A0A060VHI5_HUMAN Loading...

MHC class I antigen

AlphaFold DB , UniProt , Accession A0A060VHI5, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 366 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	34	Very low	40.3	Very low	243 Å²	243	152.2 Å²	152.2	100%	1.197	78%	0.784	S	S	*	*				0	96.1	0	-76.1	164.4	156.6	0	0	108.4
2	R	33	Very low	40.3	Very low	249 Å²	249	151.3 Å²	151.3	94%	0.94	78%	0.78	S	S	*	*			trans	-108.5	107.3	169.2	-94	-178.4	172.7	167.1	-2.3	105.8	M4	R2-M4 PolarHBondContact O-N 3.26Å
3	V	35.5	Very low	40.1	Very low	145 Å²	145	149.2 Å²	149.2	88%	0.879	77%	0.77	S	S	*	*			trans	-75.4	108.6	173.3	178.4	0	0	0	0	106.4	A5	V3-A5 PolarHBondContact O-N 3.34Å
4	M	39.1	Very low	40.1	Very low	180 Å²	180	143.2 Å²	143.2	89%	0.887	75%	0.748	S	S	*	*			trans	-84	99.4	177	-156.5	165.3	67.7	0	0	106.9	R2	R2-M4 PolarHBondContact O-N 3.26Å
5	A	43	Very low	40	Very low	78 Å²	78	136.6 Å²	136.6	65%	0.645	73%	0.728	S	S	*	*			trans	-63.4	138.4	173.9	0	0	0	0	0	109.6	V3 R7	V3-A5 PolarHBondContact O-N 3.34Å; A5-R7 PolarHBondContact O-N 3.19Å
6	P	43.6	Very low	39.6	Very low	89 Å²	89	130.8 Å²	130.8	58%	0.578	71%	0.711	S	S	*	*			trans	-74.3	114.6	-174.1	26.2	-26.1	0	0	0	110.1	A8 L9	P6-A8 PolarHBondContact O-N 3.16Å; P6-L9 PolarHBondContact O-N 2.94Å; P6-L9 VanDerWaalsContact O-N 3.16Å
7	R	48.3	Very low	39.3	Very low	228 Å²	228	130.3 Å²	130.3	86%	0.86	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-8.1	171.8	-96.1	177.2	164.2	166.5	-6	114.7	A5	A5-R7 PolarHBondContact O-N 3.19Å
8	A	44.8	Very low	39.2	Very low	71 Å²	71	126.9 Å²	126.9	59%	0.587	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-23.2	176.4	0	0	0	0	0	113.7	P6	P6-A8 PolarHBondContact O-N 3.16Å
9	L	40.2	Very low	39.1	Very low	123 Å²	123	126.7 Å²	126.7	64%	0.644	70%	0.697	S	S	*	*	H	α-helix	trans	-81.3	-21.1	-177.7	-126.2	88.3	0	0	0	113.7	P6	P6-L9 PolarHBondContact O-N 2.94Å; P6-L9 VanDerWaalsContact O-N 3.16Å
10	L	38.8	Very low	38.8	Very low	137 Å²	137	125.6 Å²	125.6	72%	0.717	69%	0.694	S	S	*	*	H	α-helix	trans	-81.1	-21	-178.6	-98.1	130	0	0	0	113.7	S14	L10-S14 PolarHBondContact O-OG 3.46Å
11	L	42.7	Very low	38.7	Very low	131 Å²	131	127.4 Å²	127.4	69%	0.686	70%	0.697	S	S	*	*	H	α-helix	trans	-81.7	-23	178.6	-77.7	164.7	0	0	0	113.3	S14	L11-S14 WeakPolarHBondContact CA-OG 3.49Å; L11-S14 PolarHBondContact O-OG 3Å
12	L	40.8	Very low	39.2	Very low	142 Å²	142	120.5 Å²	120.5	74%	0.743	67%	0.669	S	S	*	*	H	α-helix	trans	-77.1	-23.7	176.7	-78.2	160.7	0	0	0	112.8
13	L	37.9	Very low	40.1	Very low	123 Å²	123	114.2 Å²	114.2	64%	0.644	65%	0.645	S	S	*	*	H	α-helix	trans	-85.1	-21.5	176.9	-75.6	160.6	0	0	0	113.1
14	S	39.7	Very low	41	Very low	66 Å²	66	110 Å²	110	46%	0.462	63%	0.625	S	S	.	*	H	α-helix	trans	-80.7	-23	175	43.7	0	0	0	0	113.9	L10 L11	L10-S14 PolarHBondContact O-OG 3.46Å; L11-S14 WeakPolarHBondContact CA-OG 3.49Å; L11-S14 PolarHBondContact O-OG 3Å
15	G	37.9	Very low	42.6	Very low	44 Å²	44	104 Å²	104	45%	0.454	60%	0.601	S	S	.	*	H	α-helix	trans	-77.4	-28.9	176.3	0	0	0	0	0	113.9
16	G	33.9	Very low	44.9	Very low	44 Å²	44	103.8 Å²	103.8	45%	0.454	60%	0.595	S	S	.	*	H	α-helix	trans	-79.3	-29.2	178.3	0	0	0	0	0	114.1
17	L	35.2	Very low	47.4	Very low	122 Å²	122	101 Å²	101	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-79	-21	-178.8	-79.5	162.7	0	0	0	113.7	L19	L17-L19 VanDerWaalsContact C-N 3.34Å
18	A	37.1	Very low	49.7	Very low	70 Å²	70	91.2 Å²	91.2	58%	0.579	54%	0.54	S	S	*	.	S	Bend	trans	-77.9	-18.2	177.4	0	0	0	0	0	113.5
19	L	37.2	Very low	52.3	Low	123 Å²	123	87.9 Å²	87.9	64%	0.644	51%	0.513	S	S	*	.	S	Bend	trans	-96	-10.4	-175.7	-92.4	147.5	0	0	0	114	L17	L17-L19 VanDerWaalsContact C-N 3.34Å
20	T	34.1	Very low	55.1	Low	104 Å²	104	84.4 Å²	84.4	64%	0.638	49%	0.491	S	S	*	.	S	Bend	trans	-98.9	-9.6	-179.8	54.2	0	0	0	0	113.8
21	E	36.1	Very low	57.9	Low	163 Å²	163	78.8 Å²	78.8	76%	0.762	46%	0.46	S	S	*	.	S	Bend	trans	-83	-8.6	-178.5	-109	-178.6	174.9	0	0	114
22	T	43.9	Very low	60.6	Low	99 Å²	99	76.6 Å²	76.6	61%	0.607	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	3.6	-167.8	54	0	0	0	0	116.2
23	W	52	Low	63.4	Low	116 Å²	116	70.2 Å²	70.2	44%	0.439	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	26.2	176.7	-59.1	102.7	0	0	0	113	C25 H287 E288	W23-C25 PolarHBondContact O-N 2.91Å; W23-H287 WeakPolarHBondContact CH2-O 3.32Å; W23-H287 VanDerWaalsContact CZ3-C 3.46Å; W23-E288 HydrophobicContact CE3-CB 3.71Å; W23-E288 HydrophobicContact CE3-CG 3.53Å; W23-E288 HydrophobicContact CH2-CB 4.24Å; W23-E288 HydrophobicContact CZ3-CB 3.26Å; W23-E288 HydrophobicContact CZ3-CG 3.68Å
24	A	54.1	Low	66.3	Low	56 Å²	56	66.3 Å²	66.3	46%	0.463	39%	0.393	S	S	.	.	S	Bend	trans	-79.7	99.2	169.4	0	0	0	0	0	106.9	S26 P129	A24-S26 PolarHBondContact O-N 3.09Å; A24-P129 HydrophobicContact CB-CB 3.92Å; A24-P129 HydrophobicContact CB-CG 3.22Å
25	C	73.8	Confident	69.1	Low	56 Å²	56	63.2 Å²	63.2	38%	0.378	37%	0.372	S	S	.	.			trans	-55	106.5	-173.3	-54	0	0	0	0	110.9	W23 E288	W23-C25 PolarHBondContact O-N 2.91Å; C25-E288 PolarHBondContact SG-OE1 2.6Å
26	S	91.4	Very high	72	Confident	73 Å²	73	63.6 Å²	63.6	51%	0.51	37%	0.365	S	S	.	.			trans	-87.8	147.5	165.6	57.6	0	0	0	0	109.2	A24 L127	A24-S26 PolarHBondContact O-N 3.09Å; S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 3.31Å; S26-L127 VanDerWaalsContact CB-O 3.31Å; S26-L127 WeakPolarHBondContact CB-O 3.34Å
27	H	95.6	Very high	75	Confident	30 Å²	30	62.3 Å²	62.3	14%	0.139	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.8	176.8	-67.6	-76.2	0	0	0	110.7	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.31Å; H27-D53 IonicContact CE1-OD2 2.84Å; H27-D53 IonicContact CG-OD2 3.06Å; H27-D53 IonicContact ND1-OD1 3.41Å; H27-D53 IonicContact ND1-OD2 3.67Å; H27-D53 PolarHBondContact ND1-OD2 3.24Å; H27-D126 CarbonylContact O-C 3.57Å; H27-D126 WeakPolarHBondContact O-CA 3.31Å; H27-L127 PolarHBondContact N-O 2.83Å; H27-L127 VanDerWaalsContact N-O 3.1Å; H27-L127 PolarHBondContact O-N 3.07Å; H27-L192 HydrophobicContact CB-CD1 4.46Å; H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4.01Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å
28	S	97.5	Very high	77.9	Confident	23 Å²	23	60 Å²	60	16%	0.161	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.8	-179.3	66.3	0	0	0	0	111.6	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.56Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.36Å; S28-D53 PolarHBondContact N-OD1 2.9Å; S28-D53 PolarHBondContact O-N 2.92Å; S28-D53 PolarHBondContact OG-OD1 3.22Å; S28-C125 WeakPolarHBondContact CA-O 3.31Å; S28-D126 WeakPolarHBondContact CB-OD1 3.44Å
29	M	98.6	Very high	80.6	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.7	167.5	-175.7	171.3	61.5	0	0	108.3	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.28Å; M29-Y31 HydrophobicContact CG-CE2 4.07Å; M29-Y31 HydrophobicContact SD-CE2 4.06Å; M29-Y51 CarbonylContact C-O 3.55Å; M29-Y51 WeakPolarHBondContact CA-O 3.37Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; M29-F57 HydrophobicContact CG-CE1 4.49Å; M29-F57 HydrophobicContact SD-CZ 4.38Å; M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.37Å; M29-C125 PolarHBondContact N-O 2.89Å; M29-C125 PolarHBondContact O-N 2.83Å; M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 WeakPolarHBondContact CE-O 3.45Å; M29-C188 WeakPolarHBondContact CE-SG 3.23Å; M29-W191 HydrophobicContact CE-CB 4.07Å; M29-W191 HydrophobicContact SD-CB 4.45Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.96Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.42Å; M29-Y195 HydrophobicContact SD-CD2 3.7Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å
30	R	98.5	Very high	83.2	Confident	50 Å²	50	57.5 Å²	57.5	19%	0.189	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.3	-175.6	-56.4	-62.5	-178.5	74.3	1.4	110.8	F32 G50 Y51 S123 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.46Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.92Å; R30-G50 CarbonylContact O-C 3.54Å; R30-G50 WeakPolarHBondContact O-CA 3.44Å; R30-Y51 PolarHBondContact N-O 3.02Å; R30-Y51 PolarHBondContact O-N 3.29Å; R30-S123 WeakPolarHBondContact CA-O 3.33Å; R30-D126 IonicContact CZ-OD1 2.98Å; R30-D126 IonicContact NE-OD1 3.65Å; R30-D126 PolarHBondContact NE-OD1 2.64Å; R30-D126 VanDerWaalsContact NE-OD1 3.1Å; R30-D126 IonicContact NH2-OD1 3.04Å; R30-D126 PolarHBondContact NH2-OD1 3.11Å; R30-D126 IonicContact NH2-OD2 3.64Å; R30-D126 PolarHBondContact NH2-OD2 3.08Å; R30-Y137 PolarHBondContact NH2-OH 3.18Å
31	Y	98.7	Very high	86	Confident	19 Å²	19	62.3 Å²	62.3	8%	0.075	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134	169.1	-70.2	-92.6	0	0	0	109.2	M29 V49 F57 V58 M122 S123	M29-Y31 HydrophobicContact CE-CE2 4.28Å; M29-Y31 HydrophobicContact CG-CE2 4.07Å; M29-Y31 HydrophobicContact SD-CE2 4.06Å; Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.47Å; Y31-F57 HydrophobicContact CE1-CZ 4.24Å; Y31-F57 AromaticContact CZ-CZ 3.87Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.23Å; Y31-V58 HydrophobicContact CE1-CG2 3.88Å; Y31-M122 WeakPolarHBondContact O-CA 3.13Å; Y31-S123 PolarHBondContact N-O 3Å; Y31-S123 PolarHBondContact O-N 3.1Å
32	F	98.8	Very high	88.7	Confident	84 Å²	84	57.4 Å²	57.4	37%	0.368	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	112.6	176.4	-56.7	-93	0	0	0	108.8	R30 S48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.46Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.92Å; F32-S48 WeakPolarHBondContact O-CA 3.43Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 2.97Å; F32-V49 PolarHBondContact O-N 2.88Å; F32-Y51 HydrophobicContact CD2-CD2 4.1Å; F32-Y51 HydrophobicContact CE2-CD2 4.09Å; F32-R121 WeakPolarHBondContact CA-O 3.46Å; F32-M122 HydrophobicContact CD1-CB 4.05Å; F32-M122 HydrophobicContact CD1-CG 3.72Å; F32-M122 HydrophobicContact CE1-CB 4.17Å; F32-M122 HydrophobicContact CE1-CG 3.43Å; F32-M122 VanDerWaalsContact CE1-CG 3.43Å; F32-M122 HydrophobicContact CZ-CG 4.09Å
33	D	98.8	Very high	91.2	Very high	9 Å²	9	57 Å²	57	5%	0.048	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.2	176.1	-60.8	-32.7	0	0	0	109	F46 I47 S48 Q120 R121	D33-F46 HydrophobicContact CB-CE2 3.85Å; D33-F46 HydrophobicContact CB-CZ 4.08Å; D33-I47 CarbonylContact C-O 3.55Å; D33-I47 WeakPolarHBondContact CA-O 3.26Å; D33-S48 WeakPolarHBondContact OD1-CB 3.25Å; D33-S48 PolarHBondContact OD1-OG 3.1Å; D33-Q120 CarbonylContact O-C 3.59Å; D33-Q120 VanDerWaalsContact O-CA 3.29Å; D33-Q120 WeakPolarHBondContact O-CA 3.42Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 3.42Å; D33-R121 PolarHBondContact O-N 2.89Å; D33-R121 IonicContact OD2-NH1 3.2Å
34	T	98.9	Very high	93.3	Very high	40 Å²	40	52.9 Å²	52.9	25%	0.245	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	119.9	175.5	-60.9	0	0	0	0	109.7	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4.01Å; T34-F46 WeakPolarHBondContact O-CA 3.07Å; T34-I47 PolarHBondContact N-O 3.03Å; T34-I47 PolarHBondContact O-N 2.81Å; T34-T118 HydrophobicContact CG2-CG2 4.07Å; T34-L119 WeakPolarHBondContact CA-O 3.34Å; T34-Q120 HydrophobicContact CG2-CG 4.15Å
35	A	98.8	Very high	95.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.6	174.4	0	0	0	0	0	110.2	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.53Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.35Å; A35-F46 HydrophobicContact CB-CD2 4.28Å; A35-D98 HydrophobicContact CB-CB 3.67Å; A35-L102 HydrophobicContact CB-CD1 3.88Å; A35-T118 WeakPolarHBondContact O-CA 3.27Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 3.12Å; A35-L119 PolarHBondContact O-N 3.19Å
36	V	98.6	Very high	96.6	Very high	52 Å²	52	52 Å²	52	32%	0.315	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.1	-179.2	-173	0	0	0	0	109.4	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4.01Å; V36-P44 CarbonylContact O-C 3.47Å; V36-P44 WeakPolarHBondContact O-CA 3.48Å; V36-P44 WeakPolarHBondContact O-CB 3.37Å; V36-R45 PolarHBondContact N-O 3.03Å; V36-R45 PolarHBondContact O-N 3.14Å; V36-H117 WeakPolarHBondContact CA-O 3.34Å; V36-T118 HydrophobicContact CG2-CG2 4.19Å
37	S	98.1	Very high	97	Very high	18 Å²	18	51 Å²	51	13%	0.126	28%	0.277	C	S	.	.			trans	-68.4	148.3	173.5	72.6	0	0	0	0	110.5	S116 H117	S37-S116 PolarHBondContact O-OG 3.1Å; S37-H117 PolarHBondContact N-O 3.34Å; S37-H117 PolarHBondContact OG-N 3.01Å; S37-H117 PolarHBondContact OG-O 3.34Å
38	R	96.3	Very high	97.1	Very high	72 Å²	72	49.6 Å²	49.6	27%	0.272	27%	0.271	S	S	.	.			trans	-141.4	73.8	-179.9	53.6	174.4	176.5	-161.1	-10.4	111	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 2.83Å; R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.41Å; R38-R41 HydrophobicContact CG-CB 4.13Å; R38-R41 PolarHBondContact NE-O 2.86Å; R38-R41 VanDerWaalsContact NE-O 3.17Å; R38-R41 PolarHBondContact O-N 2.91Å; R38-E43 VanDerWaalsContact CZ-O 3.3Å; R38-E43 PolarHBondContact NE-O 2.9Å; R38-E43 PolarHBondContact NH2-O 2.82Å; R38-D63 IonicContact CZ-OD1 3.48Å; R38-D63 IonicContact CZ-OD2 3.58Å; R38-D63 IonicContact NH1-OD1 3.38Å; R38-D63 PolarHBondContact NH1-OD1 2.93Å; R38-D63 IonicContact NH1-OD2 2.73Å; R38-D63 PolarHBondContact NH1-OD2 2.91Å; R38-D63 IonicContact NH2-OD1 2.76Å; R38-D63 PolarHBondContact NH2-OD1 2.8Å; R38-D63 IonicContact NH2-OD2 3.64Å
39	P	93.3	Very high	97.2	Very high	52 Å²	52	50 Å²	50	34%	0.338	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	132.4	-178.2	-27.1	35.3	0	0	0	112.1	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.41Å; P39-E113 VanDerWaalsContact CB-O 3.29Å; P39-E113 WeakPolarHBondContact CB-O 3.3Å; P39-E113 WeakPolarHBondContact CG-O 3.31Å; P39-G115 VanDerWaalsContact CG-O 3.24Å; P39-G115 WeakPolarHBondContact CG-O 3.28Å
40	G	91.9	Very high	97.2	Very high	89 Å²	89	49.9 Å²	49.9	92%	0.918	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-0	-177	0	0	0	0	0	116.2	R38	R38-G40 PolarHBondContact O-N 2.83Å
41	R	93.6	Very high	97.2	Very high	206 Å²	206	51.1 Å²	51.1	78%	0.777	28%	0.277	S	S	*	.	S	Bend	trans	-123.6	21.8	-179.3	-57.7	-174.6	-178.1	-171.6	0.9	113.7	R38 P39	R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.41Å; R38-R41 HydrophobicContact CG-CB 4.13Å; R38-R41 PolarHBondContact NE-O 2.86Å; R38-R41 VanDerWaalsContact NE-O 3.17Å; R38-R41 PolarHBondContact O-N 2.91Å; P39-R41 PolarHBondContact O-N 3.41Å
42	G	92.1	Very high	97.2	Very high	59 Å²	59	50.2 Å²	50.2	61%	0.608	27%	0.273	S	S	*	.	S	Bend	trans	97.9	-159.8	177.8	0	0	0	0	0	113.7
43	E	95	Very high	97	Very high	92 Å²	92	47.6 Å²	47.6	43%	0.43	26%	0.263	S	S	.	.	S	Bend	trans	-70.4	154.6	-178.3	-63.8	-58.5	165.9	0	0	112.5	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.3Å; R38-E43 PolarHBondContact NE-O 2.9Å; R38-E43 PolarHBondContact NH2-O 2.82Å; E43-R45 PolarHBondContact O-N 2.8Å; E43-R99 IonicContact OE1-CZ 3.34Å; E43-R99 IonicContact OE1-NE 3.67Å; E43-R99 IonicContact OE1-NH1 2.81Å; E43-R99 PolarHBondContact OE1-NH1 3.44Å; E43-R99 IonicContact OE1-NH2 3.86Å; E43-R99 PolarHBondContact OE1-NH2 2.98Å; E43-R99 VanDerWaalsContact OE2-CD 3.3Å; E43-R99 WeakPolarHBondContact OE2-CD 3.39Å; E43-R99 IonicContact OE2-CZ 2.63Å; E43-R99 IonicContact OE2-NE 3.85Å; E43-R99 PolarHBondContact OE2-NE 2.92Å; E43-R99 IonicContact OE2-NH1 3.1Å; E43-R99 PolarHBondContact OE2-NH1 3.38Å; E43-R99 IonicContact OE2-NH2 3.89Å; E43-R99 PolarHBondContact OE2-NH2 3.41Å
44	P	97.6	Very high	96.9	Very high	28 Å²	28	50.2 Å²	50.2	18%	0.182	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-51.4	134	172.5	-25.7	34.8	0	0	0	111.6	V36 R99 L102	V36-P44 CarbonylContact O-C 3.47Å; V36-P44 WeakPolarHBondContact O-CA 3.48Å; V36-P44 WeakPolarHBondContact O-CB 3.37Å; P44-R99 HydrophobicContact CG-CB 4.38Å; P44-R99 HydrophobicContact CG-CG 4.18Å; P44-L102 HydrophobicContact CB-CD1 3.68Å; P44-L102 HydrophobicContact CG-CD1 3.85Å
45	R	98.4	Very high	96.8	Very high	92 Å²	92	49.7 Å²	49.7	35%	0.347	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	129.9	173.4	-176.8	-178.4	-177	-176.7	-1.5	108.3	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.53Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.35Å; V36-R45 PolarHBondContact N-O 3.03Å; V36-R45 PolarHBondContact O-N 3.14Å; E43-R45 PolarHBondContact O-N 2.8Å; R45-I47 HydrophobicContact CG-CG1 4.36Å; R45-D61 IonicContact CZ-OD1 2.63Å; R45-D61 IonicContact CZ-OD2 2.74Å; R45-D61 IonicContact NE-OD1 3.27Å; R45-D61 PolarHBondContact NE-OD1 2.66Å; R45-D61 IonicContact NE-OD2 3.82Å; R45-D61 IonicContact NH2-OD1 3.06Å; R45-D61 PolarHBondContact NH2-OD1 3.31Å; R45-D61 IonicContact NH2-OD2 2.84Å; R45-D61 PolarHBondContact NH2-OD2 3.23Å; R45-S62 WeakPolarHBondContact CA-OG 3.44Å; R45-D63 VanDerWaalsContact CD-OD2 3.27Å; R45-D63 WeakPolarHBondContact CD-OD2 3.34Å; R45-D63 HydrophobicContact CG-CB 4.35Å; R45-D63 IonicContact NE-OD2 2.87Å
46	F	98.8	Very high	96.7	Very high	3 Å²	3	52 Å²	52	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.1	176.9	175.6	-92.2	0	0	0	110	D33 T34 A35 F60 S62 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.85Å; D33-F46 HydrophobicContact CB-CZ 4.08Å; T34-F46 WeakPolarHBondContact O-CA 3.07Å; A35-F46 HydrophobicContact CB-CD2 4.28Å; F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.88Å; F46-F60 HydrophobicContact CE1-CD1 3.88Å; F46-F60 HydrophobicContact CE1-CE1 4.28Å; F46-S62 PolarHBondContact N-OG 3.24Å; F46-S62 PolarHBondContact O-N 3.13Å; F46-S62 PolarHBondContact O-OG 2.98Å; F46-Q94 HydrophobicContact CE2-CB 4.24Å; F46-Q94 HydrophobicContact CE2-CG 3.75Å; F46-Q94 HydrophobicContact CZ-CB 3.91Å; F46-Q94 HydrophobicContact CZ-CG 3.75Å; F46-A95 HydrophobicContact CB-CB 3.66Å; F46-A95 HydrophobicContact CD1-CB 3.73Å; F46-A95 HydrophobicContact CD2-CB 4.09Å; F46-A95 HydrophobicContact CE1-CB 4.4Å; F46-A95 HydrophobicContact CG-CB 3.55Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.43Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.43Å
47	I	98.8	Very high	96.7	Very high	51 Å²	51	49.5 Å²	49.5	26%	0.262	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.9	175	-57.4	174.6	0	0	0	107.5	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.55Å; D33-I47 WeakPolarHBondContact CA-O 3.26Å; T34-I47 PolarHBondContact N-O 3.03Å; T34-I47 PolarHBondContact O-N 2.81Å; R45-I47 HydrophobicContact CG-CG1 4.36Å; I47-V49 HydrophobicContact CG2-CG1 4.44Å; I47-F60 WeakPolarHBondContact CA-O 3.36Å
48	S	98.8	Very high	96.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.6	171	-174.1	0	0	0	0	109.5	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.43Å; D33-S48 WeakPolarHBondContact OD1-CB 3.25Å; D33-S48 PolarHBondContact OD1-OG 3.1Å; S48-R59 CarbonylContact O-C 3.58Å; S48-R59 WeakPolarHBondContact O-CA 3.04Å; S48-F60 PolarHBondContact N-O 3.44Å; S48-F60 PolarHBondContact O-N 2.79Å; S48-Y91 VanDerWaalsContact OG-CE1 3.27Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.36Å
49	V	98.8	Very high	96.8	Very high	31 Å²	31	49.1 Å²	49.1	19%	0.188	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.5	173.5	-65.5	0	0	0	0	110.2	Y31 F32 I47 Y51 V58 R59	Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.47Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 2.97Å; F32-V49 PolarHBondContact O-N 2.88Å; I47-V49 HydrophobicContact CG2-CG1 4.44Å; V49-Y51 HydrophobicContact CB-CE2 4.16Å; V49-Y51 HydrophobicContact CG2-CD2 4.47Å; V49-Y51 HydrophobicContact CG2-CE2 3.89Å; V49-V58 WeakPolarHBondContact CA-O 3.37Å; V49-R59 HydrophobicContact CG1-CG 4.3Å
50	G	98.6	Very high	97.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.5	178.1	0	0	0	0	0	111.5	R30 H56 F57 V58	R30-G50 CarbonylContact O-C 3.54Å; R30-G50 WeakPolarHBondContact O-CA 3.44Å; G50-H56 PolarHBondContact O-CD2 3.35Å; G50-H56 VanDerWaalsContact O-CD2 3.3Å; G50-F57 WeakPolarHBondContact O-CD1 3.18Å; G50-F57 PolarHBondContact O-N 2.93Å; G50-V58 PolarHBondContact N-O 3.4Å; G50-V58 PolarHBondContact O-N 3.38Å
51	Y	98.6	Very high	97.4	Very high	75 Å²	75	43.3 Å²	43.3	29%	0.294	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.9	177.7	-74.6	-103	0	0	0	110.4	M29 R30 F32 V49 T55 H56	M29-Y51 CarbonylContact C-O 3.55Å; M29-Y51 WeakPolarHBondContact CA-O 3.37Å; R30-Y51 PolarHBondContact N-O 3.02Å; R30-Y51 PolarHBondContact O-N 3.29Å; F32-Y51 HydrophobicContact CD2-CD2 4.1Å; F32-Y51 HydrophobicContact CE2-CD2 4.09Å; V49-Y51 HydrophobicContact CB-CE2 4.16Å; V49-Y51 HydrophobicContact CG2-CD2 4.47Å; V49-Y51 HydrophobicContact CG2-CE2 3.89Å; Y51-T55 WeakPolarHBondContact CA-O 3.32Å; Y51-T55 VanDerWaalsContact CD1-C 3.5Å; Y51-H56 HydrophobicContact CD1-CB 4.06Å; Y51-H56 VanDerWaalsContact CD1-N 3.34Å; Y51-H56 HydrophobicContact CE1-CB 3.49Å; Y51-H56 VanDerWaalsContact CE1-CB 3.49Å; Y51-H56 HydrophobicContact CE2-CB 4.28Å; Y51-H56 AromaticContact CE2-CD2 3.82Å; Y51-H56 AromaticContact CZ-CD2 3.97Å; Y51-H56 AromaticContact CZ-CG 3.86Å
52	V	98.3	Very high	97.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.4	156.3	176.9	0	0	0	0	105.9	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.56Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.36Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; V52-D54 PolarHBondContact O-N 3.43Å; V52-T55 PolarHBondContact N-O 2.81Å; V52-T55 WeakPolarHBondContact O-CA 3.49Å; V52-T55 WeakPolarHBondContact O-CB 3.46Å; V52-T55 PolarHBondContact O-N 2.98Å; V52-F57 HydrophobicContact CG2-CD1 4.03Å; V52-F57 HydrophobicContact CG2-CE1 4.01Å; V52-W75 HydrophobicContact CB-CH2 4.42Å; V52-W75 HydrophobicContact CB-CZ2 4.47Å; V52-W75 HydrophobicContact CG2-CH2 3.87Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.27Å; V52-Y195 HydrophobicContact CG2-CD2 3.92Å; V52-Y195 HydrophobicContact CG2-CG 4.43Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.07Å; V52-L203 HydrophobicContact CG1-CG 4.49Å
53	D	96.1	Very high	97.9	Very high	30 Å²	30	35.7 Å²	35.7	16%	0.16	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	-124.4	-167	-54.7	-41.5	0	0	0	110.5	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.31Å; H27-D53 IonicContact CE1-OD2 2.84Å; H27-D53 IonicContact CG-OD2 3.06Å; H27-D53 IonicContact ND1-OD1 3.41Å; H27-D53 IonicContact ND1-OD2 3.67Å; H27-D53 PolarHBondContact ND1-OD2 3.24Å; S28-D53 PolarHBondContact N-OD1 2.9Å; S28-D53 PolarHBondContact O-N 2.92Å; S28-D53 PolarHBondContact OG-OD1 3.22Å; D53-T55 VanDerWaalsContact C-N 3.33Å
54	D	95.9	Very high	98	Very high	63 Å²	63	32.7 Å²	32.7	34%	0.337	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	12	178.7	-64.1	-53.4	0	0	0	113.5	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.43Å; D54-Y233 HydrophobicContact CB-CE2 4.01Å; D54-P234 VanDerWaalsContact OD2-CB 3.3Å; D54-P234 WeakPolarHBondContact OD2-CB 3.38Å; D54-A235 HydrophobicContact CB-CB 4.34Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.4Å; D54-A235 PolarHBondContact OD2-N 3.28Å; D54-F265 HydrophobicContact CB-CE2 3.78Å; D54-F265 HydrophobicContact CB-CZ 3.73Å
55	T	96.9	Very high	98	Very high	29 Å²	29	37 Å²	37	18%	0.178	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.2	-176.1	-59.3	0	0	0	0	112.5	Y51 V52 D53 F57 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.32Å; Y51-T55 VanDerWaalsContact CD1-C 3.5Å; V52-T55 PolarHBondContact N-O 2.81Å; V52-T55 WeakPolarHBondContact O-CA 3.49Å; V52-T55 WeakPolarHBondContact O-CB 3.46Å; V52-T55 PolarHBondContact O-N 2.98Å; D53-T55 VanDerWaalsContact C-N 3.33Å; T55-F57 PolarHBondContact O-N 3.19Å; T55-L203 HydrophobicContact CG2-CD2 4.02Å; T55-Y233 PolarHBondContact OG1-OH 2.83Å
56	H	97	Very high	97.8	Very high	50 Å²	50	36 Å²	36	23%	0.231	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	121.5	174.3	-174.2	-153.3	0	0	0	110.7	G50 Y51 V58 R72	G50-H56 PolarHBondContact O-CD2 3.35Å; G50-H56 VanDerWaalsContact O-CD2 3.3Å; Y51-H56 HydrophobicContact CD1-CB 4.06Å; Y51-H56 VanDerWaalsContact CD1-N 3.34Å; Y51-H56 HydrophobicContact CE1-CB 3.49Å; Y51-H56 VanDerWaalsContact CE1-CB 3.49Å; Y51-H56 HydrophobicContact CE2-CB 4.28Å; Y51-H56 AromaticContact CE2-CD2 3.82Å; Y51-H56 AromaticContact CZ-CD2 3.97Å; Y51-H56 AromaticContact CZ-CG 3.86Å; H56-V58 PolarHBondContact CD2-O 2.86Å; H56-V58 PolarHBondContact NE2-O 3.41Å; H56-R72 CarbonylContact O-C 3.56Å
57	F	98	Very high	97.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-23.3	-175.2	80.1	-84.3	0	0	0	115.1	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.49Å; M29-F57 HydrophobicContact SD-CZ 4.38Å; Y31-F57 HydrophobicContact CE1-CZ 4.24Å; Y31-F57 AromaticContact CZ-CZ 3.87Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.23Å; G50-F57 WeakPolarHBondContact O-CD1 3.18Å; G50-F57 PolarHBondContact O-N 2.93Å; V52-F57 HydrophobicContact CG2-CD1 4.03Å; V52-F57 HydrophobicContact CG2-CE1 4.01Å; T55-F57 PolarHBondContact O-N 3.19Å; F57-R72 PolarHBondContact O-N 3.15Å; F57-A73 HydrophobicContact CB-CB 3.97Å; F57-W75 HydrophobicContact CB-CH2 3.18Å; F57-W75 HydrophobicContact CB-CZ2 3.33Å; F57-W75 HydrophobicContact CB-CZ3 4.03Å; F57-W75 AromaticContact CD1-CH2 3.95Å; F57-W75 HydrophobicContact CD1-CH2 3.95Å; F57-W75 AromaticContact CD2-CH2 3.55Å; F57-W75 HydrophobicContact CD2-CH2 3.55Å; F57-W75 AromaticContact CD2-CZ3 3.82Å; F57-W75 HydrophobicContact CD2-CZ3 3.82Å; F57-W75 HydrophobicContact CE2-CH2 4.4Å; F57-W75 AromaticContact CG-CH2 3.31Å; F57-W75 HydrophobicContact CG-CH2 3.31Å; F57-W75 AromaticContact CG-CZ2 3.97Å; F57-W75 HydrophobicContact CG-CZ2 3.97Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; F57-V76 HydrophobicContact CB-CG1 4.45Å; F57-V76 HydrophobicContact CD2-CB 4.24Å; F57-V76 HydrophobicContact CD2-CG1 4.35Å; F57-V76 HydrophobicContact CD2-CG2 4.04Å; F57-V76 VanDerWaalsContact O-CG1 3.28Å; F57-V76 WeakPolarHBondContact O-CG1 3.36Å; F57-Y195 HydrophobicContact CE2-CD2 4.2Å; F57-Y195 AromaticContact CE2-CE2 3.61Å; F57-Y195 HydrophobicContact CE2-CE2 3.61Å; F57-Y195 AromaticContact CE2-CZ 3.81Å; F57-Y195 HydrophobicContact CZ-CD2 4.21Å; F57-Y195 AromaticContact CZ-CE2 3.68Å; F57-Y195 HydrophobicContact CZ-CE2 3.68Å
58	V	98.3	Very high	97.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.1	177.5	-74.9	0	0	0	0	112.6	Y31 V49 G50 H56 E70 V76 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 3.88Å; V49-V58 WeakPolarHBondContact CA-O 3.37Å; G50-V58 PolarHBondContact N-O 3.4Å; G50-V58 PolarHBondContact O-N 3.38Å; H56-V58 PolarHBondContact CD2-O 2.86Å; H56-V58 PolarHBondContact NE2-O 3.41Å; V58-E70 WeakPolarHBondContact CA-O 3.12Å; V58-V76 HydrophobicContact CG1-CG2 4.41Å; V58-W84 HydrophobicContact CG1-CH2 3.89Å; V58-W84 HydrophobicContact CG1-CZ3 3.87Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.39Å
59	R	98.4	Very high	97.7	Very high	81 Å²	81	42.6 Å²	42.6	31%	0.306	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.9	173	178.6	176.3	170.7	-179.8	-3.6	111.3	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.58Å; S48-R59 WeakPolarHBondContact O-CA 3.04Å; V49-R59 HydrophobicContact CG1-CG 4.3Å; R59-D61 IonicContact NH2-OD2 3.87Å; R59-D61 PolarHBondContact NH2-OD2 2.84Å; R59-E70 PolarHBondContact N-O 2.93Å; R59-E70 PolarHBondContact O-N 2.77Å; R59-R72 HydrophobicContact CB-CG 4.02Å
60	F	98.8	Very high	97.6	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.7	163.6	178.8	-85.9	0	0	0	109.7	F46 I47 S48 P67 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.88Å; F46-F60 HydrophobicContact CE1-CD1 3.88Å; F46-F60 HydrophobicContact CE1-CE1 4.28Å; I47-F60 WeakPolarHBondContact CA-O 3.36Å; S48-F60 PolarHBondContact N-O 3.44Å; S48-F60 PolarHBondContact O-N 2.79Å; F60-P67 HydrophobicContact CE2-CB 3.88Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; F60-Y91 HydrophobicContact CB-CD1 4.14Å; F60-Y91 HydrophobicContact CB-CD2 3.57Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.66Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.66Å; F60-Y91 HydrophobicContact CD2-CD2 3.66Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.79Å; F60-Y91 HydrophobicContact CG-CD2 3.79Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; F60-K92 HydrophobicContact CE2-CG 4.31Å; F60-K92 HydrophobicContact CZ-CG 4.04Å
61	D	98.7	Very high	97.6	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.08	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	119.5	176	-164.4	-25.9	0	0	0	109.5	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.63Å; R45-D61 IonicContact CZ-OD2 2.74Å; R45-D61 IonicContact NE-OD1 3.27Å; R45-D61 PolarHBondContact NE-OD1 2.66Å; R45-D61 IonicContact NE-OD2 3.82Å; R45-D61 IonicContact NH2-OD1 3.06Å; R45-D61 PolarHBondContact NH2-OD1 3.31Å; R45-D61 IonicContact NH2-OD2 2.84Å; R45-D61 PolarHBondContact NH2-OD2 3.23Å; R59-D61 IonicContact NH2-OD2 3.87Å; R59-D61 PolarHBondContact NH2-OD2 2.84Å; D61-D63 PolarHBondContact O-N 2.83Å; D61-D63 PolarHBondContact OD1-N 3.09Å; D61-D63 VanDerWaalsContact OD1-N 3.16Å; D61-A64 HydrophobicContact CB-CB 4.43Å; D61-A64 WeakPolarHBondContact O-CB 3.33Å; D61-A64 PolarHBondContact O-N 3.22Å
62	S	98.4	Very high	97.5	Very high	34 Å²	34	48.4 Å²	48.4	24%	0.238	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.1	-178.6	68.9	0	0	0	0	113.4	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.44Å; F46-S62 PolarHBondContact N-OG 3.24Å; F46-S62 PolarHBondContact O-N 3.13Å; F46-S62 PolarHBondContact O-OG 2.98Å; S62-P67 WeakPolarHBondContact O-CG 3.49Å
63	D	97.6	Very high	97.4	Very high	71 Å²	71	48.5 Å²	48.5	38%	0.38	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.8	-180	-79.6	4.8	0	0	0	112.8	R38 R45 D61	R38-D63 IonicContact CZ-OD1 3.48Å; R38-D63 IonicContact CZ-OD2 3.58Å; R38-D63 IonicContact NH1-OD1 3.38Å; R38-D63 PolarHBondContact NH1-OD1 2.93Å; R38-D63 IonicContact NH1-OD2 2.73Å; R38-D63 PolarHBondContact NH1-OD2 2.91Å; R38-D63 IonicContact NH2-OD1 2.76Å; R38-D63 PolarHBondContact NH2-OD1 2.8Å; R38-D63 IonicContact NH2-OD2 3.64Å; R45-D63 VanDerWaalsContact CD-OD2 3.27Å; R45-D63 WeakPolarHBondContact CD-OD2 3.34Å; R45-D63 HydrophobicContact CG-CB 4.35Å; R45-D63 IonicContact NE-OD2 2.87Å; D61-D63 PolarHBondContact O-N 2.83Å; D61-D63 PolarHBondContact OD1-N 3.09Å; D61-D63 VanDerWaalsContact OD1-N 3.16Å
64	A	97.3	Very high	97.4	Very high	30 Å²	30	52 Å²	52	25%	0.248	29%	0.291	C	S	.	.	S	Bend	trans	-61.5	150	172.8	0	0	0	0	0	110.9	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.43Å; D61-A64 WeakPolarHBondContact O-CB 3.33Å; D61-A64 PolarHBondContact O-N 3.22Å; A64-S66 PolarHBondContact O-N 2.95Å; A64-S66 VanDerWaalsContact O-N 3.16Å; A64-P67 WeakPolarHBondContact O-CD 2.97Å; A64-P67 VanDerWaalsContact O-CG 3.28Å; A64-P67 WeakPolarHBondContact O-CG 3.32Å
65	A	96.9	Very high	97.4	Very high	117 Å²	117	49.7 Å²	49.7	97%	0.967	28%	0.278	S	S	*	.	S	Bend	trans	-58.7	-31.4	179.8	0	0	0	0	0	112.9
66	S	96.1	Very high	97.5	Very high	73 Å²	73	48.3 Å²	48.3	51%	0.51	27%	0.269	S	S	.	.	S	Bend	trans	-134.9	87.5	172.4	-175.6	0	0	0	0	109	A64 R68	A64-S66 PolarHBondContact O-N 2.95Å; A64-S66 VanDerWaalsContact O-N 3.16Å; S66-R68 PolarHBondContact O-N 2.81Å
67	P	97.2	Very high	97.4	Very high	35 Å²	35	51.7 Å²	51.7	23%	0.227	29%	0.285	C	S	.	.			trans	-63.1	111.3	-174.4	-24.9	35.7	0	0	0	112	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.88Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; S62-P67 WeakPolarHBondContact O-CG 3.49Å; A64-P67 WeakPolarHBondContact O-CD 2.97Å; A64-P67 VanDerWaalsContact O-CG 3.28Å; A64-P67 WeakPolarHBondContact O-CG 3.32Å; P67-K92 VanDerWaalsContact O-CE 3.27Å; P67-K92 WeakPolarHBondContact O-CE 3.36Å; P67-K92 PolarHBondContact O-NZ 2.94Å
68	R	97.9	Very high	97.2	Very high	146 Å²	146	57.7 Å²	57.7	55%	0.551	31%	0.313	S	S	*	.			trans	-145.2	158.7	179.6	-64.1	-173.3	176.1	-163.2	-6.1	109.9	S66 T88	S66-R68 PolarHBondContact O-N 2.81Å; R68-T88 HydrophobicContact CB-CG2 4.37Å; R68-T88 HydrophobicContact CG-CG2 4.26Å
69	G	97.6	Very high	97.2	Very high	10 Å²	10	58.2 Å²	58.2	10%	0.103	32%	0.316	C	S	.	.			trans	-66.1	130.1	168.3	0	0	0	0	0	109.7	T88	G69-T88 PolarHBondContact N-OG1 3.05Å
70	E	97.8	Very high	97	Very high	68 Å²	68	56.1 Å²	56.1	32%	0.318	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.4	-178.6	-65	175.3	168.5	0	0	109.9	V58 R59 R72	V58-E70 WeakPolarHBondContact CA-O 3.12Å; R59-E70 PolarHBondContact N-O 2.93Å; R59-E70 PolarHBondContact O-N 2.77Å; E70-R72 IonicContact OE2-CZ 2.74Å; E70-R72 IonicContact OE2-NH2 3.86Å; E70-R72 PolarHBondContact OE2-NH2 3.04Å
71	P	97.9	Very high	97	Very high	47 Å²	47	60.7 Å²	60.7	31%	0.305	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	146	172.5	29.1	-33.8	0	0	0	110.9	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.76Å; P71-E77 HydrophobicContact CB-CG 3.68Å; P71-E77 HydrophobicContact CG-CG 3.91Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.78Å; P71-W84 HydrophobicContact CG-CH2 4.22Å; P71-W84 HydrophobicContact CG-CZ2 4.21Å
72	R	97.4	Very high	96.9	Very high	113 Å²	113	67.7 Å²	67.7	43%	0.426	38%	0.381	S	S	.	.			trans	-129.6	-1.6	176.2	-60.2	-67.2	174	178.8	-2	113	H56 F57 R59 E70	H56-R72 CarbonylContact O-C 3.56Å; F57-R72 PolarHBondContact O-N 3.15Å; R59-R72 HydrophobicContact CB-CG 4.02Å; E70-R72 IonicContact OE2-CZ 2.74Å; E70-R72 IonicContact OE2-NH2 3.86Å; E70-R72 PolarHBondContact OE2-NH2 3.04Å
73	A	96.1	Very high	96.9	Very high	3 Å²	3	66.5 Å²	66.5	3%	0.025	37%	0.372	C	S	.	.	S	Bend	trans	-135.6	143.2	172.4	0	0	0	0	0	110.8	F57 W75 V76	F57-A73 HydrophobicContact CB-CB 3.97Å; A73-W75 VanDerWaalsContact C-N 3.28Å; A73-W75 HydrophobicContact CB-CD2 4.16Å; A73-W75 HydrophobicContact CB-CG 4.37Å; A73-W75 HydrophobicContact CB-CZ2 3.99Å; A73-W75 PolarHBondContact O-N 3.43Å; A73-V76 WeakPolarHBondContact O-CG1 3.18Å; A73-V76 PolarHBondContact O-N 3.43Å
74	P	96.1	Very high	96.9	Very high	102 Å²	102	65 Å²	65	66%	0.662	36%	0.361	S	S	*	.	H	α-helix	trans	-57.8	-37.1	-177.4	-27.1	35.1	0	0	0	114.1	V76 E77	P74-V76 PolarHBondContact O-N 3.01Å; P74-E77 WeakPolarHBondContact O-CB 3.2Å; P74-E77 PolarHBondContact O-N 2.93Å; P74-E77 VanDerWaalsContact O-N 3.11Å
75	W	95.9	Very high	96.9	Very high	15 Å²	15	68.1 Å²	68.1	6%	0.057	37%	0.373	C	S	.	.	H	α-helix	trans	-70.2	-13.7	-176.2	53.7	-107.1	0	0	0	114.5	V52 F57 A73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CB-CH2 4.42Å; V52-W75 HydrophobicContact CB-CZ2 4.47Å; V52-W75 HydrophobicContact CG2-CH2 3.87Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; F57-W75 HydrophobicContact CB-CH2 3.18Å; F57-W75 HydrophobicContact CB-CZ2 3.33Å; F57-W75 HydrophobicContact CB-CZ3 4.03Å; F57-W75 AromaticContact CD1-CH2 3.95Å; F57-W75 HydrophobicContact CD1-CH2 3.95Å; F57-W75 AromaticContact CD2-CH2 3.55Å; F57-W75 HydrophobicContact CD2-CH2 3.55Å; F57-W75 AromaticContact CD2-CZ3 3.82Å; F57-W75 HydrophobicContact CD2-CZ3 3.82Å; F57-W75 HydrophobicContact CE2-CH2 4.4Å; F57-W75 AromaticContact CG-CH2 3.31Å; F57-W75 HydrophobicContact CG-CH2 3.31Å; F57-W75 AromaticContact CG-CZ2 3.97Å; F57-W75 HydrophobicContact CG-CZ2 3.97Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; A73-W75 VanDerWaalsContact C-N 3.28Å; A73-W75 HydrophobicContact CB-CD2 4.16Å; A73-W75 HydrophobicContact CB-CG 4.37Å; A73-W75 HydrophobicContact CB-CZ2 3.99Å; A73-W75 PolarHBondContact O-N 3.43Å; W75-Q78 WeakPolarHBondContact O-CG 3.45Å; W75-Q78 PolarHBondContact O-NE2 2.93Å; W75-Y195 HydrophobicContact CE3-CD1 4.24Å; W75-Y195 HydrophobicContact CE3-CG 4.46Å; W75-Y195 HydrophobicContact CH2-CD2 4.48Å; W75-Y195 HydrophobicContact CH2-CG 4.11Å; W75-Y195 AromaticContact CZ3-CD1 3.58Å; W75-Y195 HydrophobicContact CZ3-CD1 3.58Å; W75-Y195 HydrophobicContact CZ3-CD2 4.26Å; W75-Y195 HydrophobicContact CZ3-CE1 4.31Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; W75-N198 HydrophobicContact CB-CB 4.41Å; W75-T202 VanDerWaalsContact CD1-OG1 3.24Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.41Å; W75-L203 HydrophobicContact CZ2-CD1 3.87Å; W75-L203 HydrophobicContact CZ2-CD2 4.15Å; W75-L203 HydrophobicContact CZ2-CG 4.44Å
76	V	97.1	Very high	96.9	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-94.7	-17.2	172.5	71.7	0	0	0	0	112.1	F57 V58 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.45Å; F57-V76 HydrophobicContact CD2-CB 4.24Å; F57-V76 HydrophobicContact CD2-CG1 4.35Å; F57-V76 HydrophobicContact CD2-CG2 4.04Å; F57-V76 VanDerWaalsContact O-CG1 3.28Å; F57-V76 WeakPolarHBondContact O-CG1 3.36Å; V58-V76 HydrophobicContact CG1-CG2 4.41Å; P71-V76 HydrophobicContact CB-CG1 3.76Å; A73-V76 WeakPolarHBondContact O-CG1 3.18Å; A73-V76 PolarHBondContact O-N 3.43Å; P74-V76 PolarHBondContact O-N 3.01Å; V76-Q78 PolarHBondContact O-N 2.99Å; V76-E79 HydrophobicContact CG2-CG 3.96Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.41Å; V76-E79 WeakPolarHBondContact O-CG 3.47Å; V76-E79 PolarHBondContact O-N 2.04Å; V76-Y83 HydrophobicContact CG2-CE1 4.1Å; V76-W84 HydrophobicContact CG1-CH2 4.11Å; V76-W84 HydrophobicContact CG1-CZ2 4.35Å; V76-W84 HydrophobicContact CG2-CH2 3.94Å; V76-W84 HydrophobicContact CG2-CZ2 4.01Å; V76-W84 WeakPolarHBondContact O-CZ2 3.12Å; V76-Y195 HydrophobicContact CG2-CE1 4.45Å
77	E	95.5	Very high	97	Very high	122 Å²	122	64.3 Å²	64.3	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-26.8	179.8	-66	-178.9	-176.3	0	0	112.8	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.68Å; P71-E77 HydrophobicContact CG-CG 3.91Å; P74-E77 WeakPolarHBondContact O-CB 3.2Å; P74-E77 PolarHBondContact O-N 2.93Å; P74-E77 VanDerWaalsContact O-N 3.11Å; E77-E79 PolarHBondContact O-N 3.01Å
78	Q	94.8	Very high	97.1	Very high	125 Å²	125	63 Å²	63	58%	0.584	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.4	175.8	66.9	-179.3	11.8	0	0	114.1	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.45Å; W75-Q78 PolarHBondContact O-NE2 2.93Å; V76-Q78 PolarHBondContact O-N 2.99Å; Q78-N198 VanDerWaalsContact NE2-CB 3.26Å; Q78-N198 PolarHBondContact NE2-ND2 2.04Å; Q78-N198 PolarHBondContact NE2-OD1 2.74Å
79	E	96.7	Very high	97.1	Very high	12 Å²	12	61 Å²	61	6%	0.056	31%	0.311	C	S	.	.	S	Bend	trans	-65.5	136	175.2	-67.1	-62.1	160	0	0	111.1	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.96Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.41Å; V76-E79 WeakPolarHBondContact O-CG 3.47Å; V76-E79 PolarHBondContact O-N 2.04Å; E77-E79 PolarHBondContact O-N 3.01Å; E79-Y83 HydrophobicContact CB-CD1 3.5Å; E79-Y83 VanDerWaalsContact CB-CD1 3.5Å; E79-Y83 HydrophobicContact CB-CD2 4.48Å; E79-Y83 HydrophobicContact CB-CE1 4.1Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.04Å; E79-Y83 HydrophobicContact CG-CD2 4.42Å; E79-Y83 HydrophobicContact CG-CE1 4.24Å; E79-Y83 HydrophobicContact CG-CG 4.15Å; E79-W84 PolarHBondContact O-NE1 3.5Å; E79-R194 IonicContact OE1-CZ 2.82Å; E79-R194 IonicContact OE1-NE 3.72Å; E79-R194 PolarHBondContact OE1-NE 2.85Å; E79-R194 IonicContact OE1-NH2 2.76Å; E79-R194 PolarHBondContact OE1-NH2 3.02Å; E79-R194 IonicContact OE2-CZ 3.32Å; E79-R194 IonicContact OE2-NE 3.68Å; E79-R194 IonicContact OE2-NH2 3.38Å; E79-R194 PolarHBondContact OE2-NH2 2.98Å; E79-N198 PolarHBondContact OE1-ND2 2.88Å
80	G	96	Very high	97.1	Very high	36 Å²	36	63.9 Å²	63.9	37%	0.371	32%	0.321	S	S	.	.			trans	-69.8	168.7	-174.3	0	0	0	0	0	114.2	E82 Y83 W84	G80-E82 PolarHBondContact O-N 2.82Å; G80-Y83 WeakPolarHBondContact O-CB 3.49Å; G80-Y83 PolarHBondContact O-N 2.84Å; G80-W84 PolarHBondContact O-N 3.1Å
81	P	97	Very high	97.1	Very high	100 Å²	100	61.2 Å²	61.2	65%	0.649	31%	0.308	S	S	*	.	H	α-helix	trans	-57.7	-34.5	-178.6	22.8	-33.7	0	0	0	113.3	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 2.83Å; P81-W84 PolarHBondContact O-N 2.88Å; P81-D85 WeakPolarHBondContact O-CB 3.3Å; P81-D85 PolarHBondContact O-N 2.91Å
82	E	97.4	Very high	97.1	Very high	163 Å²	163	62.7 Å²	62.7	76%	0.762	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-34.8	177.6	-63.3	-177.9	178.2	0	0	113	G80 R86	G80-E82 PolarHBondContact O-N 2.82Å; E82-R86 VanDerWaalsContact O-CB 3.23Å; E82-R86 WeakPolarHBondContact O-CB 3.35Å; E82-R86 PolarHBondContact O-N 2.67Å
83	Y	97.4	Very high	97.2	Very high	8 Å²	8	64.7 Å²	64.7	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-52.8	174.1	168.3	-92.6	0	0	0	109.8	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.1Å; E79-Y83 HydrophobicContact CB-CD1 3.5Å; E79-Y83 VanDerWaalsContact CB-CD1 3.5Å; E79-Y83 HydrophobicContact CB-CD2 4.48Å; E79-Y83 HydrophobicContact CB-CE1 4.1Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.04Å; E79-Y83 HydrophobicContact CG-CD2 4.42Å; E79-Y83 HydrophobicContact CG-CE1 4.24Å; E79-Y83 HydrophobicContact CG-CG 4.15Å; G80-Y83 WeakPolarHBondContact O-CB 3.49Å; G80-Y83 PolarHBondContact O-N 2.84Å; P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 2.83Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.9Å; Y83-R86 PolarHBondContact O-N 2.86Å; Y83-E87 HydrophobicContact CD1-CG 4.36Å; Y83-E87 HydrophobicContact CD2-CG 4.09Å; Y83-E87 HydrophobicContact CE1-CG 3.98Å; Y83-E87 HydrophobicContact CE2-CG 3.66Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.5Å; Y83-E87 PolarHBondContact O-N 3.39Å; Y83-W191 AromaticContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CH2 3.5Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CZ2 4.23Å; Y83-W191 AromaticContact CD2-CZ3 3.67Å; Y83-W191 HydrophobicContact CD2-CZ3 3.67Å; Y83-W191 HydrophobicContact CE2-CE3 4.15Å; Y83-W191 AromaticContact CE2-CH2 3.9Å; Y83-W191 HydrophobicContact CE2-CH2 3.9Å; Y83-W191 AromaticContact CE2-CZ3 3.66Å; Y83-W191 HydrophobicContact CE2-CZ3 3.66Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.47Å; Y83-Y195 PolarHBondContact OH-OH 3.31Å
84	W	98	Very high	97.3	Very high	40 Å²	40	67 Å²	67	15%	0.152	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-38.7	-177.7	-66.9	111.8	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.89Å; V58-W84 HydrophobicContact CG1-CZ3 3.87Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.78Å; P71-W84 HydrophobicContact CG-CH2 4.22Å; P71-W84 HydrophobicContact CG-CZ2 4.21Å; V76-W84 HydrophobicContact CG1-CH2 4.11Å; V76-W84 HydrophobicContact CG1-CZ2 4.35Å; V76-W84 HydrophobicContact CG2-CH2 3.94Å; V76-W84 HydrophobicContact CG2-CZ2 4.01Å; V76-W84 WeakPolarHBondContact O-CZ2 3.12Å; E79-W84 PolarHBondContact O-NE1 3.5Å; G80-W84 PolarHBondContact O-N 3.1Å; P81-W84 PolarHBondContact O-N 2.88Å; W84-T88 WeakPolarHBondContact O-CB 3.26Å; W84-T88 PolarHBondContact O-N 2.95Å; W84-T88 PolarHBondContact O-OG1 3.4Å
85	D	98	Very high	97.4	Very high	95 Å²	95	63.2 Å²	63.2	51%	0.508	31%	0.305	S	S	.	.	H	α-helix	trans	-64.7	-46.4	174.6	-77	-22.5	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.3Å; P81-D85 PolarHBondContact O-N 2.91Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.9Å; D85-T88 PolarHBondContact O-N 2.7Å; D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.43Å; D85-Q89 PolarHBondContact O-N 3.47Å
86	R	97.5	Very high	97.5	Very high	101 Å²	101	69.1 Å²	69.1	38%	0.381	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-47.4	178.4	-176.5	-178.6	64.7	-137.8	-6.2	112.2	E82 Y83 Q89 K90	E82-R86 VanDerWaalsContact O-CB 3.23Å; E82-R86 WeakPolarHBondContact O-CB 3.35Å; E82-R86 PolarHBondContact O-N 2.67Å; Y83-R86 PolarHBondContact O-N 2.86Å; R86-Q89 PolarHBondContact O-N 3.17Å; R86-K90 WeakPolarHBondContact O-CG 3.5Å; R86-K90 PolarHBondContact O-N 3.08Å
87	E	97.6	Very high	97.5	Very high	10 Å²	10	71.2 Å²	71.2	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-42	178.7	-64.9	-43.9	117.5	0	0	110.9	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.36Å; Y83-E87 HydrophobicContact CD2-CG 4.09Å; Y83-E87 HydrophobicContact CE1-CG 3.98Å; Y83-E87 HydrophobicContact CE2-CG 3.66Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.5Å; Y83-E87 PolarHBondContact O-N 3.39Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 3.29Å; E87-K90 WeakPolarHBondContact O-CB 3.31Å; E87-K90 PolarHBondContact O-N 2.9Å; E87-K90 WeakPolarHBondContact OE1-CE 3.32Å; E87-K90 IonicContact OE1-NZ 3.1Å; E87-K90 PolarHBondContact OE1-NZ 3.04Å; E87-K90 WeakPolarHBondContact OE2-CD 3.48Å; E87-K90 IonicContact OE2-NZ 3.33Å; E87-K90 PolarHBondContact OE2-NZ 3.46Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.37Å; E87-Y91 PolarHBondContact O-N 3.36Å
88	T	98.4	Very high	97.6	Very high	7 Å²	7	65.7 Å²	65.7	4%	0.043	33%	0.325	C	S	.	.	H	α-helix	trans	-56.3	-43.7	173.2	-64.5	0	0	0	0	112.1	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.37Å; R68-T88 HydrophobicContact CG-CG2 4.26Å; G69-T88 PolarHBondContact N-OG1 3.05Å; W84-T88 WeakPolarHBondContact O-CB 3.26Å; W84-T88 PolarHBondContact O-N 2.95Å; W84-T88 PolarHBondContact O-OG1 3.4Å; D85-T88 PolarHBondContact O-N 2.7Å; T88-Y91 PolarHBondContact O-N 2.96Å; T88-K92 HydrophobicContact CG2-CD 4.2Å; T88-K92 WeakPolarHBondContact O-CG 3.33Å; T88-K92 PolarHBondContact O-N 3.42Å
89	Q	98.3	Very high	97.8	Very high	105 Å²	105	64.3 Å²	64.3	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-69.3	-32.2	177.2	-67.7	-58	-28	0	0	112.8	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.43Å; D85-Q89 PolarHBondContact O-N 3.47Å; R86-Q89 PolarHBondContact O-N 3.17Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 3.29Å; Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.33Å; Q89-R93 PolarHBondContact O-N 2.91Å; Q89-R93 VanDerWaalsContact O-N 3.07Å; Q89-R93 PolarHBondContact O-NE 2.84Å
90	K	97.4	Very high	97.8	Very high	69 Å²	69	67.3 Å²	67.3	30%	0.3	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-49.5	171.7	-72.9	172.6	178.1	173.5	0	110.9	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.5Å; R86-K90 PolarHBondContact O-N 3.08Å; E87-K90 WeakPolarHBondContact O-CB 3.31Å; E87-K90 PolarHBondContact O-N 2.9Å; E87-K90 WeakPolarHBondContact OE1-CE 3.32Å; E87-K90 IonicContact OE1-NZ 3.1Å; E87-K90 PolarHBondContact OE1-NZ 3.04Å; E87-K90 WeakPolarHBondContact OE2-CD 3.48Å; E87-K90 IonicContact OE2-NZ 3.33Å; E87-K90 PolarHBondContact OE2-NZ 3.46Å; K90-K92 VanDerWaalsContact C-N 3.33Å; K90-K92 PolarHBondContact O-N 3.37Å; K90-R93 PolarHBondContact O-N 3.48Å; K90-R93 VanDerWaalsContact O-N 3.16Å; K90-Q94 PolarHBondContact O-N 2.95Å
91	Y	98.5	Very high	97.9	Very high	12 Å²	12	67.7 Å²	67.7	5%	0.047	33%	0.33	C	S	.	.	H	α-helix	trans	-58.8	-43	177.5	-61.9	-51.1	0	0	0	112.3	S48 V58 F60 E87 T88 R93 Q94 A95	S48-Y91 VanDerWaalsContact OG-CE1 3.27Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.36Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.39Å; F60-Y91 HydrophobicContact CB-CD1 4.14Å; F60-Y91 HydrophobicContact CB-CD2 3.57Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.66Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.66Å; F60-Y91 HydrophobicContact CD2-CD2 3.66Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.79Å; F60-Y91 HydrophobicContact CG-CD2 3.79Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.37Å; E87-Y91 PolarHBondContact O-N 3.36Å; T88-Y91 PolarHBondContact O-N 2.96Å; Y91-R93 PolarHBondContact O-N 3.18Å; Y91-Q94 PolarHBondContact O-N 2.65Å; Y91-A95 WeakPolarHBondContact O-CB 3.17Å; Y91-A95 PolarHBondContact O-N 2.75Å
92	K	98.4	Very high	98	Very high	79 Å²	79	63.3 Å²	63.3	34%	0.343	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-39.8	176.9	-73.9	178.2	178.8	178.7	0	112.9	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.31Å; F60-K92 HydrophobicContact CZ-CG 4.04Å; P67-K92 VanDerWaalsContact O-CE 3.27Å; P67-K92 WeakPolarHBondContact O-CE 3.36Å; P67-K92 PolarHBondContact O-NZ 2.94Å; T88-K92 HydrophobicContact CG2-CD 4.2Å; T88-K92 WeakPolarHBondContact O-CG 3.33Å; T88-K92 PolarHBondContact O-N 3.42Å; K90-K92 VanDerWaalsContact C-N 3.33Å; K90-K92 PolarHBondContact O-N 3.37Å; K92-Q96 WeakPolarHBondContact O-CG 3.38Å; K92-Q96 PolarHBondContact O-N 3.35Å
93	R	98.3	Very high	98	Very high	154 Å²	154	62.2 Å²	62.2	58%	0.581	29%	0.29	S	S	*	.	H	α-helix	trans	-66.7	-41.7	174.7	-75.7	-174.9	-68.9	168.5	-1.5	111.6	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.33Å; Q89-R93 PolarHBondContact O-N 2.91Å; Q89-R93 VanDerWaalsContact O-N 3.07Å; Q89-R93 PolarHBondContact O-NE 2.84Å; K90-R93 PolarHBondContact O-N 3.48Å; K90-R93 VanDerWaalsContact O-N 3.16Å; Y91-R93 PolarHBondContact O-N 3.18Å; R93-Q96 PolarHBondContact O-N 3.15Å; R93-A97 PolarHBondContact O-N 3.04Å
94	Q	98.3	Very high	98	Very high	51 Å²	51	65 Å²	65	24%	0.238	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-45.1	176.3	-169.8	60.8	47.1	0	0	111.4	F46 K90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.24Å; F46-Q94 HydrophobicContact CE2-CG 3.75Å; F46-Q94 HydrophobicContact CZ-CB 3.91Å; F46-Q94 HydrophobicContact CZ-CG 3.75Å; K90-Q94 PolarHBondContact O-N 2.95Å; Y91-Q94 PolarHBondContact O-N 2.65Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 3.22Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 3.19Å; Q94-D98 PolarHBondContact NE2-OD1 3.2Å; Q94-D98 PolarHBondContact O-N 3Å
95	A	98.4	Very high	98	Very high	23 Å²	23	63.3 Å²	63.3	19%	0.19	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-40.1	176	0	0	0	0	0	112.6	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.66Å; F46-A95 HydrophobicContact CD1-CB 3.73Å; F46-A95 HydrophobicContact CD2-CB 4.09Å; F46-A95 HydrophobicContact CE1-CB 4.4Å; F46-A95 HydrophobicContact CG-CB 3.55Å; Y91-A95 WeakPolarHBondContact O-CB 3.17Å; Y91-A95 PolarHBondContact O-N 2.75Å; A95-R99 WeakPolarHBondContact O-CB 3.47Å; A95-R99 PolarHBondContact O-N 3.28Å
96	Q	98.1	Very high	98	Very high	139 Å²	139	61.7 Å²	61.7	65%	0.65	29%	0.286	S	S	*	.	H	α-helix	trans	-67.7	-41.7	174.5	-73.5	-174.8	-11.4	0	0	112.4	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.38Å; K92-Q96 PolarHBondContact O-N 3.35Å; R93-Q96 PolarHBondContact O-N 3.15Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 3.22Å; Q96-R99 PolarHBondContact O-N 2.87Å; Q96-V100 WeakPolarHBondContact O-CG2 3.37Å; Q96-V100 PolarHBondContact O-N 2.92Å
97	A	97.6	Very high	98	Very high	44 Å²	44	59 Å²	59	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-46.7	176.1	0	0	0	0	0	111	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 3.04Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 3.19Å; A97-R99 VanDerWaalsContact C-N 3.33Å; A97-R99 PolarHBondContact O-N 3.38Å; A97-V100 WeakPolarHBondContact O-CB 3.42Å; A97-V100 PolarHBondContact O-N 3.29Å; A97-V100 VanDerWaalsContact O-N 3.07Å; A97-S101 PolarHBondContact O-N 2.9Å; A97-S101 PolarHBondContact O-OG 3.49Å; A97-S101 VanDerWaalsContact O-OG 3.13Å
98	D	98.2	Very high	98	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.032	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-36	-179.6	-73.4	-1.6	0	0	0	112.3	A35 F46 Q94 V100 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.67Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.43Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.43Å; Q94-D98 PolarHBondContact NE2-OD1 3.2Å; Q94-D98 PolarHBondContact O-N 3Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.26Å; D98-S101 PolarHBondContact O-N 3.41Å; D98-L102 WeakPolarHBondContact O-CB 3.42Å; D98-L102 VanDerWaalsContact O-CG 3.32Å; D98-L102 WeakPolarHBondContact O-CG 3.39Å; D98-L102 PolarHBondContact O-N 3.17Å; D98-L119 HydrophobicContact CB-CD2 4.13Å
99	R	98	Very high	98	Very high	97 Å²	97	64.1 Å²	64.1	37%	0.366	31%	0.309	S	S	.	.	H	α-helix	trans	-57.4	-44.9	170.7	175.1	-171.2	170.6	170.7	11.1	111.7	E43 P44 A95 Q96 A97 R103	E43-R99 IonicContact OE1-CZ 3.34Å; E43-R99 IonicContact OE1-NE 3.67Å; E43-R99 IonicContact OE1-NH1 2.81Å; E43-R99 PolarHBondContact OE1-NH1 3.44Å; E43-R99 IonicContact OE1-NH2 3.86Å; E43-R99 PolarHBondContact OE1-NH2 2.98Å; E43-R99 VanDerWaalsContact OE2-CD 3.3Å; E43-R99 WeakPolarHBondContact OE2-CD 3.39Å; E43-R99 IonicContact OE2-CZ 2.63Å; E43-R99 IonicContact OE2-NE 3.85Å; E43-R99 PolarHBondContact OE2-NE 2.92Å; E43-R99 IonicContact OE2-NH1 3.1Å; E43-R99 PolarHBondContact OE2-NH1 3.38Å; E43-R99 IonicContact OE2-NH2 3.89Å; E43-R99 PolarHBondContact OE2-NH2 3.41Å; P44-R99 HydrophobicContact CG-CB 4.38Å; P44-R99 HydrophobicContact CG-CG 4.18Å; A95-R99 WeakPolarHBondContact O-CB 3.47Å; A95-R99 PolarHBondContact O-N 3.28Å; Q96-R99 PolarHBondContact O-N 2.87Å; A97-R99 VanDerWaalsContact C-N 3.33Å; A97-R99 PolarHBondContact O-N 3.38Å; R99-R103 PolarHBondContact O-N 3.45Å
100	V	97.8	Very high	97.9	Very high	75 Å²	75	66.3 Å²	66.3	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-41.6	177.9	174.7	0	0	0	0	110.4	Q96 A97 D98 R103 N104	Q96-V100 WeakPolarHBondContact O-CG2 3.37Å; Q96-V100 PolarHBondContact O-N 2.92Å; A97-V100 WeakPolarHBondContact O-CB 3.42Å; A97-V100 PolarHBondContact O-N 3.29Å; A97-V100 VanDerWaalsContact O-N 3.07Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.26Å; V100-R103 PolarHBondContact O-N 2.84Å; V100-N104 PolarHBondContact O-N 3.41Å; V100-N104 PolarHBondContact O-ND2 3.47Å
101	S	98.2	Very high	97.9	Very high	43 Å²	43	65.9 Å²	65.9	30%	0.301	32%	0.323	S	S	.	.	H	α-helix	trans	-59.6	-46.2	176.5	-64.4	0	0	0	0	112	A97 D98 R103 N104 L105	A97-S101 PolarHBondContact O-N 2.9Å; A97-S101 PolarHBondContact O-OG 3.49Å; A97-S101 VanDerWaalsContact O-OG 3.13Å; D98-S101 PolarHBondContact O-N 3.41Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 3.3Å; S101-N104 PolarHBondContact O-N 3.26Å; S101-N104 VanDerWaalsContact O-N 3.09Å; S101-L105 WeakPolarHBondContact O-CB 3.21Å; S101-L105 VanDerWaalsContact O-CG 3.22Å; S101-L105 WeakPolarHBondContact O-CG 3.39Å; S101-L105 PolarHBondContact O-N 3.47Å
102	L	98.4	Very high	97.8	Very high	8 Å²	8	68.9 Å²	68.9	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-56.2	-40.7	175.6	-78	168.4	0	0	0	112.2	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.88Å; P44-L102 HydrophobicContact CB-CD1 3.68Å; P44-L102 HydrophobicContact CG-CD1 3.85Å; D98-L102 WeakPolarHBondContact O-CB 3.42Å; D98-L102 VanDerWaalsContact O-CG 3.32Å; D98-L102 WeakPolarHBondContact O-CG 3.39Å; D98-L102 PolarHBondContact O-N 3.17Å; L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.28Å; L102-R106 VanDerWaalsContact O-N 3.1Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.08Å; L102-Y142 HydrophobicContact CD2-CE2 3.99Å
103	R	96.9	Very high	97.5	Very high	141 Å²	141	71.1 Å²	71.1	53%	0.532	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-43.1	175.7	-173.9	-174.6	-64.3	162.7	-1	112	R99 V100 S101 G107	R99-R103 PolarHBondContact O-N 3.45Å; V100-R103 PolarHBondContact O-N 2.84Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 3.3Å; R103-G107 PolarHBondContact O-N 3.32Å
104	N	97.8	Very high	97.2	Very high	66 Å²	66	70.5 Å²	70.5	35%	0.353	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-46.5	179.3	-69	-22.9	0	0	0	111.4	V100 S101 G107 Y108	V100-N104 PolarHBondContact O-N 3.41Å; V100-N104 PolarHBondContact O-ND2 3.47Å; S101-N104 PolarHBondContact O-N 3.26Å; S101-N104 VanDerWaalsContact O-N 3.09Å; N104-G107 CarbonylContact O-C 3.53Å; N104-G107 WeakPolarHBondContact O-CA 3.43Å; N104-G107 PolarHBondContact O-N 2.97Å; N104-G107 VanDerWaalsContact O-N 3.1Å; N104-Y108 HydrophobicContact CB-CE2 4.48Å; N104-Y108 WeakPolarHBondContact O-CD1 3.34Å; N104-Y108 VanDerWaalsContact O-CG 3.32Å; N104-Y108 PolarHBondContact O-N 2.91Å
105	L	98.3	Very high	97	Very high	5 Å²	5	69.3 Å²	69.3	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-49	179.5	-70.9	165.3	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.21Å; S101-L105 VanDerWaalsContact O-CG 3.22Å; S101-L105 WeakPolarHBondContact O-CG 3.39Å; S101-L105 PolarHBondContact O-N 3.47Å; L105-G107 PolarHBondContact O-N 3.47Å; L105-Y108 PolarHBondContact O-N 3.01Å; L105-Y109 HydrophobicContact CD2-CE2 4.23Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.43Å; L105-Y109 PolarHBondContact O-N 3.34Å; L105-L119 HydrophobicContact CD1-CD1 3.89Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å; L105-Y142 HydrophobicContact CB-CD1 4.32Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.49Å; L105-Y147 HydrophobicContact CD2-CD1 4.32Å; L105-Y147 HydrophobicContact CD2-CD2 4.02Å; L105-Y147 HydrophobicContact CD2-CE1 3.74Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.45Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.35Å
106	R	97.4	Very high	97	Very high	61 Å²	61	71.8 Å²	71.8	23%	0.23	38%	0.383	C	S	.	.	H	α-helix	trans	-52.3	-41.9	174	-172.9	-171.6	66.1	176.9	10	112.1	L102 N110 Q111 E113	L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.28Å; L102-R106 VanDerWaalsContact O-N 3.1Å; R106-N110 PolarHBondContact O-N 2.96Å; R106-N110 VanDerWaalsContact O-N 3.15Å; R106-Q111 HydrophobicContact CG-CB 3.82Å; R106-Q111 PolarHBondContact O-N 3.27Å; R106-E113 IonicContact CZ-OE1 3.16Å; R106-E113 IonicContact NH1-OE1 3.38Å; R106-E113 PolarHBondContact NH1-OE1 2.89Å; R106-E113 IonicContact NH2-OE1 2.74Å; R106-E113 PolarHBondContact NH2-OE1 3.01Å
107	G	97.5	Very high	97	Very high	44 Å²	44	66 Å²	66	45%	0.454	36%	0.355	S	S	.	.	H	α-helix	trans	-66.4	-45.9	175.4	0	0	0	0	0	113.4	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.32Å; N104-G107 CarbonylContact O-C 3.53Å; N104-G107 WeakPolarHBondContact O-CA 3.43Å; N104-G107 PolarHBondContact O-N 2.97Å; N104-G107 VanDerWaalsContact O-N 3.1Å; L105-G107 PolarHBondContact O-N 3.47Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.31Å; G107-N110 PolarHBondContact O-N 2.94Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 2.94Å
108	Y	98.1	Very high	97.1	Very high	56 Å²	56	65.7 Å²	65.7	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-35.9	179.1	-62.2	-15.9	0	0	0	112.6	N104 L105 I166 K170	N104-Y108 HydrophobicContact CB-CE2 4.48Å; N104-Y108 WeakPolarHBondContact O-CD1 3.34Å; N104-Y108 VanDerWaalsContact O-CG 3.32Å; N104-Y108 PolarHBondContact O-N 2.91Å; L105-Y108 PolarHBondContact O-N 3.01Å; Y108-I166 HydrophobicContact CD1-CD1 4.15Å; Y108-I166 HydrophobicContact CE1-CD1 4.44Å; Y108-I166 HydrophobicContact CE1-CG2 4.06Å; Y108-I166 HydrophobicContact CE2-CB 4.23Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; Y108-K170 PolarHBondContact OH-NZ 2.93Å
109	Y	98.1	Very high	97.1	Very high	69 Å²	69	65.9 Å²	65.9	27%	0.271	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	3.7	178.4	-68.9	-71	0	0	0	113.9	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.23Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.43Å; L105-Y109 PolarHBondContact O-N 3.34Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.31Å; Y109-Q111 PolarHBondContact O-N 3.47Å; Y109-Y142 AromaticContact CD2-CD1 3.76Å; Y109-Y142 HydrophobicContact CD2-CD1 3.76Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.85Å; Y109-Y142 HydrophobicContact CE2-CE1 3.85Å; Y109-Y142 HydrophobicContact CG-CE1 4.47Å; Y109-Y147 HydrophobicContact CE2-CD2 4.38Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.35Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.16Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.38Å; Y109-D161 VanDerWaalsContact OH-CG 3.23Å; Y109-D161 PolarHBondContact OH-OD1 2.9Å; Y109-D161 VanDerWaalsContact OH-OD1 3.13Å; Y109-D161 PolarHBondContact OH-OD2 2.72Å; Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.41Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.87Å; Y109-A163 VanDerWaalsContact CZ-CB 3.44Å
110	N	97.1	Very high	97.1	Very high	151 Å²	151	65 Å²	65	81%	0.807	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	40.8	-178	-56.1	-59.7	0	0	0	113.3	R106 G107	R106-N110 PolarHBondContact O-N 2.96Å; R106-N110 VanDerWaalsContact O-N 3.15Å; G107-N110 PolarHBondContact O-N 2.94Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 2.94Å
111	Q	97.5	Very high	97.2	Very high	60 Å²	60	63.3 Å²	63.3	28%	0.28	34%	0.336	S	S	.	.			trans	-87.5	154	-177.1	-70.2	165.6	-36.2	0	0	112.1	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.82Å; R106-Q111 PolarHBondContact O-N 3.27Å; Y109-Q111 PolarHBondContact O-N 3.47Å; Q111-H117 PolarHBondContact NE2-CE1 3.33Å; Q111-H117 PolarHBondContact OE1-CE1 2.95Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.26Å; Q111-Y142 PolarHBondContact OE1-OH 2.82Å; Q111-D143 PolarHBondContact NE2-OD2 2.94Å
112	S	95.3	Very high	97.2	Very high	75 Å²	75	62.3 Å²	62.3	52%	0.524	33%	0.326	S	S	.	.			trans	-64.5	150.7	178.3	177.6	0	0	0	0	112.3	D114 G115	S112-D114 VanDerWaalsContact C-N 3.26Å; S112-D114 PolarHBondContact O-N 2.87Å; S112-D114 PolarHBondContact OG-N 3.37Å; S112-G115 PolarHBondContact O-N 3.36Å
113	E	92.5	Very high	97.2	Very high	126 Å²	126	62.1 Å²	62.1	59%	0.589	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-22.4	174.4	-57.9	-150.7	126.1	0	0	113.7	P39 R106 G115	P39-E113 VanDerWaalsContact CB-O 3.29Å; P39-E113 WeakPolarHBondContact CB-O 3.3Å; P39-E113 WeakPolarHBondContact CG-O 3.31Å; R106-E113 IonicContact CZ-OE1 3.16Å; R106-E113 IonicContact NH1-OE1 3.38Å; R106-E113 PolarHBondContact NH1-OE1 2.89Å; R106-E113 IonicContact NH2-OE1 2.74Å; R106-E113 PolarHBondContact NH2-OE1 3.01Å; E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 2.86Å
114	D	92.5	Very high	97.2	Very high	141 Å²	141	55.4 Å²	55.4	75%	0.754	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-9.6	-179	-59.7	-39	0	0	0	112.7	S112	S112-D114 VanDerWaalsContact C-N 3.26Å; S112-D114 PolarHBondContact O-N 2.87Å; S112-D114 PolarHBondContact OG-N 3.37Å
115	G	94	Very high	97.3	Very high	25 Å²	25	52.3 Å²	52.3	26%	0.258	28%	0.284	S	S	.	.			trans	-75.1	132.1	178.8	0	0	0	0	0	113	P39 S112 E113 H117	P39-G115 VanDerWaalsContact CG-O 3.24Å; P39-G115 WeakPolarHBondContact CG-O 3.28Å; S112-G115 PolarHBondContact O-N 3.36Å; E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 2.86Å; G115-H117 PolarHBondContact O-CD2 2.85Å
116	S	97.6	Very high	97.2	Very high	76 Å²	76	53.1 Å²	53.1	53%	0.531	29%	0.288	S	S	.	.			trans	-79.4	133.2	164.2	-176.8	0	0	0	0	109.2	S37	S37-S116 PolarHBondContact O-OG 3.1Å
117	H	98.4	Very high	97.2	Very high	16 Å²	16	50.4 Å²	50.4	7%	0.074	28%	0.278	C	S	.	.			trans	-133.2	149.8	-176.8	-65	-72.9	0	0	0	110.6	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.34Å; S37-H117 PolarHBondContact N-O 3.34Å; S37-H117 PolarHBondContact OG-N 3.01Å; S37-H117 PolarHBondContact OG-O 3.34Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; Q111-H117 PolarHBondContact NE2-CE1 3.33Å; Q111-H117 PolarHBondContact OE1-CE1 2.95Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.26Å; G115-H117 PolarHBondContact O-CD2 2.85Å; H117-Y142 HydrophobicContact CB-CE2 3.81Å; H117-Y142 WeakPolarHBondContact CB-OH 3.44Å; H117-Y142 AromaticContact CG-CZ 3.99Å; H117-Y142 AromaticContact ND1-CZ 3.91Å; H117-Y142 PolarHBondContact ND1-OH 2.94Å; H117-D143 WeakPolarHBondContact CA-OD1 3.28Å; H117-D143 WeakPolarHBondContact CB-OD1 3.5Å; H117-D143 IonicContact CE1-OD2 2.78Å; H117-D143 IonicContact CG-OD1 3Å; H117-D143 IonicContact CG-OD2 2.66Å; H117-D143 IonicContact ND1-OD1 2.98Å; H117-D143 IonicContact ND1-OD2 3.5Å; H117-D143 PolarHBondContact ND1-OD2 3.43Å
118	T	98.8	Very high	97	Very high	39 Å²	39	48.7 Å²	48.7	24%	0.239	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.8	-176.2	-55.7	0	0	0	0	110.3	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.07Å; A35-T118 WeakPolarHBondContact O-CA 3.27Å; V36-T118 HydrophobicContact CG2-CG2 4.19Å; T118-Q120 HydrophobicContact CG2-CG 3.91Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.38Å; T118-Y142 VanDerWaalsContact O-CD2 3.26Å; T118-Y142 WeakPolarHBondContact O-CD2 3.26Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 3Å
119	L	98.8	Very high	96.6	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.047	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.8	169.7	175.1	62.5	0	0	0	108.1	T34 A35 D98 L102 L105	T34-L119 WeakPolarHBondContact CA-O 3.34Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 3.12Å; A35-L119 PolarHBondContact O-N 3.19Å; D98-L119 HydrophobicContact CB-CD2 4.13Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.08Å; L105-L119 HydrophobicContact CD1-CD1 3.89Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å
120	Q	98.8	Very high	96.1	Very high	78 Å²	78	51.8 Å²	51.8	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.9	177.2	-61.7	174.4	-86.7	0	0	109.1	D33 T34 T118 S140 A141	D33-Q120 CarbonylContact O-C 3.59Å; D33-Q120 VanDerWaalsContact O-CA 3.29Å; D33-Q120 WeakPolarHBondContact O-CA 3.42Å; T34-Q120 HydrophobicContact CG2-CG 4.15Å; T118-Q120 HydrophobicContact CG2-CG 3.91Å; Q120-S140 CarbonylContact O-C 3.55Å; Q120-S140 WeakPolarHBondContact O-CA 3.4Å; Q120-A141 HydrophobicContact CB-CB 4.45Å; Q120-A141 PolarHBondContact N-O 2.79Å; Q120-A141 PolarHBondContact O-N 2.9Å
121	R	98.6	Very high	95.7	Very high	41 Å²	41	45.6 Å²	45.6	16%	0.155	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.5	172.3	176.9	171.4	172.4	-95.9	4	110	F32 D33 D138 Q139	F32-R121 WeakPolarHBondContact CA-O 3.46Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 3.42Å; D33-R121 PolarHBondContact O-N 2.89Å; D33-R121 IonicContact OD2-NH1 3.2Å; R121-D138 IonicContact CZ-OD1 3.81Å; R121-D138 IonicContact CZ-OD2 2.91Å; R121-D138 IonicContact NE-OD1 3.38Å; R121-D138 PolarHBondContact NE-OD1 3.09Å; R121-D138 IonicContact NE-OD2 2.7Å; R121-D138 PolarHBondContact NE-OD2 2.95Å; R121-D138 VanDerWaalsContact NE-OD2 3.1Å; R121-D138 IonicContact NH2-OD1 2.71Å; R121-D138 PolarHBondContact NH2-OD1 3.47Å; R121-D138 IonicContact NH2-OD2 3.54Å; R121-Q139 CarbonylContact C-O 3.57Å; R121-Q139 VanDerWaalsContact CA-O 3.3Å; R121-Q139 WeakPolarHBondContact CA-O 3.45Å
122	M	98.6	Very high	95.6	Very high	21 Å²	21	50.9 Å²	50.9	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.7	168.6	-174.3	-79.9	-75.4	0	0	108.3	Y31 F32 Y137 D138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.13Å; F32-M122 HydrophobicContact CD1-CB 4.05Å; F32-M122 HydrophobicContact CD1-CG 3.72Å; F32-M122 HydrophobicContact CE1-CB 4.17Å; F32-M122 HydrophobicContact CE1-CG 3.43Å; F32-M122 VanDerWaalsContact CE1-CG 3.43Å; F32-M122 HydrophobicContact CZ-CG 4.09Å; M122-Y137 HydrophobicContact CE-CD1 3.84Å; M122-Y137 HydrophobicContact CE-CG 3.95Å; M122-Y137 HydrophobicContact SD-CG 4.35Å; M122-D138 WeakPolarHBondContact O-CA 3.31Å; M122-Q139 HydrophobicContact CB-CG 4.07Å; M122-Q139 HydrophobicContact CE-CG 3.93Å; M122-Q139 PolarHBondContact N-O 3.33Å; M122-Q139 PolarHBondContact O-N 2.84Å
123	S	98	Very high	95.6	Very high	5 Å²	5	49.7 Å²	49.7	4%	0.035	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.6	174.3	64.7	0	0	0	0	111.2	R30 Y31 Y137	R30-S123 WeakPolarHBondContact CA-O 3.33Å; Y31-S123 PolarHBondContact N-O 3Å; Y31-S123 PolarHBondContact O-N 3.1Å; S123-Y137 VanDerWaalsContact CA-O 3.22Å; S123-Y137 WeakPolarHBondContact CA-O 3.38Å
124	G	98.2	Very high	95.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	-178.9	-177	0	0	0	0	0	114.7	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.37Å; G124-G136 CarbonylContact O-C 3.59Å; G124-G136 WeakPolarHBondContact O-CA 3.4Å; G124-Y137 PolarHBondContact N-O 2.98Å; G124-Y137 PolarHBondContact O-N 2.86Å; G124-L184 WeakPolarHBondContact O-CD2 3.24Å
125	C	98.4	Very high	96	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.3	-178.1	53.7	0	0	0	0	111	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.31Å; M29-C125 PolarHBondContact N-O 2.89Å; M29-C125 PolarHBondContact O-N 2.83Å; C125-L133 HydrophobicContact CB-CD1 3.57Å; C125-R135 CarbonylContact C-O 3.51Å; C125-R135 WeakPolarHBondContact CA-O 3.35Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.26Å; C125-C188 PolarHBondContact N-SG 3.18Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.39Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.93Å
126	D	98	Very high	96.2	Very high	22 Å²	22	46.3 Å²	46.3	12%	0.118	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.2	173.4	-61.6	-3.5	0	0	0	108.7	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.57Å; H27-D126 WeakPolarHBondContact O-CA 3.31Å; S28-D126 WeakPolarHBondContact CB-OD1 3.44Å; R30-D126 IonicContact CZ-OD1 2.98Å; R30-D126 IonicContact NE-OD1 3.65Å; R30-D126 PolarHBondContact NE-OD1 2.64Å; R30-D126 VanDerWaalsContact NE-OD1 3.1Å; R30-D126 IonicContact NH2-OD1 3.04Å; R30-D126 PolarHBondContact NH2-OD1 3.11Å; R30-D126 IonicContact NH2-OD2 3.64Å; R30-D126 PolarHBondContact NH2-OD2 3.08Å; D126-L134 HydrophobicContact CB-CB 4.39Å; D126-L134 PolarHBondContact O-N 3.45Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 2.8Å; D126-R135 PolarHBondContact O-N 3.26Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.17Å; D126-Y137 PolarHBondContact OD2-OH 2.91Å; D126-Y137 VanDerWaalsContact OD2-OH 3.07Å
127	L	96.8	Very high	96.2	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.3	174.1	-57.1	-176.8	0	0	0	109.9	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 3.31Å; S26-L127 VanDerWaalsContact CB-O 3.31Å; S26-L127 WeakPolarHBondContact CB-O 3.34Å; H27-L127 PolarHBondContact N-O 2.83Å; H27-L127 VanDerWaalsContact N-O 3.1Å; H27-L127 PolarHBondContact O-N 3.07Å; L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.39Å; L127-V189 HydrophobicContact CD1-CG1 4.46Å; L127-V189 HydrophobicContact CD2-CB 4.07Å; L127-V189 HydrophobicContact CD2-CG1 3.75Å; L127-V189 HydrophobicContact CD2-CG2 3.64Å; L127-L192 HydrophobicContact CB-CD2 4.47Å; L127-L192 HydrophobicContact CD1-CB 4.23Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.58Å; L127-L192 HydrophobicContact CG-CG 4.22Å; L127-R193 HydrophobicContact CD1-CG 3.91Å
128	G	93.6	Very high	96.2	Very high	9 Å²	9	44.3 Å²	44.3	9%	0.093	22%	0.222	C	C	.	.			trans	-69.5	174.4	165.6	0	0	0	0	0	111.9	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.49Å; G128-G131 WeakPolarHBondContact O-CA 3.46Å; G128-G131 PolarHBondContact O-N 2.83Å; G128-R132 PolarHBondContact N-O 3.37Å
129	P	89.1	Confident	96.2	Very high	89 Å²	89	46 Å²	46	58%	0.578	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.6	178.6	-18.6	28.8	0	0	0	113.7	A24 G131	A24-P129 HydrophobicContact CB-CB 3.92Å; A24-P129 HydrophobicContact CB-CG 3.22Å; P129-G131 PolarHBondContact O-N 2.87Å
130	D	88.6	Confident	96.2	Very high	101 Å²	101	46.7 Å²	46.7	54%	0.54	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.5	174	70.4	-14.6	0	0	0	113	G128 R132	G128-D130 PolarHBondContact O-N 3.49Å; D130-R132 PolarHBondContact O-N 2.63Å; D130-R132 WeakPolarHBondContact OD1-CB 3.37Å; D130-R132 PolarHBondContact OD1-N 3.48Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.45Å; D130-R132 IonicContact OD2-CZ 2.6Å; D130-R132 IonicContact OD2-NE 2.92Å
131	G	88.7	Confident	96.2	Very high	20 Å²	20	43.7 Å²	43.7	21%	0.206	22%	0.222	C	C	.	.	S	Bend	trans	71.9	9.2	-178.3	0	0	0	0	0	114	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.46Å; G128-G131 PolarHBondContact O-N 2.83Å; P129-G131 PolarHBondContact O-N 2.87Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 3.17Å; G131-R193 PolarHBondContact O-NH2 3.24Å
132	R	93.4	Very high	96.2	Very high	171 Å²	171	42.2 Å²	42.2	65%	0.645	22%	0.216	S	C	*	.	S	Bend	trans	-88.7	155.2	178.7	-61.9	-173.6	-176.1	165.1	-2.2	111.3	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.39Å; G128-R132 PolarHBondContact N-O 3.37Å; D130-R132 PolarHBondContact O-N 2.63Å; D130-R132 WeakPolarHBondContact OD1-CB 3.37Å; D130-R132 PolarHBondContact OD1-N 3.48Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.45Å; D130-R132 IonicContact OD2-CZ 2.6Å; D130-R132 IonicContact OD2-NE 2.92Å; R132-L134 PolarHBondContact O-N 3.48Å; R132-L134 VanDerWaalsContact O-N 3.12Å
133	L	96.6	Very high	96.2	Very high	51 Å²	51	44.4 Å²	44.4	27%	0.267	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	118.3	175.1	-176.1	73	0	0	0	109.7	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.57Å; L133-R135 WeakPolarHBondContact CD1-O 3.34Å; L133-L154 HydrophobicContact CD2-CD1 4.12Å; L133-E185 HydrophobicContact CD2-CB 4.38Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L133-V189 HydrophobicContact CB-CG2 3.99Å; L133-V189 HydrophobicContact CD1-CG2 3.91Å
134	L	96.2	Very high	96.2	Very high	124 Å²	124	47 Å²	47	65%	0.649	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	-46.4	170.1	-177.1	65.5	0	0	0	110	D126 R132	D126-L134 HydrophobicContact CB-CB 4.39Å; D126-L134 PolarHBondContact O-N 3.45Å; R132-L134 PolarHBondContact O-N 3.48Å; R132-L134 VanDerWaalsContact O-N 3.12Å
135	R	96.6	Very high	96.2	Very high	91 Å²	91	54.6 Å²	54.6	34%	0.343	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	144.5	-177.4	-173.3	161.3	170.2	146	11.5	112.2	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.51Å; C125-R135 WeakPolarHBondContact CA-O 3.35Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 2.8Å; D126-R135 PolarHBondContact O-N 3.26Å; L133-R135 WeakPolarHBondContact CD1-O 3.34Å; R135-Y137 HydrophobicContact CB-CE2 4Å; R135-Y137 VanDerWaalsContact CD-CZ 3.42Å; R135-Y137 WeakPolarHBondContact CD-OH 3.2Å; R135-Y137 HydrophobicContact CG-CD2 4.31Å; R135-Y137 HydrophobicContact CG-CE1 4.14Å; R135-Y137 HydrophobicContact CG-CE2 3.64Å; R135-Y137 PolarHBondContact NE-OH 3.15Å; R135-E152 VanDerWaalsContact CZ-CD 3.45Å; R135-E152 VanDerWaalsContact CZ-CG 3.44Å; R135-E152 IonicContact CZ-OE1 2.79Å; R135-E152 IonicContact NH1-OE1 2.74Å; R135-E152 PolarHBondContact NH1-OE1 3.27Å; R135-E152 IonicContact NH1-OE2 3.56Å; R135-E152 VanDerWaalsContact NH2-CG 3.27Å; R135-E152 IonicContact NH2-OE1 3.34Å; R135-E152 PolarHBondContact NH2-OE1 2.87Å
136	G	98	Very high	96.2	Very high	5 Å²	5	60.7 Å²	60.7	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.6	170.6	0	0	0	0	0	111.4	G124	G124-G136 CarbonylContact O-C 3.59Å; G124-G136 WeakPolarHBondContact O-CA 3.4Å
137	Y	98.2	Very high	96.2	Very high	38 Å²	38	60.1 Å²	60.1	15%	0.149	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	137.2	-177.1	-58.6	-94.3	0	0	0	111	R30 M122 S123 G124 D126 R135	R30-Y137 PolarHBondContact NH2-OH 3.18Å; M122-Y137 HydrophobicContact CE-CD1 3.84Å; M122-Y137 HydrophobicContact CE-CG 3.95Å; M122-Y137 HydrophobicContact SD-CG 4.35Å; S123-Y137 VanDerWaalsContact CA-O 3.22Å; S123-Y137 WeakPolarHBondContact CA-O 3.38Å; G124-Y137 PolarHBondContact N-O 2.98Å; G124-Y137 PolarHBondContact O-N 2.86Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.17Å; D126-Y137 PolarHBondContact OD2-OH 2.91Å; D126-Y137 VanDerWaalsContact OD2-OH 3.07Å; R135-Y137 HydrophobicContact CB-CE2 4Å; R135-Y137 VanDerWaalsContact CD-CZ 3.42Å; R135-Y137 WeakPolarHBondContact CD-OH 3.2Å; R135-Y137 HydrophobicContact CG-CD2 4.31Å; R135-Y137 HydrophobicContact CG-CE1 4.14Å; R135-Y137 HydrophobicContact CG-CE2 3.64Å; R135-Y137 PolarHBondContact NE-OH 3.15Å
138	D	98.4	Very high	96.3	Very high	12 Å²	12	60.4 Å²	60.4	6%	0.064	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	106.3	161.5	-167	132	0	0	0	107.6	R121 M122 L150 L180	R121-D138 IonicContact CZ-OD1 3.81Å; R121-D138 IonicContact CZ-OD2 2.91Å; R121-D138 IonicContact NE-OD1 3.38Å; R121-D138 PolarHBondContact NE-OD1 3.09Å; R121-D138 IonicContact NE-OD2 2.7Å; R121-D138 PolarHBondContact NE-OD2 2.95Å; R121-D138 VanDerWaalsContact NE-OD2 3.1Å; R121-D138 IonicContact NH2-OD1 2.71Å; R121-D138 PolarHBondContact NH2-OD1 3.47Å; R121-D138 IonicContact NH2-OD2 3.54Å; M122-D138 WeakPolarHBondContact O-CA 3.31Å; D138-L150 HydrophobicContact CB-CB 3.99Å; D138-L150 HydrophobicContact CB-CD2 4.2Å; D138-L150 WeakPolarHBondContact O-CB 3.33Å; D138-L150 PolarHBondContact O-N 3.46Å; D138-L180 HydrophobicContact CB-CD1 4.23Å; D138-L180 WeakPolarHBondContact OD1-CD1 3.47Å; D138-L180 WeakPolarHBondContact OD1-CD2 3.47Å
139	Q	98.6	Very high	96.6	Very high	76 Å²	76	61.3 Å²	61.3	36%	0.355	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.4	-177.7	62.8	-170.5	56.6	0	0	110.6	R121 M122 I148 A149	R121-Q139 CarbonylContact C-O 3.57Å; R121-Q139 VanDerWaalsContact CA-O 3.3Å; R121-Q139 WeakPolarHBondContact CA-O 3.45Å; M122-Q139 HydrophobicContact CB-CG 4.07Å; M122-Q139 HydrophobicContact CE-CG 3.93Å; M122-Q139 PolarHBondContact N-O 3.33Å; M122-Q139 PolarHBondContact O-N 2.84Å; Q139-I148 WeakPolarHBondContact CA-O 3.35Å; Q139-A149 HydrophobicContact CB-CB 3.85Å
140	S	98.7	Very high	97	Very high	22 Å²	22	57.8 Å²	57.8	15%	0.154	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.9	-179.9	-55.9	0	0	0	0	111.1	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.55Å; Q120-S140 WeakPolarHBondContact O-CA 3.4Å; S140-Y147 WeakPolarHBondContact O-CB 3.43Å; S140-Y147 PolarHBondContact O-N 3.48Å; S140-I148 PolarHBondContact N-O 2.9Å; S140-I148 PolarHBondContact O-N 3.36Å
141	A	98.8	Very high	97.5	Very high	16 Å²	16	55 Å²	55	13%	0.132	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.9	174.7	0	0	0	0	0	110.2	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.45Å; Q120-A141 PolarHBondContact N-O 2.79Å; Q120-A141 PolarHBondContact O-N 2.9Å; A141-K145 CarbonylContact C-O 3.6Å; A141-K145 WeakPolarHBondContact CA-O 3.4Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.04Å
142	Y	98.8	Very high	97.9	Very high	10 Å²	10	60.5 Å²	60.5	4%	0.039	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.8	177.4	-174.5	-121.1	0	0	0	110.2	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 3.99Å; L105-Y142 HydrophobicContact CB-CD1 4.32Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.49Å; Y109-Y142 AromaticContact CD2-CD1 3.76Å; Y109-Y142 HydrophobicContact CD2-CD1 3.76Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.85Å; Y109-Y142 HydrophobicContact CE2-CE1 3.85Å; Y109-Y142 HydrophobicContact CG-CE1 4.47Å; Q111-Y142 PolarHBondContact OE1-OH 2.82Å; H117-Y142 HydrophobicContact CB-CE2 3.81Å; H117-Y142 WeakPolarHBondContact CB-OH 3.44Å; H117-Y142 AromaticContact CG-CZ 3.99Å; H117-Y142 AromaticContact ND1-CZ 3.91Å; H117-Y142 PolarHBondContact ND1-OH 2.94Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.38Å; T118-Y142 VanDerWaalsContact O-CD2 3.26Å; T118-Y142 WeakPolarHBondContact O-CD2 3.26Å; Y142-G144 PolarHBondContact O-N 3.48Å; Y142-K145 PolarHBondContact N-O 3.43Å; Y142-K145 PolarHBondContact O-N 2.94Å
143	D	98.4	Very high	98.1	Very high	66 Å²	66	56 Å²	56	35%	0.353	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	40.6	-174.5	-66	-22.5	0	0	0	113.1	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 2.94Å; H117-D143 WeakPolarHBondContact CA-OD1 3.28Å; H117-D143 WeakPolarHBondContact CB-OD1 3.5Å; H117-D143 IonicContact CE1-OD2 2.78Å; H117-D143 IonicContact CG-OD1 3Å; H117-D143 IonicContact CG-OD2 2.66Å; H117-D143 IonicContact ND1-OD1 2.98Å; H117-D143 IonicContact ND1-OD2 3.5Å; H117-D143 PolarHBondContact ND1-OD2 3.43Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 3Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 3.31Å
144	G	97.7	Very high	98.2	Very high	59 Å²	59	54 Å²	54	61%	0.608	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	8.8	177.8	0	0	0	0	0	115.3	Y142	Y142-G144 PolarHBondContact O-N 3.48Å
145	K	98.6	Very high	98.3	Very high	161 Å²	161	55.9 Å²	55.9	70%	0.7	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.5	176.9	-62.5	178.7	-177.4	176.4	0	110.7	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.6Å; A141-K145 WeakPolarHBondContact CA-O 3.4Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.04Å; Y142-K145 PolarHBondContact N-O 3.43Å; Y142-K145 PolarHBondContact O-N 2.94Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 3.31Å; K145-Y147 PolarHBondContact O-N 3.33Å
146	D	98.7	Very high	98.3	Very high	128 Å²	128	53.5 Å²	53.5	68%	0.684	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.7	134.6	174	-67.2	-33	0	0	0	110.6	A160	D146-A160 HydrophobicContact CB-CB 4.49Å; D146-A160 WeakPolarHBondContact O-CB 3.17Å
147	Y	98.8	Very high	98.4	Very high	9 Å²	9	54.1 Å²	54.1	4%	0.035	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-61.5	-179.4	178.6	-107.6	0	0	0	110.5	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.32Å; L105-Y147 HydrophobicContact CD2-CD2 4.02Å; L105-Y147 HydrophobicContact CD2-CE1 3.74Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.45Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.35Å; Y109-Y147 HydrophobicContact CE2-CD2 4.38Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.35Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.16Å; S140-Y147 WeakPolarHBondContact O-CB 3.43Å; S140-Y147 PolarHBondContact O-N 3.48Å; K145-Y147 PolarHBondContact O-N 3.33Å; Y147-A160 WeakPolarHBondContact O-CB 3.39Å; Y147-A160 PolarHBondContact O-N 2.79Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.86Å; Y147-A164 HydrophobicContact CD2-CB 3.83Å; Y147-A164 HydrophobicContact CE1-CB 4.45Å; Y147-A164 VanDerWaalsContact CE2-CA 3.48Å; Y147-A164 HydrophobicContact CE2-CB 3.68Å; Y147-A164 HydrophobicContact CG-CB 4.3Å; Y147-A164 WeakPolarHBondContact O-CB 3.28Å; Y147-T167 HydrophobicContact CE1-CG2 4.17Å; Y147-T167 WeakPolarHBondContact OH-CB 3.39Å; Y147-T167 PolarHBondContact OH-OG1 2.87Å
148	I	98.8	Very high	98.4	Very high	10 Å²	10	56.1 Å²	56.1	5%	0.051	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	140.3	-179.8	-161.3	169	0	0	0	110.9	Q139 S140 W157 T158 T167 Q168 L171	Q139-I148 WeakPolarHBondContact CA-O 3.35Å; S140-I148 PolarHBondContact N-O 2.9Å; S140-I148 PolarHBondContact O-N 3.36Å; I148-W157 HydrophobicContact CD1-CB 4.48Å; I148-W157 HydrophobicContact CD1-CE3 4.2Å; I148-W157 HydrophobicContact CG1-CB 4.48Å; I148-W157 HydrophobicContact CG1-CE3 4.02Å; I148-T158 WeakPolarHBondContact CA-O 3.16Å; I148-T167 HydrophobicContact CD1-CG2 3.94Å; I148-Q168 HydrophobicContact CD1-CB 4.02Å; I148-L171 HydrophobicContact CD1-CD1 3.76Å
149	A	98.8	Very high	98.4	Very high	29 Å²	29	56.6 Å²	56.6	24%	0.24	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139	178.7	0	0	0	0	0	111.4	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.85Å; A149-W157 CarbonylContact O-C 3.49Å; A149-W157 WeakPolarHBondContact O-CA 3.04Å; A149-T158 PolarHBondContact N-O 3.02Å; A149-T158 PolarHBondContact O-N 3.36Å
150	L	98.8	Very high	98.4	Very high	14 Å²	14	55.8 Å²	55.8	7%	0.073	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.3	166.9	-175.9	68.6	0	0	0	108.5	D138 L154 W157 A177 L180 L184	D138-L150 HydrophobicContact CB-CB 3.99Å; D138-L150 HydrophobicContact CB-CD2 4.2Å; D138-L150 WeakPolarHBondContact O-CB 3.33Å; D138-L150 PolarHBondContact O-N 3.46Å; L150-L154 HydrophobicContact CD2-CD2 3.8Å; L150-L154 HydrophobicContact CG-CD2 4.35Å; L150-W157 HydrophobicContact CB-CE3 4.13Å; L150-W157 HydrophobicContact CB-CH2 4.32Å; L150-W157 HydrophobicContact CB-CZ3 3.88Å; L150-W157 HydrophobicContact CD1-CD2 4.24Å; L150-W157 HydrophobicContact CD1-CE3 4.36Å; L150-W157 HydrophobicContact CD1-CH2 4.18Å; L150-W157 HydrophobicContact CD1-CZ2 4.01Å; L150-W157 HydrophobicContact CD1-CZ3 4.34Å; L150-A177 HydrophobicContact CD1-CB 4Å; L150-L180 HydrophobicContact CD2-CB 4.26Å; L150-L184 HydrophobicContact CD2-CD1 3.92Å
151	N	98.6	Very high	98.4	Very high	44 Å²	44	57.3 Å²	57.3	24%	0.235	32%	0.317	C	S	.	.			trans	-72.7	163.6	-179.5	-67.8	-26.8	0	0	0	111.4	D153 L154 S156 W157 T158	N151-D153 PolarHBondContact O-N 2.89Å; N151-D153 VanDerWaalsContact O-N 3.08Å; N151-L154 WeakPolarHBondContact O-CA 3.49Å; N151-L154 PolarHBondContact O-N 3.06Å; N151-S156 WeakPolarHBondContact CB-O 3.49Å; N151-S156 WeakPolarHBondContact CB-OG 3.33Å; N151-S156 PolarHBondContact N-O 2.74Å; N151-S156 PolarHBondContact ND2-OG 3.17Å; N151-W157 PolarHBondContact ND2-N 2.82Å; N151-T158 WeakPolarHBondContact OD1-CB 3.45Å; N151-T158 PolarHBondContact OD1-N 3.12Å; N151-T158 PolarHBondContact OD1-OG1 3.25Å
152	E	97.4	Very high	98.3	Very high	135 Å²	135	61.7 Å²	61.7	63%	0.631	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.3	-179.8	-67.6	178.2	-162.3	0	0	113.7	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.45Å; R135-E152 VanDerWaalsContact CZ-CG 3.44Å; R135-E152 IonicContact CZ-OE1 2.79Å; R135-E152 IonicContact NH1-OE1 2.74Å; R135-E152 PolarHBondContact NH1-OE1 3.27Å; R135-E152 IonicContact NH1-OE2 3.56Å; R135-E152 VanDerWaalsContact NH2-CG 3.27Å; R135-E152 IonicContact NH2-OE1 3.34Å; R135-E152 PolarHBondContact NH2-OE1 2.87Å; E152-L154 PolarHBondContact O-N 3.32Å
153	D	97.4	Very high	98.3	Very high	77 Å²	77	61.5 Å²	61.5	41%	0.412	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-7.5	174.7	69.8	5.5	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 2.89Å; N151-D153 VanDerWaalsContact O-N 3.08Å; D153-R155 VanDerWaalsContact O-CG 3.31Å; D153-R155 WeakPolarHBondContact O-CG 3.41Å; D153-R155 PolarHBondContact O-N 2.82Å; D153-R155 PolarHBondContact OD1-N 3.38Å; D153-S156 VanDerWaalsContact CG-OG 3.22Å; D153-S156 PolarHBondContact OD1-N 2.76Å; D153-S156 PolarHBondContact OD1-OG 3.2Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.47Å; D153-S156 PolarHBondContact OD2-OG 2.69Å
154	L	97.9	Very high	98.3	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	33%	0.326	C	S	.	.	S	Bend	trans	53.8	27.5	-175.6	-53.9	-178.7	0	0	0	113.7	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.12Å; L150-L154 HydrophobicContact CD2-CD2 3.8Å; L150-L154 HydrophobicContact CG-CD2 4.35Å; N151-L154 WeakPolarHBondContact O-CA 3.49Å; N151-L154 PolarHBondContact O-N 3.06Å; E152-L154 PolarHBondContact O-N 3.32Å; L154-R181 HydrophobicContact CB-CB 4.09Å; L154-R181 HydrophobicContact CB-CG 3.85Å; L154-R181 HydrophobicContact CD1-CG 4.16Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L154-E185 HydrophobicContact CD1-CG 4.19Å
155	R	97.6	Very high	98.4	Very high	163 Å²	163	59 Å²	59	62%	0.615	31%	0.313	S	S	*	.	S	Bend	trans	-135.2	-34.1	-173.2	-71.3	169.5	-176.1	-92.3	14.4	112.7	D153 A177	D153-R155 VanDerWaalsContact O-CG 3.31Å; D153-R155 WeakPolarHBondContact O-CG 3.41Å; D153-R155 PolarHBondContact O-N 2.82Å; D153-R155 PolarHBondContact OD1-N 3.38Å; R155-A177 WeakPolarHBondContact O-CB 3.47Å
156	S	98	Very high	98.4	Very high	41 Å²	41	54.2 Å²	54.2	29%	0.287	30%	0.295	S	S	.	.			trans	-113.2	165.4	-177.5	64.6	0	0	0	0	111.8	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.49Å; N151-S156 WeakPolarHBondContact CB-OG 3.33Å; N151-S156 PolarHBondContact N-O 2.74Å; N151-S156 PolarHBondContact ND2-OG 3.17Å; D153-S156 VanDerWaalsContact CG-OG 3.22Å; D153-S156 PolarHBondContact OD1-N 2.76Å; D153-S156 PolarHBondContact OD1-OG 3.2Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.47Å; D153-S156 PolarHBondContact OD2-OG 2.69Å
157	W	98.7	Very high	98.3	Very high	17 Å²	17	49.5 Å²	49.5	6%	0.064	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.1	-176	-60.2	90.3	0	0	0	110.7	I148 A149 L150 N151 Q168 L171 A176 A177 L180	I148-W157 HydrophobicContact CD1-CB 4.48Å; I148-W157 HydrophobicContact CD1-CE3 4.2Å; I148-W157 HydrophobicContact CG1-CB 4.48Å; I148-W157 HydrophobicContact CG1-CE3 4.02Å; A149-W157 CarbonylContact O-C 3.49Å; A149-W157 WeakPolarHBondContact O-CA 3.04Å; L150-W157 HydrophobicContact CB-CE3 4.13Å; L150-W157 HydrophobicContact CB-CH2 4.32Å; L150-W157 HydrophobicContact CB-CZ3 3.88Å; L150-W157 HydrophobicContact CD1-CD2 4.24Å; L150-W157 HydrophobicContact CD1-CE3 4.36Å; L150-W157 HydrophobicContact CD1-CH2 4.18Å; L150-W157 HydrophobicContact CD1-CZ2 4.01Å; L150-W157 HydrophobicContact CD1-CZ3 4.34Å; N151-W157 PolarHBondContact ND2-N 2.82Å; W157-Q168 HydrophobicContact CB-CG 4.09Å; W157-Q168 PolarHBondContact O-NE2 3.25Å; W157-L171 HydrophobicContact CD2-CD1 4.01Å; W157-L171 HydrophobicContact CE3-CD1 4.02Å; W157-L171 HydrophobicContact CH2-CD1 3.76Å; W157-L171 HydrophobicContact CZ2-CB 4.17Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.9Å; W157-A176 HydrophobicContact CZ2-CB 4.3Å; W157-A177 HydrophobicContact CZ2-CB 4.3Å; W157-L180 HydrophobicContact CH2-CD1 3.38Å; W157-L180 HydrophobicContact CZ2-CD1 3.86Å; W157-L180 HydrophobicContact CZ3-CD1 4.47Å
158	T	98.7	Very high	98.3	Very high	80 Å²	80	51 Å²	51	49%	0.491	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.3	165.4	-66.4	0	0	0	0	108.9	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.16Å; A149-T158 PolarHBondContact N-O 3.02Å; A149-T158 PolarHBondContact O-N 3.36Å; N151-T158 WeakPolarHBondContact OD1-CB 3.45Å; N151-T158 PolarHBondContact OD1-N 3.12Å; N151-T158 PolarHBondContact OD1-OG1 3.25Å
159	A	98.7	Very high	98.3	Very high	23 Å²	23	57.6 Å²	57.6	19%	0.19	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.6	176.2	0	0	0	0	0	110	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.73Å; A159-Q165 HydrophobicContact CB-CG 4.02Å; A159-Q168 HydrophobicContact CB-CB 4.4Å
160	A	98.5	Very high	98.3	Very high	59 Å²	59	61.6 Å²	61.6	49%	0.488	31%	0.314	S	S	.	.	S	Bend	trans	-74.5	-31.9	-175.7	0	0	0	0	0	113.4	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.49Å; D146-A160 WeakPolarHBondContact O-CB 3.17Å; Y147-A160 WeakPolarHBondContact O-CB 3.39Å; Y147-A160 PolarHBondContact O-N 2.79Å
161	D	98.4	Very high	98.3	Very high	53 Å²	53	63 Å²	63	28%	0.283	32%	0.322	S	S	.	.	S	Bend	trans	-150.4	-174.3	-178	67.4	26.8	0	0	0	113.2	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.38Å; Y109-D161 VanDerWaalsContact OH-CG 3.23Å; Y109-D161 PolarHBondContact OH-OD1 2.9Å; Y109-D161 VanDerWaalsContact OH-OD1 3.13Å; Y109-D161 PolarHBondContact OH-OD2 2.72Å; D161-A163 VanDerWaalsContact C-N 3.32Å; D161-A163 PolarHBondContact O-N 3.1Å; D161-A163 WeakPolarHBondContact OD1-CA 3.24Å; D161-A163 WeakPolarHBondContact OD1-CB 3.3Å; D161-A163 PolarHBondContact OD1-N 3.4Å; D161-A164 PolarHBondContact O-N 2.74Å; D161-A164 PolarHBondContact OD1-N 2.74Å; D161-Q165 WeakPolarHBondContact O-CG 3.27Å; D161-Q165 PolarHBondContact O-N 2.81Å
162	T	98.2	Very high	98.3	Very high	109 Å²	109	65.4 Å²	65.4	67%	0.669	33%	0.331	S	S	*	.	H	α-helix	trans	-66.7	-29.1	-178.6	51.8	0	0	0	0	113.7
163	A	98.1	Very high	98.3	Very high	5 Å²	5	63 Å²	63	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	-71.7	-43.5	174.1	0	0	0	0	0	110.2	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.41Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.87Å; Y109-A163 VanDerWaalsContact CZ-CB 3.44Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.86Å; D161-A163 VanDerWaalsContact C-N 3.32Å; D161-A163 PolarHBondContact O-N 3.1Å; D161-A163 WeakPolarHBondContact OD1-CA 3.24Å; D161-A163 WeakPolarHBondContact OD1-CB 3.3Å; D161-A163 PolarHBondContact OD1-N 3.4Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.04Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.42Å; A163-I166 PolarHBondContact O-N 2.97Å
164	A	98.6	Very high	98.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-35.2	174.3	0	0	0	0	0	113	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.83Å; Y147-A164 HydrophobicContact CE1-CB 4.45Å; Y147-A164 VanDerWaalsContact CE2-CA 3.48Å; Y147-A164 HydrophobicContact CE2-CB 3.68Å; Y147-A164 HydrophobicContact CG-CB 4.3Å; Y147-A164 WeakPolarHBondContact O-CB 3.28Å; A159-A164 HydrophobicContact CB-CB 3.73Å; D161-A164 PolarHBondContact O-N 2.74Å; D161-A164 PolarHBondContact OD1-N 2.74Å; A164-I166 PolarHBondContact O-N 3.26Å; A164-T167 WeakPolarHBondContact O-CB 3.43Å; A164-T167 PolarHBondContact O-N 2.89Å; A164-Q168 PolarHBondContact O-N 3.14Å
165	Q	98.7	Very high	98.3	Very high	74 Å²	74	70 Å²	70	35%	0.346	37%	0.369	S	S	.	.	H	α-helix	trans	-60.3	-28.2	173.5	-72.6	173.3	11	0	0	113.1	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.02Å; D161-Q165 WeakPolarHBondContact O-CG 3.27Å; D161-Q165 PolarHBondContact O-N 2.81Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.04Å; Q165-R169 WeakPolarHBondContact O-CG 3.41Å; Q165-R169 PolarHBondContact O-N 2.85Å; Q165-R169 VanDerWaalsContact O-N 3.14Å
166	I	98.4	Very high	98.3	Very high	60 Å²	60	62.9 Å²	62.9	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-66.5	-44.9	173.9	-56.8	171	0	0	0	109.6	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.15Å; Y108-I166 HydrophobicContact CE1-CD1 4.44Å; Y108-I166 HydrophobicContact CE1-CG2 4.06Å; Y108-I166 HydrophobicContact CE2-CB 4.23Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.42Å; A163-I166 PolarHBondContact O-N 2.97Å; A164-I166 PolarHBondContact O-N 3.26Å; I166-K170 WeakPolarHBondContact O-CG 3.31Å; I166-K170 PolarHBondContact O-N 2.84Å
167	T	98.3	Very high	98.3	Very high	29 Å²	29	61.3 Å²	61.3	18%	0.178	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-44.4	175	-69.3	0	0	0	0	111.3	Y147 I148 A164 R169 K170 L171	Y147-T167 HydrophobicContact CE1-CG2 4.17Å; Y147-T167 WeakPolarHBondContact OH-CB 3.39Å; Y147-T167 PolarHBondContact OH-OG1 2.87Å; I148-T167 HydrophobicContact CD1-CG2 3.94Å; A164-T167 WeakPolarHBondContact O-CB 3.43Å; A164-T167 PolarHBondContact O-N 2.89Å; T167-R169 PolarHBondContact O-N 2.83Å; T167-K170 WeakPolarHBondContact O-CB 3.45Å; T167-K170 PolarHBondContact O-N 2.9Å; T167-L171 HydrophobicContact CG2-CD1 3.79Å; T167-L171 HydrophobicContact CG2-CG 4.03Å; T167-L171 WeakPolarHBondContact O-CG 3.43Å; T167-L171 PolarHBondContact O-N 2.82Å
168	Q	98.7	Very high	98.2	Very high	41 Å²	41	66.1 Å²	66.1	19%	0.192	36%	0.359	C	S	.	.	H	α-helix	trans	-51.6	-52.4	177.2	175.9	176.3	10.6	0	0	111.8	I148 W157 A159 A164 K170 L171 E172	I148-Q168 HydrophobicContact CD1-CB 4.02Å; W157-Q168 HydrophobicContact CB-CG 4.09Å; W157-Q168 PolarHBondContact O-NE2 3.25Å; A159-Q168 HydrophobicContact CB-CB 4.4Å; A164-Q168 PolarHBondContact O-N 3.14Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 3.36Å; Q168-L171 PolarHBondContact O-N 3.1Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.44Å; Q168-E172 PolarHBondContact NE2-OE1 2.62Å; Q168-E172 WeakPolarHBondContact O-CG 3.34Å; Q168-E172 PolarHBondContact O-N 2.86Å
169	R	98.6	Very high	98.1	Very high	147 Å²	147	69.3 Å²	69.3	56%	0.555	37%	0.368	S	S	*	.	H	α-helix	trans	-58.8	-36.8	179	-68.3	173	-165.3	129.4	7.3	112.5	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.41Å; Q165-R169 PolarHBondContact O-N 2.85Å; Q165-R169 VanDerWaalsContact O-N 3.14Å; T167-R169 PolarHBondContact O-N 2.83Å; R169-A173 VanDerWaalsContact O-CB 3.26Å; R169-A173 WeakPolarHBondContact O-CB 3.3Å; R169-A173 PolarHBondContact O-N 2.99Å
170	K	98.1	Very high	98	Very high	114 Å²	114	69.7 Å²	69.7	50%	0.496	37%	0.367	S	S	.	.	H	α-helix	trans	-67.8	-43.1	176.4	-70.7	178.3	176.1	-174	0	111.6	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 2.93Å; I166-K170 WeakPolarHBondContact O-CG 3.31Å; I166-K170 PolarHBondContact O-N 2.84Å; T167-K170 WeakPolarHBondContact O-CB 3.45Å; T167-K170 PolarHBondContact O-N 2.9Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 3.36Å; K170-A174 VanDerWaalsContact O-CB 3.29Å; K170-A174 WeakPolarHBondContact O-CB 3.22Å; K170-A174 PolarHBondContact O-N 3.23Å
171	L	98	Very high	98	Very high	43 Å²	43	70.1 Å²	70.1	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-41.4	178.3	-67	176	0	0	0	111.7	I148 W157 T167 Q168 A174 R175 A176	I148-L171 HydrophobicContact CD1-CD1 3.76Å; W157-L171 HydrophobicContact CD2-CD1 4.01Å; W157-L171 HydrophobicContact CE3-CD1 4.02Å; W157-L171 HydrophobicContact CH2-CD1 3.76Å; W157-L171 HydrophobicContact CZ2-CB 4.17Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.9Å; T167-L171 HydrophobicContact CG2-CD1 3.79Å; T167-L171 HydrophobicContact CG2-CG 4.03Å; T167-L171 WeakPolarHBondContact O-CG 3.43Å; T167-L171 PolarHBondContact O-N 2.82Å; Q168-L171 PolarHBondContact O-N 3.1Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; L171-A174 CarbonylContact O-C 3.59Å; L171-A174 PolarHBondContact O-N 2.99Å; L171-R175 PolarHBondContact O-N 3.04Å; L171-A176 HydrophobicContact CB-CB 4.06Å; L171-A176 HydrophobicContact CD2-CB 3.67Å; L171-A176 HydrophobicContact CG-CB 4.44Å; L171-A176 PolarHBondContact O-N 3.21Å
172	E	98.4	Very high	98	Very high	94 Å²	94	70.6 Å²	70.6	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-47.4	175.4	-72.3	170.5	176	0	0	111.4	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.44Å; Q168-E172 PolarHBondContact NE2-OE1 2.62Å; Q168-E172 WeakPolarHBondContact O-CG 3.34Å; Q168-E172 PolarHBondContact O-N 2.86Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.33Å; E172-R175 PolarHBondContact O-N 3.31Å
173	A	98.3	Very high	98	Very high	86 Å²	86	68.4 Å²	68.4	71%	0.711	35%	0.347	S	S	*	.	H	α-helix	trans	-60.8	-35.5	176.5	0	0	0	0	0	112.5	R169 R175	R169-A173 VanDerWaalsContact O-CB 3.26Å; R169-A173 WeakPolarHBondContact O-CB 3.3Å; R169-A173 PolarHBondContact O-N 2.99Å; A173-R175 VanDerWaalsContact C-N 3.32Å
174	A	97.6	Very high	98	Very high	69 Å²	69	68.2 Å²	68.2	57%	0.57	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-3	176.4	0	0	0	0	0	114	K170 L171 E172 A176	K170-A174 VanDerWaalsContact O-CB 3.29Å; K170-A174 WeakPolarHBondContact O-CB 3.22Å; K170-A174 PolarHBondContact O-N 3.23Å; L171-A174 CarbonylContact O-C 3.59Å; L171-A174 PolarHBondContact O-N 2.99Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.33Å; A174-A176 PolarHBondContact O-N 3.03Å
175	R	97.5	Very high	97.9	Very high	162 Å²	162	72.5 Å²	72.5	61%	0.611	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.2	-172.8	-56.7	-175.4	177.8	-165.5	1.1	113.4	L171 E172 A173 A177 E178	L171-R175 PolarHBondContact O-N 3.04Å; E172-R175 PolarHBondContact O-N 3.31Å; A173-R175 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 2.94Å; R175-A177 VanDerWaalsContact O-N 3.15Å; R175-E178 HydrophobicContact CB-CG 4.3Å; R175-E178 IonicContact NH1-OE1 2.65Å; R175-E178 WeakPolarHBondContact O-CB 3.49Å; R175-E178 PolarHBondContact O-N 3.37Å
176	A	97.4	Very high	97.9	Very high	14 Å²	14	70.1 Å²	70.1	12%	0.116	36%	0.36	C	S	.	.	H	α-helix	trans	-58.8	-32	-174.9	0	0	0	0	0	113	W157 L171 A174 E178 Q179 L180	W157-A176 HydrophobicContact CZ2-CB 4.3Å; L171-A176 HydrophobicContact CB-CB 4.06Å; L171-A176 HydrophobicContact CD2-CB 3.67Å; L171-A176 HydrophobicContact CG-CB 4.44Å; L171-A176 PolarHBondContact O-N 3.21Å; A174-A176 PolarHBondContact O-N 3.03Å; A176-E178 VanDerWaalsContact C-N 3.26Å; A176-E178 PolarHBondContact O-N 2.85Å; A176-Q179 PolarHBondContact O-N 2.84Å; A176-L180 PolarHBondContact O-N 3.13Å; A176-L180 VanDerWaalsContact O-N 3.09Å
177	A	98.1	Very high	97.8	Very high	9 Å²	9	69.6 Å²	69.6	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-60	-33.9	177.1	0	0	0	0	0	112.7	L150 R155 W157 R175 Q179 L180 R181	L150-A177 HydrophobicContact CD1-CB 4Å; R155-A177 WeakPolarHBondContact O-CB 3.47Å; W157-A177 HydrophobicContact CZ2-CB 4.3Å; R175-A177 PolarHBondContact O-N 2.94Å; R175-A177 VanDerWaalsContact O-N 3.15Å; A177-Q179 PolarHBondContact O-N 2.92Å; A177-L180 PolarHBondContact O-N 2.6Å; A177-R181 WeakPolarHBondContact O-CB 3.39Å; A177-R181 PolarHBondContact O-N 2.82Å
178	E	97.7	Very high	97.8	Very high	118 Å²	118	68.2 Å²	68.2	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-64.9	-40.7	178.4	-64.4	178.3	-177.6	0	0	111.5	R175 A176 A182	R175-E178 HydrophobicContact CB-CG 4.3Å; R175-E178 IonicContact NH1-OE1 2.65Å; R175-E178 WeakPolarHBondContact O-CB 3.49Å; R175-E178 PolarHBondContact O-N 3.37Å; A176-E178 VanDerWaalsContact C-N 3.26Å; A176-E178 PolarHBondContact O-N 2.85Å; E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 3.04Å
179	Q	96.2	Very high	97.8	Very high	146 Å²	146	66.6 Å²	66.6	68%	0.682	34%	0.344	S	S	*	.	H	α-helix	trans	-69.3	-43.8	178	-64.8	-178.8	-9.6	0	0	111.7	A176 A177 A182 Y183	A176-Q179 PolarHBondContact O-N 2.84Å; A177-Q179 PolarHBondContact O-N 2.92Å; Q179-A182 PolarHBondContact O-N 3.35Å; Q179-Y183 PolarHBondContact O-N 3.11Å
180	L	97.3	Very high	97.8	Very high	32 Å²	32	65.5 Å²	65.5	17%	0.168	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-43	177.5	-70.5	173.7	0	0	0	111.4	D138 L150 W157 A176 A177 A182 Y183 L184	D138-L180 HydrophobicContact CB-CD1 4.23Å; D138-L180 WeakPolarHBondContact OD1-CD1 3.47Å; D138-L180 WeakPolarHBondContact OD1-CD2 3.47Å; L150-L180 HydrophobicContact CD2-CB 4.26Å; W157-L180 HydrophobicContact CH2-CD1 3.38Å; W157-L180 HydrophobicContact CZ2-CD1 3.86Å; W157-L180 HydrophobicContact CZ3-CD1 4.47Å; A176-L180 PolarHBondContact O-N 3.13Å; A176-L180 VanDerWaalsContact O-N 3.09Å; A177-L180 PolarHBondContact O-N 2.6Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.45Å; L180-Y183 WeakPolarHBondContact O-CB 3.01Å; L180-Y183 PolarHBondContact O-N 2.85Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.26Å; L180-L184 PolarHBondContact O-N 3.18Å
181	R	98.1	Very high	97.7	Very high	67 Å²	67	62.3 Å²	62.3	25%	0.253	33%	0.331	S	S	.	.	H	α-helix	trans	-59.4	-45.3	174.7	-175.7	171.9	-179.5	-129.6	-12.5	112	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.09Å; L154-R181 HydrophobicContact CB-CG 3.85Å; L154-R181 HydrophobicContact CD1-CG 4.16Å; A177-R181 WeakPolarHBondContact O-CB 3.39Å; A177-R181 PolarHBondContact O-N 2.82Å; R181-Y183 VanDerWaalsContact C-N 3.29Å; R181-Y183 PolarHBondContact O-N 3.38Å; R181-L184 PolarHBondContact O-N 3.05Å; R181-E185 HydrophobicContact CG-CG 4.08Å; R181-E185 IonicContact CZ-OE1 3.1Å; R181-E185 IonicContact CZ-OE2 3.11Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 3.82Å; R181-E185 PolarHBondContact NE-OE1 3.46Å; R181-E185 IonicContact NE-OE2 3.97Å; R181-E185 PolarHBondContact NE-OE2 3.2Å; R181-E185 IonicContact NH2-OE1 3.98Å; R181-E185 PolarHBondContact NH2-OE1 3.42Å; R181-E185 IonicContact NH2-OE2 3.98Å; R181-E185 PolarHBondContact NH2-OE2 3.04Å; R181-E185 WeakPolarHBondContact O-CB 3.13Å; R181-E185 PolarHBondContact O-N 3.04Å
182	A	98.1	Very high	97.7	Very high	64 Å²	64	60.2 Å²	60.2	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-38.9	176.3	0	0	0	0	0	112.4	E178 Q179 L180 G186	E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 3.04Å; Q179-A182 PolarHBondContact O-N 3.35Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.45Å; A182-G186 PolarHBondContact O-N 3.24Å; A182-G186 VanDerWaalsContact O-N 3.11Å
183	Y	97.2	Very high	97.7	Very high	62 Å²	62	61.6 Å²	61.6	24%	0.243	32%	0.321	C	S	.	.	I	π-helix	trans	-65.6	-48.2	173.3	168	-101.2	0	0	0	112.2	Q179 L180 R181 G186 T187 C188	Q179-Y183 PolarHBondContact O-N 3.11Å; L180-Y183 WeakPolarHBondContact O-CB 3.01Å; L180-Y183 PolarHBondContact O-N 2.85Å; R181-Y183 VanDerWaalsContact C-N 3.29Å; R181-Y183 PolarHBondContact O-N 3.38Å; Y183-G186 CarbonylContact O-C 3.58Å; Y183-T187 HydrophobicContact CD2-CG2 3.95Å; Y183-T187 HydrophobicContact CE2-CG2 3.87Å; Y183-T187 PolarHBondContact O-N 3.48Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; Y183-C188 HydrophobicContact CE1-CB 4.1Å; Y183-C188 WeakPolarHBondContact O-CB 3.26Å; Y183-C188 PolarHBondContact O-N 2.82Å
184	L	98.3	Very high	97.6	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	31%	0.308	C	S	.	.	I	π-helix	trans	-69.4	-41.5	-174.9	-69.1	170.9	0	0	0	112.5	G124 L150 L154 L180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.24Å; L150-L184 HydrophobicContact CD2-CD1 3.92Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.26Å; L180-L184 PolarHBondContact O-N 3.18Å; R181-L184 PolarHBondContact O-N 3.05Å; L184-V189 WeakPolarHBondContact O-CG2 3.43Å
185	E	97.7	Very high	97.6	Very high	90 Å²	90	59.9 Å²	59.9	42%	0.421	28%	0.281	S	S	.	.	I	π-helix	trans	-77.6	-25.2	177.9	-68.8	-178.6	167.3	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.38Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L154-E185 HydrophobicContact CD1-CG 4.19Å; R181-E185 HydrophobicContact CG-CG 4.08Å; R181-E185 IonicContact CZ-OE1 3.1Å; R181-E185 IonicContact CZ-OE2 3.11Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 3.82Å; R181-E185 PolarHBondContact NE-OE1 3.46Å; R181-E185 IonicContact NE-OE2 3.97Å; R181-E185 PolarHBondContact NE-OE2 3.2Å; R181-E185 IonicContact NH2-OE1 3.98Å; R181-E185 PolarHBondContact NH2-OE1 3.42Å; R181-E185 IonicContact NH2-OE2 3.98Å; R181-E185 PolarHBondContact NH2-OE2 3.04Å; R181-E185 WeakPolarHBondContact O-CB 3.13Å; R181-E185 PolarHBondContact O-N 3.04Å
186	G	97.5	Very high	97.5	Very high	23 Å²	23	52.9 Å²	52.9	24%	0.237	26%	0.256	C	S	.	.	I	π-helix	trans	-108.3	-89.8	-178.2	0	0	0	0	0	112.5	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 3.24Å; A182-G186 VanDerWaalsContact O-N 3.11Å; Y183-G186 CarbonylContact O-C 3.58Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.09Å; G186-V189 PolarHBondContact O-N 3.37Å; G186-V189 VanDerWaalsContact O-N 3.14Å; G186-E190 WeakPolarHBondContact O-CG 3.34Å; G186-E190 PolarHBondContact O-N 3.14Å
187	T	97.3	Very high	97.5	Very high	50 Å²	50	58.2 Å²	58.2	31%	0.307	28%	0.278	S	S	.	.	I	π-helix	trans	-53.3	-45.2	-171	-57.1	0	0	0	0	113	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.95Å; Y183-T187 HydrophobicContact CE2-CG2 3.87Å; Y183-T187 PolarHBondContact O-N 3.48Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; T187-V189 PolarHBondContact O-N 3.03Å; T187-E190 PolarHBondContact O-N 2.89Å; T187-W191 VanDerWaalsContact CG2-CD1 3.46Å; T187-W191 WeakPolarHBondContact O-CB 3.16Å; T187-W191 PolarHBondContact O-N 3.23Å
188	C	98.2	Very high	97.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.288	C	S	.	.	I	π-helix	trans	-60.1	-48.7	-179.5	-171.4	0	0	0	0	111.5	M29 C125 Y183 G186 W191 L192	M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 WeakPolarHBondContact CE-O 3.45Å; M29-C188 WeakPolarHBondContact CE-SG 3.23Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.26Å; C125-C188 PolarHBondContact N-SG 3.18Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.39Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.93Å; Y183-C188 HydrophobicContact CE1-CB 4.1Å; Y183-C188 WeakPolarHBondContact O-CB 3.26Å; Y183-C188 PolarHBondContact O-N 2.82Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.09Å; C188-W191 PolarHBondContact O-N 2.96Å; C188-L192 WeakPolarHBondContact O-CB 3.48Å; C188-L192 PolarHBondContact O-N 3.23Å
189	V	98.1	Very high	97.3	Very high	6 Å²	6	54.8 Å²	54.8	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-44.2	178.2	171.4	0	0	0	0	111.5	L127 L133 L184 G186 T187 R193	L127-V189 HydrophobicContact CD1-CG1 4.46Å; L127-V189 HydrophobicContact CD2-CB 4.07Å; L127-V189 HydrophobicContact CD2-CG1 3.75Å; L127-V189 HydrophobicContact CD2-CG2 3.64Å; L133-V189 HydrophobicContact CB-CG2 3.99Å; L133-V189 HydrophobicContact CD1-CG2 3.91Å; L184-V189 WeakPolarHBondContact O-CG2 3.43Å; G186-V189 PolarHBondContact O-N 3.37Å; G186-V189 VanDerWaalsContact O-N 3.14Å; T187-V189 PolarHBondContact O-N 3.03Å; V189-R193 VanDerWaalsContact CG1-CZ 3.42Å; V189-R193 WeakPolarHBondContact O-CG 3.46Å; V189-R193 PolarHBondContact O-N 3.42Å
190	E	97.9	Very high	97.2	Very high	125 Å²	125	53 Å²	53	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-61.3	-46.1	178.6	-72.4	174.2	175.5	0	0	112.2	G186 T187 R194	G186-E190 WeakPolarHBondContact O-CG 3.34Å; G186-E190 PolarHBondContact O-N 3.14Å; T187-E190 PolarHBondContact O-N 2.89Å; E190-R194 PolarHBondContact O-N 3.44Å; E190-R194 VanDerWaalsContact O-N 3.09Å
191	W	97.9	Very high	96.9	Very high	46 Å²	46	60 Å²	60	17%	0.174	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-41.5	178.9	-81.7	100.5	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.07Å; M29-W191 HydrophobicContact SD-CB 4.45Å; Y83-W191 AromaticContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CH2 3.5Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.5Å; Y83-W191 HydrophobicContact CD2-CZ2 4.23Å; Y83-W191 AromaticContact CD2-CZ3 3.67Å; Y83-W191 HydrophobicContact CD2-CZ3 3.67Å; Y83-W191 HydrophobicContact CE2-CE3 4.15Å; Y83-W191 AromaticContact CE2-CH2 3.9Å; Y83-W191 HydrophobicContact CE2-CH2 3.9Å; Y83-W191 AromaticContact CE2-CZ3 3.66Å; Y83-W191 HydrophobicContact CE2-CZ3 3.66Å; T187-W191 VanDerWaalsContact CG2-CD1 3.46Å; T187-W191 WeakPolarHBondContact O-CB 3.16Å; T187-W191 PolarHBondContact O-N 3.23Å; C188-W191 PolarHBondContact O-N 2.96Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.4Å; W191-R194 WeakPolarHBondContact O-CB 3.35Å; W191-R194 PolarHBondContact O-N 2.8Å; W191-R194 VanDerWaalsContact O-N 3.17Å; W191-Y195 HydrophobicContact CB-CE2 4.07Å; W191-Y195 HydrophobicContact CE3-CD1 4.43Å; W191-Y195 AromaticContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE2 4.31Å; W191-Y195 AromaticContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.43Å; W191-Y195 AromaticContact CZ3-CE1 3.94Å; W191-Y195 HydrophobicContact CZ3-CE1 3.94Å; W191-Y195 VanDerWaalsContact O-CD2 3.3Å; W191-Y195 WeakPolarHBondContact O-CD2 3.35Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 3.04Å
192	L	98.1	Very high	96.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-44.9	176.2	174.7	50.4	0	0	0	111.2	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.46Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.96Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.42Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.27Å; L127-L192 HydrophobicContact CB-CD2 4.47Å; L127-L192 HydrophobicContact CD1-CB 4.23Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.58Å; L127-L192 HydrophobicContact CG-CG 4.22Å; C188-L192 WeakPolarHBondContact O-CB 3.48Å; C188-L192 PolarHBondContact O-N 3.23Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 3.39Å; L192-Y195 PolarHBondContact O-N 2.95Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.82Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.2Å; L192-L196 PolarHBondContact O-N 3.15Å
193	R	96.8	Very high	96.3	Very high	122 Å²	122	56 Å²	56	46%	0.46	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-42.9	174.2	-71.8	176.9	-172.6	153.6	-0.9	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.91Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 3.17Å; G131-R193 PolarHBondContact O-NH2 3.24Å; V189-R193 VanDerWaalsContact CG1-CZ 3.42Å; V189-R193 WeakPolarHBondContact O-CG 3.46Å; V189-R193 PolarHBondContact O-N 3.42Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.4Å; R193-L196 PolarHBondContact O-N 3.36Å; R193-E197 PolarHBondContact O-N 3.12Å
194	R	97.1	Very high	96	Very high	119 Å²	119	57.4 Å²	57.4	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-43.8	176.6	178.7	178.9	174.5	120.5	-4.4	111.6	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 2.82Å; E79-R194 IonicContact OE1-NE 3.72Å; E79-R194 PolarHBondContact OE1-NE 2.85Å; E79-R194 IonicContact OE1-NH2 2.76Å; E79-R194 PolarHBondContact OE1-NH2 3.02Å; E79-R194 IonicContact OE2-CZ 3.32Å; E79-R194 IonicContact OE2-NE 3.68Å; E79-R194 IonicContact OE2-NH2 3.38Å; E79-R194 PolarHBondContact OE2-NH2 2.98Å; E190-R194 PolarHBondContact O-N 3.44Å; E190-R194 VanDerWaalsContact O-N 3.09Å; W191-R194 WeakPolarHBondContact O-CB 3.35Å; W191-R194 PolarHBondContact O-N 2.8Å; W191-R194 VanDerWaalsContact O-N 3.17Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 3.39Å; R194-E197 PolarHBondContact O-N 3.45Å; R194-N198 WeakPolarHBondContact O-CB 3.2Å; R194-N198 PolarHBondContact O-N 2.87Å; R194-N198 PolarHBondContact O-OD1 3.32Å
195	Y	97.4	Very high	95.6	Very high	1 Å²	1	61.3 Å²	61.3	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-67.5	-39.9	178.2	-61.9	-30.9	0	0	0	112.4	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.7Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å; V52-Y195 HydrophobicContact CG2-CD2 3.92Å; V52-Y195 HydrophobicContact CG2-CG 4.43Å; F57-Y195 HydrophobicContact CE2-CD2 4.2Å; F57-Y195 AromaticContact CE2-CE2 3.61Å; F57-Y195 HydrophobicContact CE2-CE2 3.61Å; F57-Y195 AromaticContact CE2-CZ 3.81Å; F57-Y195 HydrophobicContact CZ-CD2 4.21Å; F57-Y195 AromaticContact CZ-CE2 3.68Å; F57-Y195 HydrophobicContact CZ-CE2 3.68Å; W75-Y195 HydrophobicContact CE3-CD1 4.24Å; W75-Y195 HydrophobicContact CE3-CG 4.46Å; W75-Y195 HydrophobicContact CH2-CD2 4.48Å; W75-Y195 HydrophobicContact CH2-CG 4.11Å; W75-Y195 AromaticContact CZ3-CD1 3.58Å; W75-Y195 HydrophobicContact CZ3-CD1 3.58Å; W75-Y195 HydrophobicContact CZ3-CD2 4.26Å; W75-Y195 HydrophobicContact CZ3-CE1 4.31Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; V76-Y195 HydrophobicContact CG2-CE1 4.45Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.47Å; Y83-Y195 PolarHBondContact OH-OH 3.31Å; W191-Y195 HydrophobicContact CB-CE2 4.07Å; W191-Y195 HydrophobicContact CE3-CD1 4.43Å; W191-Y195 AromaticContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE2 4.31Å; W191-Y195 AromaticContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.43Å; W191-Y195 AromaticContact CZ3-CE1 3.94Å; W191-Y195 HydrophobicContact CZ3-CE1 3.94Å; W191-Y195 VanDerWaalsContact O-CD2 3.3Å; W191-Y195 WeakPolarHBondContact O-CD2 3.35Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 3.04Å; L192-Y195 PolarHBondContact O-N 2.95Å; Y195-E197 VanDerWaalsContact C-N 3.28Å; Y195-E197 PolarHBondContact O-N 3.09Å; Y195-N198 PolarHBondContact O-N 2.84Å; Y195-G199 WeakPolarHBondContact O-CA 3.23Å; Y195-G199 PolarHBondContact O-N 3Å; Y195-L203 WeakPolarHBondContact O-CD1 3.28Å
196	L	96.1	Very high	95.5	Very high	15 Å²	15	58.8 Å²	58.8	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-35.6	174.7	-71.1	169.5	0	0	0	112.4	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4.01Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.82Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.2Å; L192-L196 PolarHBondContact O-N 3.15Å; R193-L196 PolarHBondContact O-N 3.36Å; L196-K200 WeakPolarHBondContact O-CA 3.45Å; L196-K200 WeakPolarHBondContact O-CB 3.47Å; L196-K200 PolarHBondContact O-N 2.84Å; L196-K200 VanDerWaalsContact O-N 3.12Å; L196-L203 HydrophobicContact CD2-CB 4.08Å; L196-L203 HydrophobicContact CD2-CD1 4.33Å; L196-Q204 HydrophobicContact CD2-CG 4.48Å; L196-Q204 PolarHBondContact O-NE2 2.8Å
197	E	95.9	Very high	95.4	Very high	125 Å²	125	60.7 Å²	60.7	58%	0.584	28%	0.282	S	S	*	.	H	α-helix	trans	-72.3	-48.5	174.4	-171.5	60.2	-151.4	0	0	111.3	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.12Å; R194-E197 PolarHBondContact O-N 3.45Å; Y195-E197 VanDerWaalsContact C-N 3.28Å; Y195-E197 PolarHBondContact O-N 3.09Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.47Å; E197-K200 WeakPolarHBondContact O-CB 3.5Å; E197-K200 PolarHBondContact O-N 3.22Å
198	N	96.6	Very high	95.3	Very high	52 Å²	52	61.4 Å²	61.4	28%	0.278	29%	0.288	S	S	.	.	H	α-helix	trans	-60.2	-40.2	179.1	-71.9	-4.9	0	0	0	112.7	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.41Å; Q78-N198 VanDerWaalsContact NE2-CB 3.26Å; Q78-N198 PolarHBondContact NE2-ND2 2.04Å; Q78-N198 PolarHBondContact NE2-OD1 2.74Å; E79-N198 PolarHBondContact OE1-ND2 2.88Å; R194-N198 WeakPolarHBondContact O-CB 3.2Å; R194-N198 PolarHBondContact O-N 2.87Å; R194-N198 PolarHBondContact O-OD1 3.32Å; Y195-N198 PolarHBondContact O-N 2.84Å
199	G	95.6	Very high	95.3	Very high	3 Å²	3	62 Å²	62	3%	0.031	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	20.4	-176	0	0	0	0	0	113.5	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.23Å; Y195-G199 PolarHBondContact O-N 3Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.47Å; G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 2.63Å; G199-T202 CarbonylContact O-C 3.53Å; G199-T202 WeakPolarHBondContact O-CA 3.47Å; G199-T202 PolarHBondContact O-N 3.36Å; G199-T202 PolarHBondContact O-OG1 3Å; G199-L203 WeakPolarHBondContact O-CB 3.46Å; G199-L203 PolarHBondContact O-N 2.89Å
200	K	93.5	Very high	95.3	Very high	110 Å²	110	69.1 Å²	69.1	48%	0.478	32%	0.322	S	S	.	.	H	α-helix	trans	-49.7	-44.8	-171.7	-178.1	173	-176.5	173.3	0	114	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.45Å; L196-K200 WeakPolarHBondContact O-CB 3.47Å; L196-K200 PolarHBondContact O-N 2.84Å; L196-K200 VanDerWaalsContact O-N 3.12Å; E197-K200 WeakPolarHBondContact O-CB 3.5Å; E197-K200 PolarHBondContact O-N 3.22Å; K200-T202 PolarHBondContact O-N 2.91Å; K200-Q204 WeakPolarHBondContact O-CB 3.05Å; K200-Q204 PolarHBondContact O-N 3.34Å; K200-Q204 VanDerWaalsContact O-N 3.17Å
201	E	91.3	Very high	95.3	Very high	178 Å²	178	65.2 Å²	65.2	83%	0.832	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-23.7	179.3	-62.7	-174.8	165.7	0	0	113.3	G199 R205	G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 2.63Å; E201-R205 WeakPolarHBondContact O-CD 3.29Å
202	T	91.1	Very high	95.2	Very high	43 Å²	43	67 Å²	67	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-104.8	-36.8	-177.2	57	0	0	0	0	114.3	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.24Å; G199-T202 CarbonylContact O-C 3.53Å; G199-T202 WeakPolarHBondContact O-CA 3.47Å; G199-T202 PolarHBondContact O-N 3.36Å; G199-T202 PolarHBondContact O-OG1 3Å; K200-T202 PolarHBondContact O-N 2.91Å; T202-R205 WeakPolarHBondContact O-CG 3.26Å
203	L	92.5	Very high	95.2	Very high	3 Å²	3	68.2 Å²	68.2	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-94.7	-27.6	-171.6	-63	171.8	0	0	0	112.5	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.07Å; V52-L203 HydrophobicContact CG1-CG 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.02Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.41Å; W75-L203 HydrophobicContact CZ2-CD1 3.87Å; W75-L203 HydrophobicContact CZ2-CD2 4.15Å; W75-L203 HydrophobicContact CZ2-CG 4.44Å; Y195-L203 WeakPolarHBondContact O-CD1 3.28Å; L196-L203 HydrophobicContact CD2-CB 4.08Å; L196-L203 HydrophobicContact CD2-CD1 4.33Å; G199-L203 WeakPolarHBondContact O-CB 3.46Å; G199-L203 PolarHBondContact O-N 2.89Å
204	Q	90.5	Very high	95.1	Very high	92 Å²	92	63.9 Å²	63.9	43%	0.43	31%	0.312	S	S	.	.	S	Bend	trans	-103.5	25	178.5	-58.3	179.6	39.3	0	0	111.4	L196 K200	L196-Q204 HydrophobicContact CD2-CG 4.48Å; L196-Q204 PolarHBondContact O-NE2 2.8Å; K200-Q204 WeakPolarHBondContact O-CB 3.05Å; K200-Q204 PolarHBondContact O-N 3.34Å; K200-Q204 VanDerWaalsContact O-N 3.17Å
205	R	91.4	Very high	95.1	Very high	84 Å²	84	60.8 Å²	60.8	32%	0.317	30%	0.302	S	S	.	.			trans	-101.2	146.3	173.4	81.3	-174.1	-172.2	-134.5	0.4	109.3	E201 T202 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.29Å; T202-R205 WeakPolarHBondContact O-CG 3.26Å; R205-E207 HydrophobicContact CG-CG 4.5Å; R205-E207 IonicContact CZ-OE1 3.99Å; R205-E207 IonicContact NE-OE1 3.57Å; R205-E207 PolarHBondContact NE-OE1 2.79Å; R205-E207 IonicContact NH2-OE1 3.65Å; R205-E207 PolarHBondContact NH2-OE1 3.04Å; R205-Y233 HydrophobicContact CG-CD1 4.22Å; R205-Y233 VanDerWaalsContact O-CD1 3.28Å; R205-Y233 WeakPolarHBondContact O-CD1 3.33Å
206	A	93.8	Very high	94.9	Very high	38 Å²	38	64.5 Å²	64.5	31%	0.314	32%	0.319	S	S	.	.			trans	-119.4	119.1	166.2	0	0	0	0	0	108.4	Y233 E288	A206-Y233 CarbonylContact C-O 3.6Å; A206-Y233 WeakPolarHBondContact CA-O 3.41Å; A206-E288 HydrophobicContact CB-CB 4.25Å; A206-E288 HydrophobicContact CB-CG 3.94Å
207	E	95.4	Very high	94.8	Very high	62 Å²	62	68.5 Å²	68.5	29%	0.29	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-98	114.2	175.9	-68.5	-176.2	-119.5	0	0	108.6	R205 F232 Y233 H287	R205-E207 HydrophobicContact CG-CG 4.5Å; R205-E207 IonicContact CZ-OE1 3.99Å; R205-E207 IonicContact NE-OE1 3.57Å; R205-E207 PolarHBondContact NE-OE1 2.79Å; R205-E207 IonicContact NH2-OE1 3.65Å; R205-E207 PolarHBondContact NH2-OE1 3.04Å; E207-F232 WeakPolarHBondContact O-CA 3.44Å; E207-F232 WeakPolarHBondContact O-CB 3.49Å; E207-Y233 PolarHBondContact N-O 2.92Å; E207-Y233 PolarHBondContact O-N 3.18Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; E207-H287 PolarHBondContact O-CE1 3.22Å
208	P	96.9	Very high	94.6	Very high	66 Å²	66	67.5 Å²	67.5	43%	0.429	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-68.2	147.8	-179.6	26.2	-33	0	0	0	111.6	L290	P208-L290 HydrophobicContact CB-CD2 3.89Å
209	P	97.8	Very high	94.4	Very high	11 Å²	11	67.7 Å²	67.7	7%	0.071	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-65.9	137.8	179.2	26.5	-34	0	0	0	112.2	T211 A229 F232 I237 M285 H287 L290	P209-T211 HydrophobicContact CB-CG2 4.01Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-A229 HydrophobicContact CB-CB 3.88Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.18Å; P209-I237 HydrophobicContact CB-CD1 4.22Å; P209-I237 HydrophobicContact CG-CD1 4.14Å; P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-CG 4.46Å; P209-M285 HydrophobicContact CG-SD 3.38Å; P209-M285 WeakPolarHBondContact CG-SD 3.14Å; P209-H287 HydrophobicContact CG-CB 4.23Å; P209-L290 HydrophobicContact CG-CD1 4.11Å; P209-L290 HydrophobicContact CG-CD2 4.44Å; P209-L290 HydrophobicContact CG-CG 4.38Å
210	K	97.8	Very high	94	Very high	157 Å²	157	74.6 Å²	74.6	68%	0.683	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	117.3	162.2	-64.3	172.7	-171.9	165.8	0	108	L230	K210-L230 HydrophobicContact CB-CB 4.49Å; K210-L230 PolarHBondContact N-O 3.03Å; K210-L230 PolarHBondContact O-N 3.39Å
211	T	97.1	Very high	94	Very high	43 Å²	43	76.4 Å²	76.4	26%	0.264	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	144.7	-169.6	62.9	0	0	0	0	113.2	P209 W228 M285 L294 L296	P209-T211 HydrophobicContact CB-CG2 4.01Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 2.99Å; T211-M285 HydrophobicContact CG2-CE 3.49Å; T211-M285 VanDerWaalsContact CG2-CE 3.49Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.28Å; T211-L294 HydrophobicContact CG2-CD1 4.24Å; T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.06Å
212	H	96	Very high	94.2	Very high	82 Å²	82	72.4 Å²	72.4	38%	0.38	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	158	168.5	61.5	-72.5	0	0	0	110.5	W228	H212-W228 AromaticContact CD2-CD1 3.94Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.35Å; H212-W228 AromaticContact CE1-CD1 3.86Å; H212-W228 AromaticContact CE1-CG 3.63Å; H212-W228 PolarHBondContact N-O 3.15Å; H212-W228 AromaticContact NE2-CD1 3.45Å; H212-W228 AromaticContact NE2-CG 3.69Å; H212-W228 PolarHBondContact O-N 2.89Å
213	V	97.7	Very high	94.4	Very high	26 Å²	26	70.4 Å²	70.4	16%	0.158	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.3	174.7	-177.9	0	0	0	0	108.9	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.43Å; V213-L225 HydrophobicContact CG1-CD2 4.46Å; V213-R226 CarbonylContact C-O 3.54Å; V213-R226 WeakPolarHBondContact CA-O 3.49Å; V213-C227 HydrophobicContact CG2-CB 4.47Å; V213-W241 HydrophobicContact CG1-CH2 3.91Å; V213-W241 HydrophobicContact CG1-CZ2 4.38Å; V213-W241 HydrophobicContact CG2-CH2 4.44Å; V213-L296 HydrophobicContact CG2-CB 3.9Å; V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.84Å
214	T	96.4	Very high	94.6	Very high	32 Å²	32	71 Å²	71	20%	0.196	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	144.1	176.9	52	0	0	0	0	110.1	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.35Å; T214-H216 VanDerWaalsContact OG1-CE1 3.28Å; T214-L225 WeakPolarHBondContact O-CA 3.5Å; T214-R226 PolarHBondContact N-O 2.85Å; T214-R226 PolarHBondContact O-N 2.82Å; T214-R226 WeakPolarHBondContact OG1-CB 3.46Å; T214-R226 PolarHBondContact OG1-O 3.48Å; T214-R226 VanDerWaalsContact OG1-O 3.1Å; T214-W228 PolarHBondContact OG1-NE1 2.98Å
215	H	95.7	Very high	95	Very high	54 Å²	54	66.7 Å²	66.7	25%	0.25	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.5	-179.6	169.9	-92.2	0	0	0	109.7	A223 T224 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.37Å; H215-T224 WeakPolarHBondContact CA-O 3.33Å; H215-L225 HydrophobicContact CB-CD2 3.97Å; H215-E278 IonicContact NE2-OE1 3.18Å; H215-W298 HydrophobicContact CB-CD2 4.17Å; H215-W298 HydrophobicContact CB-CG 4.2Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.26Å; H215-W298 AromaticContact CG-CE2 3.8Å; H215-W298 AromaticContact CG-CZ2 3.83Å
216	H	94.3	Very high	95.3	Very high	79 Å²	79	65.1 Å²	65.1	37%	0.366	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	104.9	-179.1	-57.3	83.8	0	0	0	109	T214 L218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.35Å; T214-H216 VanDerWaalsContact OG1-CE1 3.28Å; H216-L218 PolarHBondContact O-N 3.04Å; H216-A223 CarbonylContact O-C 3.53Å; H216-A223 WeakPolarHBondContact O-CA 3.36Å; H216-T224 PolarHBondContact N-O 2.94Å; H216-T224 PolarHBondContact O-N 2.88Å; H216-R226 PolarHBondContact CE1-NH1 3.14Å; H216-R226 VanDerWaalsContact CE1-NH1 3.31Å
217	P	93.7	Very high	95.5	Very high	99 Å²	99	63.3 Å²	63.3	64%	0.643	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.9	130.8	174	-19.5	29.9	0	0	0	110.7
218	L	91.1	Very high	95.6	Very high	104 Å²	104	62.6 Å²	62.6	55%	0.545	32%	0.322	S	S	.	.			trans	-101.3	-40.8	173.6	-64.8	178.4	0	0	0	111	H216 E222 T224 V272	H216-L218 PolarHBondContact O-N 3.04Å; L218-E222 PolarHBondContact N-O 2.82Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.42Å; L218-V272 HydrophobicContact CD1-CG1 4.23Å; L218-V272 HydrophobicContact CD1-CG2 4.27Å
219	S	92	Very high	95.7	Very high	55 Å²	55	59.4 Å²	59.4	39%	0.385	30%	0.302	S	S	.	.	S	Bend	trans	-150.8	-178.2	176.7	71.7	0	0	0	0	110.3	H221 E222	S219-H221 PolarHBondContact O-N 2.92Å; S219-H221 PolarHBondContact OG-N 3.1Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; S219-E222 PolarHBondContact N-O 2.72Å; S219-E222 VanDerWaalsContact O-O 3.11Å; S219-E222 PolarHBondContact OG-N 2.83Å
220	D	89.1	Confident	95.7	Very high	149 Å²	149	61.5 Å²	61.5	80%	0.797	31%	0.312	S	S	*	.	S	Bend	trans	-63.1	-19.3	172.2	-65.8	-23	0	0	0	112.6	S275	D220-S275 WeakPolarHBondContact O-CB 3.35Å; D220-S275 PolarHBondContact O-OG 3.1Å
221	H	92.8	Very high	95.7	Very high	147 Å²	147	54.9 Å²	54.9	68%	0.681	29%	0.288	S	S	*	.	S	Bend	trans	-106.7	-17.2	-174	-56.4	-47.9	0	0	0	114.1	S219 P274 S275	S219-H221 PolarHBondContact O-N 2.92Å; S219-H221 PolarHBondContact OG-N 3.1Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.44Å; H221-S275 PolarHBondContact O-N 3.38Å; H221-S275 PolarHBondContact O-OG 3Å
222	E	95.1	Very high	95.7	Very high	95 Å²	95	52.8 Å²	52.8	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	146.6	-171.3	-66.3	-179.6	168.9	0	0	112.4	L218 S219 V272 V273 S275	L218-E222 PolarHBondContact N-O 2.82Å; S219-E222 PolarHBondContact N-O 2.72Å; S219-E222 VanDerWaalsContact O-O 3.11Å; S219-E222 PolarHBondContact OG-N 2.83Å; E222-V272 HydrophobicContact CB-CG1 4.14Å; E222-V272 HydrophobicContact CG-CG1 4.38Å; E222-V273 WeakPolarHBondContact CA-O 3.45Å; E222-S275 PolarHBondContact N-OG 2.84Å
223	A	95.6	Very high	95.7	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.6	172.4	0	0	0	0	0	110.9	H215 H216 V272 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.37Å; H216-A223 CarbonylContact O-C 3.53Å; H216-A223 WeakPolarHBondContact O-CA 3.36Å; A223-V272 WeakPolarHBondContact O-CA 3.45Å; A223-V273 HydrophobicContact CB-CG2 4.48Å; A223-V273 PolarHBondContact N-O 3.3Å; A223-V273 PolarHBondContact O-N 3.09Å
224	T	97.1	Very high	95.6	Very high	16 Å²	16	48.7 Å²	48.7	10%	0.098	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.8	169.9	-54.6	0	0	0	0	109.8	H215 H216 L218 A270 V271	H215-T224 WeakPolarHBondContact CA-O 3.33Å; H216-T224 PolarHBondContact N-O 2.94Å; H216-T224 PolarHBondContact O-N 2.88Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.42Å; T224-A270 HydrophobicContact CG2-CB 3.89Å; T224-V271 WeakPolarHBondContact CA-O 3.4Å
225	L	97.8	Very high	95.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128	163.9	-63.5	-176.1	0	0	0	109	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.43Å; V213-L225 HydrophobicContact CG1-CD2 4.46Å; T214-L225 WeakPolarHBondContact O-CA 3.5Å; H215-L225 HydrophobicContact CB-CD2 3.97Å; L225-W241 HydrophobicContact CB-CH2 3.72Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CB-CZ3 4.5Å; L225-W241 HydrophobicContact CD1-CH2 4.1Å; L225-W241 HydrophobicContact CD1-CZ3 4.26Å; L225-A270 CarbonylContact O-C 3.55Å; L225-A270 WeakPolarHBondContact O-CA 3.48Å; L225-V271 HydrophobicContact CB-CG1 4.26Å; L225-V271 PolarHBondContact N-O 3.02Å; L225-V271 PolarHBondContact O-N 2.88Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.15Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.49Å; L225-E278 HydrophobicContact CD2-CG 4.35Å; L225-W298 HydrophobicContact CD1-CB 4.33Å; L225-W298 HydrophobicContact CD2-CB 3.8Å; L225-W298 HydrophobicContact CD2-CD2 4.37Å; L225-W298 HydrophobicContact CD2-CG 3.91Å
226	R	98	Very high	95.6	Very high	51 Å²	51	52.1 Å²	52.1	19%	0.192	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	117.9	176.2	-179	-176.6	-61.9	117.2	2.8	110.4	V213 T214 H216 W228 W268 A269 A270	V213-R226 CarbonylContact C-O 3.54Å; V213-R226 WeakPolarHBondContact CA-O 3.49Å; T214-R226 PolarHBondContact N-O 2.85Å; T214-R226 PolarHBondContact O-N 2.82Å; T214-R226 WeakPolarHBondContact OG1-CB 3.46Å; T214-R226 PolarHBondContact OG1-O 3.48Å; T214-R226 VanDerWaalsContact OG1-O 3.1Å; H216-R226 PolarHBondContact CE1-NH1 3.14Å; H216-R226 VanDerWaalsContact CE1-NH1 3.31Å; R226-W228 HydrophobicContact CG-CZ2 4.39Å; R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.2Å; R226-A269 WeakPolarHBondContact CA-O 3.21Å; R226-A270 HydrophobicContact CB-CB 3.99Å; R226-A270 HydrophobicContact CG-CB 4.11Å
227	C	98	Very high	95.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.7	176.7	-176.3	0	0	0	0	109.4	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.47Å; C227-W241 HydrophobicContact CB-CH2 4.41Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; C227-W268 CarbonylContact O-C 3.56Å; C227-W268 WeakPolarHBondContact O-CA 3.41Å; C227-W268 WeakPolarHBondContact O-CB 3.42Å; C227-A269 PolarHBondContact N-O 2.82Å; C227-A269 PolarHBondContact O-N 3.35Å; C227-C283 HydrophobicContact CB-CB 3.54Å; C227-C283 WeakPolarHBondContact CB-SG 3.19Å; C227-C283 WeakPolarHBondContact SG-CB 3.38Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.44Å
228	W	98.3	Very high	95.8	Very high	47 Å²	47	47 Å²	47	18%	0.178	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.7	-178	-69.4	89.4	0	0	0	111.2	T211 H212 T214 R226 L230 W268	T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 2.99Å; H212-W228 AromaticContact CD2-CD1 3.94Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.35Å; H212-W228 AromaticContact CE1-CD1 3.86Å; H212-W228 AromaticContact CE1-CG 3.63Å; H212-W228 PolarHBondContact N-O 3.15Å; H212-W228 AromaticContact NE2-CD1 3.45Å; H212-W228 AromaticContact NE2-CG 3.69Å; H212-W228 PolarHBondContact O-N 2.89Å; T214-W228 PolarHBondContact OG1-NE1 2.98Å; R226-W228 HydrophobicContact CG-CZ2 4.39Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.44Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.45Å; W228-W268 HydrophobicContact CE3-CB 3.89Å; W228-W268 AromaticContact CE3-CD1 3.82Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.68Å; W228-W268 HydrophobicContact CH2-CG 4.3Å; W228-W268 HydrophobicContact CZ3-CB 4.33Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å
229	A	98.4	Very high	96.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122	163.3	0	0	0	0	0	107.8	P209 F232 I237 L239 Q266 K267 M285	P209-A229 HydrophobicContact CB-CB 3.88Å; A229-F232 HydrophobicContact CB-CD1 3.92Å; A229-F232 HydrophobicContact CB-CE1 3.65Å; A229-F232 WeakPolarHBondContact O-CE1 3.37Å; A229-I237 HydrophobicContact CB-CD1 3.69Å; A229-L239 HydrophobicContact CB-CD1 4.25Å; A229-L239 HydrophobicContact CB-CD2 4.28Å; A229-Q266 CarbonylContact O-C 3.42Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.04Å; A229-K267 PolarHBondContact N-O 3.42Å; A229-K267 PolarHBondContact O-N 2.84Å; A229-K267 VanDerWaalsContact O-O 3.09Å; A229-M285 HydrophobicContact CB-CE 3.68Å; A229-M285 HydrophobicContact CB-SD 3.92Å
230	L	98.3	Very high	96.4	Very high	54 Å²	54	41.8 Å²	41.8	28%	0.283	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.6	-176.6	-59	177.2	0	0	0	111	K210 W228 F232 Q266	K210-L230 HydrophobicContact CB-CB 4.49Å; K210-L230 PolarHBondContact N-O 3.03Å; K210-L230 PolarHBondContact O-N 3.39Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.44Å; L230-F232 PolarHBondContact O-N 2.94Å; L230-Q266 HydrophobicContact CD2-CB 3.58Å
231	G	97.6	Very high	96.8	Very high	18 Å²	18	34.8 Å²	34.8	19%	0.186	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.8	33.2	168.5	0	0	0	0	0	113.9	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.41Å; G231-F265 PolarHBondContact N-O 2.98Å
232	F	97.4	Very high	97	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	156	179.5	60	-89.9	0	0	0	112.4	E207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.44Å; E207-F232 WeakPolarHBondContact O-CB 3.49Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.18Å; A229-F232 HydrophobicContact CB-CD1 3.92Å; A229-F232 HydrophobicContact CB-CE1 3.65Å; A229-F232 WeakPolarHBondContact O-CE1 3.37Å; L230-F232 PolarHBondContact O-N 2.94Å; F232-P234 WeakPolarHBondContact CD2-O 3.22Å; F232-I237 HydrophobicContact CD1-CD1 4.01Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.05Å; F232-I237 HydrophobicContact CE1-CD1 3.9Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.78Å; F232-I237 HydrophobicContact CE2-CD1 3.96Å; F232-I237 HydrophobicContact CE2-CG1 4.46Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 4.09Å; F232-I237 HydrophobicContact CZ-CB 4.16Å; F232-I237 HydrophobicContact CZ-CD1 3.91Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; F232-T257 HydrophobicContact CE2-CG2 4.1Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 CarbonylContact O-C 3.52Å; F232-T264 WeakPolarHBondContact O-CA 3.46Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.47Å; F232-F265 HydrophobicContact CD2-CB 3.95Å; F232-F265 HydrophobicContact CE1-CB 4.25Å; F232-F265 WeakPolarHBondContact CE1-O 3.49Å; F232-F265 HydrophobicContact CE2-CB 3.5Å; F232-F265 VanDerWaalsContact CE2-CB 3.5Å; F232-F265 HydrophobicContact CE2-CG 4.49Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.65Å; F232-F265 PolarHBondContact N-O 3.46Å; F232-F265 PolarHBondContact O-N 3.39Å; F232-K267 HydrophobicContact CE1-CB 4.35Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; F232-H287 AromaticContact CD2-CD2 3.8Å; F232-H287 AromaticContact CD2-NE2 3.64Å
233	Y	96.2	Very high	97.1	Very high	4 Å²	4	29 Å²	29	2%	0.016	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-151.2	137.4	173.4	177.7	-84.2	0	0	0	108.9	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.01Å; T55-Y233 PolarHBondContact OG1-OH 2.83Å; R205-Y233 HydrophobicContact CG-CD1 4.22Å; R205-Y233 VanDerWaalsContact O-CD1 3.28Å; R205-Y233 WeakPolarHBondContact O-CD1 3.33Å; A206-Y233 CarbonylContact C-O 3.6Å; A206-Y233 WeakPolarHBondContact CA-O 3.41Å; E207-Y233 PolarHBondContact N-O 2.92Å; E207-Y233 PolarHBondContact O-N 3.18Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; Y233-G263 WeakPolarHBondContact CD2-O 3.29Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 AromaticContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CE2-CE2 4.48Å; Y233-H287 PolarHBondContact O-CE1 3.22Å
234	P	95.4	Very high	97	Very high	18 Å²	18	33.6 Å²	33.6	12%	0.117	17%	0.171	C	C	.	.	S	Bend	cis	-71.5	179.2	1.4	30.9	-36.5	0	0	0	113.1	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.3Å; D54-P234 WeakPolarHBondContact OD2-CB 3.38Å; F232-P234 WeakPolarHBondContact CD2-O 3.22Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.26Å; P234-H287 PolarHBondContact O-NE2 3.24Å; P234-E288 HydrophobicContact CG-CB 4.24Å
235	A	96.5	Very high	96.7	Very high	14 Å²	14	35.3 Å²	35.3	12%	0.116	19%	0.192	C	C	.	.	S	Bend	trans	-70.7	-25.3	-175.5	0	0	0	0	0	113.7	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.34Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.4Å; D54-A235 PolarHBondContact OD2-N 3.28Å; A235-I237 PolarHBondContact O-N 3.38Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; A235-F265 HydrophobicContact CB-CD1 3.73Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.67Å; A235-F265 HydrophobicContact CB-CG 3.74Å; A235-F265 HydrophobicContact CB-CZ 3.69Å
236	E	95.6	Very high	96.6	Very high	144 Å²	144	41.5 Å²	41.5	67%	0.673	22%	0.221	S	C	*	.			trans	-64.4	116.8	179.6	-171.4	58.8	-144.7	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.26Å; E236-H287 PolarHBondContact O-CD2 3.2Å
237	I	96	Very high	96.4	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.051	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	139.1	-178.5	-165.3	170.8	0	0	0	109.6	P209 A229 F232 A235 L239 K267 M285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.22Å; P209-I237 HydrophobicContact CG-CD1 4.14Å; A229-I237 HydrophobicContact CB-CD1 3.69Å; F232-I237 HydrophobicContact CD1-CD1 4.01Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.05Å; F232-I237 HydrophobicContact CE1-CD1 3.9Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.78Å; F232-I237 HydrophobicContact CE2-CD1 3.96Å; F232-I237 HydrophobicContact CE2-CG1 4.46Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 4.09Å; F232-I237 HydrophobicContact CZ-CB 4.16Å; F232-I237 HydrophobicContact CZ-CD1 3.91Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; A235-I237 PolarHBondContact O-N 3.38Å; I237-L239 HydrophobicContact CB-CD1 4.39Å; I237-L239 HydrophobicContact CD1-CD1 3.64Å; I237-L239 HydrophobicContact CG1-CD1 3.57Å; I237-L239 HydrophobicContact CG2-CD1 4.05Å; I237-K267 HydrophobicContact CG2-CB 4.26Å; I237-K267 HydrophobicContact CG2-CD 3.57Å; I237-M285 HydrophobicContact CD1-CG 4.16Å; I237-M285 HydrophobicContact CD1-SD 4.03Å; I237-M285 HydrophobicContact CG1-CG 4.38Å; I237-Q286 WeakPolarHBondContact CG1-O 3.41Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 4Å
238	T	96.6	Very high	96.3	Very high	60 Å²	60	44.2 Å²	44.2	37%	0.368	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.1	175.2	-62.8	0	0	0	0	110.1	T240 M285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.19Å; T238-M285 VanDerWaalsContact O-CA 3.32Å; T238-M285 WeakPolarHBondContact O-CA 3.4Å; T238-Q286 PolarHBondContact N-O 3.34Å; T238-Q286 PolarHBondContact O-N 3.47Å
239	L	96.9	Very high	95.7	Very high	7 Å²	7	47 Å²	47	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126	174.2	-86.4	65.3	0	0	0	108.9	A229 I237 L254 K267 A269 H284 M285	A229-L239 HydrophobicContact CB-CD1 4.25Å; A229-L239 HydrophobicContact CB-CD2 4.28Å; I237-L239 HydrophobicContact CB-CD1 4.39Å; I237-L239 HydrophobicContact CD1-CD1 3.64Å; I237-L239 HydrophobicContact CG1-CD1 3.57Å; I237-L239 HydrophobicContact CG2-CD1 4.05Å; L239-L254 HydrophobicContact CB-CD1 4.1Å; L239-K267 HydrophobicContact CD1-CD 4.2Å; L239-K267 HydrophobicContact CD2-CB 4.44Å; L239-K267 HydrophobicContact CD2-CG 4.45Å; L239-A269 HydrophobicContact CB-CB 4.12Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; L239-H284 WeakPolarHBondContact CA-O 3.26Å; L239-M285 HydrophobicContact CD1-CE 4.11Å; L239-M285 HydrophobicContact CD1-CG 4.03Å; L239-M285 HydrophobicContact CD1-SD 4.44Å; L239-M285 HydrophobicContact CD2-CE 4.25Å; L239-M285 HydrophobicContact CG-CE 3.99Å
240	T	96.9	Very high	95.2	Very high	43 Å²	43	56 Å²	56	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	142.2	178.6	50.2	0	0	0	0	110.6	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.19Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; T240-H284 PolarHBondContact N-O 3.18Å; T240-H284 PolarHBondContact O-N 2.74Å; T240-H284 WeakPolarHBondContact OG1-CB 3.43Å; T240-H284 PolarHBondContact OG1-O 3.43Å
241	W	97.9	Very high	94.6	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.2	168.8	-82.9	105.3	0	0	0	109.6	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.91Å; V213-W241 HydrophobicContact CG1-CZ2 4.38Å; V213-W241 HydrophobicContact CG2-CH2 4.44Å; L225-W241 HydrophobicContact CB-CH2 3.72Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CB-CZ3 4.5Å; L225-W241 HydrophobicContact CD1-CH2 4.1Å; L225-W241 HydrophobicContact CD1-CZ3 4.26Å; C227-W241 HydrophobicContact CB-CH2 4.41Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 2.78Å; W241-A269 VanDerWaalsContact NE1-C 3.35Å; W241-A269 PolarHBondContact NE1-O 2.81Å; W241-V271 HydrophobicContact CB-CG1 4.35Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4.02Å; W241-V271 HydrophobicContact CG-CB 4.13Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.33Å; W241-T282 VanDerWaalsContact CE3-C 3.42Å; W241-C283 HydrophobicContact CD2-CB 4.17Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.02Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4Å
242	Q	97.4	Very high	94.4	Very high	38 Å²	38	59.1 Å²	59.1	18%	0.178	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146.1	172	-69.1	-172.1	-6.1	0	0	110.3	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.49Å; Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.2Å; Q242-D247 PolarHBondContact NE2-OD1 3.17Å; Q242-Y281 CarbonylContact O-C 3.57Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.43Å; Q242-T282 PolarHBondContact N-O 2.81Å; Q242-T282 PolarHBondContact O-N 3.27Å; Q242-H284 PolarHBondContact OE1-CE1 2.79Å; Q242-H284 PolarHBondContact OE1-NE2 3.24Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.1Å
243	R	96.8	Very high	94.3	Very high	82 Å²	82	64.7 Å²	64.7	31%	0.309	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116.5	168.4	-176.6	-176.9	69	-166.7	-5.7	108.5	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 2.96Å; R243-G245 VanDerWaalsContact O-N 3.09Å; R243-E246 PolarHBondContact N-O 2.86Å; R243-E246 PolarHBondContact O-N 3.09Å; R243-Q248 HydrophobicContact CB-CG 3.95Å; R243-R280 WeakPolarHBondContact CA-O 3.24Å; R243-R280 HydrophobicContact CG-CB 4.38Å; R243-Y281 HydrophobicContact CB-CD1 4.11Å; R243-Y281 HydrophobicContact CB-CE1 3.93Å; R243-Y281 WeakPolarHBondContact CD-OH 3.41Å; R243-Y281 HydrophobicContact CG-CD1 4.48Å; R243-Y281 HydrophobicContact CG-CD2 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.14Å; R243-Y281 HydrophobicContact CG-CE2 4.09Å
244	D	94.4	Very high	94.3	Very high	98 Å²	98	68.7 Å²	68.7	52%	0.524	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	32.3	-174.5	-47.1	-61	0	0	0	113.8	R280	D244-R280 PolarHBondContact N-O 3.19Å; D244-R280 IonicContact OD1-CZ 3.42Å; D244-R280 IonicContact OD1-NE 3.5Å; D244-R280 PolarHBondContact OD1-NE 3.32Å; D244-R280 VanDerWaalsContact OD1-NE 3.1Å; D244-R280 IonicContact OD1-NH2 2.74Å; D244-R280 IonicContact OD2-CZ 3.52Å; D244-R280 IonicContact OD2-NE 3.93Å; D244-R280 PolarHBondContact OD2-NE 3.37Å; D244-R280 IonicContact OD2-NH2 3.54Å; D244-R280 PolarHBondContact OD2-NH2 3.39Å
245	G	90.9	Very high	94.4	Very high	51 Å²	51	69.4 Å²	69.4	53%	0.526	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	-0.3	-177.6	0	0	0	0	0	115.9	R243	R243-G245 PolarHBondContact O-N 2.96Å; R243-G245 VanDerWaalsContact O-N 3.09Å
246	E	94.9	Very high	94.4	Very high	130 Å²	130	77 Å²	77	61%	0.607	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.9	175.3	-64	-175	164.5	0	0	111.9	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.49Å; R243-E246 PolarHBondContact N-O 2.86Å; R243-E246 PolarHBondContact O-N 3.09Å; E246-Q248 PolarHBondContact O-NE2 2.91Å
247	D	94.8	Very high	94.5	Very high	93 Å²	93	72.3 Å²	72.3	50%	0.497	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	133.9	179.1	-68.5	-20.3	0	0	0	112.5	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.2Å; Q242-D247 PolarHBondContact NE2-OD1 3.17Å
248	Q	94.3	Very high	94.6	Very high	15 Å²	15	76.4 Å²	76.4	7%	0.07	40%	0.397	C	S	.	.			trans	-105.2	39.8	-178	-57.3	-58.9	-69.2	0	0	112.1	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 2.78Å; R243-Q248 HydrophobicContact CB-CG 3.95Å; E246-Q248 PolarHBondContact O-NE2 2.91Å; Q248-Q250 VanDerWaalsContact C-N 3.33Å; Q248-Q250 PolarHBondContact O-N 3.24Å; Q248-D251 PolarHBondContact O-N 3.34Å; Q248-T252 VanDerWaalsContact O-CB 3.32Å; Q248-T252 WeakPolarHBondContact O-CB 3.44Å; Q248-T252 PolarHBondContact O-N 2.86Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 3.3Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å
249	T	87.4	Confident	94.6	Very high	106 Å²	106	78.1 Å²	78.1	65%	0.65	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-37.4	-169.5	-45.2	0	0	0	0	114.1
250	Q	87.4	Confident	94.6	Very high	190 Å²	190	80.1 Å²	80.1	89%	0.888	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-31.5	-178.4	-66.8	-174.9	6.9	0	0	113.1	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.33Å; Q248-Q250 PolarHBondContact O-N 3.24Å; Q250-T252 VanDerWaalsContact C-N 3.33Å
251	D	85.1	Confident	94.4	Very high	113 Å²	113	81.7 Å²	81.7	60%	0.604	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	1.4	-177.9	-58.8	-45.5	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 3.34Å
252	T	93.6	Very high	94.2	Very high	24 Å²	24	87 Å²	87	15%	0.147	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.9	-179.7	-64	0	0	0	0	110.8	Q248 Q250 L254 A269 A270	Q248-T252 VanDerWaalsContact O-CB 3.32Å; Q248-T252 WeakPolarHBondContact O-CB 3.44Å; Q248-T252 PolarHBondContact O-N 2.86Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 3.3Å; Q250-T252 VanDerWaalsContact C-N 3.33Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 3.44Å; T252-A269 HydrophobicContact CG2-CB 3.93Å; T252-A270 CarbonylContact C-O 3.48Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.43Å
253	E	96.1	Very high	93.9	Very high	116 Å²	116	87.3 Å²	87.3	54%	0.542	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	105.7	163.4	-173.7	-174.7	-171.7	0	0	108.9	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.22Å; E253-W268 HydrophobicContact CG-CH2 3.9Å; E253-W268 HydrophobicContact CG-CZ3 3.83Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.33Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.49Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.1Å; E253-A270 PolarHBondContact O-N 2.9Å
254	L	96.3	Very high	93.9	Very high	88 Å²	88	83.8 Å²	83.8	46%	0.461	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.3	177.8	-174.5	68.3	0	0	0	109.9	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.1Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 3.44Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; L254-A269 HydrophobicContact CD1-CB 3.68Å
255	V	96.6	Very high	94.1	Very high	33 Å²	33	80.3 Å²	80.3	20%	0.2	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-82.8	152.8	174.8	-64.8	0	0	0	0	112	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.42Å; V255-K267 WeakPolarHBondContact O-CE 3.41Å; V255-K267 WeakPolarHBondContact O-CG 3.36Å; V255-K267 PolarHBondContact O-NZ 2.81Å; V255-W268 HydrophobicContact CB-CD2 4.47Å; V255-W268 HydrophobicContact CB-CZ2 4.38Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.05Å; V255-W268 HydrophobicContact CG2-CD2 3.72Å; V255-W268 HydrophobicContact CG2-CE3 4.44Å; V255-W268 HydrophobicContact CG2-CG 3.71Å; V255-W268 HydrophobicContact CG2-CZ2 4.38Å; V255-W268 WeakPolarHBondContact CG2-O 3.32Å; V255-W268 PolarHBondContact N-O 2.81Å
256	E	96.8	Very high	94.5	Very high	173 Å²	173	80 Å²	80	81%	0.808	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-57.5	148.5	167.5	-67.5	-176.6	173.8	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 2.79Å
257	T	97.8	Very high	94.6	Very high	46 Å²	46	74.9 Å²	74.9	28%	0.282	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-67.9	129.7	174	-56	0	0	0	0	108.4	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.1Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; T257-F265 HydrophobicContact CG2-CB 3.77Å; T257-F265 HydrophobicContact CG2-CD1 3.9Å; T257-F265 HydrophobicContact CG2-CG 4.1Å; T257-K267 WeakPolarHBondContact OG1-CD 3.38Å; T257-K267 PolarHBondContact OG1-NZ 2.87Å
258	R	97.4	Very high	94.8	Very high	97 Å²	97	71.6 Å²	71.6	37%	0.366	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.9	-174.7	68.8	-167.8	-179.5	-174.2	3.6	111.4	E256 F265 Q266	E256-R258 PolarHBondContact O-N 2.79Å; R258-F265 WeakPolarHBondContact O-CA 3.21Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.27Å; R258-Q266 WeakPolarHBondContact O-CG 3.14Å; R258-Q266 PolarHBondContact O-N 3.13Å
259	P	97.3	Very high	95	Very high	95 Å²	95	70.9 Å²	70.9	62%	0.617	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.6	178.2	28.5	-34.5	0	0	0	111.1	F265	P259-F265 HydrophobicContact CB-CE1 4.3Å
260	A	96.8	Very high	95.5	Very high	49 Å²	49	66 Å²	66	41%	0.405	37%	0.369	S	S	.	.			trans	-87.5	-18.5	172.9	0	0	0	0	0	112.9	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.47Å; A260-T264 WeakPolarHBondContact CB-O 3.48Å; A260-T264 PolarHBondContact N-O 2.97Å
261	G	93.5	Very high	95.9	Very high	76 Å²	76	57 Å²	57	78%	0.784	33%	0.327	S	S	*	.	S	Bend	trans	96.9	-6.3	179	0	0	0	0	0	114.8
262	D	92.9	Very high	96.5	Very high	114 Å²	114	55 Å²	55	61%	0.61	32%	0.319	S	S	*	.	S	Bend	trans	-105.3	11.3	176.2	60.4	1.8	0	0	0	113	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.47Å; D262-T264 WeakPolarHBondContact OD1-CB 3.3Å; D262-T264 PolarHBondContact OD1-N 2.57Å; D262-T264 PolarHBondContact OD1-OG1 2.79Å
263	G	91.9	Very high	96.7	Very high	44 Å²	44	54 Å²	54	45%	0.454	31%	0.312	S	S	.	.	S	Bend	trans	92	-4.4	-174.1	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.29Å
264	T	96.7	Very high	96.6	Very high	8 Å²	8	50.6 Å²	50.6	5%	0.049	30%	0.301	C	S	.	.			trans	-103.2	173.1	175.3	73.5	0	0	0	0	112.5	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.41Å; F232-T264 CarbonylContact O-C 3.52Å; F232-T264 WeakPolarHBondContact O-CA 3.46Å; A260-T264 WeakPolarHBondContact CB-O 3.48Å; A260-T264 PolarHBondContact N-O 2.97Å; D262-T264 WeakPolarHBondContact OD1-CB 3.3Å; D262-T264 PolarHBondContact OD1-N 2.57Å; D262-T264 PolarHBondContact OD1-OG1 2.79Å
265	F	98.1	Very high	96.4	Very high	26 Å²	26	49 Å²	49	11%	0.114	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	163.2	-177.4	-63.9	-86	0	0	0	112.4	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.78Å; D54-F265 HydrophobicContact CB-CZ 3.73Å; G231-F265 PolarHBondContact N-O 2.98Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.47Å; F232-F265 HydrophobicContact CD2-CB 3.95Å; F232-F265 HydrophobicContact CE1-CB 4.25Å; F232-F265 WeakPolarHBondContact CE1-O 3.49Å; F232-F265 HydrophobicContact CE2-CB 3.5Å; F232-F265 VanDerWaalsContact CE2-CB 3.5Å; F232-F265 HydrophobicContact CE2-CG 4.49Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.65Å; F232-F265 PolarHBondContact N-O 3.46Å; F232-F265 PolarHBondContact O-N 3.39Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 AromaticContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CE2-CE2 4.48Å; A235-F265 HydrophobicContact CB-CD1 3.73Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.67Å; A235-F265 HydrophobicContact CB-CG 3.74Å; A235-F265 HydrophobicContact CB-CZ 3.69Å; T257-F265 HydrophobicContact CG2-CB 3.77Å; T257-F265 HydrophobicContact CG2-CD1 3.9Å; T257-F265 HydrophobicContact CG2-CG 4.1Å; R258-F265 WeakPolarHBondContact O-CA 3.21Å; P259-F265 HydrophobicContact CB-CE1 4.3Å
266	Q	98.2	Very high	96.1	Very high	44 Å²	44	50.8 Å²	50.8	21%	0.206	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.2	174	41.9	166.7	-19	0	0	110	A229 L230 R258	A229-Q266 CarbonylContact O-C 3.42Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.04Å; L230-Q266 HydrophobicContact CD2-CB 3.58Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.27Å; R258-Q266 WeakPolarHBondContact O-CG 3.14Å; R258-Q266 PolarHBondContact O-N 3.13Å
267	K	98.4	Very high	96	Very high	22 Å²	22	45.6 Å²	45.6	10%	0.096	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	154.8	177.3	-162.6	-176	-172.6	69.6	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.42Å; A229-K267 PolarHBondContact O-N 2.84Å; A229-K267 VanDerWaalsContact O-O 3.09Å; F232-K267 HydrophobicContact CE1-CB 4.35Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; I237-K267 HydrophobicContact CG2-CB 4.26Å; I237-K267 HydrophobicContact CG2-CD 3.57Å; L239-K267 HydrophobicContact CD1-CD 4.2Å; L239-K267 HydrophobicContact CD2-CB 4.44Å; L239-K267 HydrophobicContact CD2-CG 4.45Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; V255-K267 HydrophobicContact CG2-CG 4.42Å; V255-K267 WeakPolarHBondContact O-CE 3.41Å; V255-K267 WeakPolarHBondContact O-CG 3.36Å; V255-K267 PolarHBondContact O-NZ 2.81Å; T257-K267 WeakPolarHBondContact OG1-CD 3.38Å; T257-K267 PolarHBondContact OG1-NZ 2.87Å
268	W	98.1	Very high	95.9	Very high	25 Å²	25	44.4 Å²	44.4	10%	0.095	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157.1	169.4	58.3	-98.5	0	0	0	111.4	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.2Å; C227-W268 CarbonylContact O-C 3.56Å; C227-W268 WeakPolarHBondContact O-CA 3.41Å; C227-W268 WeakPolarHBondContact O-CB 3.42Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.45Å; W228-W268 HydrophobicContact CE3-CB 3.89Å; W228-W268 AromaticContact CE3-CD1 3.82Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.68Å; W228-W268 HydrophobicContact CH2-CG 4.3Å; W228-W268 HydrophobicContact CZ3-CB 4.33Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å; E253-W268 HydrophobicContact CB-CZ3 4.22Å; E253-W268 HydrophobicContact CG-CH2 3.9Å; E253-W268 HydrophobicContact CG-CZ3 3.83Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.33Å; V255-W268 HydrophobicContact CB-CD2 4.47Å; V255-W268 HydrophobicContact CB-CZ2 4.38Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.05Å; V255-W268 HydrophobicContact CG2-CD2 3.72Å; V255-W268 HydrophobicContact CG2-CE3 4.44Å; V255-W268 HydrophobicContact CG2-CG 3.71Å; V255-W268 HydrophobicContact CG2-CZ2 4.38Å; V255-W268 WeakPolarHBondContact CG2-O 3.32Å; V255-W268 PolarHBondContact N-O 2.81Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
269	A	98.1	Very high	95.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.5	173.1	0	0	0	0	0	108.4	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.21Å; C227-A269 PolarHBondContact N-O 2.82Å; C227-A269 PolarHBondContact O-N 3.35Å; L239-A269 HydrophobicContact CB-CB 4.12Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; W241-A269 VanDerWaalsContact NE1-C 3.35Å; W241-A269 PolarHBondContact NE1-O 2.81Å; T252-A269 HydrophobicContact CG2-CB 3.93Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.49Å; L254-A269 HydrophobicContact CD1-CB 3.68Å
270	A	97.7	Very high	95.6	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145	179.2	0	0	0	0	0	112	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.89Å; L225-A270 CarbonylContact O-C 3.55Å; L225-A270 WeakPolarHBondContact O-CA 3.48Å; R226-A270 HydrophobicContact CB-CB 3.99Å; R226-A270 HydrophobicContact CG-CB 4.11Å; T252-A270 CarbonylContact C-O 3.48Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.43Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.1Å; E253-A270 PolarHBondContact O-N 2.9Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
271	V	97.6	Very high	95.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142	176.5	62.9	0	0	0	0	109	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.4Å; L225-V271 HydrophobicContact CB-CG1 4.26Å; L225-V271 PolarHBondContact N-O 3.02Å; L225-V271 PolarHBondContact O-N 2.88Å; W241-V271 HydrophobicContact CB-CG1 4.35Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4.02Å; W241-V271 HydrophobicContact CG-CB 4.13Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.33Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.44Å; V271-Y281 HydrophobicContact CG1-CD1 4Å; V271-Y281 HydrophobicContact CG1-CE1 4.43Å; V271-Y281 HydrophobicContact CG2-CD1 4.33Å; V271-Y281 HydrophobicContact CG2-CE1 3.99Å
272	V	97.1	Very high	95.8	Very high	71 Å²	71	41.4 Å²	41.4	43%	0.43	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.6	171.6	-179	0	0	0	0	108.2	L218 E222 A223	L218-V272 HydrophobicContact CD1-CG1 4.23Å; L218-V272 HydrophobicContact CD1-CG2 4.27Å; E222-V272 HydrophobicContact CB-CG1 4.14Å; E222-V272 HydrophobicContact CG-CG1 4.38Å; A223-V272 WeakPolarHBondContact O-CA 3.45Å
273	V	96.3	Very high	96.1	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.7	-175.6	-52.3	0	0	0	0	110.5	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.45Å; A223-V273 HydrophobicContact CB-CG2 4.48Å; A223-V273 PolarHBondContact N-O 3.3Å; A223-V273 PolarHBondContact O-N 3.09Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.15Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.44Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.73Å; V273-Y281 HydrophobicContact CG1-CD1 3.68Å; V273-Y281 HydrophobicContact CG1-CD2 3.59Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å
274	P	95.8	Very high	96.3	Very high	46 Å²	46	35.9 Å²	35.9	30%	0.299	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	139.3	170.5	-19.3	31.9	0	0	0	111.3	H221 G276 Q277	H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.44Å; P274-G276 PolarHBondContact O-N 3.22Å; P274-Q277 HydrophobicContact CB-CB 4.4Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.46Å; P274-Q277 PolarHBondContact O-N 2.81Å
275	S	91.8	Very high	96.3	Very high	55 Å²	55	35.5 Å²	35.5	39%	0.385	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	130.5	175.4	-61.5	0	0	0	0	111.1	D220 H221 E222 Q277 E278	D220-S275 WeakPolarHBondContact O-CB 3.35Å; D220-S275 PolarHBondContact O-OG 3.1Å; H221-S275 PolarHBondContact O-N 3.38Å; H221-S275 PolarHBondContact O-OG 3Å; E222-S275 PolarHBondContact N-OG 2.84Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; S275-E278 WeakPolarHBondContact CA-OE1 3.28Å
276	G	90.8	Very high	96.2	Very high	69 Å²	69	39 Å²	39	71%	0.711	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	-2.1	-178.5	0	0	0	0	0	115	P274 E278	P274-G276 PolarHBondContact O-N 3.22Å; G276-E278 WeakPolarHBondContact CA-OE2 3.24Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.23Å; G276-E278 PolarHBondContact N-OE2 3.22Å
277	Q	94.4	Very high	96.1	Very high	65 Å²	65	37 Å²	37	30%	0.304	20%	0.203	S	C	.	.			trans	-106	6.7	175.1	-60.7	-168.6	40.2	0	0	113.1	P274 S275 Q279 R280 Y281	P274-Q277 HydrophobicContact CB-CB 4.4Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.46Å; P274-Q277 PolarHBondContact O-N 2.81Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; Q277-Q279 PolarHBondContact O-N 2.87Å; Q277-Q279 VanDerWaalsContact O-N 3.13Å; Q277-R280 WeakPolarHBondContact O-CB 3.42Å; Q277-R280 PolarHBondContact O-N 2.86Å; Q277-Y281 HydrophobicContact CB-CE2 4.47Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.34Å
278	E	94.2	Very high	95.8	Very high	20 Å²	20	39 Å²	39	9%	0.093	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57.1	-35	-173.1	-57.7	80.6	-177.2	0	0	112.3	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.18Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.49Å; L225-E278 HydrophobicContact CD2-CG 4.35Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; S275-E278 WeakPolarHBondContact CA-OE1 3.28Å; G276-E278 WeakPolarHBondContact CA-OE2 3.24Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.23Å; G276-E278 PolarHBondContact N-OE2 3.22Å; E278-R280 PolarHBondContact O-N 2.83Å; E278-Y281 PolarHBondContact O-N 3.46Å; E278-Y281 VanDerWaalsContact O-N 3.14Å; E278-W298 HydrophobicContact CB-CD2 4.35Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.77Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.73Å
279	Q	93.9	Very high	95.5	Very high	108 Å²	108	39.1 Å²	39.1	51%	0.505	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-69.9	-16	180	-62.5	-57.4	-42	0	0	114.1	Q277 W298	Q277-Q279 PolarHBondContact O-N 2.87Å; Q277-Q279 VanDerWaalsContact O-N 3.13Å; Q279-W298 PolarHBondContact NE2-O 3.39Å
280	R	95.9	Very high	95.3	Very high	108 Å²	108	40.2 Å²	40.2	41%	0.408	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-78.6	-13.6	174.2	-63.7	175.2	68.2	-176.6	8	112.3	R243 D244 Q277 E278	R243-R280 WeakPolarHBondContact CA-O 3.24Å; R243-R280 HydrophobicContact CG-CB 4.38Å; D244-R280 PolarHBondContact N-O 3.19Å; D244-R280 IonicContact OD1-CZ 3.42Å; D244-R280 IonicContact OD1-NE 3.5Å; D244-R280 PolarHBondContact OD1-NE 3.32Å; D244-R280 VanDerWaalsContact OD1-NE 3.1Å; D244-R280 IonicContact OD1-NH2 2.74Å; D244-R280 IonicContact OD2-CZ 3.52Å; D244-R280 IonicContact OD2-NE 3.93Å; D244-R280 PolarHBondContact OD2-NE 3.37Å; D244-R280 IonicContact OD2-NH2 3.54Å; D244-R280 PolarHBondContact OD2-NH2 3.39Å; Q277-R280 WeakPolarHBondContact O-CB 3.42Å; Q277-R280 PolarHBondContact O-N 2.86Å; E278-R280 PolarHBondContact O-N 2.83Å
281	Y	96.9	Very high	95	Very high	7 Å²	7	49.6 Å²	49.6	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.9	-177.4	-69.7	-101	0	0	0	110.7	Q242 R243 Q248 V271 V273 Q277 E278	Q242-Y281 CarbonylContact O-C 3.57Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.43Å; R243-Y281 HydrophobicContact CB-CD1 4.11Å; R243-Y281 HydrophobicContact CB-CE1 3.93Å; R243-Y281 WeakPolarHBondContact CD-OH 3.41Å; R243-Y281 HydrophobicContact CG-CD1 4.48Å; R243-Y281 HydrophobicContact CG-CD2 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.14Å; R243-Y281 HydrophobicContact CG-CE2 4.09Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å; V271-Y281 HydrophobicContact CG1-CD1 4Å; V271-Y281 HydrophobicContact CG1-CE1 4.43Å; V271-Y281 HydrophobicContact CG2-CD1 4.33Å; V271-Y281 HydrophobicContact CG2-CE1 3.99Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.73Å; V273-Y281 HydrophobicContact CG1-CD1 3.68Å; V273-Y281 HydrophobicContact CG1-CD2 3.59Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å; Q277-Y281 HydrophobicContact CB-CE2 4.47Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.34Å; E278-Y281 PolarHBondContact O-N 3.46Å; E278-Y281 VanDerWaalsContact O-N 3.14Å
282	T	97.6	Very high	94.8	Very high	32 Å²	32	56.8 Å²	56.8	20%	0.196	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.4	177.3	51.4	0	0	0	0	110.4	W241 Q242 H284 T295 L296	W241-T282 VanDerWaalsContact CE3-C 3.42Å; Q242-T282 PolarHBondContact N-O 2.81Å; Q242-T282 PolarHBondContact O-N 3.27Å; T282-H284 PolarHBondContact OG1-NE2 3.06Å; T282-T295 HydrophobicContact CG2-CG2 4.01Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.39Å
283	C	97.7	Very high	94.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.3	171.8	175.4	0	0	0	0	109.1	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.54Å; C227-C283 WeakPolarHBondContact CB-SG 3.19Å; C227-C283 WeakPolarHBondContact SG-CB 3.38Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.44Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; W241-C283 HydrophobicContact CD2-CB 4.17Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.02Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4Å; C283-T295 CarbonylContact O-C 3.59Å; C283-T295 WeakPolarHBondContact O-CA 3.4Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 2.82Å; C283-L296 PolarHBondContact O-N 3.49Å
284	H	97.1	Very high	94.6	Very high	41 Å²	41	59.9 Å²	59.9	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.8	176.2	-68.4	-108.3	0	0	0	109.8	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.26Å; T240-H284 PolarHBondContact N-O 3.18Å; T240-H284 PolarHBondContact O-N 2.74Å; T240-H284 WeakPolarHBondContact OG1-CB 3.43Å; T240-H284 PolarHBondContact OG1-O 3.43Å; Q242-H284 PolarHBondContact OE1-CE1 2.79Å; Q242-H284 PolarHBondContact OE1-NE2 3.24Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.1Å; T282-H284 PolarHBondContact OG1-NE2 3.06Å; H284-L294 CarbonylContact C-O 3.58Å; H284-L294 WeakPolarHBondContact CA-O 3.27Å; H284-T295 PolarHBondContact CE1-OG1 2.87Å; H284-T295 PolarHBondContact ND1-OG1 2.77Å
285	M	96.5	Very high	94.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.2	-174.3	-173.4	176	-56.8	0	0	111.6	P209 T211 A229 I237 T238 L239 L290 P293 L294 L296	P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-CG 4.46Å; P209-M285 HydrophobicContact CG-SD 3.38Å; P209-M285 WeakPolarHBondContact CG-SD 3.14Å; T211-M285 HydrophobicContact CG2-CE 3.49Å; T211-M285 VanDerWaalsContact CG2-CE 3.49Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.28Å; A229-M285 HydrophobicContact CB-CE 3.68Å; A229-M285 HydrophobicContact CB-SD 3.92Å; I237-M285 HydrophobicContact CD1-CG 4.16Å; I237-M285 HydrophobicContact CD1-SD 4.03Å; I237-M285 HydrophobicContact CG1-CG 4.38Å; T238-M285 VanDerWaalsContact O-CA 3.32Å; T238-M285 WeakPolarHBondContact O-CA 3.4Å; L239-M285 HydrophobicContact CD1-CE 4.11Å; L239-M285 HydrophobicContact CD1-CG 4.03Å; L239-M285 HydrophobicContact CD1-SD 4.44Å; L239-M285 HydrophobicContact CD2-CE 4.25Å; L239-M285 HydrophobicContact CG-CE 3.99Å; M285-L290 HydrophobicContact CG-CD1 4.34Å; M285-P293 CarbonylContact O-C 3.57Å; M285-P293 WeakPolarHBondContact O-CA 3.41Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.98Å; M285-L294 PolarHBondContact O-N 2.89Å; M285-L296 HydrophobicContact CE-CD1 4.3Å
286	Q	96.6	Very high	94.8	Very high	100 Å²	100	60.6 Å²	60.6	47%	0.467	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.4	175.5	-58.2	178.8	12.2	0	0	109.3	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.41Å; T238-Q286 PolarHBondContact N-O 3.34Å; T238-Q286 PolarHBondContact O-N 3.47Å; Q286-P293 HydrophobicContact CG-CB 4.04Å; Q286-P293 HydrophobicContact CG-CG 4.18Å
287	H	95.4	Very high	95	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.009	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	142.2	-177.6	-177.7	-98.2	0	0	0	112.1	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.32Å; W23-H287 VanDerWaalsContact CZ3-C 3.46Å; E207-H287 PolarHBondContact O-CE1 3.22Å; P209-H287 HydrophobicContact CG-CB 4.23Å; F232-H287 AromaticContact CD2-CD2 3.8Å; F232-H287 AromaticContact CD2-NE2 3.64Å; Y233-H287 PolarHBondContact O-CE1 3.22Å; P234-H287 PolarHBondContact O-NE2 3.24Å; E236-H287 PolarHBondContact O-CD2 3.2Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 4Å; H287-G289 PolarHBondContact ND1-N 2.93Å; H287-G289 PolarHBondContact O-N 2.74Å; H287-G289 VanDerWaalsContact O-N 3.15Å; H287-L290 HydrophobicContact CB-CD1 3.89Å; H287-L290 HydrophobicContact CB-CG 4.1Å; H287-L290 WeakPolarHBondContact O-CB 3.39Å; H287-L290 PolarHBondContact O-N 3.11Å
288	E	92.3	Very high	95	Very high	65 Å²	65	59.3 Å²	59.3	30%	0.304	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	9.2	-85.3	150.6	-137.3	-169.4	154	0	0	118.5	W23 C25 A206 P234 L290	W23-E288 HydrophobicContact CE3-CB 3.71Å; W23-E288 HydrophobicContact CE3-CG 3.53Å; W23-E288 HydrophobicContact CH2-CB 4.24Å; W23-E288 HydrophobicContact CZ3-CB 3.26Å; W23-E288 HydrophobicContact CZ3-CG 3.68Å; C25-E288 PolarHBondContact SG-OE1 2.6Å; A206-E288 HydrophobicContact CB-CB 4.25Å; A206-E288 HydrophobicContact CB-CG 3.94Å; P234-E288 HydrophobicContact CG-CB 4.24Å; E288-L290 VanDerWaalsContact C-N 3.25Å; E288-L290 PolarHBondContact O-N 3.44Å
289	G	92.4	Very high	94.6	Very high	27 Å²	27	66.4 Å²	66.4	28%	0.278	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3.5	-168.2	0	0	0	0	0	113.5	H287	H287-G289 PolarHBondContact ND1-N 2.93Å; H287-G289 PolarHBondContact O-N 2.74Å; H287-G289 VanDerWaalsContact O-N 3.15Å
290	L	94.3	Very high	93.9	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.115	33%	0.333	C	S	.	.			trans	-90	125.9	177.2	-63.9	175.3	0	0	0	110	P208 P209 M285 H287 E288 E292 L294	P208-L290 HydrophobicContact CB-CD2 3.89Å; P209-L290 HydrophobicContact CG-CD1 4.11Å; P209-L290 HydrophobicContact CG-CD2 4.44Å; P209-L290 HydrophobicContact CG-CG 4.38Å; M285-L290 HydrophobicContact CG-CD1 4.34Å; H287-L290 HydrophobicContact CB-CD1 3.89Å; H287-L290 HydrophobicContact CB-CG 4.1Å; H287-L290 WeakPolarHBondContact O-CB 3.39Å; H287-L290 PolarHBondContact O-N 3.11Å; E288-L290 VanDerWaalsContact C-N 3.25Å; E288-L290 PolarHBondContact O-N 3.44Å; L290-E292 VanDerWaalsContact C-N 3.27Å; L290-E292 PolarHBondContact O-N 3.37Å; L290-L294 HydrophobicContact CD1-CB 4.48Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.9Å; L290-L294 HydrophobicContact CD2-CD1 3.55Å; L290-L294 HydrophobicContact CD2-CG 3.94Å; L290-L294 HydrophobicContact CG-CD1 4.4Å
291	Q	91.3	Very high	92.3	Very high	201 Å²	201	64 Å²	64	94%	0.939	35%	0.345	S	S	*	.	S	Bend	trans	-63.4	-36.8	174.8	-67.1	-177.6	-5.4	0	0	111.9
292	E	92.3	Very high	90	Very high	153 Å²	153	69 Å²	69	72%	0.715	38%	0.381	S	S	*	.	S	Bend	trans	-139.2	150.7	176.2	-65.5	-177.2	178.3	0	0	109.1	L290 L294	L290-E292 VanDerWaalsContact C-N 3.27Å; L290-E292 PolarHBondContact O-N 3.37Å; E292-L294 PolarHBondContact O-N 3.16Å
293	P	94.4	Very high	87.5	Confident	78 Å²	78	75 Å²	75	51%	0.506	41%	0.407	S	S	.	.			trans	-52.3	137	172.5	-26.7	35.7	0	0	0	111.9	M285 Q286	M285-P293 CarbonylContact O-C 3.57Å; M285-P293 WeakPolarHBondContact O-CA 3.41Å; Q286-P293 HydrophobicContact CG-CB 4.04Å; Q286-P293 HydrophobicContact CG-CG 4.18Å
294	L	95.1	Very high	84.9	Confident	59 Å²	59	80 Å²	80	31%	0.309	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	140.4	177.7	-68	177	0	0	0	110.8	T211 H284 M285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.24Å; H284-L294 CarbonylContact C-O 3.58Å; H284-L294 WeakPolarHBondContact CA-O 3.27Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.98Å; M285-L294 PolarHBondContact O-N 2.89Å; L290-L294 HydrophobicContact CD1-CB 4.48Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.9Å; L290-L294 HydrophobicContact CD2-CD1 3.55Å; L290-L294 HydrophobicContact CD2-CG 3.94Å; L290-L294 HydrophobicContact CG-CD1 4.4Å; E292-L294 PolarHBondContact O-N 3.16Å
295	T	96.6	Very high	82.7	Confident	81 Å²	81	84.5 Å²	84.5	50%	0.497	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.5	169.7	-58.9	0	0	0	0	108.9	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 4.01Å; C283-T295 CarbonylContact O-C 3.59Å; C283-T295 WeakPolarHBondContact O-CA 3.4Å; H284-T295 PolarHBondContact CE1-OG1 2.87Å; H284-T295 PolarHBondContact ND1-OG1 2.77Å
296	L	95.8	Very high	80.8	Confident	35 Å²	35	89.4 Å²	89.4	18%	0.183	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.6	-174.6	-59.2	162.1	0	0	0	109.7	T211 V213 T282 C283 M285	T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.06Å; V213-L296 HydrophobicContact CG2-CB 3.9Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.39Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 2.82Å; C283-L296 PolarHBondContact O-N 3.49Å; M285-L296 HydrophobicContact CE-CD1 4.3Å
297	S	93.8	Very high	78.9	Confident	60 Å²	60	88.8 Å²	88.8	42%	0.42	50%	0.499	S	S	.	.			trans	-106.3	162.6	166.8	55.9	0	0	0	0	110.1	E299	S297-E299 PolarHBondContact O-N 3.27Å
298	W	94.3	Very high	77.3	Confident	46 Å²	46	94.3 Å²	94.3	17%	0.174	53%	0.528	C	S	.	.			trans	-72.5	124.6	170.1	169.5	61.2	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.84Å; H215-W298 HydrophobicContact CB-CD2 4.17Å; H215-W298 HydrophobicContact CB-CG 4.2Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.26Å; H215-W298 AromaticContact CG-CE2 3.8Å; H215-W298 AromaticContact CG-CZ2 3.83Å; L225-W298 HydrophobicContact CD1-CB 4.33Å; L225-W298 HydrophobicContact CD2-CB 3.8Å; L225-W298 HydrophobicContact CD2-CD2 4.37Å; L225-W298 HydrophobicContact CD2-CG 3.91Å; E278-W298 HydrophobicContact CB-CD2 4.35Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.77Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.73Å; Q279-W298 PolarHBondContact NE2-O 3.39Å; W298-P300 HydrophobicContact CE3-CG 4.39Å; W298-P300 HydrophobicContact CH2-CB 4.24Å; W298-P300 HydrophobicContact CH2-CG 3.9Å; W298-P300 HydrophobicContact CZ2-CB 4.1Å; W298-P300 HydrophobicContact CZ2-CG 4.1Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å
299	E	86.7	Confident	75.7	Confident	169 Å²	169	99 Å²	99	79%	0.79	55%	0.552	S	S	*	*			trans	-105.1	121	173	-160.7	162.7	-158.9	0	0	109.4	S297 S301	S297-E299 PolarHBondContact O-N 3.27Å; E299-S301 PolarHBondContact O-N 3.05Å
300	P	79.1	Confident	74.4	Confident	71 Å²	71	99.9 Å²	99.9	46%	0.461	56%	0.561	S	S	.	*			trans	-59.6	124.9	174.4	-19.3	29.9	0	0	0	109.1	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.39Å; W298-P300 HydrophobicContact CH2-CB 4.24Å; W298-P300 HydrophobicContact CH2-CG 3.9Å; W298-P300 HydrophobicContact CZ2-CB 4.1Å; W298-P300 HydrophobicContact CZ2-CG 4.1Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å; P300-S302 PolarHBondContact O-N 3.28Å
301	S	62.5	Low	73.5	Confident	96 Å²	96	103.4 Å²	103.4	67%	0.671	58%	0.579	S	S	*	*			trans	-50.3	105.3	176.5	145	0	0	0	0	110.1	E299 Q303	E299-S301 PolarHBondContact O-N 3.05Å; S301-Q303 PolarHBondContact O-N 3.32Å; S301-Q303 PolarHBondContact OG-N 2.97Å
302	S	48.1	Very low	72.7	Confident	110 Å²	110	98.1 Å²	98.1	77%	0.769	56%	0.56	S	S	*	*			trans	-76	70.1	165.3	63.1	0	0	0	0	107.9	P300 P304	P300-S302 PolarHBondContact O-N 3.28Å; S302-P304 WeakPolarHBondContact O-CD 3.44Å; S302-P304 VanDerWaalsContact O-N 3.15Å
303	Q	44.4	Very low	71.9	Confident	158 Å²	158	93.4 Å²	93.4	74%	0.738	55%	0.547	S	S	*	.			trans	-63.4	114.4	156.9	-85.5	-173.8	-9.7	0	0	105	S301 T305	S301-Q303 PolarHBondContact O-N 3.32Å; S301-Q303 PolarHBondContact OG-N 2.97Å; Q303-T305 PolarHBondContact O-N 2.84Å
304	P	44.5	Very low	71.2	Confident	105 Å²	105	91.4 Å²	91.4	68%	0.682	54%	0.541	S	S	*	.			trans	-58	115.4	168.8	24.1	-29.4	0	0	0	104.8	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.44Å; S302-P304 VanDerWaalsContact O-N 3.15Å; P304-I306 PolarHBondContact O-N 3.46Å
305	T	51	Low	70.7	Confident	136 Å²	136	93.4 Å²	93.4	83%	0.834	55%	0.551	S	S	*	*			trans	-65	84.2	164.1	-42.1	0	0	0	0	104.4	Q303 P307	Q303-T305 PolarHBondContact O-N 2.84Å; T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.42Å
306	I	55.3	Low	70	Confident	104 Å²	104	92.1 Å²	92.1	53%	0.533	55%	0.549	S	S	.	.			trans	-50.1	119.5	167.5	-63.3	174.9	0	0	0	103	P304 I308 I311	P304-I306 PolarHBondContact O-N 3.46Å; I306-I308 HydrophobicContact CB-CG1 4.48Å; I306-I308 HydrophobicContact CG2-CG1 4.29Å; I306-I308 WeakPolarHBondContact O-CG1 3.35Å; I306-I308 PolarHBondContact O-N 2.82Å; I306-I311 HydrophobicContact CG2-CD1 4.03Å
307	P	57.5	Low	69.5	Low	86 Å²	86	94.6 Å²	94.6	56%	0.558	57%	0.565	S	S	*	*			trans	-73.8	75.8	-175.1	29.5	-33.6	0	0	0	107.4	T305 M309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.42Å; P307-M309 PolarHBondContact O-N 3.07Å; P307-G310 WeakPolarHBondContact O-CA 3.5Å; P307-G310 PolarHBondContact O-N 3.23Å; P307-I311 PolarHBondContact O-N 3.41Å; P307-I311 VanDerWaalsContact O-N 3.08Å
308	I	61.6	Low	69.1	Low	119 Å²	119	97.2 Å²	97.2	61%	0.61	57%	0.574	S	S	*	*	H	α-helix	trans	-55.5	-35.4	178.5	-66.9	167.4	0	0	0	108.3	I306 G310 I311 V312	I306-I308 HydrophobicContact CB-CG1 4.48Å; I306-I308 HydrophobicContact CG2-CG1 4.29Å; I306-I308 WeakPolarHBondContact O-CG1 3.35Å; I306-I308 PolarHBondContact O-N 2.82Å; I308-G310 PolarHBondContact O-N 3.04Å; I308-I311 PolarHBondContact O-N 2.88Å; I308-V312 HydrophobicContact CG2-CG2 4.33Å; I308-V312 WeakPolarHBondContact O-CB 3.49Å; I308-V312 WeakPolarHBondContact O-CG2 3.41Å; I308-V312 PolarHBondContact O-N 3.47Å
309	M	57.9	Low	68.6	Low	164 Å²	164	99.4 Å²	99.4	81%	0.808	59%	0.592	S	S	*	*	H	α-helix	trans	-64.8	-36	174	-165.8	165.4	64.1	0	0	113.4	P307 A313	P307-M309 PolarHBondContact O-N 3.07Å; M309-A313 VanDerWaalsContact O-CB 3.26Å; M309-A313 WeakPolarHBondContact O-CB 3.13Å; M309-A313 PolarHBondContact O-N 2.98Å
310	G	66.8	Low	68.5	Low	45 Å²	45	95.4 Å²	95.4	46%	0.464	58%	0.579	S	S	.	*	H	α-helix	trans	-70.4	-38.2	176.3	0	0	0	0	0	112.7	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.5Å; P307-G310 PolarHBondContact O-N 3.23Å; I308-G310 PolarHBondContact O-N 3.04Å; G310-G314 PolarHBondContact O-N 3.01Å
311	I	73.6	Confident	68.8	Low	95 Å²	95	97.1 Å²	97.1	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-68.9	-43	176.1	-61.7	172.2	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 4.03Å; P307-I311 PolarHBondContact O-N 3.41Å; P307-I311 VanDerWaalsContact O-N 3.08Å; I308-I311 PolarHBondContact O-N 2.88Å; I311-G314 PolarHBondContact O-N 3.36Å; I311-L315 HydrophobicContact CG2-CD1 3.99Å; I311-L315 WeakPolarHBondContact O-CB 3.36Å; I311-L315 WeakPolarHBondContact O-CG 3.46Å; I311-L315 PolarHBondContact O-N 3.41Å
312	V	74.8	Confident	69.7	Low	90 Å²	90	95.7 Å²	95.7	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-65.8	-43.2	177.5	172.5	0	0	0	0	111.4	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.33Å; I308-V312 WeakPolarHBondContact O-CB 3.49Å; I308-V312 WeakPolarHBondContact O-CG2 3.41Å; I308-V312 PolarHBondContact O-N 3.47Å; V312-L315 PolarHBondContact O-N 3.16Å; V312-A316 WeakPolarHBondContact O-CB 3.27Å; V312-A316 PolarHBondContact O-N 3.41Å
313	A	75.3	Confident	71.4	Confident	54 Å²	54	94.5 Å²	94.5	45%	0.446	57%	0.566	S	S	.	*	H	α-helix	trans	-63.3	-43	175.2	0	0	0	0	0	111.8	M309 A316 V317	M309-A313 VanDerWaalsContact O-CB 3.26Å; M309-A313 WeakPolarHBondContact O-CB 3.13Å; M309-A313 PolarHBondContact O-N 2.98Å; A313-A316 PolarHBondContact O-N 2.88Å; A313-V317 WeakPolarHBondContact O-CG2 3.45Å; A313-V317 PolarHBondContact O-N 2.71Å
314	G	81.1	Confident	73.1	Confident	36 Å²	36	91.7 Å²	91.7	37%	0.371	56%	0.556	S	S	.	*	H	α-helix	trans	-61.9	-43.7	176.4	0	0	0	0	0	113	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.01Å; I311-G314 PolarHBondContact O-N 3.36Å; G314-V317 PolarHBondContact O-N 2.94Å; G314-L318 PolarHBondContact O-N 3.04Å
315	L	84.6	Confident	74.8	Confident	101 Å²	101	88.3 Å²	88.3	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-41.3	175.9	-79.3	166.6	0	0	0	112.1	I311 V312 V317 L318 V319	I311-L315 HydrophobicContact CG2-CD1 3.99Å; I311-L315 WeakPolarHBondContact O-CB 3.36Å; I311-L315 WeakPolarHBondContact O-CG 3.46Å; I311-L315 PolarHBondContact O-N 3.41Å; V312-L315 PolarHBondContact O-N 3.16Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 2.7Å; L315-L318 PolarHBondContact O-N 3.23Å; L315-V319 WeakPolarHBondContact O-CG2 3.48Å; L315-V319 PolarHBondContact O-N 2.98Å
316	A	82.2	Confident	76.2	Confident	55 Å²	55	84.7 Å²	84.7	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.8	0	0	0	0	0	111.7	V312 A313 V319 V320	V312-A316 WeakPolarHBondContact O-CB 3.27Å; V312-A316 PolarHBondContact O-N 3.41Å; A313-A316 PolarHBondContact O-N 2.88Å; A316-V319 PolarHBondContact O-N 3.27Å; A316-V320 VanDerWaalsContact O-CG2 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 3.19Å
317	V	85.3	Confident	77.3	Confident	87 Å²	87	83.4 Å²	83.4	53%	0.527	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176.3	172.7	0	0	0	0	111.4	A313 G314 L315 V319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.45Å; A313-V317 PolarHBondContact O-N 2.71Å; G314-V317 PolarHBondContact O-N 2.94Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 2.7Å; V317-V319 PolarHBondContact O-N 3.5Å; V317-V320 PolarHBondContact O-N 2.9Å; V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.39Å; V317-L321 WeakPolarHBondContact O-CB 3.1Å; V317-L321 WeakPolarHBondContact O-CG 3.29Å; V317-L321 PolarHBondContact O-N 3.24Å
318	L	84.2	Confident	78.2	Confident	115 Å²	115	83.2 Å²	83.2	60%	0.602	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-42.1	176.5	-89.1	162.3	0	0	0	112.6	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.04Å; L315-L318 PolarHBondContact O-N 3.23Å; L318-L321 PolarHBondContact O-N 3.3Å; L318-A322 WeakPolarHBondContact O-CB 3.23Å; L318-A322 PolarHBondContact O-N 3.02Å
319	V	84.6	Confident	78.8	Confident	91 Å²	91	81.6 Å²	81.6	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.1	-44.2	176.2	172.4	0	0	0	0	110.8	L315 A316 V317 L321 A322 V323	L315-V319 WeakPolarHBondContact O-CG2 3.48Å; L315-V319 PolarHBondContact O-N 2.98Å; A316-V319 PolarHBondContact O-N 3.27Å; V317-V319 PolarHBondContact O-N 3.5Å; V319-L321 PolarHBondContact O-N 3.04Å; V319-A322 PolarHBondContact O-N 2.87Å; V319-V323 HydrophobicContact CG1-CG2 4.49Å; V319-V323 VanDerWaalsContact O-CG2 3.31Å; V319-V323 WeakPolarHBondContact O-CG2 3.36Å; V319-V323 PolarHBondContact O-N 3.04Å
320	V	84.6	Confident	79.5	Confident	86 Å²	86	76.4 Å²	76.4	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-44.4	177.1	171.5	0	0	0	0	111.1	A316 V317 A322 V323 L324	A316-V320 VanDerWaalsContact O-CG2 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 3.19Å; V317-V320 PolarHBondContact O-N 2.9Å; V320-A322 PolarHBondContact O-N 3.2Å; V320-V323 PolarHBondContact O-N 3.06Å; V320-L324 HydrophobicContact CG1-CD1 3.93Å; V320-L324 HydrophobicContact CG1-CG 4.43Å; V320-L324 WeakPolarHBondContact O-CB 3.37Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.05Å; V320-L324 PolarHBondContact O-N 3.4Å
321	L	84.1	Confident	79.7	Confident	106 Å²	106	80.4 Å²	80.4	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-63.9	-39.6	177	-72.6	171.9	0	0	0	112.3	V317 L318 V319 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.39Å; V317-L321 WeakPolarHBondContact O-CB 3.1Å; V317-L321 WeakPolarHBondContact O-CG 3.29Å; V317-L321 PolarHBondContact O-N 3.24Å; L318-L321 PolarHBondContact O-N 3.3Å; V319-L321 PolarHBondContact O-N 3.04Å; L321-L324 PolarHBondContact O-N 2.86Å; L321-G325 PolarHBondContact O-N 3.4Å
322	A	82.5	Confident	79.5	Confident	67 Å²	67	82.2 Å²	82.2	55%	0.554	51%	0.512	S	S	*	.	H	α-helix	trans	-64.8	-41.7	176.3	0	0	0	0	0	111.9	L318 V319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.23Å; L318-A322 PolarHBondContact O-N 3.02Å; V319-A322 PolarHBondContact O-N 2.87Å; V320-A322 PolarHBondContact O-N 3.2Å; A322-G325 PolarHBondContact O-N 3.44Å; A322-A326 WeakPolarHBondContact O-CB 3.48Å; A322-A326 PolarHBondContact O-N 3.34Å
323	V	82.8	Confident	78.8	Confident	85 Å²	85	81.8 Å²	81.8	52%	0.515	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-45.6	176	173.1	0	0	0	0	110.8	V319 V320 G325 A326 V327	V319-V323 HydrophobicContact CG1-CG2 4.49Å; V319-V323 VanDerWaalsContact O-CG2 3.31Å; V319-V323 WeakPolarHBondContact O-CG2 3.36Å; V319-V323 PolarHBondContact O-N 3.04Å; V320-V323 PolarHBondContact O-N 3.06Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.07Å; V323-A326 PolarHBondContact O-N 2.7Å; V323-V327 HydrophobicContact CG1-CG2 4.48Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.16Å; V323-V327 PolarHBondContact O-N 2.95Å
324	L	81.6	Confident	78.1	Confident	99 Å²	99	88.9 Å²	88.9	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-42.7	176.1	-71.3	172.1	0	0	0	111.6	V320 L321 V327 V328	V320-L324 HydrophobicContact CG1-CD1 3.93Å; V320-L324 HydrophobicContact CG1-CG 4.43Å; V320-L324 WeakPolarHBondContact O-CB 3.37Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.05Å; V320-L324 PolarHBondContact O-N 3.4Å; L321-L324 PolarHBondContact O-N 2.86Å; L324-V327 PolarHBondContact O-N 2.91Å; L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.37Å; L324-V328 PolarHBondContact O-N 3.07Å
325	G	79.9	Confident	76.9	Confident	34 Å²	34	97.6 Å²	97.6	35%	0.351	55%	0.55	S	S	.	.	H	α-helix	trans	-57.5	-49.7	173.7	0	0	0	0	0	112	L321 A322 V323 V327 V328 T329	L321-G325 PolarHBondContact O-N 3.4Å; A322-G325 PolarHBondContact O-N 3.44Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.07Å; G325-V327 VanDerWaalsContact C-N 3.35Å; G325-V327 PolarHBondContact O-N 3.31Å; G325-V328 PolarHBondContact O-N 2.97Å; G325-T329 PolarHBondContact O-N 3.02Å; G325-T329 PolarHBondContact O-OG1 3.42Å
326	A	78.9	Confident	75.2	Confident	60 Å²	60	101.9 Å²	101.9	50%	0.496	56%	0.564	S	S	.	*	H	α-helix	trans	-61.4	-39.8	177.9	0	0	0	0	0	112.8	A322 V323 T329 A330	A322-A326 WeakPolarHBondContact O-CB 3.48Å; A322-A326 PolarHBondContact O-N 3.34Å; V323-A326 PolarHBondContact O-N 2.7Å; A326-T329 PolarHBondContact O-N 3.27Å; A326-A330 VanDerWaalsContact O-CB 3.28Å; A326-A330 WeakPolarHBondContact O-CB 3.36Å; A326-A330 PolarHBondContact O-N 2.84Å
327	V	78.4	Confident	73.6	Confident	77 Å²	77	103.7 Å²	103.7	47%	0.467	57%	0.573	S	S	.	*	H	α-helix	trans	-65.4	-43.6	176.5	171.7	0	0	0	0	111.1	V323 L324 G325 A330 M331	V323-V327 HydrophobicContact CG1-CG2 4.48Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.16Å; V323-V327 PolarHBondContact O-N 2.95Å; L324-V327 PolarHBondContact O-N 2.91Å; G325-V327 VanDerWaalsContact C-N 3.35Å; G325-V327 PolarHBondContact O-N 3.31Å; V327-A330 PolarHBondContact O-N 3.18Å; V327-M331 HydrophobicContact CG1-CG 4.42Å; V327-M331 WeakPolarHBondContact O-CB 3.31Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.27Å; V327-M331 PolarHBondContact O-N 2.73Å
328	V	78.2	Confident	71.8	Confident	81 Å²	81	104.8 Å²	104.8	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-63.4	-45.5	176.6	172.3	0	0	0	0	110.7	L324 G325 A330 M331 M332	L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.37Å; L324-V328 PolarHBondContact O-N 3.07Å; G325-V328 PolarHBondContact O-N 2.97Å; V328-A330 PolarHBondContact O-N 3.06Å; V328-M331 PolarHBondContact O-N 2.66Å; V328-M332 HydrophobicContact CG1-CG 4.49Å; V328-M332 HydrophobicContact CG1-SD 4.21Å; V328-M332 WeakPolarHBondContact O-CG 3.47Å; V328-M332 PolarHBondContact O-N 3.22Å
329	T	72.8	Confident	69.6	Low	86 Å²	86	102.4 Å²	102.4	53%	0.528	59%	0.588	S	S	.	*	H	α-helix	trans	-61.1	-44.1	176	-52.5	0	0	0	0	111.5	G325 A326 M331 M332 C333	G325-T329 PolarHBondContact O-N 3.02Å; G325-T329 PolarHBondContact O-OG1 3.42Å; A326-T329 PolarHBondContact O-N 3.27Å; T329-M331 PolarHBondContact O-N 3Å; T329-M332 PolarHBondContact O-N 2.63Å; T329-C333 WeakPolarHBondContact O-CB 3.3Å; T329-C333 PolarHBondContact O-N 3.27Å; T329-C333 PolarHBondContact O-SG 3.06Å; T329-C333 VanDerWaalsContact O-SG 3.36Å
330	A	72.3	Confident	67.3	Low	55 Å²	55	101.5 Å²	101.5	46%	0.455	60%	0.597	S	S	.	*	H	α-helix	trans	-64.2	-38.8	176.6	0	0	0	0	0	112.5	A326 V327 V328 C333 R334	A326-A330 VanDerWaalsContact O-CB 3.28Å; A326-A330 WeakPolarHBondContact O-CB 3.36Å; A326-A330 PolarHBondContact O-N 2.84Å; V327-A330 PolarHBondContact O-N 3.18Å; V328-A330 PolarHBondContact O-N 3.06Å; A330-C333 PolarHBondContact O-N 3.17Å; A330-R334 WeakPolarHBondContact O-CB 3.28Å; A330-R334 WeakPolarHBondContact O-CG 3.38Å; A330-R334 PolarHBondContact O-N 3.32Å
331	M	71.1	Confident	64.9	Low	128 Å²	128	107.9 Å²	107.9	63%	0.631	62%	0.618	S	S	*	*	H	α-helix	trans	-68	-39	175.4	-73.3	-131.2	-68.6	0	0	112.2	V327 V328 T329 R334 R335	V327-M331 HydrophobicContact CG1-CG 4.42Å; V327-M331 WeakPolarHBondContact O-CB 3.31Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.27Å; V327-M331 PolarHBondContact O-N 2.73Å; V328-M331 PolarHBondContact O-N 2.66Å; T329-M331 PolarHBondContact O-N 3Å; M331-R334 PolarHBondContact O-N 2.76Å; M331-R335 WeakPolarHBondContact O-CB 3.46Å; M331-R335 PolarHBondContact O-N 3.38Å
332	M	70.2	Confident	62.5	Low	133 Å²	133	106.7 Å²	106.7	66%	0.655	63%	0.632	S	S	*	*	H	α-helix	trans	-67.4	-39.4	174.4	-70	-175.7	81.3	0	0	111.9	V328 T329 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.49Å; V328-M332 HydrophobicContact CG1-SD 4.21Å; V328-M332 WeakPolarHBondContact O-CG 3.47Å; V328-M332 PolarHBondContact O-N 3.22Å; T329-M332 PolarHBondContact O-N 2.63Å; M332-R335 PolarHBondContact O-N 3.06Å; M332-K336 WeakPolarHBondContact O-CB 3.21Å; M332-K336 PolarHBondContact O-N 2.73Å
333	C	60.2	Low	60	Low	82 Å²	82	107.5 Å²	107.5	55%	0.554	65%	0.647	S	S	*	*	H	α-helix	trans	-62.9	-41.4	172.1	-73.8	0	0	0	0	111.8	T329 A330 K336 S337	T329-C333 WeakPolarHBondContact O-CB 3.3Å; T329-C333 PolarHBondContact O-N 3.27Å; T329-C333 PolarHBondContact O-SG 3.06Å; T329-C333 VanDerWaalsContact O-SG 3.36Å; A330-C333 PolarHBondContact O-N 3.17Å; C333-K336 PolarHBondContact O-N 3.18Å; C333-S337 PolarHBondContact O-N 3.43Å; C333-S337 VanDerWaalsContact O-N 3.12Å; C333-S337 PolarHBondContact O-OG 2.89Å
334	R	59.6	Low	57.8	Low	203 Å²	203	109 Å²	109	77%	0.766	66%	0.66	S	S	*	*	H	α-helix	trans	-68.4	-32.5	174.9	-81.4	-171.4	165.8	-175.3	-2.6	113.5	A330 M331 K336 S337	A330-R334 WeakPolarHBondContact O-CB 3.28Å; A330-R334 WeakPolarHBondContact O-CG 3.38Å; A330-R334 PolarHBondContact O-N 3.32Å; M331-R334 PolarHBondContact O-N 2.76Å; R334-K336 VanDerWaalsContact C-N 3.32Å; R334-S337 PolarHBondContact O-OG 3.16Å
335	R	56.2	Low	55.3	Low	219 Å²	219	109 Å²	109	83%	0.826	67%	0.668	S	S	*	*	H	α-helix	trans	-70.8	-28.1	173	-122.9	178.9	-179.5	175.8	0.1	112.4	M331 M332	M331-R335 WeakPolarHBondContact O-CB 3.46Å; M331-R335 PolarHBondContact O-N 3.38Å; M332-R335 PolarHBondContact O-N 3.06Å
336	K	49.3	Very low	53.1	Low	191 Å²	191	111.7 Å²	111.7	83%	0.83	68%	0.681	S	S	*	*	H	α-helix	trans	-87.5	-14.5	179.7	-160.8	155.8	-179.6	174	0	113.7	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.21Å; M332-K336 PolarHBondContact O-N 2.73Å; C333-K336 PolarHBondContact O-N 3.18Å; R334-K336 VanDerWaalsContact C-N 3.32Å
337	S	49.8	Very low	51.1	Low	93 Å²	93	118 Å²	118	65%	0.65	70%	0.7	S	S	*	*	S	Bend	trans	-92.2	2.5	177	59.1	0	0	0	0	115.3	C333 R334	C333-S337 PolarHBondContact O-N 3.43Å; C333-S337 VanDerWaalsContact O-N 3.12Å; C333-S337 PolarHBondContact O-OG 2.89Å; R334-S337 PolarHBondContact O-OG 3.16Å
338	S	47.5	Very low	48.8	Very low	109 Å²	109	118.9 Å²	118.9	76%	0.762	72%	0.716	S	S	*	*	S	Bend	trans	-97.9	38	175.2	87.3	0	0	0	0	113.8
339	G	37.8	Very low	46.5	Very low	66 Å²	66	119.8 Å²	119.8	68%	0.68	73%	0.732	S	S	*	*	S	Bend	trans	-155	81.2	178.9	0	0	0	0	0	113.5
340	G	36.3	Very low	44.8	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	75%	0.748	S	S	*	*			trans	64.5	97.9	141.1	0	0	0	0	0	121.7
341	K	33.9	Very low	43	Very low	219 Å²	219	124.6 Å²	124.6	95%	0.952	77%	0.765	S	S	*	*				61.3	117	115.7	-146.2	160.3	-174.2	172.8	0	121
342	G	32.7	Very low	41.3	Very low	82 Å²	82	126 Å²	126	85%	0.845	78%	0.775	S	S	*	*			trans	126.9	124.5	132.3	0	0	0	0	0	117.9
343	G	31.1	Very low	39.7	Very low	84 Å²	84	126 Å²	126	87%	0.866	79%	0.787	S	S	*	*			trans	130.6	105.9	148.2	0	0	0	0	0	117.9
344	S	35	Very low	38.7	Very low	115 Å²	115	126.6 Å²	126.6	80%	0.804	80%	0.799	S	S	*	*			trans	-64.3	172.6	167.2	-146.8	0	0	0	0	112
345	C	30.7	Very low	37.5	Very low	100 Å²	100	126.5 Å²	126.5	68%	0.676	81%	0.807	S	S	*	*			cis	-170.4	144.4	22	-147.7	0	0	0	0	110.2
346	S	34.1	Very low	36.3	Very low	90 Å²	90	119.5 Å²	119.5	63%	0.629	80%	0.802	S	S	*	*			trans	46.3	117.5	135.6	60.5	0	0	0	0	125
347	Q	36.2	Very low	35.7	Very low	192 Å²	192	116 Å²	116	90%	0.897	80%	0.803	S	S	*	*				83.7	141.4	109.2	-154.6	170	7.6	0	0	123.4
348	A	29.7	Very low	35.2	Very low	97 Å²	97	119 Å²	119	80%	0.802	81%	0.811	S	S	*	*			trans	93.3	138.3	162.3	0	0	0	0	0	115.9
349	A	29.7	Very low	34.5	Very low	100 Å²	100	122.5 Å²	122.5	83%	0.826	82%	0.816	S	S	*	*			cis	-158.1	157.3	22.1	0	0	0	0	0	112.7
350	C	37.8	Very low	34.3	Very low	126 Å²	126	123.6 Å²	123.6	85%	0.851	81%	0.813	S	S	*	*			trans	-83.1	156.3	160.8	-66	0	0	0	0	111.8
351	S	34.2	Very low	34.2	Very low	116 Å²	116	127.9 Å²	127.9	81%	0.811	82%	0.818	S	S	*	*			trans	-161.8	115.3	148	38.7	0	0	0	0	107.8
352	N	36	Very low	34.1	Very low	158 Å²	158	123.7 Å²	123.7	85%	0.845	80%	0.804	S	S	*	*				63.7	119.3	65.4	-88.3	3.5	0	0	0	116.4
353	S	35.1	Very low	34	Very low	131 Å²	131	125.5 Å²	125.5	92%	0.916	80%	0.799	S	S	*	*			trans	-156.3	132.5	134.8	-24.1	0	0	0	0	110.3
354	A	39.8	Very low	33.9	Very low	96 Å²	96	126.4 Å²	126.4	79%	0.793	79%	0.791	S	S	*	*			trans	-130.9	143	172	0	0	0	0	0	108.4
355	Q	35.1	Very low	33.7	Very low	201 Å²	201	130.8 Å²	130.8	94%	0.939	80%	0.796	S	S	*	*			trans	-175.5	113.4	155.8	-116	164.5	-10.6	0	0	107
356	G	31.1	Very low	34.1	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	83%	0.83	S	S	*	*				104.8	140.9	85.6	0	0	0	0	0	107.6
357	S	36.6	Very low	34.1	Very low	119 Å²	119	136.3 Å²	136.3	83%	0.832	84%	0.84	S	S	*	*			cis	-166.7	171.7	14	-52.1	0	0	0	0	108.6
358	D	37.9	Very low	34	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	84%	0.837	S	S	*	*			trans	-42.6	152.7	178.3	-59.4	-60.3	0	0	0	119
359	E	34.2	Very low	34.2	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	84%	0.839	S	S	*	*				-169.6	139.6	110.5	-118.2	-176.1	135.6	0	0	114.9
360	S	33.8	Very low	34.5	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	84%	0.84	S	S	*	*			trans	1.6	127.8	157.2	54	0	0	0	0	120.6
361	L	33.5	Very low	34.3	Very low	161 Å²	161	138.2 Å²	138.2	84%	0.843	84%	0.839	S	S	*	*				62.5	135.1	76.2	-104.6	170.7	0	0	0	115.2
362	I	32.9	Very low	34.3	Very low	132 Å²	132	139.7 Å²	139.7	68%	0.677	84%	0.841	S	S	*	*			trans	115.6	97.8	150	-54.8	-159.9	0	0	0	117.4
363	T	29.2	Very low	34.2	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	84%	0.841	S	S	*	*			trans	70.1	157.9	135.1	62.2	0	0	0	0	121
364	C	28.8	Very low	34.1	Very low	103 Å²	103	138.9 Å²	138.9	70%	0.696	84%	0.835	S	S	*	*			cis	178.5	144.4	-26.5	-102.7	0	0	0	0	104.8
365	K	32.5	Very low	33.6	Very low	207 Å²	207	142.5 Å²	142.5	90%	0.9	84%	0.838	S	S	*	*			trans	65	148.9	148.8	-74.3	178.6	171.3	178	0	117.3
366	A	38	Very low	33.5	Very low	169 Å²	169	137.2 Å²	137.2	100%	1.397	83%	0.829	S	S	*	*			cis	-130.8	0	19.5	0	0	0	0	0	112.1

Retrieved 366 of 366 residues in 1431.5 ms (Link to these results)

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