-79	175.7	0	0	0	110.4
351	P	35.4	Very low	36.9	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	79%	0.786	S	S	*	*			trans	-83.5	130.9	-167	31.5	-35.3	0	0	0	113.5
352	C	27	Very low	38.9	Very low	121 Å²	121	130.9 Å²	130.9	82%	0.818	76%	0.757	S	S	*	*			trans	-96.4	122.9	166.8	-168.7	0	0	0	0	110.3	A354	C352-A354 VanDerWaalsContact C-N 3.32Å; C352-A354 PolarHBondContact O-N 3.46Å
353	V	34.3	Very low	40.9	Very low	133 Å²	133	123.5 Å²	123.5	81%	0.806	72%	0.719	S	S	*	*			trans	-81.4	79.7	176.5	-175.4	0	0	0	0	109.6
354	A	35.2	Very low	42.9	Very low	82 Å²	82	116 Å²	116	68%	0.678	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-72.2	129.4	164.3	0	0	0	0	0	109.4	C352 A356	C352-A354 VanDerWaalsContact C-N 3.32Å; C352-A354 PolarHBondContact O-N 3.46Å; A354-A356 PolarHBondContact O-N 3.49Å
355	L	34.3	Very low	44.4	Very low	158 Å²	158	109.9 Å²	109.9	83%	0.827	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-60.8	126.4	164.4	-89.1	71.1	0	0	0	107.8	P357	L355-P357 WeakPolarHBondContact O-CD 3.25Å
356	A	31.3	Very low	45.3	Very low	90 Å²	90	108.2 Å²	108.2	74%	0.744	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-58.7	126.5	169.1	0	0	0	0	0	108.6	A354 S358	A354-A356 PolarHBondContact O-N 3.49Å; A356-S358 PolarHBondContact O-N 2.91Å
357	P	41.5	Very low	45.9	Very low	117 Å²	117	108.6 Å²	108.6	76%	0.76	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-55.8	138	171.7	-24.1	34.1	0	0	0	109.7	L355 A359	L355-P357 WeakPolarHBondContact O-CD 3.25Å; P357-A359 PolarHBondContact O-N 2.99Å
358	S	43.9	Very low	46	Very low	117 Å²	117	109.3 Å²	109.3	82%	0.818	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-47.1	129	171.5	-59.2	0	0	0	0	109.4	A356 R360	A356-S358 PolarHBondContact O-N 2.91Å; S358-R360 PolarHBondContact O-N 3.43Å
359	A	50.9	Low	46.5	Very low	95 Å²	95	104.1 Å²	104.1	79%	0.785	60%	0.598	S	S	*	*			trans	-55.5	111.8	-174.5	0	0	0	0	0	109.9	P357 V361	P357-A359 PolarHBondContact O-N 2.99Å; A359-V361 PolarHBondContact O-N 2.56Å; A359-V361 VanDerWaalsContact O-N 3.1Å
360	R	59.4	Low	46.8	Very low	164 Å²	164	104.1 Å²	104.1	62%	0.619	60%	0.603	S	S	*	*			trans	-53.9	119.2	-179.1	-80.6	-170	171.8	94	7.7	108.8	D261 S358 N362	D261-R360 IonicContact OD2-CZ 2.78Å; D261-R360 IonicContact OD2-NE 2.98Å; D261-R360 PolarHBondContact OD2-NE 2.79Å; D261-R360 VanDerWaalsContact OD2-NE 3.1Å; D261-R360 IonicContact OD2-NH2 3.75Å; D261-R360 PolarHBondContact OD2-NH2 3.07Å; S358-R360 PolarHBondContact O-N 3.43Å; R360-N362 PolarHBondContact O-N 3.08Å
361	V	65.9	Low	47.2	Very low	86 Å²	86	105.2 Å²	105.2	52%	0.521	60%	0.601	S	S	.	*			trans	-77.6	113	176.4	179.3	0	0	0	0	107.6	A359 P363 Q366	A359-V361 PolarHBondContact O-N 2.56Å; A359-V361 VanDerWaalsContact O-N 3.1Å; V361-P363 WeakPolarHBondContact O-CD 3.23Å; V361-P363 VanDerWaalsContact O-N 3.16Å; V361-Q366 VanDerWaalsContact CG1-NE2 3.28Å
362	N	75.4	Confident	47.3	Very low	19 Å²	19	102.2 Å²	102.2	10%	0.102	59%	0.592	C	S	.	*			trans	-57.7	114.8	174.3	172.8	-17.5	0	0	0	110	P249 D250 R360 F364 S365	P249-N362 WeakPolarHBondContact CG-ND2 3.43Å; P249-N362 VanDerWaalsContact CG-OD1 3.26Å; P249-N362 WeakPolarHBondContact CG-OD1 3.44Å; D250-N362 WeakPolarHBondContact OD1-CB 3.45Å; D250-N362 PolarHBondContact OD1-ND2 3.37Å; R360-N362 PolarHBondContact O-N 3.08Å; N362-F364 PolarHBondContact O-N 2.85Å; N362-F364 WeakPolarHBondContact OD1-CB 3.38Å; N362-F364 PolarHBondContact OD1-N 3Å; N362-S365 PolarHBondContact ND2-OG 3Å; N362-S365 WeakPolarHBondContact O-CB 3.26Å; N362-S365 PolarHBondContact O-N 3.15Å; N362-S365 PolarHBondContact OD1-N 3Å
363	P	73.9	Confident	47.7	Very low	17 Å²	17	97.8 Å²	97.8	11%	0.11	57%	0.566	C	S	.	*	G	3₁₀ helix	trans	-68.7	-21.6	-172.7	26.6	-33.9	0	0	0	113	R254 F258 V361 S365	R254-P363 HydrophobicContact CB-CG 3.97Å; F258-P363 HydrophobicContact CD1-CB 4.06Å; F258-P363 HydrophobicContact CD1-CG 4.4Å; F258-P363 HydrophobicContact CE1-CB 4.05Å; V361-P363 WeakPolarHBondContact O-CD 3.23Å; V361-P363 VanDerWaalsContact O-N 3.16Å; P363-S365 VanDerWaalsContact C-N 3.28Å; P363-S365 PolarHBondContact O-N 3.28Å
364	F	74.2	Confident	47.9	Very low	6 Å²	6	99.9 Å²	99.9	3%	0.026	57%	0.565	C	S	.	*	G	3₁₀ helix	trans	-81.3	-7.8	176.5	-60.6	-95.8	0	0	0	112.9	P212 Y213 L220 P249 R254 F258 N362 L377	P212-F364 HydrophobicContact CB-CD1 4.37Å; P212-F364 VanDerWaalsContact O-CE1 3.32Å; P212-F364 WeakPolarHBondContact O-CE1 3.42Å; Y213-F364 HydrophobicContact CD1-CD1 4.39Å; Y213-F364 HydrophobicContact CD1-CG 4.41Å; Y213-F364 HydrophobicContact CE1-CB 4.49Å; Y213-F364 HydrophobicContact CE1-CG 4.45Å; L220-F364 HydrophobicContact CD1-CE1 3.77Å; L220-F364 HydrophobicContact CD1-CZ 4.11Å; L220-F364 HydrophobicContact CD2-CE1 4.43Å; P249-F364 HydrophobicContact CB-CD2 3.78Å; P249-F364 HydrophobicContact CB-CE2 4.21Å; P249-F364 HydrophobicContact CG-CB 4.33Å; P249-F364 HydrophobicContact CG-CD2 3.67Å; P249-F364 HydrophobicContact CG-CE2 4.39Å; P249-F364 HydrophobicContact CG-CG 4.29Å; R254-F364 HydrophobicContact CG-CE2 4.24Å; F258-F364 HydrophobicContact CB-CZ 4.24Å; F258-F364 HydrophobicContact CD1-CD1 4.22Å; F258-F364 HydrophobicContact CD1-CD2 4.35Å; F258-F364 AromaticContact CD1-CE1 3.88Å; F258-F364 HydrophobicContact CD1-CE1 3.88Å; F258-F364 HydrophobicContact CD1-CE2 4.01Å; F258-F364 HydrophobicContact CD1-CG 4.45Å; F258-F364 AromaticContact CD1-CZ 3.77Å; F258-F364 HydrophobicContact CD1-CZ 3.77Å; F258-F364 HydrophobicContact CE1-CD1 4.45Å; F258-F364 HydrophobicContact CG-CZ 4.45Å; N362-F364 PolarHBondContact O-N 2.85Å; N362-F364 WeakPolarHBondContact OD1-CB 3.38Å; N362-F364 PolarHBondContact OD1-N 3Å; F364-L377 HydrophobicContact CD1-CD1 4.44Å
365	S	61.3	Low	48.1	Very low	48 Å²	48	99.1 Å²	99.1	34%	0.336	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-87.8	-3.4	176.8	-74.1	0	0	0	0	114.4	N362 P363	N362-S365 PolarHBondContact ND2-OG 3Å; N362-S365 WeakPolarHBondContact O-CB 3.26Å; N362-S365 PolarHBondContact O-N 3.15Å; N362-S365 PolarHBondContact OD1-N 3Å; P363-S365 VanDerWaalsContact C-N 3.28Å; P363-S365 PolarHBondContact O-N 3.28Å
366	Q	50.8	Low	48.5	Very low	138 Å²	138	96.8 Å²	96.8	65%	0.645	53%	0.532	S	S	*	.			trans	-134.7	94	-176.6	-60.5	-165.8	25.2	0	0	114	V361	V361-Q366 VanDerWaalsContact CG1-NE2 3.28Å
367	R	46.3	Very low	49.2	Very low	119 Å²	119	94.4 Å²	94.4	45%	0.449	51%	0.506	S	S	.	.			trans	-131.8	126	143	-76.4	-171.3	175.7	163.6	3	108.1	L220 I375	L220-R367 PolarHBondContact O-NH1 3.18Å; L220-R367 PolarHBondContact O-NH2 3Å; R367-I375 VanDerWaalsContact O-O 3.08Å
368	E	39.1	Very low	49.2	Very low	141 Å²	141	94.8 Å²	94.8	66%	0.659	50%	0.496	S	S	*	.	B	Isolated β-bridge	trans	-81.2	143.4	166.8	-62.2	-172.3	151.4	0	0	108.6
369	D	38.8	Very low	48.7	Very low	56 Å²	56	94.8 Å²	94.8	30%	0.299	49%	0.487	S	S	.	.			trans	-79	173.3	173.5	78.4	-4.6	0	0	0	111.7	K371 G372 G373 I375	D369-K371 PolarHBondContact O-N 3.22Å; D369-K371 VanDerWaalsContact OD1-CA 3.24Å; D369-K371 WeakPolarHBondContact OD1-CA 3.12Å; D369-K371 WeakPolarHBondContact OD1-CB 3.47Å; D369-K371 PolarHBondContact OD1-N 3.05Å; D369-G372 PolarHBondContact O-N 2.62Å; D369-G372 PolarHBondContact OD1-N 3.23Å; D369-G373 PolarHBondContact N-O 3.33Å; D369-G373 PolarHBondContact OD1-N 3.48Å; D369-I375 HydrophobicContact CB-CD1 3.65Å; D369-I375 HydrophobicContact CB-CG1 4.02Å
370	L	36.9	Very low	47.9	Very low	189 Å²	189	94.7 Å²	94.7	99%	0.99	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	21.6	175.3	-64.6	172.8	0	0	0	113.5
371	K	36.4	Very low	46.6	Very low	192 Å²	192	91.6 Å²	91.6	84%	0.835	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.6	6.2	176.9	-65	-172	175.6	-177.8	0	113.7	D369 G373	D369-K371 PolarHBondContact O-N 3.22Å; D369-K371 VanDerWaalsContact OD1-CA 3.24Å; D369-K371 WeakPolarHBondContact OD1-CA 3.12Å; D369-K371 WeakPolarHBondContact OD1-CB 3.47Å; D369-K371 PolarHBondContact OD1-N 3.05Å; K371-G373 VanDerWaalsContact C-N 3.34Å
372	G	37.3	Very low	45.3	Very low	58 Å²	58	90.1 Å²	90.1	60%	0.598	47%	0.471	S	S	*	.	S	Bend	trans	77.3	15.4	180	0	0	0	0	0	114.8	D369	D369-G372 PolarHBondContact O-N 2.62Å; D369-G372 PolarHBondContact OD1-N 3.23Å
373	G	35	Very low	43.5	Very low	28 Å²	28	96 Å²	96	29%	0.289	50%	0.496	S	S	.	.			trans	-80.8	132.4	169.5	0	0	0	0	0	111.4	D369 K371 I375	D369-G373 PolarHBondContact N-O 3.33Å; D369-G373 PolarHBondContact OD1-N 3.48Å; K371-G373 VanDerWaalsContact C-N 3.34Å; G373-I375 VanDerWaalsContact C-N 3.28Å; G373-I375 PolarHBondContact O-N 2.97Å
374	K	37.5	Very low	41.7	Very low	178 Å²	178	96 Å²	96	77%	0.774	50%	0.496	S	S	*	.	B	Isolated β-bridge	trans	-77.3	77.3	171.7	-68.2	-170.4	177.7	-172.6	0	110.7	K376	K374-K376 PolarHBondContact O-N 2.85Å
375	I	40.6	Very low	40.1	Very low	66 Å²	66	97 Å²	97	34%	0.338	50%	0.503	S	S	.	.			trans	-75.5	104.3	175.1	-61.2	-165.1	0	0	0	108.2	R367 D369 G373 D379	R367-I375 VanDerWaalsContact O-O 3.08Å; D369-I375 HydrophobicContact CB-CD1 3.65Å; D369-I375 HydrophobicContact CB-CG1 4.02Å; G373-I375 VanDerWaalsContact C-N 3.28Å; G373-I375 PolarHBondContact O-N 2.97Å; I375-D379 HydrophobicContact CG2-CB 4.04Å
376	K	41.7	Very low	39.1	Very low	109 Å²	109	94.7 Å²	94.7	47%	0.474	49%	0.487	S	S	.	.			trans	-59.6	148.2	162.9	-80.3	-166.6	172.5	-165.5	0	108	K374 F378 D379	K374-K376 PolarHBondContact O-N 2.85Å; K376-F378 HydrophobicContact CB-CB 4.31Å; K376-F378 HydrophobicContact CB-CD2 3.96Å; K376-F378 HydrophobicContact CD-CD2 4.35Å; K376-F378 PolarHBondContact O-N 2.86Å; K376-D379 PolarHBondContact O-N 2.78Å
377	L	45.5	Very low	38.4	Very low	40 Å²	40	89.6 Å²	89.6	21%	0.209	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-4.2	-179.6	-133.4	130.1	0	0	0	114.5	P212 L220 F364	P212-L377 HydrophobicContact CB-CD2 3.93Å; P212-L377 HydrophobicContact CG-CD2 3.84Å; L220-L377 HydrophobicContact CD2-CD2 4.46Å; F364-L377 HydrophobicContact CD1-CD1 4.44Å
378	F	43.4	Very low	38.3	Very low	125 Å²	125	84.4 Å²	84.4	55%	0.548	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-28.4	175.5	-66.4	-113.9	0	0	0	114.1	Y213 K376	Y213-F378 WeakPolarHBondContact OH-CZ 3.29Å; K376-F378 HydrophobicContact CB-CB 4.31Å; K376-F378 HydrophobicContact CB-CD2 3.96Å; K376-F378 HydrophobicContact CD-CD2 4.35Å; K376-F378 PolarHBondContact O-N 2.86Å
379	D	32.5	Very low	38.6	Very low	117 Å²	117	78.9 Å²	78.9	63%	0.626	42%	0.424	S	S	*	.	S	Bend	trans	-86.9	-14.8	-165.3	-76.4	-42.4	0	0	0	114.8	I375 K376 P381	I375-D379 HydrophobicContact CG2-CB 4.04Å; K376-D379 PolarHBondContact O-N 2.78Å; D379-P381 WeakPolarHBondContact O-CD 3.36Å
380	T	34.2	Very low	38.7	Very low	93 Å²	93	77 Å²	77	57%	0.571	41%	0.413	S	S	*	.	S	Bend	trans	-77.8	119.2	149.5	48.8	0	0	0	0	107.2	S382	T380-S382 PolarHBondContact O-N 2.91Å
381	P	32.9	Very low	38.9	Very low	98 Å²	98	73 Å²	73	64%	0.636	40%	0.396	S	S	*	.			trans	-57.6	114.2	168.8	25	-32.5	0	0	0	107	D379 K383	D379-P381 WeakPolarHBondContact O-CD 3.36Å; P381-K383 PolarHBondContact O-N 3.24Å
382	S	36.7	Very low	39	Very low	55 Å²	55	64.5 Å²	64.5	39%	0.385	36%	0.36	S	S	.	.			trans	-55	136.8	179.5	54	0	0	0	0	107.6	T380 S384	T380-S382 PolarHBondContact O-N 2.91Å; S382-S384 PolarHBondContact O-N 3.31Å
383	K	38.9	Very low	39	Very low	143 Å²	143	66.2 Å²	66.2	62%	0.622	36%	0.36	S	S	*	.			trans	-73.2	42.7	176.8	-64.2	177.8	-178.2	172.6	0	110.3	L190 V209 P381 V385	L190-K383 WeakPolarHBondContact CD1-O 3.24Å; L190-K383 WeakPolarHBondContact CD2-O 3.05Å; V209-K383 HydrophobicContact CG1-CB 4.22Å; P381-K383 PolarHBondContact O-N 3.24Å; K383-V385 WeakPolarHBondContact O-CG2 3.41Å; K383-V385 PolarHBondContact O-N 3.49Å
384	S	36.4	Very low	39.1	Very low	16 Å²	16	70 Å²	70	11%	0.112	38%	0.38	C	S	.	.			trans	-67.7	88.5	168.5	-174.1	0	0	0	0	107.3	F59 D166 S382 I386	F59-S384 WeakPolarHBondContact CD2-O 3.26Å; F59-S384 WeakPolarHBondContact CE2-O 3.48Å; D166-S384 WeakPolarHBondContact OD2-CB 3.42Å; D166-S384 PolarHBondContact OD2-OG 3.17Å; S382-S384 PolarHBondContact O-N 3.31Å; S384-I386 PolarHBondContact O-N 3.27Å
385	V	40.6	Very low	39.1	Very low	27 Å²	27	66.1 Å²	66.1	16%	0.164	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	99	-174.5	168.9	0	0	0	0	107.7	N87 G189 L190 K383	N87-V385 HydrophobicContact CB-CG1 3.54Å; G189-V385 WeakPolarHBondContact CA-O 3.24Å; G189-V385 WeakPolarHBondContact O-CG1 3.49Å; L190-V385 HydrophobicContact CD2-CB 4.09Å; L190-V385 HydrophobicContact CD2-CG2 4.08Å; L190-V385 HydrophobicContact CG-CB 4.27Å; K383-V385 WeakPolarHBondContact O-CG2 3.41Å; K383-V385 PolarHBondContact O-N 3.49Å
386	I	38.7	Very low	39	Very low	1 Å²	1	68.5 Å²	68.5	1%	0.005	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	58.8	170.3	-32.4	152.3	0	0	0	114.1	S60 K77 N84 N87 M88 E91 D187 S384 L388	S60-I386 WeakPolarHBondContact OG-CG2 3.45Å; K77-I386 HydrophobicContact CD-CG2 4.14Å; K77-I386 VanDerWaalsContact CE-CG2 3.43Å; K77-I386 WeakPolarHBondContact CE-O 3.18Å; K77-I386 PolarHBondContact NZ-O 3.21Å; N84-I386 VanDerWaalsContact ND2-CG1 3.29Å; N84-I386 WeakPolarHBondContact ND2-CG1 3.47Å; N87-I386 HydrophobicContact CB-CD1 4.28Å; M88-I386 HydrophobicContact CB-CD1 4.18Å; E91-I386 WeakPolarHBondContact OE2-CD1 3.34Å; D187-I386 VanDerWaalsContact OD1-O 3.12Å; S384-I386 PolarHBondContact O-N 3.27Å; I386-L388 PolarHBondContact O-N 3Å
387	S	37.7	Very low	38.8	Very low	31 Å²	31	70 Å²	70	22%	0.217	41%	0.406	C	S	.	.			trans	-56.9	129.6	178.8	-173.3	0	0	0	0	113.3	S60 D187 T389	S60-S387 PolarHBondContact OG-O 3.12Å; S60-S387 VanDerWaalsContact OG-O 3.1Å; D187-S387 WeakPolarHBondContact OD2-CA 3.45Å; D187-S387 PolarHBondContact OD2-OG 3.47Å; S387-T389 VanDerWaalsContact C-N 3.32Å; S387-T389 PolarHBondContact OG-N 3.49Å
388	L	43.4	Very low	38.4	Very low	10 Å²	10	74.2 Å²	74.2	5%	0.052	44%	0.437	C	S	.	.			trans	-74.1	-20.7	174.8	-97.4	-178.5	0	0	0	113.1	V62 K77 L104 D187 I386 F390	V62-L388 HydrophobicContact CG2-CD2 4.48Å; K77-L388 HydrophobicContact CB-CD2 4.09Å; K77-L388 HydrophobicContact CD-CD2 3.54Å; K77-L388 HydrophobicContact CD-CG 4.05Å; K77-L388 VanDerWaalsContact CE-CD2 3.5Å; K77-L388 HydrophobicContact CG-CD2 3.78Å; L104-L388 HydrophobicContact CD2-CD1 3.42Å; L104-L388 VanDerWaalsContact CD2-CD1 3.42Å; D187-L388 HydrophobicContact CB-CB 3.95Å; D187-L388 HydrophobicContact CB-CD1 4.24Å; D187-L388 HydrophobicContact CB-CG 4.37Å; D187-L388 PolarHBondContact OD1-N 3.17Å; D187-L388 PolarHBondContact OD2-N 3.27Å; I386-L388 PolarHBondContact O-N 3Å; L388-F390 WeakPolarHBondContact O-CD1 3.32Å; L388-F390 WeakPolarHBondContact O-CE1 3.46Å; L388-F390 PolarHBondContact O-N 3.35Å
389	T	45.1	Very low	38.3	Very low	25 Å²	25	75.8 Å²	75.8	15%	0.153	45%	0.451	C	S	.	.			trans	-84.5	112.6	-159.4	-59.2	0	0	0	0	112.9	N127 K170 N171 S387	N127-T389 HydrophobicContact CB-CG2 4.03Å; N127-T389 WeakPolarHBondContact ND2-CG2 3.46Å; K170-T389 HydrophobicContact CB-CG2 3.67Å; K170-T389 HydrophobicContact CG-CG2 4.06Å; K170-T389 VanDerWaalsContact O-CG2 3.29Å; K170-T389 WeakPolarHBondContact O-CG2 3.18Å; K170-T389 PolarHBondContact O-OG1 2.79Å; N171-T389 PolarHBondContact N-OG1 3.24Å; N171-T389 PolarHBondContact OD1-OG1 3.44Å; S387-T389 VanDerWaalsContact C-N 3.32Å; S387-T389 PolarHBondContact OG-N 3.49Å
390	F	41.8	Very low	38.3	Very low	16 Å²	16	77.2 Å²	77.2	7%	0.07	46%	0.459	C	S	.	.			trans	-102.5	155.9	166.8	47.7	-85	0	0	0	110.8	I54 V62 N127 L388 L392	I54-F390 HydrophobicContact CB-CD2 4.02Å; I54-F390 HydrophobicContact CB-CE2 4.13Å; I54-F390 HydrophobicContact CD1-CD1 4.49Å; I54-F390 HydrophobicContact CD1-CD2 4.11Å; I54-F390 HydrophobicContact CD1-CE1 3.94Å; I54-F390 HydrophobicContact CD1-CE2 3.46Å; I54-F390 VanDerWaalsContact CD1-CE2 3.46Å; I54-F390 HydrophobicContact CD1-CZ 3.38Å; I54-F390 HydrophobicContact CG1-CD1 4.33Å; I54-F390 HydrophobicContact CG1-CD2 3.92Å; I54-F390 HydrophobicContact CG1-CE1 4.27Å; I54-F390 HydrophobicContact CG1-CE2 3.81Å; I54-F390 HydrophobicContact CG1-CG 4.2Å; I54-F390 HydrophobicContact CG1-CZ 4.01Å; I54-F390 WeakPolarHBondContact O-CB 3.34Å; I54-F390 WeakPolarHBondContact O-CD2 3.41Å; V62-F390 HydrophobicContact CB-CD1 3.58Å; V62-F390 HydrophobicContact CB-CE1 3.86Å; V62-F390 HydrophobicContact CB-CG 4.47Å; V62-F390 HydrophobicContact CG1-CD1 3.88Å; V62-F390 HydrophobicContact CG1-CE1 3.58Å; V62-F390 HydrophobicContact CG1-CZ 4.41Å; V62-F390 HydrophobicContact CG2-CD1 3.76Å; V62-F390 HydrophobicContact CG2-CE1 4.15Å; N127-F390 PolarHBondContact ND2-O 2.96Å; N127-F390 VanDerWaalsContact ND2-O 3.1Å; L388-F390 WeakPolarHBondContact O-CD1 3.32Å; L388-F390 WeakPolarHBondContact O-CE1 3.46Å; L388-F390 PolarHBondContact O-N 3.35Å; F390-L392 HydrophobicContact CD2-CD2 3.82Å; F390-L392 HydrophobicContact CD2-CG 4.08Å; F390-L392 HydrophobicContact CE2-CD2 3.55Å; F390-L392 HydrophobicContact CE2-CG 3.77Å
391	T	41.2	Very low	38.3	Very low	104 Å²	104	78.6 Å²	78.6	64%	0.638	47%	0.467	S	S	*	.			trans	-85.1	106.6	167.2	-53.1	0	0	0	0	108.1	Q130	Q130-T391 HydrophobicContact CG-CG2 4.32Å; Q130-T391 VanDerWaalsContact NE2-CG2 3.29Å
392	L	38.5	Very low	38.6	Very low	15 Å²	15	80 Å²	80	8%	0.079	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-62.4	149.3	168.2	-80.1	-170.7	0	0	0	110.2	I54 Q130 F390	I54-L392 HydrophobicContact CB-CD2 3.78Å; I54-L392 HydrophobicContact CD1-CD2 4.49Å; I54-L392 HydrophobicContact CG2-CD2 3.94Å; Q130-L392 PolarHBondContact NE2-O 3.06Å; F390-L392 HydrophobicContact CD2-CD2 3.82Å; F390-L392 HydrophobicContact CD2-CG 4.08Å; F390-L392 HydrophobicContact CE2-CD2 3.55Å; F390-L392 HydrophobicContact CE2-CG 3.77Å
393	P	37.6	Very low	38.2	Very low	93 Å²	93	83.5 Å²	83.5	60%	0.604	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-56.5	150.4	159.5	28	-34.6	0	0	0	109.7
394	P	36.8	Very low	38.4	Very low	108 Å²	108	82 Å²	82	70%	0.701	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-57.8	151.7	173.4	27	-34.7	0	0	0	110.3
395	P	36.5	Very low	38.4	Very low	97 Å²	97	89.3 Å²	89.3	63%	0.63	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-58.6	145.8	169	28.5	-34.5	0	0	0	109.3	D397	P395-D397 PolarHBondContact O-N 3.43Å
396	P	38.4	Very low	38	Very low	115 Å²	115	91.5 Å²	91.5	75%	0.747	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-62	136.1	170.4	28	-33.8	0	0	0	109.2
397	D	38.4	Very low	37.6	Very low	140 Å²	140	100.9 Å²	100.9	75%	0.749	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-61	140.4	176.1	-74.6	-59.1	0	0	0	110.4	P395 D399	P395-D397 PolarHBondContact O-N 3.43Å; D397-D399 PolarHBondContact O-N 3.1Å
398	C	36.4	Very low	37.5	Very low	129 Å²	129	106 Å²	106	87%	0.872	64%	0.64	S	S	*	*	S	Bend	trans	-84.6	37.4	-171.8	-68.9	0	0	0	0	113.6
399	D	42.5	Very low	37	Very low	158 Å²	158	111.4 Å²	111.4	85%	0.845	67%	0.673	S	S	*	*			trans	-163.6	91	168.7	-95.3	-38.9	0	0	0	108.8	D397	D397-D399 PolarHBondContact O-N 3.1Å
400	D	32.1	Very low	36.5	Very low	148 Å²	148	117.5 Å²	117.5	79%	0.791	71%	0.705	S	S	*	*			trans	-144.5	115	172.8	-133	-23.2	0	0	0	111.7
401	V	33.6	Very low	36.1	Very low	122 Å²	122	121.6 Å²	121.6	74%	0.739	73%	0.731	S	S	*	*			trans	-115.1	125	175.7	174.6	0	0	0	0	107	T403	V401-T403 PolarHBondContact O-N 3.47Å
402	P	38.6	Very low	35.6	Very low	127 Å²	127	122.1 Å²	122.1	83%	0.825	74%	0.736	S	S	*	*			trans	-70.6	121.2	-166.7	26.8	-35.1	0	0	0	112.9
403	T	30	Very low	35.3	Very low	129 Å²	129	133 Å²	133	79%	0.791	78%	0.776	S	S	*	*			trans	-118	134.8	161.9	52.6	0	0	0	0	110.1	V401	V401-T403 PolarHBondContact O-N 3.47Å
404	P	41.2	Very low	34.9	Very low	111 Å²	111	139.5 Å²	139.5	72%	0.721	79%	0.788	S	S	*	*			trans	-87	157.6	-169.7	34.6	-36.7	0	0	0	114.9
405	D	36.6	Very low	34.8	Very low	169 Å²	169	142.8 Å²	142.8	90%	0.904	79%	0.794	S	S	*	*			trans	59.4	108.4	155.6	-54.7	-24.9	0	0	0	119.7
406	G	32.4	Very low	35	Very low	74 Å²	74	149.1 Å²	149.1	76%	0.763	81%	0.806	S	S	*	*			trans	-163.5	134.8	167.1	0	0	0	0	0	111.1
407	E	31.3	Very low	34.8	Very low	197 Å²	197	154.2 Å²	154.2	92%	0.921	81%	0.81	S	S	*	*			trans	-64.6	144.5	-164.5	-61.2	179.5	126.6	0	0	115.3
408	V	35.3	Very low	34.6	Very low	138 Å²	138	153.4 Å²	153.4	84%	0.836	81%	0.814	S	S	*	*			trans	-88.7	124.6	177.3	-178.6	0	0	0	0	110.9
409	V	33	Very low	34.4	Very low	124 Å²	124	155 Å²	155	75%	0.752	81%	0.808	S	S	*	*			trans	-117.8	118	167	-179.6	0	0	0	0	109.1
410	D	34.1	Very low	33.9	Very low	153 Å²	153	151.5 Å²	151.5	82%	0.818	80%	0.796	S	S	*	*			trans	-80.7	133.1	-176.3	-168.3	8.1	0	0	0	111.8
411	V	33.3	Very low	33.9	Very low	102 Å²	102	152.4 Å²	152.4	62%	0.618	80%	0.8	S	S	*	*			trans	-141.8	123.7	-177.7	-176.9	0	0	0	0	109.8	R413	V411-R413 PolarHBondContact O-N 2.9Å
412	P	31.9	Very low	33.8	Very low	116 Å²	116	152.3 Å²	152.3	75%	0.753	80%	0.802	S	S	*	*			trans	-62.2	122.8	-175.3	-24.6	34	0	0	0	113.6	R414	P412-R414 PolarHBondContact O-N 2.97Å
413	R	31	Very low	33.5	Very low	242 Å²	242	152.2 Å²	152.2	91%	0.913	80%	0.803	S	S	*	*			trans	-64.3	95	174.8	-71.6	-175.4	175.3	-168.3	-2.6	111.3	V411 H415	V411-R413 PolarHBondContact O-N 2.9Å; R413-H415 PolarHBondContact O-N 3.46Å
414	R	30.1	Very low	33.6	Very low	230 Å²	230	152.7 Å²	152.7	87%	0.868	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.4	124.4	167.2	-69.9	-172.7	176.7	-165.9	-0.8	109.7	P412 R416	P412-R414 PolarHBondContact O-N 2.97Å; R414-R416 PolarHBondContact O-N 3.3Å
415	H	34.6	Very low	33.9	Very low	178 Å²	178	152.6 Å²	152.6	82%	0.824	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60	127.2	170.5	-74	58	0	0	0	109.3	R413	R413-H415 PolarHBondContact O-N 3.46Å
416	R	39.8	Very low	34.4	Very low	230 Å²	230	149.8 Å²	149.8	87%	0.868	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96	130.5	175.4	-67.1	-174.7	178.9	-172.3	0.6	109.4	R414 C418	R414-R416 PolarHBondContact O-N 3.3Å; R416-C418 PolarHBondContact O-N 2.74Å
417	R	35.4	Very low	34.9	Very low	221 Å²	221	150.8 Å²	150.8	83%	0.834	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.8	119	163.7	-76.5	-179.6	171.4	169.3	-3.8	108.3
418	C	34.3	Very low	34.7	Very low	124 Å²	124	148.8 Å²	148.8	84%	0.838	78%	0.78	S	S	*	*			trans	-86.9	107.7	171.3	-65.4	0	0	0	0	109	R416	R416-C418 PolarHBondContact O-N 2.74Å
419	H	31.8	Very low	34.2	Very low	161 Å²	161	149.2 Å²	149.2	75%	0.745	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-79.3	136.5	164.1	-71.8	-90.7	0	0	0	109	L421	H419-L421 PolarHBondContact O-N 3.43Å
420	S	31.1	Very low	33.9	Very low	86 Å²	86	149.6 Å²	149.6	60%	0.601	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-68.2	126.8	174.9	41.7	0	0	0	0	110.8
421	L	31.6	Very low	33.5	Very low	167 Å²	167	148 Å²	148	87%	0.874	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-90.5	134.5	169.8	-69.5	175.3	0	0	0	109.8	H419	H419-L421 PolarHBondContact O-N 3.43Å
422	P	33	Very low	33.2	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.9	139.1	179.7	33.3	-34.1	0	0	0	111.5
423	C	32.2	Very low	33.2	Very low	126 Å²	126	147.8 Å²	147.8	85%	0.851	78%	0.784	S	S	*	*			trans	-162.4	131.3	171.1	-116.2	0	0	0	0	112.4
424	T	31.2	Very low	33	Very low	138 Å²	138	144.3 Å²	144.3	85%	0.847	78%	0.784	S	S	*	*			trans	175.6	157.4	160.6	20.5	0	0	0	0	109
425	P	48.8	Very low	32.9	Very low	109 Å²	109	138.7 Å²	138.7	71%	0.708	78%	0.78	S	S	*	*			cis	-136.6	-131.5	-46.8	40.6	-20.9	0	0	0	108.5
426	P	47	Very low	32.6	Very low	110 Å²	110	136.4 Å²	136.4	71%	0.714	78%	0.778	S	S	*	*				-110	-149.8	-58.2	41.5	-25	0	0	0	109
427	P	42	Very low	32	Very low	95 Å²	95	133.5 Å²	133.5	62%	0.617	78%	0.779	S	S	*	*			cis	-137.6	157	-8.3	37.9	-18.4	0	0	0	119
428	H	26.9	Very low	31.6	Very low	156 Å²	156	127.4 Å²	127.4	72%	0.722	78%	0.776	S	S	*	*			trans	54.4	144.4	141	84.2	-13.8	0	0	0	120.8
429	M	25.4	Very low	31.3	Very low	147 Å²	147	130 Å²	130	72%	0.724	78%	0.776	S	S	*	*				-148.1	155.8	75.6	-75.7	-135.5	72.9	0	0	114.4
430	V	25.7	Very low	31.2	Very low	132 Å²	132	130.7 Å²	130.7	80%	0.8	78%	0.779	S	S	*	*			trans	-104.6	136.9	161.5	175.8	0	0	0	0	107.7
431	C	25.8	Very low	31.1	Very low	118 Å²	118	134.8 Å²	134.8	80%	0.797	79%	0.789	S	S	*	*			trans	-114.4	125.8	171.6	-80.5	0	0	0	0	111.8
432	A	28.1	Very low	30.9	Very low	87 Å²	87	131.7 Å²	131.7	72%	0.719	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.8	169	163.2	0	0	0	0	0	109.8
433	P	30.4	Very low	30.7	Very low	127 Å²	127	131.5 Å²	131.5	83%	0.825	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-80.7	150.8	-173.1	32.6	-34.7	0	0	0	113.6
434	N	28.1	Very low	30.5	Very low	169 Å²	169	133.3 Å²	133.3	90%	0.904	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-88.2	149	174.9	-83.7	-16.6	0	0	0	113
435	S	27.6	Very low	30.4	Very low	113 Å²	113	134.1 Å²	134.1	79%	0.79	77%	0.766	S	S	*	*			trans	-131.5	102.6	169.6	59.1	0	0	0	0	112.5
436	V	28.1	Very low	29.7	Very low	129 Å²	129	134.3 Å²	134.3	78%	0.782	77%	0.765	S	S	*	*			trans	36.1	108	143.9	-172.4	0	0	0	0	120.1
437	L	26.5	Very low	29	Very low	169 Å²	169	135 Å²	135	89%	0.885	76%	0.763	S	S	*	*			trans	41.2	121	132.6	-52.3	176.5	0	0	0	122.7
438	A	28.4	Very low	28.6	Very low	94 Å²	94	136.5 Å²	136.5	78%	0.777	77%	0.765	S	S	*	*			trans	173.8	153.3	133.5	0	0	0	0	0	107.7
439	E	28.5	Very low	29	Very low	179 Å²	179	134.3 Å²	134.3	84%	0.836	76%	0.763	S	S	*	*			cis	-177.9	148.3	-30.1	-118.2	174.6	-173.1	0	0	105.4
440	E	29.3	Very low	29.3	Very low	175 Å²	175	135 Å²	135	82%	0.818	77%	0.77	S	S	*	*			trans	56.3	121.4	159.1	-54.3	-161.2	147.5	0	0	125.5
441	E	28.3	Very low	29.6	Very low	172 Å²	172	132.2 Å²	132.2	80%	0.804	77%	0.767	S	S	*	*				59.9	143.6	128.8	-66.4	-114.7	117.1	0	0	126
442	S	28.4	Very low	29.7	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	77%	0.772	S	S	*	*			trans	75.6	148.7	148.5	78	0	0	0	0	119.6
443	T	27.2	Very low	29.8	Very low	115 Å²	115	129.7 Å²	129.7	71%	0.706	77%	0.769	S	S	*	*			cis	-165	145.5	-16.1	20.6	0	0	0	0	109.7
444	F	27.8	Very low	29.9	Very low	164 Å²	164	128.8 Å²	128.8	72%	0.719	77%	0.766	S	S	*	*			trans	57.7	125.6	153.5	-78.4	-107.1	0	0	0	119.6
445	E	29.8	Very low	30.3	Very low	154 Å²	154	129.4 Å²	129.4	72%	0.72	76%	0.764	S	S	*	*				63	144.1	100.2	-60.3	-171.6	174.5	0	0	115.1
446	V	34.3	Very low	30.6	Very low	114 Å²	114	132.8 Å²	132.8	69%	0.691	77%	0.767	S	S	*	*			cis	-154.6	157.1	29.9	-139.1	0	0	0	0	113.1
447	D	31.4	Very low	30.8	Very low	125 Å²	125	133.5 Å²	133.5	67%	0.668	77%	0.766	S	S	*	*			trans	61.8	124.1	138.6	-86.9	17.2	0	0	0	126.7
448	N	34	Very low	31.1	Very low	126 Å²	126	129.3 Å²	129.3	67%	0.674	75%	0.751	S	S	*	*				105	111.3	118.6	-77	-23.5	0	0	0	124.7
449	V	34.8	Very low	31.2	Very low	110 Å²	110	131.9 Å²	131.9	67%	0.667	75%	0.751	S	S	*	*				85.9	120.9	118.8	170.8	0	0	0	0	121.2
450	N	33.5	Very low	31.4	Very low	162 Å²	162	131.2 Å²	131.2	87%	0.866	75%	0.752	S	S	*	*			trans	42.1	148	148.1	-60.6	-9.6	0	0	0	121.9
451	G	30.2	Very low	31.2	Very low	72 Å²	72	126.6 Å²	126.6	74%	0.742	75%	0.752	S	S	*	*			cis	147.1	152.4	-3.7	0	0	0	0	0	113.6
452	G	29	Very low	31.2	Very low	87 Å²	87	121.8 Å²	121.8	90%	0.897	75%	0.749	S	S	*	*			trans	83	149.8	-178.6	0	0	0	0	0	114.2
453	G	30.2	Very low	31.2	Very low	65 Å²	65	126.3 Å²	126.3	67%	0.67	76%	0.758	S	S	*	*			cis	150.8	142.1	-8.4	0	0	0	0	0	112.9
454	S	33.3	Very low	31.3	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	76%	0.763	S	S	*	*			trans	57.7	154.1	164.4	44	0	0	0	0	118.7
455	E	35.2	Very low	31.4	Very low	183 Å²	183	121.6 Å²	121.6	86%	0.855	76%	0.761	S	S	*	*			cis	-155.7	-167.2	-13.8	-115.5	156.1	-165.3	0	0	109.8
456	E	34.8	Very low	31.3	Very low	183 Å²	183	122.2 Å²	122.2	86%	0.855	77%	0.769	S	S	*	*			trans	-69.2	164.2	-179.1	-57.9	167.2	128.8	0	0	112
457	D	32	Very low	30.9	Very low	144 Å²	144	121.1 Å²	121.1	77%	0.77	77%	0.766	S	S	*	*				178.9	157.7	73.5	-164.2	13.8	0	0	0	114.7
458	S	32.8	Very low	30.9	Very low	82 Å²	82	122.5 Å²	122.5	57%	0.573	77%	0.773	S	S	*	*			trans	22.2	128.8	149.9	-68.9	0	0	0	0	127.3
459	L	31.5	Very low	30.6	Very low	147 Å²	147	123.3 Å²	123.3	77%	0.77	78%	0.782	S	S	*	*				81.4	132	121.1	-69	171.5	0	0	0	125.3
460	L	31.3	Very low	30.3	Very low	165 Å²	165	121.7 Å²	121.7	86%	0.864	79%	0.788	S	S	*	*			trans	74.2	126.5	140.4	-68.7	165.8	0	0	0	123.8
461	G	26.2	Very low	30.2	Very low	78 Å²	78	121.5 Å²	121.5	80%	0.804	79%	0.787	S	S	*	*				124.9	140.8	122.3	0	0	0	0	0	119.8
462	G	27.1	Very low	30.3	Very low	72 Å²	72	123.3 Å²	123.3	74%	0.742	79%	0.788	S	S	*	*			trans	83.2	107.3	167	0	0	0	0	0	115.2
463	E	30	Very low	30.1	Very low	196 Å²	196	122.8 Å²	122.8	92%	0.916	78%	0.783	S	S	*	*				83.4	126.3	59.3	-73.2	-151.2	112.8	0	0	116.1
464	A	29.3	Very low	30.2	Very low	97 Å²	97	127.2 Å²	127.2	80%	0.802	79%	0.79	S	S	*	*			trans	39.2	151.7	142.7	0	0	0	0	0	122.5
465	A	28.3	Very low	30.4	Very low	83 Å²	83	127.7 Å²	127.7	69%	0.686	79%	0.791	S	S	*	*			cis	-176.3	179.1	-18.7	0	0	0	0	0	107.6
466	L	27.9	Very low	30	Very low	168 Å²	168	124.1 Å²	124.1	88%	0.88	78%	0.781	S	S	*	*			trans	70.9	155.2	168.6	-49	176.5	0	0	0	115.7
467	S	27.2	Very low	29.7	Very low	90 Å²	90	123.2 Å²	123.2	63%	0.629	78%	0.777	S	S	*	*			cis	-170.9	149.3	-25	54.3	0	0	0	0	112.3
468	L	30.2	Very low	29.5	Very low	154 Å²	154	121.9 Å²	121.9	81%	0.806	77%	0.769	S	S	*	*			trans	65	139.5	144.5	-72.8	165.2	0	0	0	122.5
469	T	28.3	Very low	29.2	Very low	143 Å²	143	125 Å²	125	88%	0.877	78%	0.777	S	S	*	*			trans	66.7	149.7	160.3	57.6	0	0	0	0	118.7
470	G	28.5	Very low	29	Very low	76 Å²	76	122.3 Å²	122.3	78%	0.784	77%	0.77	S	S	*	*			cis	-166.3	177.3	2.4	0	0	0	0	0	114.7
471	D	30.8	Very low	28.7	Very low	158 Å²	158	120.4 Å²	120.4	85%	0.845	76%	0.76	S	S	*	*			trans	-71.8	156.3	-170.5	173.3	51.5	0	0	0	116.6
472	S	33.1	Very low	28.7	Very low	110 Å²	110	122.5 Å²	122.5	77%	0.769	75%	0.753	S	S	*	*				143.8	146.1	129.6	62.6	0	0	0	0	116.5
473	G	25	Very low	28.7	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	76%	0.756	S	S	*	*			trans	128.2	104.9	153.3	0	0	0	0	0	119
474	L	31	Very low	28.7	Very low	158 Å²	158	120.3 Å²	120.3	83%	0.827	74%	0.739	S	S	*	*			trans	-104.5	163.8	156.5	-68	173.1	0	0	0	109.8
475	P	38.3	Very low	28.6	Very low	118 Å²	118	122.2 Å²	122.2	77%	0.766	74%	0.736	S	S	*	*				-137.7	157.6	91.5	36.7	-21.2	0	0	0	112.6
476	V	27.6	Very low	28.7	Very low	109 Å²	109	126 Å²	126	66%	0.661	74%	0.739	S	S	*	*			cis	69.9	128.3	45.3	-175.3	0	0	0	0	110.1
477	E	26.8	Very low	28.8	Very low	163 Å²	163	126.3 Å²	126.3	76%	0.762	74%	0.736	S	S	*	*			cis	-146.7	-159.7	23.5	-146.1	167.7	-120.2	0	0	109.2
478	L	27.6	Very low	28.9	Very low	117 Å²	117	130.9 Å²	130.9	61%	0.613	75%	0.747	S	S	*	*			cis	-165.1	146.4	3.7	179.5	56.7	0	0	0	111.9
479	M	26.5	Very low	28.9	Very low	147 Å²	147	132.7 Å²	132.7	72%	0.724	75%	0.752	S	S	*	*			trans	63.9	149.5	158.1	-81.9	167.9	-178.2	0	0	121.8	L481	M479-L481 HydrophobicContact CE-CD1 4.43Å; M479-L481 HydrophobicContact CG-CD1 4.44Å
480	S	27.2	Very low	28.9	Very low	90 Å²	90	132.7 Å²	132.7	63%	0.629	75%	0.747	S	S	*	*			cis	-141.4	138.2	2.5	-101.2	0	0	0	0	111.2
481	L	25.8	Very low	29	Very low	126 Å²	126	138.1 Å²	138.1	66%	0.66	75%	0.754	S	S	*	*				61.5	136.5	82.7	-54.2	175.1	0	0	0	114.5	M479	M479-L481 HydrophobicContact CE-CD1 4.43Å; M479-L481 HydrophobicContact CG-CD1 4.44Å
482	N	26.6	Very low	28.9	Very low	121 Å²	121	139.1 Å²	139.1	65%	0.647	75%	0.753	S	S	*	*			cis	-160.7	158.8	-6.7	-112.9	5.2	0	0	0	109.9
483	L	27.7	Very low	28.7	Very low	155 Å²	155	142.3 Å²	142.3	81%	0.812	76%	0.756	S	S	*	*				42.8	143.2	94	-92.3	73.1	0	0	0	116.4
484	A	29	Very low	29.2	Very low	67 Å²	67	146.8 Å²	146.8	55%	0.554	76%	0.757	S	S	*	*			cis	-151.7	177.4	-3.2	0	0	0	0	0	110
485	D	27.3	Very low	29.8	Very low	138 Å²	138	144.1 Å²	144.1	74%	0.738	75%	0.749	S	S	*	*				134	164.3	104.7	-88.8	-41.1	0	0	0	108.7
486	Q	30.8	Very low	29.5	Very low	161 Å²	161	147.3 Å²	147.3	75%	0.752	76%	0.756	S	S	*	*			cis	-166.4	-175.8	-25	-165.1	164.1	123.5	0	0	107.7
487	E	29	Very low	29.8	Very low	175 Å²	175	149.3 Å²	149.3	82%	0.818	76%	0.763	S	S	*	*			trans	71.8	127	174.4	-53.4	176.5	170.9	0	0	115.1
488	E	30.8	Very low	30.2	Very low	186 Å²	186	147 Å²	147	87%	0.869	76%	0.763	S	S	*	*			cis	82	106.6	41.1	-68.4	-165.8	175	0	0	115.7
489	Q	29.3	Very low	30.4	Very low	192 Å²	192	147.3 Å²	147.3	90%	0.897	77%	0.77	S	S	*	*				-171.8	159.5	120.8	-107.5	176.2	14	0	0	114.7
490	D	29.1	Very low	30.7	Very low	144 Å²	144	147.3 Å²	147.3	77%	0.77	78%	0.778	S	S	*	*			trans	-83.4	167.2	-167.1	-42.4	-87.6	0	0	0	115
491	M	29.7	Very low	30.8	Very low	190 Å²	190	148.2 Å²	148.2	94%	0.936	78%	0.784	S	S	*	*				-158.9	144.5	120.2	-87.2	-142.8	-61.2	0	0	111.5
492	E	28.8	Very low	32.2	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	79%	0.789	S	S	*	*			trans	-73.2	154	-179.9	-71.2	164.4	146.6	0	0	111.5
493	E	29.4	Very low	32.4	Very low	178 Å²	178	148.2 Å²	148.2	83%	0.832	79%	0.791	S	S	*	*				45.2	128.2	87.9	-95.1	172.9	-151	0	0	112.9
494	E	34.7	Very low	32.7	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	79%	0.785	S	S	*	*			cis	-157.8	-178.8	46.7	-107.7	-107.8	106.2	0	0	111.5
495	P	44.1	Very low	32.8	Very low	103 Å²	103	150.4 Å²	150.4	67%	0.669	79%	0.794	S	S	*	*			trans	-87.4	168	-174.2	36.3	-34.2	0	0	0	114.6
496	M	32.3	Very low	32.9	Very low	184 Å²	184	149.7 Å²	149.7	91%	0.906	79%	0.79	S	S	*	*			trans	-101.2	115.2	173.7	-81.2	-84.8	-93.7	0	0	111.5
497	D	32.3	Very low	32.8	Very low	151 Å²	151	149 Å²	149	81%	0.807	79%	0.79	S	S	*	*			trans	-115	151.4	165.9	-167.8	14.1	0	0	0	110.4
498	C	35.2	Very low	32.9	Very low	114 Å²	114	145.7 Å²	145.7	77%	0.77	79%	0.786	S	S	*	*			trans	-119.7	97.8	-168.9	-81.3	0	0	0	0	112.1
499	T	33	Very low	32.8	Very low	125 Å²	125	142.1 Å²	142.1	77%	0.767	78%	0.782	S	S	*	*			trans	-69.4	131.8	-175.5	57.4	0	0	0	0	115
500	V	32.8	Very low	33.7	Very low	146 Å²	146	138 Å²	138	89%	0.885	77%	0.772	S	S	*	*				-150.6	137.5	129.6	-157.4	0	0	0	0	109.7
501	S	29.5	Very low	33.8	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	77%	0.767	S	S	*	*			trans	-106.3	-171.3	175.1	-44.7	0	0	0	0	110.3
502	P	54.6	Low	33.9	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	76%	0.76	S	S	*	*			cis	-118.8	-173.8	-9	43.7	-28.4	0	0	0	111.6
503	D	30.9	Very low	33.8	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	76%	0.755	S	S	*	*			cis	-147.5	-159.4	13.8	-142.4	-4.4	0	0	0	108.4
504	T	34.1	Very low	33.8	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	75%	0.754	S	S	*	*			cis	-154.5	172.9	15.1	-18.7	0	0	0	0	112.5
505	Q	31.8	Very low	33.5	Very low	156 Å²	156	138 Å²	138	73%	0.729	76%	0.76	S	S	*	*			trans	-40.1	155.8	159.9	-72.9	152.9	6.2	0	0	115.9
506	D	28.3	Very low	33.7	Very low	124 Å²	124	138.5 Å²	138.5	66%	0.663	76%	0.763	S	S	*	*			cis	-157.4	156.4	19.5	-124.7	-7.5	0	0	0	115.2
507	I	29.8	Very low	33.8	Very low	145 Å²	145	137.2 Å²	137.2	74%	0.744	76%	0.759	S	S	*	*			trans	29.2	128.5	135.8	-63.4	168.8	0	0	0	118.1
508	S	29.6	Very low	34.5	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	76%	0.76	S	S	*	*			cis	-164	154.3	27.8	49.5	0	0	0	0	115
509	S	29.5	Very low	34.4	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	76%	0.756	S	S	*	*			trans	-91.1	-179.2	154.2	-35.7	0	0	0	0	110
510	P	49.3	Very low	34.3	Very low	106 Å²	106	139 Å²	139	69%	0.688	76%	0.764	S	S	*	*			cis	-157.7	173.9	31.4	45.7	-23.1	0	0	0	121.7
511	L	30.4	Very low	34.3	Very low	127 Å²	127	137 Å²	137	67%	0.665	76%	0.756	S	S	*	*			trans	79.2	148.3	134.8	-87.1	165.8	0	0	0	125.4
512	Y	31.1	Very low	34.4	Very low	199 Å²	199	136.4 Å²	136.4	78%	0.78	75%	0.752	S	S	*	*			trans	72.8	142.7	155.1	-71.6	-50	0	0	0	120.1
513	S	28	Very low	33.4	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	76%	0.755	S	S	*	*			cis	-157.3	-174.9	-8.7	-155.5	0	0	0	0	114.2
514	K	28.3	Very low	34.6	Very low	187 Å²	187	135.9 Å²	135.9	81%	0.813	75%	0.754	S	S	*	*			trans	-84.7	144.3	-163.6	-53.7	161.3	175.5	172.3	0	117.2
515	R	29.4	Very low	34.3	Very low	241 Å²	241	140.3 Å²	140.3	91%	0.909	76%	0.764	S	S	*	*			trans	55.9	174.9	135.5	-84.8	-171.3	-178.4	-165	1.9	120.5
516	P	47.3	Very low	34.3	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	77%	0.767	S	S	*	*			cis	-129.7	-169.5	-15.3	30.3	-7.6	0	0	0	114.9
517	L	35.6	Very low	35.2	Very low	158 Å²	158	139.3 Å²	139.3	83%	0.827	77%	0.769	S	S	*	*			trans	-72.6	171.5	166.2	-69	84.6	0	0	0	113.2
518	P	45.8	Very low	35.2	Very low	128 Å²	128	138 Å²	138	83%	0.831	77%	0.773	S	S	*	*				-135.6	176.5	117.1	40.2	-31.5	0	0	0	115.2
519	S	33.9	Very low	35.3	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	78%	0.778	S	S	*	*			trans	-129.3	156.2	179.2	56.6	0	0	0	0	111.3
520	H	30	Very low	35.1	Very low	200 Å²	200	140.2 Å²	140.2	93%	0.926	78%	0.783	S	S	*	*			trans	-165.2	178.8	155.5	-91.9	-51.6	0	0	0	111.9
521	S	32.6	Very low	34.2	Very low	103 Å²	103	140 Å²	140	72%	0.72	78%	0.784	S	S	*	*			trans	-142.4	179.2	-157.3	64.9	0	0	0	0	116.1
522	S	32.8	Very low	34.2	Very low	97 Å²	97	142.4 Å²	142.4	68%	0.678	79%	0.794	S	S	*	*			trans	99.2	99.9	151.7	-48.8	0	0	0	0	120.9
523	T	33.9	Very low	34.3	Very low	131 Å²	131	138 Å²	138	80%	0.804	79%	0.788	S	S	*	*				29.5	163.9	123.4	58.5	0	0	0	0	123.1
524	P	55.1	Low	34.6	Very low	105 Å²	105	141 Å²	141	68%	0.682	80%	0.796	S	S	*	*			cis	-137.8	-173.9	-37.9	40.8	-24.2	0	0	0	112.7
525	F	26.9	Very low	34.6	Very low	206 Å²	206	135 Å²	135	90%	0.904	79%	0.787	S	S	*	*			trans	-177.7	157	140.8	-106	-66.4	0	0	0	114.7
526	N	31.9	Very low	34.8	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	79%	0.792	S	S	*	*			trans	-156.6	171.9	170.3	-134.2	-2.4	0	0	0	106
527	P	47.5	Very low	33.9	Very low	111 Å²	111	141.9 Å²	141.9	72%	0.721	80%	0.799	S	S	*	*			cis	-139.2	-169.7	14	44.8	-26.2	0	0	0	115.3
528	S	29.6	Very low	33.7	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	80%	0.796	S	S	*	*			trans	-171.8	163.7	133.9	47.1	0	0	0	0	112.4
529	T	32	Very low	33	Very low	139 Å²	139	137.4 Å²	137.4	85%	0.853	79%	0.789	S	S	*	*			trans	-137.2	149	-171.5	53.1	0	0	0	0	112.4
530	S	26.7	Very low	33	Very low	126 Å²	126	139.9 Å²	139.9	88%	0.881	79%	0.793	S	S	*	*			trans	-153.2	147.3	154.3	62.5	0	0	0	0	112.4
531	S	29.1	Very low	33	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	79%	0.787	S	S	*	*			trans	-136	144.9	174.6	172.3	0	0	0	0	108.6
532	M	30.4	Very low	33	Very low	177 Å²	177	138.3 Å²	138.3	87%	0.872	79%	0.792	S	S	*	*			trans	-149.6	149.1	172.4	-99.1	-72.8	104.2	0	0	110.6
533	T	32.8	Very low	32.9	Very low	106 Å²	106	137.1 Å²	137.1	65%	0.65	80%	0.795	S	S	*	*			trans	-132.4	146.3	-170.6	53.2	0	0	0	0	111.3
534	N	34.2	Very low	33.5	Very low	166 Å²	166	136.9 Å²	136.9	89%	0.888	80%	0.796	S	S	*	*			trans	-177.9	149.3	152	-88.8	-34	0	0	0	109.8
535	G	29.1	Very low	33.4	Very low	62 Å²	62	137.5 Å²	137.5	64%	0.639	80%	0.8	S	S	*	*			cis	138.5	71.5	-8.3	0	0	0	0	0	115.4
536	W	33.9	Very low	33.6	Very low	265 Å²	265	133.5 Å²	133.5	100%	1.004	80%	0.797	S	S	*	*			trans	-135	162.3	171.9	-81.7	82.7	0	0	0	112.2
537	R	27.7	Very low	33.6	Very low	233 Å²	233	134.4 Å²	134.4	88%	0.879	80%	0.802	S	S	*	*			trans	-118.7	151.8	-157.9	-66.7	176.3	172.2	-120.9	2.5	115.6
538	S	32.5	Very low	33.4	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	80%	0.803	S	S	*	*			trans	25	156.7	133.4	-42.1	0	0	0	0	121.5
539	A	31.1	Very low	34.3	Very low	83 Å²	83	134.8 Å²	134.8	69%	0.686	80%	0.801	S	S	*	*			cis	-154.5	145.1	22.9	0	0	0	0	0	112.3
540	I	32.5	Very low	34.3	Very low	151 Å²	151	135.9 Å²	135.9	77%	0.774	80%	0.801	S	S	*	*				64.3	119.4	92.6	-51	167.4	0	0	0	117.1
541	S	30.5	Very low	34.4	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	80%	0.799	S	S	*	*			trans	-163.5	166.7	140.6	-162.7	0	0	0	0	111.5
542	N	32.5	Very low	34.4	Very low	155 Å²	155	137.2 Å²	137.2	83%	0.829	80%	0.8	S	S	*	*			trans	-128.2	159.4	-169.6	-53	-69	0	0	0	113.6
543	G	31.3	Very low	34.4	Very low	72 Å²	72	136.2 Å²	136.2	74%	0.742	80%	0.797	S	S	*	*			trans	130	130.5	151.7	0	0	0	0	0	118.9
544	P	46.6	Very low	34.2	Very low	126 Å²	126	137 Å²	137	82%	0.818	80%	0.797	S	S	*	*			trans	-112.4	-160	167.6	44.8	-35.2	0	0	0	111.1
545	P	52.2	Low	33.9	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	78%	0.784	S	S	*	*			cis	-127.9	175.5	-25.4	39.8	-25.4	0	0	0	114.2
546	S	30.6	Very low	34	Very low	121 Å²	121	138.6 Å²	138.6	85%	0.846	79%	0.786	S	S	*	*			trans	-171.6	147.4	149.8	50.6	0	0	0	0	117.1
547	L	32.5	Very low	33.7	Very low	167 Å²	167	132 Å²	132	87%	0.874	77%	0.771	S	S	*	*			trans	-108.2	177.3	153.7	-76.1	171.3	0	0	0	107
548	P	43.8	Very low	33.6	Very low	114 Å²	114	126.3 Å²	126.3	74%	0.74	76%	0.762	S	S	*	*			cis	-141.8	-145.6	27.1	42	-16.6	0	0	0	111.5
549	P	47.4	Very low	33.3	Very low	121 Å²	121	128.2 Å²	128.2	79%	0.786	76%	0.762	S	S	*	*			cis	-134.2	-176.1	-6	41.3	-21.1	0	0	0	117.8
550	L	32.4	Very low	33.1	Very low	163 Å²	163	130.7 Å²	130.7	85%	0.853	77%	0.768	S	S	*	*			trans	-93	168.4	-179.2	-69.5	157.2	0	0	0	113.9
551	S	28.9	Very low	32.8	Very low	121 Å²	121	128.3 Å²	128.3	85%	0.846	77%	0.765	S	S	*	*			trans	-141.2	143.2	148.6	55.1	0	0	0	0	111.2
552	N	29.2	Very low	32.7	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	77%	0.769	S	S	*	*			trans	-96.2	160.9	-177.8	-64.1	-21.6	0	0	0	111.6
553	L	30.8	Very low	33.4	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	76%	0.759	S	S	*	*				174.6	115.2	111.5	-91.3	160.9	0	0	0	113.7
554	D	28.4	Very low	33.3	Very low	124 Å²	124	135 Å²	135	66%	0.663	76%	0.761	S	S	*	*				56.3	127.8	124.3	-78.1	37.6	0	0	0	125.4
555	N	28.6	Very low	32.2	Very low	115 Å²	115	134.7 Å²	134.7	62%	0.615	75%	0.753	S	S	*	*				87.7	104.7	129.5	-72.2	-36.4	0	0	0	123.2
556	Q	29.5	Very low	31.1	Very low	145 Å²	145	140.7 Å²	140.7	68%	0.678	76%	0.76	S	S	*	*				89.6	125.7	113.4	-78.6	-179.6	54.3	0	0	123.1
557	N	27.8	Very low	30.8	Very low	126 Å²	126	138.2 Å²	138.2	67%	0.674	75%	0.754	S	S	*	*				95.7	117.4	126.6	-71.8	-8.9	0	0	0	123.3
558	V	26	Very low	30.6	Very low	115 Å²	115	134.8 Å²	134.8	70%	0.697	75%	0.75	S	S	*	*				80.4	108.6	123.9	177.8	0	0	0	0	119.8
559	I	26.7	Very low	30.7	Very low	148 Å²	148	134.7 Å²	134.7	76%	0.759	75%	0.749	S	S	*	*				27	119.9	127.3	-42.8	168.7	0	0	0	117.5
560	V	27.2	Very low	30	Very low	136 Å²	136	136.8 Å²	136.8	82%	0.824	75%	0.75	S	S	*	*				-170.1	150.2	120.2	141.3	0	0	0	0	112.7
561	S	26.6	Very low	29.6	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	75%	0.749	S	S	*	*			trans	-37.6	146.9	175.6	-51.3	0	0	0	0	120
562	R	27.9	Very low	29.6	Very low	236 Å²	236	135.5 Å²	135.5	89%	0.891	74%	0.739	S	S	*	*				17.9	159.7	121.3	-87.6	-172	167.2	-172.8	-3.4	119.8
563	P	47.3	Very low	30.8	Very low	96 Å²	96	134.2 Å²	134.2	62%	0.623	74%	0.738	S	S	*	*			cis	-142.7	-159.9	-21	35.1	-11.7	0	0	0	113.2
564	L	28.5	Very low	31	Very low	150 Å²	150	132.4 Å²	132.4	79%	0.785	73%	0.734	S	S	*	*			trans	71.4	159.9	160.1	-61.7	157	0	0	0	117.4
565	D	24.3	Very low	31.1	Very low	120 Å²	120	131.2 Å²	131.2	64%	0.642	74%	0.741	S	S	*	*			cis	-164.5	160.3	-47.1	-141.4	-29	0	0	0	110
566	W	28.9	Very low	31.4	Very low	244 Å²	244	132.3 Å²	132.3	92%	0.924	75%	0.747	S	S	*	*			trans	58.5	156.5	162	-121.8	-96.8	0	0	0	121
567	G	24.7	Very low	31.7	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	75%	0.746	S	S	*	*			trans	122.4	83.4	151.4	0	0	0	0	0	119.4
568	A	27.1	Very low	32	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	75%	0.751	S	S	*	*			trans	-87.7	179.3	148	0	0	0	0	0	108.8
569	P	46.6	Very low	32.2	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	75%	0.75	S	S	*	*			cis	-146.3	179.1	13.7	45.2	-25.7	0	0	0	118.3
570	M	32.7	Very low	32.3	Very low	164 Å²	164	133.2 Å²	133.2	81%	0.808	75%	0.754	S	S	*	*			trans	36	135.4	141.2	-72.3	-69.7	175	0	0	122.9
571	D	24.6	Very low	32.4	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	76%	0.755	S	S	*	*			trans	-141.1	169.3	135.1	-141.2	-30.2	0	0	0	111.4
572	T	29.3	Very low	32.5	Very low	106 Å²	106	135.9 Å²	135.9	65%	0.65	76%	0.758	S	S	*	*			trans	-130.3	-157	-157.6	66.1	0	0	0	0	112.4
573	P	53.9	Low	34.1	Very low	108 Å²	108	130.5 Å²	130.5	70%	0.701	75%	0.754	S	S	*	*			cis	-121.7	-148.6	-23.2	25.9	0.1	0	0	0	110
574	T	34.5	Very low	34	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	76%	0.76	S	S	*	*			cis	-164	152.7	4.2	-22.6	0	0	0	0	109.7
575	A	30.2	Very low	34	Very low	98 Å²	98	131 Å²	131	81%	0.81	76%	0.763	S	S	*	*			trans	172.7	129.4	133.6	0	0	0	0	0	114.3
576	N	34.3	Very low	34.5	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	77%	0.77	S	S	*	*			trans	-86.3	175.6	-172.3	-67.5	0	0	0	0	114.1
577	N	36.6	Very low	35.3	Very low	124 Å²	124	126.6 Å²	126.6	66%	0.663	77%	0.765	S	S	*	*			cis	-163.6	163.6	6.5	-130.8	1.7	0	0	0	114.4
578	N	35.1	Very low	35.6	Very low	147 Å²	147	128 Å²	128	79%	0.786	77%	0.769	S	S	*	*			trans	62.8	145.7	157.4	-58.1	-8	0	0	0	120.3
579	G	28.8	Very low	35.6	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	77%	0.765	S	S	*	*			cis	165.8	148	-13.4	0	0	0	0	0	116.3
580	Y	29.8	Very low	34.8	Very low	219 Å²	219	127.5 Å²	127.5	86%	0.859	77%	0.774	S	S	*	*			trans	74.5	148.5	157.9	-70.3	-81.8	0	0	0	125.2
581	H	28.8	Very low	34.9	Very low	180 Å²	180	125.1 Å²	125.1	83%	0.833	77%	0.773	S	S	*	*			trans	87.5	167.2	156.6	-70.8	-56.4	0	0	0	122.6
582	S	28.8	Very low	35.8	Very low	112 Å²	112	123.3 Å²	123.3	78%	0.783	77%	0.77	S	S	*	*			trans	-128.1	-152.5	-153.6	-42.9	0	0	0	0	113.8
583	P	62	Low	35.9	Very low	123 Å²	123	128.5 Å²	128.5	80%	0.799	78%	0.784	S	S	*	*			trans	-95.8	172	-136.4	43.8	-40.2	0	0	0	117.3
584	P	43.9	Very low	34.6	Very low	115 Å²	115	127 Å²	127	75%	0.747	79%	0.788	S	S	*	*			trans	-139.1	135.1	136.6	35.4	-19.8	0	0	0	113.8
585	V	29.6	Very low	34.6	Very low	141 Å²	141	127.7 Å²	127.7	86%	0.855	80%	0.797	S	S	*	*				97.5	141	79.7	168.6	0	0	0	0	114.3
586	D	33.5	Very low	34.4	Very low	145 Å²	145	126.8 Å²	126.8	78%	0.775	80%	0.798	S	S	*	*			trans	-69.1	-177.4	177.9	-52.5	-79.8	0	0	0	114.9
587	P	47	Very low	34.3	Very low	127 Å²	127	126.1 Å²	126.1	83%	0.825	80%	0.804	S	S	*	*				-137.1	167.2	112.8	38.9	-30	0	0	0	116.3
588	A	30.5	Very low	33.8	Very low	98 Å²	98	123.1 Å²	123.1	81%	0.81	80%	0.803	S	S	*	*			trans	-54.9	161.7	175	0	0	0	0	0	114.3
589	G	27.2	Very low	33.6	Very low	67 Å²	67	125 Å²	125	69%	0.691	81%	0.806	S	S	*	*			cis	110.6	130.9	11.1	0	0	0	0	0	111.3
590	S	30	Very low	33.5	Very low	131 Å²	131	126.9 Å²	126.9	92%	0.916	81%	0.81	S	S	*	*			trans	-165	136.9	175.1	-82	0	0	0	0	112.3
591	S	33.8	Very low	33.6	Very low	115 Å²	115	123.1 Å²	123.1	80%	0.804	80%	0.804	S	S	*	*			trans	-147.8	153	163.9	64.6	0	0	0	0	109
592	P	45.2	Very low	33.7	Very low	113 Å²	113	122.4 Å²	122.4	73%	0.734	81%	0.806	S	S	*	*			trans	-140.5	129.5	149.1	30.3	-12.7	0	0	0	114.5
593	F	31	Very low	33.8	Very low	215 Å²	215	124.9 Å²	124.9	94%	0.943	81%	0.805	S	S	*	*			trans	41.3	126	144.9	-68.7	-85.9	0	0	0	122.1
594	G	26.1	Very low	32.2	Very low	77 Å²	77	128 Å²	128	79%	0.794	81%	0.809	S	S	*	*			trans	-178.4	73.6	164.8	0	0	0	0	0	113.6
595	S	34.9	Very low	31.5	Very low	132 Å²	132	131.4 Å²	131.4	92%	0.923	82%	0.815	S	S	*	*			trans	-79.8	123.4	176.3	-60.1	0	0	0	0	111.4
596	G	26.6	Very low	31.6	Very low	79 Å²	79	130.5 Å²	130.5	81%	0.814	81%	0.81	S	S	*	*			trans	-155.7	151.4	177.9	0	0	0	0	0	112.1
597	S	31.8	Very low	31.5	Very low	124 Å²	124	131.6 Å²	131.6	87%	0.867	81%	0.813	S	S	*	*			trans	-119.6	140.7	-167.1	58.1	0	0	0	0	114.4
598	G	26.5	Very low	30.8	Very low	62 Å²	62	130.3 Å²	130.3	64%	0.639	81%	0.808	S	S	*	*			trans	105.7	146.8	145.4	0	0	0	0	0	117.2
599	H	29.3	Very low	30.7	Very low	185 Å²	185	131 Å²	131	86%	0.856	81%	0.806	S	S	*	*			trans	61.3	126	168.9	-53.6	-89.1	0	0	0	116.5
600	S	28.3	Very low	31.1	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	81%	0.813	S	S	*	*			cis	73.9	89.7	34.7	-173.1	0	0	0	0	114.5
601	L	31.2	Very low	31.3	Very low	140 Å²	140	130.7 Å²	130.7	73%	0.733	80%	0.799	S	S	*	*			trans	-171.8	109.5	137	-103.9	162.3	0	0	0	110.4	Q603	L601-Q603 HydrophobicContact CD2-CG 4.08Å
602	D	31.6	Very low	31.3	Very low	165 Å²	165	130.6 Å²	130.6	88%	0.882	80%	0.797	S	S	*	*			trans	-84.6	137.7	150.8	-65.6	-56.8	0	0	0	107.2
603	Q	30	Very low	30.7	Very low	164 Å²	164	131.7 Å²	131.7	77%	0.766	81%	0.806	S	S	*	*			trans	-120.8	107.3	173.5	-73.6	-176	-34.2	0	0	109.3	L601	L601-Q603 HydrophobicContact CD2-CG 4.08Å
604	E	28.6	Very low	31	Very low	189 Å²	189	128.8 Å²	128.8	88%	0.883	80%	0.799	S	S	*	*			trans	-90.6	119.5	163	-67.9	-178.5	129.9	0	0	108.2
605	E	29.3	Very low	31.4	Very low	185 Å²	185	130.5 Å²	130.5	86%	0.864	81%	0.806	S	S	*	*			trans	-78.4	129.5	175.3	-68.1	-168.5	121.6	0	0	111.2
606	V	31.3	Very low	31.5	Very low	123 Å²	123	127.1 Å²	127.1	75%	0.745	79%	0.792	S	S	*	*			trans	-100.8	90.5	-179.5	-177.9	0	0	0	0	110.1	S608	V606-S608 PolarHBondContact O-N 3.05Å; V606-S608 PolarHBondContact O-OG 2.85Å
607	I	31.3	Very low	31.6	Very low	167 Å²	167	130.7 Å²	130.7	86%	0.856	79%	0.791	S	S	*	*			trans	-62.7	122.5	173.1	-58.7	177.9	0	0	0	109.2
608	S	32	Very low	31.4	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	80%	0.795	S	S	*	*			trans	-108.9	115.9	-175.5	-67	0	0	0	0	111.2	V606 P610	V606-S608 PolarHBondContact O-N 3.05Å; V606-S608 PolarHBondContact O-OG 2.85Å; S608-P610 WeakPolarHBondContact O-CD 3.43Å
609	C	28.9	Very low	31.6	Very low	113 Å²	113	140.4 Å²	140.4	76%	0.764	79%	0.794	S	S	*	*			trans	-79.7	121.6	178.7	179.6	0	0	0	0	112.3	G611	C609-G611 PolarHBondContact O-N 2.92Å
610	P	35.5	Very low	31.9	Very low	131 Å²	131	137.1 Å²	137.1	85%	0.851	79%	0.789	S	S	*	*	S	Bend	trans	-91.6	82.4	-179.1	35.7	-32.8	0	0	0	112.1	S608	S608-P610 WeakPolarHBondContact O-CD 3.43Å
611	G	35.2	Very low	31.9	Very low	60 Å²	60	137.4 Å²	137.4	62%	0.619	79%	0.791	S	S	*	*			trans	-159.4	6.4	-178.8	0	0	0	0	0	118.4	C609 C613	C609-G611 PolarHBondContact O-N 2.92Å; G611-C613 PolarHBondContact O-N 3.24Å
612	C	33.4	Very low	31.8	Very low	113 Å²	113	136.4 Å²	136.4	76%	0.764	79%	0.791	S	S	*	*			trans	-94	76.7	-167.3	-66.5	0	0	0	0	114.4	L614	C612-L614 VanDerWaalsContact C-N 3.25Å; C612-L614 PolarHBondContact O-N 2.94Å
613	C	32.6	Very low	31.7	Very low	136 Å²	136	134.3 Å²	134.3	92%	0.919	79%	0.787	S	S	*	*			trans	-74.5	72.5	168.3	-70.6	0	0	0	0	112	G611	G611-C613 PolarHBondContact O-N 3.24Å
614	L	36.3	Very low	31.9	Very low	153 Å²	153	134.4 Å²	134.4	80%	0.801	79%	0.792	S	S	*	*			trans	-113.4	110.2	172.5	-75.4	176.7	0	0	0	111.6	C612 G616	C612-L614 VanDerWaalsContact C-N 3.25Å; C612-L614 PolarHBondContact O-N 2.94Å; L614-G616 PolarHBondContact O-N 3.1Å
615	A	35.1	Very low	31.9	Very low	113 Å²	113	136.7 Å²	136.7	93%	0.934	79%	0.793	S	S	*	*			trans	-75.6	113	162.7	0	0	0	0	0	109.4
616	G	36.1	Very low	32	Very low	61 Å²	61	132.1 Å²	132.1	63%	0.629	79%	0.786	S	S	*	*	S	Bend	trans	121.7	124.1	173.3	0	0	0	0	0	114.6	L614	L614-G616 PolarHBondContact O-N 3.1Å
617	L	29.6	Very low	32.1	Very low	154 Å²	154	131.7 Å²	131.7	81%	0.806	79%	0.786	S	S	*	*			trans	65.7	63.3	167.4	-50.7	-177.2	0	0	0	117.5	F619	L617-F619 HydrophobicContact CD2-CE2 4.32Å
618	R	26.8	Very low	32.2	Very low	251 Å²	251	129.4 Å²	129.4	95%	0.947	78%	0.782	S	S	*	*			trans	-78.4	126.2	150.4	-110	-179.1	175.3	170.6	-1.4	109.8
619	F	32.1	Very low	32.2	Very low	140 Å²	140	136.3 Å²	136.3	61%	0.614	79%	0.793	S	S	*	*			trans	-125.1	137.3	161.2	-76.4	-75.5	0	0	0	109	L617	L617-F619 HydrophobicContact CD2-CE2 4.32Å
620	P	33.7	Very low	32.4	Very low	115 Å²	115	142.1 Å²	142.1	75%	0.747	80%	0.798	S	S	*	*			trans	-73.5	135.8	175.3	30.3	-33.6	0	0	0	111	V622	P620-V622 PolarHBondContact O-N 3.41Å
621	S	29.5	Very low	32.4	Very low	111 Å²	111	143.5 Å²	143.5	78%	0.776	80%	0.799	S	S	*	*			trans	-74.8	107.9	176	47.9	0	0	0	0	111.2
622	V	29.8	Very low	32.5	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	81%	0.807	S	S	*	*			trans	-92	105.7	169.4	179.5	0	0	0	0	109	P620 L624	P620-V622 PolarHBondContact O-N 3.41Å; V622-L624 PolarHBondContact O-N 3.23Å; V622-L624 VanDerWaalsContact O-N 3.12Å
623	C	29.5	Very low	32.2	Very low	120 Å²	120	152.1 Å²	152.1	81%	0.811	81%	0.814	S	S	*	*			trans	-71.8	101.3	178.6	-62.2	0	0	0	0	111.1	R625	C623-R625 PolarHBondContact O-N 3.01Å
624	L	33.1	Very low	32.1	Very low	166 Å²	166	154.7 Å²	154.7	87%	0.869	81%	0.81	S	S	*	*			trans	-81.8	98.2	173.5	-78.5	173	0	0	0	111.2	V622	V622-L624 PolarHBondContact O-N 3.23Å; V622-L624 VanDerWaalsContact O-N 3.12Å
625	R	29.5	Very low	31.8	Very low	238 Å²	238	153.8 Å²	153.8	90%	0.898	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.2	170.1	-164.3	176.7	-163.7	150.9	5.2	110	C623	C623-R625 PolarHBondContact O-N 3.01Å
626	A	31.6	Very low	31.6	Very low	88 Å²	88	156.9 Å²	156.9	73%	0.727	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.4	135.6	178.1	0	0	0	0	0	111.4
627	P	32.8	Very low	31.3	Very low	114 Å²	114	160.8 Å²	160.8	74%	0.74	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-74.6	145	176.8	30.5	-34.3	0	0	0	111.4
628	P	34.1	Very low	31.3	Very low	119 Å²	119	157.1 Å²	157.1	77%	0.773	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70.9	138.6	-179.3	29.2	-34.8	0	0	0	111.7	R630	P628-R630 PolarHBondContact O-N 3.28Å
629	R	32.1	Very low	31.4	Very low	247 Å²	247	152.3 Å²	152.3	93%	0.932	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.3	128.6	171.7	-71.1	-172.5	175.4	-158.3	-0.1	110.5
630	R	31.6	Very low	31.4	Very low	234 Å²	234	155.3 Å²	155.3	88%	0.883	82%	0.82	S	S	*	*			trans	-125	131.6	160	-80.4	-172.9	169.2	-170.7	-2.9	109	P628	P628-R630 PolarHBondContact O-N 3.28Å
631	N	35.8	Very low	31.3	Very low	160 Å²	160	154.4 Å²	154.4	86%	0.856	82%	0.823	S	S	*	*			trans	-76.1	137.7	172.8	-68.3	-9.8	0	0	0	110.4
632	P	37.8	Very low	31.3	Very low	123 Å²	123	153.7 Å²	153.7	80%	0.799	82%	0.824	S	S	*	*			trans	-114.8	105.8	162.1	33.4	-20.1	0	0	0	111
633	Y	27.5	Very low	31.4	Very low	231 Å²	231	152.2 Å²	152.2	91%	0.906	82%	0.818	S	S	*	*			trans	-132.3	97.8	163.5	-112	-70.3	0	0	0	108.6
634	K	30.5	Very low	31.5	Very low	190 Å²	190	155.5 Å²	155.5	83%	0.826	82%	0.822	S	S	*	*			trans	177.5	125.2	140.6	-101.6	167.1	-178.4	-179.1	0	112.6
635	N	29.5	Very low	31.3	Very low	135 Å²	135	150.8 Å²	150.8	72%	0.722	81%	0.813	S	S	*	*			trans	29.4	123	137.2	-49	13.2	0	0	0	119.2
636	L	31.8	Very low	31.3	Very low	177 Å²	177	147.2 Å²	147.2	93%	0.927	81%	0.81	S	S	*	*				-128.2	131	128	-77.2	177.9	0	0	0	108.7
637	N	29.8	Very low	31.3	Very low	143 Å²	143	150.6 Å²	150.6	77%	0.765	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.6	150.9	161.6	-72.6	-3.3	0	0	0	108.4
638	G	28.7	Very low	31.3	Very low	78 Å²	78	150.8 Å²	150.8	80%	0.804	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-101.2	122.2	157.5	0	0	0	0	0	109.1
639	D	29.8	Very low	31.9	Very low	149 Å²	149	151.2 Å²	151.2	80%	0.797	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-81.8	121.8	172.3	-77.1	-46.9	0	0	0	110.7
640	H	32	Very low	31.7	Very low	203 Å²	203	142.6 Å²	142.6	94%	0.94	81%	0.809	S	S	*	*			trans	-138.4	133.6	149.3	-87.8	-58.7	0	0	0	109
641	A	30.5	Very low	33	Very low	97 Å²	97	137 Å²	137	80%	0.802	80%	0.803	S	S	*	*			trans	-105.9	171.5	-173.7	0	0	0	0	0	112.1
642	A	30.7	Very low	32.9	Very low	96 Å²	96	139 Å²	139	79%	0.793	80%	0.804	S	S	*	*			trans	71.9	146.3	176.2	0	0	0	0	0	116
643	S	31	Very low	32.6	Very low	88 Å²	88	136.8 Å²	136.8	62%	0.615	80%	0.803	S	S	*	*			cis	-165.8	158.7	-17.5	46.4	0	0	0	0	110.5
644	H	31.9	Very low	32.8	Very low	190 Å²	190	133.9 Å²	133.9	88%	0.88	80%	0.802	S	S	*	*			trans	63.5	157.4	179.5	-46	-86.3	0	0	0	114.5
645	G	27.9	Very low	34.5	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	80%	0.795	S	S	*	*			cis	148.7	141	-10.5	0	0	0	0	0	112.6
646	L	30.5	Very low	35.9	Very low	163 Å²	163	129.2 Å²	129.2	85%	0.853	80%	0.799	S	S	*	*			trans	80.2	126	165.1	-60.8	172.8	0	0	0	120.7
647	L	30.2	Very low	36.2	Very low	160 Å²	160	125.9 Å²	125.9	84%	0.838	79%	0.79	S	S	*	*			trans	77.3	123	137.7	-65.1	166.4	0	0	0	122.7
648	C	33.4	Very low	37.7	Very low	118 Å²	118	124.5 Å²	124.5	80%	0.797	79%	0.789	S	S	*	*			trans	-77.5	159.8	150.2	-45.3	0	0	0	0	110
649	P	46.6	Very low	38	Very low	128 Å²	128	127.4 Å²	127.4	83%	0.831	79%	0.786	S	S	*	*				-151.2	-179.4	79.6	39.8	-20.6	0	0	0	116
650	G	29.1	Very low	38.3	Very low	65 Å²	65	125.2 Å²	125.2	67%	0.67	78%	0.778	S	S	*	*			trans	-92.3	-148	160.9	0	0	0	0	0	111.9
651	P	57.6	Low	38.4	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	77%	0.765	S	S	*	*			cis	-140.8	-152.5	-3	40	-17.7	0	0	0	113.9
652	K	34.4	Very low	38.5	Very low	204 Å²	204	123 Å²	123	89%	0.887	76%	0.764	S	S	*	*			trans	88.5	146.4	172.1	-50.7	167.3	-173.8	176.1	0	115.5
653	G	31.9	Very low	38.7	Very low	76 Å²	76	122.2 Å²	122.2	78%	0.784	76%	0.758	S	S	*	*			cis	-166.5	-178.6	0.5	0	0	0	0	0	114
654	L	30.8	Very low	38.7	Very low	169 Å²	169	123 Å²	123	89%	0.885	76%	0.764	S	S	*	*			trans	-129.7	-168.9	-171.2	-75.5	166.6	0	0	0	110.8
655	P	65.4	Low	38.7	Very low	104 Å²	104	121.8 Å²	121.8	68%	0.675	76%	0.762	S	S	*	*				-118.6	-145.3	-60	33.8	-13.1	0	0	0	110.1
656	P	58.7	Low	39	Very low	124 Å²	124	125.5 Å²	125.5	81%	0.805	77%	0.767	S	S	*	*				-143.6	174.2	63	38.2	-17.1	0	0	0	117.6
657	S	39.4	Very low	40.1	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	76%	0.764	S	S	*	*			trans	-96	-142.8	179	-44.2	0	0	0	0	111.2
658	P	61.4	Low	40.1	Very low	114 Å²	114	119.4 Å²	119.4	74%	0.74	76%	0.76	S	S	*	*			cis	-109.7	-159.5	13.9	47.5	-36.4	0	0	0	111.4
659	N	35.2	Very low	40.1	Very low	140 Å²	140	122 Å²	122	75%	0.749	77%	0.765	S	S	*	*			cis	-161.3	163.7	-9.2	-132.7	17.6	0	0	0	106.4
660	T	35	Very low	39.6	Very low	102 Å²	102	122.5 Å²	122.5	63%	0.626	77%	0.765	S	S	*	*			cis	-144.9	-138.5	-6.8	-19.7	0	0	0	0	105
661	T	35.1	Very low	40	Very low	109 Å²	109	126.9 Å²	126.9	67%	0.669	77%	0.773	S	S	*	*			cis	-170.7	156.7	-19	18.9	0	0	0	0	103.5
662	N	32.6	Very low	40	Very low	144 Å²	144	126.9 Å²	126.9	77%	0.77	77%	0.773	S	S	*	*			cis	-171.2	157.8	-19.1	-100	7	0	0	0	106.2
663	A	33.7	Very low	39.9	Very low	81 Å²	81	121 Å²	121	67%	0.669	77%	0.77	S	S	*	*			cis	-169.2	140	-24.5	0	0	0	0	0	110.3
664	S	31.1	Very low	40	Very low	105 Å²	105	121.7 Å²	121.7	73%	0.734	77%	0.768	S	S	*	*			trans	42.5	120	145.3	-174.1	0	0	0	0	121.9
665	L	33	Very low	40.3	Very low	163 Å²	163	122.7 Å²	122.7	85%	0.853	77%	0.769	S	S	*	*				-174.6	143.8	107.5	-96.9	167.4	0	0	0	112.9
666	D	33.6	Very low	39.3	Very low	144 Å²	144	127.8 Å²	127.8	77%	0.77	80%	0.798	S	S	*	*			trans	-150.4	175.4	177	-143.9	13.3	0	0	0	105.5
667	P	53.5	Low	38.3	Very low	123 Å²	123	128 Å²	128	80%	0.799	80%	0.797	S	S	*	*			cis	-139.3	176.1	22.1	43.3	-24.1	0	0	0	117.6
668	G	31.6	Very low	38.3	Very low	72 Å²	72	129.1 Å²	129.1	74%	0.742	80%	0.8	S	S	*	*			trans	-167.3	108.5	166.3	0	0	0	0	0	115.7
669	L	33	Very low	37	Very low	174 Å²	174	129.9 Å²	129.9	91%	0.911	80%	0.804	S	S	*	*			trans	-66.1	153.9	170.6	-62.6	153.6	0	0	0	110.1
670	T	35.4	Very low	37.1	Very low	137 Å²	137	129.4 Å²	129.4	84%	0.84	81%	0.807	S	S	*	*				-157.8	166.1	51	46.7	0	0	0	0	115.9
671	L	38.4	Very low	37.2	Very low	158 Å²	158	131.1 Å²	131.1	83%	0.827	82%	0.818	S	S	*	*			trans	-67.3	-178.5	168.1	-70.9	166.3	0	0	0	114.6
672	P	57.2	Low	37.4	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	83%	0.828	S	S	*	*			cis	-140.4	166.4	-36.3	35.1	-17.6	0	0	0	116.1
673	G	31	Very low	37.7	Very low	81 Å²	81	131.7 Å²	131.7	84%	0.835	83%	0.832	S	S	*	*			trans	77.1	169.7	144.4	0	0	0	0	0	118.6
674	A	34	Very low	38	Very low	90 Å²	90	135.6 Å²	135.6	74%	0.744	85%	0.845	S	S	*	*			cis	-161.6	149.9	-10.9	0	0	0	0	0	110.4
675	Q	37.7	Very low	38.6	Very low	191 Å²	191	138.2 Å²	138.2	89%	0.893	85%	0.854	S	S	*	*			trans	56.7	135.3	166.2	-62.9	175.1	-3.4	0	0	116.5
676	T	45.2	Very low	39.1	Very low	210 Å²	210	135.9 Å²	135.9	100%	1.288	85%	0.854	S	S	*	*			cis	-135.1	0	26.8	50.8	0	0	0	0	112.8

Retrieved 676 of 676 residues in 411.2 ms (Link to these results)

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